################################### # 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 25502 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HCCH-TOCSY' . . . 25502 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.119 0.003 . . . . . . 1 MET HA . 25502 1 2 . 1 1 1 1 MET HB2 H 1 2.141 0.014 . . . . . . 1 MET HB2 . 25502 1 3 . 1 1 1 1 MET HB3 H 1 2.123 0.019 . . . . . . 1 MET HB3 . 25502 1 4 . 1 1 1 1 MET HG2 H 1 2.579 0.002 . . . . . . 1 MET HG2 . 25502 1 5 . 1 1 1 1 MET HG3 H 1 2.547 0.009 . . . . . . 1 MET HG3 . 25502 1 6 . 1 1 1 1 MET HE1 H 1 2.087 0.010 . . . . . . 1 MET QE . 25502 1 7 . 1 1 1 1 MET HE2 H 1 2.087 0.010 . . . . . . 1 MET QE . 25502 1 8 . 1 1 1 1 MET HE3 H 1 2.087 0.010 . . . . . . 1 MET QE . 25502 1 9 . 1 1 1 1 MET CA C 13 54.839 0.010 . . . . . . 1 MET CA . 25502 1 10 . 1 1 1 1 MET CB C 13 33.810 0.020 . . . . . . 1 MET CB . 25502 1 11 . 1 1 1 1 MET CG C 13 30.694 0.015 . . . . . . 1 MET CG . 25502 1 12 . 1 1 1 1 MET CE C 13 16.738 0.020 . . . . . . 1 MET CE . 25502 1 13 . 1 1 2 2 VAL HA H 1 4.176 0.015 . . . . . . 2 VAL HA . 25502 1 14 . 1 1 2 2 VAL HB H 1 2.046 0.003 . . . . . . 2 VAL HB . 25502 1 15 . 1 1 2 2 VAL HG11 H 1 0.935 0.008 . . . . . . 2 VAL QG1 . 25502 1 16 . 1 1 2 2 VAL HG12 H 1 0.935 0.008 . . . . . . 2 VAL QG1 . 25502 1 17 . 1 1 2 2 VAL HG13 H 1 0.935 0.008 . . . . . . 2 VAL QG1 . 25502 1 18 . 1 1 2 2 VAL HG21 H 1 0.927 0.009 . . . . . . 2 VAL QG2 . 25502 1 19 . 1 1 2 2 VAL HG22 H 1 0.927 0.009 . . . . . . 2 VAL QG2 . 25502 1 20 . 1 1 2 2 VAL HG23 H 1 0.927 0.009 . . . . . . 2 VAL QG2 . 25502 1 21 . 1 1 2 2 VAL CA C 13 61.492 0.012 . . . . . . 2 VAL CA . 25502 1 22 . 1 1 2 2 VAL CB C 13 33.126 0.020 . . . . . . 2 VAL CB . 25502 1 23 . 1 1 2 2 VAL CG1 C 13 20.576 0.022 . . . . . . 2 VAL CG1 . 25502 1 24 . 1 1 2 2 VAL CG2 C 13 20.526 0.084 . . . . . . 2 VAL CG2 . 25502 1 25 . 1 1 3 3 ASN H H 1 8.600 0.021 . . . . . . 3 ASN H . 25502 1 26 . 1 1 3 3 ASN HA H 1 5.137 0.003 . . . . . . 3 ASN HA . 25502 1 27 . 1 1 3 3 ASN HB2 H 1 2.771 0.006 . . . . . . 3 ASN HB2 . 25502 1 28 . 1 1 3 3 ASN HB3 H 1 3.612 0.005 . . . . . . 3 ASN HB3 . 25502 1 29 . 1 1 3 3 ASN HD21 H 1 8.457 0.018 . . . . . . 3 ASN HD21 . 25502 1 30 . 1 1 3 3 ASN HD22 H 1 6.983 0.003 . . . . . . 3 ASN HD22 . 25502 1 31 . 1 1 3 3 ASN CA C 13 51.008 0.057 . . . . . . 3 ASN CA . 25502 1 32 . 1 1 3 3 ASN CB C 13 37.799 0.100 . . . . . . 3 ASN CB . 25502 1 33 . 1 1 3 3 ASN N N 15 126.515 0.060 . . . . . . 3 ASN N . 25502 1 34 . 1 1 3 3 ASN ND2 N 15 109.703 0.009 . . . . . . 3 ASN ND2 . 25502 1 35 . 1 1 4 4 PRO HA H 1 4.753 0.002 . . . . . . 4 PRO HA . 25502 1 36 . 1 1 4 4 PRO HB2 H 1 1.711 0.005 . . . . . . 4 PRO HB2 . 25502 1 37 . 1 1 4 4 PRO HB3 H 1 2.364 0.014 . . . . . . 4 PRO HB3 . 25502 1 38 . 1 1 4 4 PRO HG2 H 1 2.086 0.004 . . . . . . 4 PRO HG2 . 25502 1 39 . 1 1 4 4 PRO HG3 H 1 2.187 0.006 . . . . . . 4 PRO HG3 . 25502 1 40 . 1 1 4 4 PRO HD2 H 1 4.093 0.012 . . . . . . 4 PRO HD2 . 25502 1 41 . 1 1 4 4 PRO HD3 H 1 4.065 0.014 . . . . . . 4 PRO HD3 . 25502 1 42 . 1 1 4 4 PRO CA C 13 62.669 0.060 . . . . . . 4 PRO CA . 25502 1 43 . 1 1 4 4 PRO CB C 13 33.138 0.079 . . . . . . 4 PRO CB . 25502 1 44 . 1 1 4 4 PRO CG C 13 26.689 0.005 . . . . . . 4 PRO CG . 25502 1 45 . 1 1 4 4 PRO CD C 13 50.660 0.057 . . . . . . 4 PRO CD . 25502 1 46 . 1 1 5 5 THR H H 1 8.771 0.002 . . . . . . 5 THR H . 25502 1 47 . 1 1 5 5 THR HA H 1 5.716 0.003 . . . . . . 5 THR HA . 25502 1 48 . 1 1 5 5 THR HB H 1 4.059 0.007 . . . . . . 5 THR HB . 25502 1 49 . 1 1 5 5 THR HG21 H 1 1.201 0.004 . . . . . . 5 THR QG2 . 25502 1 50 . 1 1 5 5 THR HG22 H 1 1.201 0.004 . . . . . . 5 THR QG2 . 25502 1 51 . 1 1 5 5 THR HG23 H 1 1.201 0.004 . . . . . . 5 THR QG2 . 25502 1 52 . 1 1 5 5 THR CA C 13 60.698 0.077 . . . . . . 5 THR CA . 25502 1 53 . 1 1 5 5 THR CG2 C 13 22.127 0.070 . . . . . . 5 THR CG2 . 25502 1 54 . 1 1 5 5 THR N N 15 114.826 0.020 . . . . . . 5 THR N . 25502 1 55 . 1 1 6 6 VAL H H 1 8.741 0.004 . . . . . . 6 VAL H . 25502 1 56 . 1 1 6 6 VAL HA H 1 5.339 0.003 . . . . . . 6 VAL HA . 25502 1 57 . 1 1 6 6 VAL HB H 1 2.306 0.004 . . . . . . 6 VAL HB . 25502 1 58 . 1 1 6 6 VAL HG11 H 1 1.055 0.007 . . . . . . 6 VAL QG1 . 25502 1 59 . 1 1 6 6 VAL HG12 H 1 1.055 0.007 . . . . . . 6 VAL QG1 . 25502 1 60 . 1 1 6 6 VAL HG13 H 1 1.055 0.007 . . . . . . 6 VAL QG1 . 25502 1 61 . 1 1 6 6 VAL HG21 H 1 1.066 0.006 . . . . . . 6 VAL QG2 . 25502 1 62 . 1 1 6 6 VAL HG22 H 1 1.066 0.006 . . . . . . 6 VAL QG2 . 25502 1 63 . 1 1 6 6 VAL HG23 H 1 1.066 0.006 . . . . . . 6 VAL QG2 . 25502 1 64 . 1 1 6 6 VAL CA C 13 58.797 0.056 . . . . . . 6 VAL CA . 25502 1 65 . 1 1 6 6 VAL CB C 13 36.135 0.010 . . . . . . 6 VAL CB . 25502 1 66 . 1 1 6 6 VAL CG1 C 13 21.612 0.009 . . . . . . 6 VAL CG1 . 25502 1 67 . 1 1 6 6 VAL CG2 C 13 20.545 0.007 . . . . . . 6 VAL CG2 . 25502 1 68 . 1 1 6 6 VAL N N 15 120.113 0.060 . . . . . . 6 VAL N . 25502 1 69 . 1 1 7 7 PHE H H 1 8.954 0.007 . . . . . . 7 PHE H . 25502 1 70 . 1 1 7 7 PHE HA H 1 5.895 0.003 . . . . . . 7 PHE HA . 25502 1 71 . 1 1 7 7 PHE HB2 H 1 2.842 0.006 . . . . . . 7 PHE HB2 . 25502 1 72 . 1 1 7 7 PHE HB3 H 1 2.632 0.006 . . . . . . 7 PHE HB3 . 25502 1 73 . 1 1 7 7 PHE HD1 H 1 6.735 0.008 . . . . . . 7 PHE QD . 25502 1 74 . 1 1 7 7 PHE HD2 H 1 6.735 0.008 . . . . . . 7 PHE QD . 25502 1 75 . 1 1 7 7 PHE HE1 H 1 6.989 0.006 . . . . . . 7 PHE QE . 25502 1 76 . 1 1 7 7 PHE HE2 H 1 6.989 0.006 . . . . . . 7 PHE QE . 25502 1 77 . 1 1 7 7 PHE HZ H 1 7.024 0.023 . . . . . . 7 PHE HZ . 25502 1 78 . 1 1 7 7 PHE CA C 13 55.688 0.010 . . . . . . 7 PHE CA . 25502 1 79 . 1 1 7 7 PHE CB C 13 43.043 0.042 . . . . . . 7 PHE CB . 25502 1 80 . 1 1 7 7 PHE N N 15 118.968 0.020 . . . . . . 7 PHE N . 25502 1 81 . 1 1 8 8 PHE H H 1 9.540 0.012 . . . . . . 8 PHE H . 25502 1 82 . 1 1 8 8 PHE HA H 1 5.317 0.006 . . . . . . 8 PHE HA . 25502 1 83 . 1 1 8 8 PHE HB2 H 1 3.459 0.004 . . . . . . 8 PHE HB2 . 25502 1 84 . 1 1 8 8 PHE HB3 H 1 3.258 0.006 . . . . . . 8 PHE HB3 . 25502 1 85 . 1 1 8 8 PHE HD1 H 1 7.488 0.005 . . . . . . 8 PHE QD . 25502 1 86 . 1 1 8 8 PHE HD2 H 1 7.488 0.005 . . . . . . 8 PHE QD . 25502 1 87 . 1 1 8 8 PHE HE1 H 1 7.179 0.004 . . . . . . 8 PHE QE . 25502 1 88 . 1 1 8 8 PHE HE2 H 1 7.179 0.004 . . . . . . 8 PHE QE . 25502 1 89 . 1 1 8 8 PHE HZ H 1 6.191 0.003 . . . . . . 8 PHE HZ . 25502 1 90 . 1 1 8 8 PHE CA C 13 53.423 0.078 . . . . . . 8 PHE CA . 25502 1 91 . 1 1 8 8 PHE CB C 13 42.870 0.077 . . . . . . 8 PHE CB . 25502 1 92 . 1 1 8 8 PHE N N 15 116.774 0.050 . . . . . . 8 PHE N . 25502 1 93 . 1 1 9 9 ASP H H 1 9.266 0.007 . . . . . . 9 ASP H . 25502 1 94 . 1 1 9 9 ASP HA H 1 5.533 0.005 . . . . . . 9 ASP HA . 25502 1 95 . 1 1 9 9 ASP HB2 H 1 2.862 0.009 . . . . . . 9 ASP HB2 . 25502 1 96 . 1 1 9 9 ASP HB3 H 1 2.520 0.009 . . . . . . 9 ASP HB3 . 25502 1 97 . 1 1 9 9 ASP CA C 13 54.765 0.066 . . . . . . 9 ASP CA . 25502 1 98 . 1 1 9 9 ASP CB C 13 41.313 0.075 . . . . . . 9 ASP CB . 25502 1 99 . 1 1 9 9 ASP N N 15 123.959 0.070 . . . . . . 9 ASP N . 25502 1 100 . 1 1 10 10 ILE H H 1 9.030 0.009 . . . . . . 10 ILE H . 25502 1 101 . 1 1 10 10 ILE HA H 1 5.172 0.003 . . . . . . 10 ILE HA . 25502 1 102 . 1 1 10 10 ILE HB H 1 2.061 0.009 . . . . . . 10 ILE HB . 25502 1 103 . 1 1 10 10 ILE HG12 H 1 1.846 0.011 . . . . . . 10 ILE HG12 . 25502 1 104 . 1 1 10 10 ILE HG13 H 1 1.654 0.017 . . . . . . 10 ILE HG13 . 25502 1 105 . 1 1 10 10 ILE HG21 H 1 0.965 0.007 . . . . . . 10 ILE QG2 . 25502 1 106 . 1 1 10 10 ILE HG22 H 1 0.965 0.007 . . . . . . 10 ILE QG2 . 25502 1 107 . 1 1 10 10 ILE HG23 H 1 0.965 0.007 . . . . . . 10 ILE QG2 . 25502 1 108 . 1 1 10 10 ILE HD11 H 1 0.995 0.004 . . . . . . 10 ILE QD1 . 25502 1 109 . 1 1 10 10 ILE HD12 H 1 0.995 0.004 . . . . . . 10 ILE QD1 . 25502 1 110 . 1 1 10 10 ILE HD13 H 1 0.995 0.004 . . . . . . 10 ILE QD1 . 25502 1 111 . 1 1 10 10 ILE CA C 13 58.159 0.015 . . . . . . 10 ILE CA . 25502 1 112 . 1 1 10 10 ILE CB C 13 37.703 0.096 . . . . . . 10 ILE CB . 25502 1 113 . 1 1 10 10 ILE CG1 C 13 27.012 0.050 . . . . . . 10 ILE CG1 . 25502 1 114 . 1 1 10 10 ILE CG2 C 13 18.415 0.007 . . . . . . 10 ILE CG2 . 25502 1 115 . 1 1 10 10 ILE CD1 C 13 11.271 0.050 . . . . . . 10 ILE CD1 . 25502 1 116 . 1 1 10 10 ILE N N 15 124.122 0.080 . . . . . . 10 ILE N . 25502 1 117 . 1 1 11 11 ALA H H 1 9.603 0.007 . . . . . . 11 ALA H . 25502 1 118 . 1 1 11 11 ALA HA H 1 5.165 0.004 . . . . . . 11 ALA HA . 25502 1 119 . 1 1 11 11 ALA HB1 H 1 1.055 0.009 . . . . . . 11 ALA QB . 25502 1 120 . 1 1 11 11 ALA HB2 H 1 1.055 0.009 . . . . . . 11 ALA QB . 25502 1 121 . 1 1 11 11 ALA HB3 H 1 1.055 0.009 . . . . . . 11 ALA QB . 25502 1 122 . 1 1 11 11 ALA CA C 13 50.664 0.010 . . . . . . 11 ALA CA . 25502 1 123 . 1 1 11 11 ALA CB C 13 22.561 0.008 . . . . . . 11 ALA CB . 25502 1 124 . 1 1 11 11 ALA N N 15 132.244 0.080 . . . . . . 11 ALA N . 25502 1 125 . 1 1 12 12 VAL H H 1 8.943 0.008 . . . . . . 12 VAL H . 25502 1 126 . 1 1 12 12 VAL HA H 1 4.511 0.004 . . . . . . 12 VAL HA . 25502 1 127 . 1 1 12 12 VAL HB H 1 1.787 0.007 . . . . . . 12 VAL HB . 25502 1 128 . 1 1 12 12 VAL HG11 H 1 0.335 0.006 . . . . . . 12 VAL QG1 . 25502 1 129 . 1 1 12 12 VAL HG12 H 1 0.335 0.006 . . . . . . 12 VAL QG1 . 25502 1 130 . 1 1 12 12 VAL HG13 H 1 0.335 0.006 . . . . . . 12 VAL QG1 . 25502 1 131 . 1 1 12 12 VAL HG21 H 1 0.653 0.008 . . . . . . 12 VAL QG2 . 25502 1 132 . 1 1 12 12 VAL HG22 H 1 0.653 0.008 . . . . . . 12 VAL QG2 . 25502 1 133 . 1 1 12 12 VAL HG23 H 1 0.653 0.008 . . . . . . 12 VAL QG2 . 25502 1 134 . 1 1 12 12 VAL CA C 13 60.426 0.084 . . . . . . 12 VAL CA . 25502 1 135 . 1 1 12 12 VAL CB C 13 33.181 0.055 . . . . . . 12 VAL CB . 25502 1 136 . 1 1 12 12 VAL CG1 C 13 21.124 0.006 . . . . . . 12 VAL CG1 . 25502 1 137 . 1 1 12 12 VAL CG2 C 13 21.463 0.060 . . . . . . 12 VAL CG2 . 25502 1 138 . 1 1 12 12 VAL N N 15 118.199 0.090 . . . . . . 12 VAL N . 25502 1 139 . 1 1 13 13 ASP H H 1 9.846 0.004 . . . . . . 13 ASP H . 25502 1 140 . 1 1 13 13 ASP HA H 1 4.320 0.007 . . . . . . 13 ASP HA . 25502 1 141 . 1 1 13 13 ASP HB2 H 1 3.101 0.011 . . . . . . 13 ASP HB2 . 25502 1 142 . 1 1 13 13 ASP HB3 H 1 2.512 0.011 . . . . . . 13 ASP HB3 . 25502 1 143 . 1 1 13 13 ASP CA C 13 55.826 0.020 . . . . . . 13 ASP CA . 25502 1 144 . 1 1 13 13 ASP CB C 13 39.835 0.063 . . . . . . 13 ASP CB . 25502 1 145 . 1 1 13 13 ASP N N 15 130.748 0.050 . . . . . . 13 ASP N . 25502 1 146 . 1 1 14 14 GLY H H 1 8.558 0.004 . . . . . . 14 GLY H . 25502 1 147 . 1 1 14 14 GLY HA2 H 1 3.420 0.004 . . . . . . 14 GLY HA2 . 25502 1 148 . 1 1 14 14 GLY HA3 H 1 4.215 0.010 . . . . . . 14 GLY HA3 . 25502 1 149 . 1 1 14 14 GLY CA C 13 45.082 0.001 . . . . . . 14 GLY CA . 25502 1 150 . 1 1 14 14 GLY N N 15 101.493 0.050 . . . . . . 14 GLY N . 25502 1 151 . 1 1 15 15 GLU H H 1 8.046 0.002 . . . . . . 15 GLU H . 25502 1 152 . 1 1 15 15 GLU HA H 1 4.836 0.003 . . . . . . 15 GLU HA . 25502 1 153 . 1 1 15 15 GLU HB2 H 1 2.093 0.005 . . . . . . 15 GLU HB2 . 25502 1 154 . 1 1 15 15 GLU HB3 H 1 1.987 0.023 . . . . . . 15 GLU HB3 . 25502 1 155 . 1 1 15 15 GLU HG2 H 1 2.290 0.005 . . . . . . 15 GLU HG2 . 25502 1 156 . 1 1 15 15 GLU HG3 H 1 2.198 0.006 . . . . . . 15 GLU HG3 . 25502 1 157 . 1 1 15 15 GLU CA C 13 52.753 0.030 . . . . . . 15 GLU CA . 25502 1 158 . 1 1 15 15 GLU CB C 13 30.236 0.001 . . . . . . 15 GLU CB . 25502 1 159 . 1 1 15 15 GLU CG C 13 35.635 0.081 . . . . . . 15 GLU CG . 25502 1 160 . 1 1 15 15 GLU N N 15 123.014 0.060 . . . . . . 15 GLU N . 25502 1 161 . 1 1 16 16 PRO HA H 1 4.176 0.004 . . . . . . 16 PRO HA . 25502 1 162 . 1 1 16 16 PRO HB2 H 1 1.886 0.007 . . . . . . 16 PRO HB2 . 25502 1 163 . 1 1 16 16 PRO HB3 H 1 2.326 0.007 . . . . . . 16 PRO HB3 . 25502 1 164 . 1 1 16 16 PRO HG2 H 1 2.150 0.003 . . . . . . 16 PRO HG2 . 25502 1 165 . 1 1 16 16 PRO HG3 H 1 1.982 0.005 . . . . . . 16 PRO HG3 . 25502 1 166 . 1 1 16 16 PRO HD2 H 1 3.953 0.008 . . . . . . 16 PRO HD2 . 25502 1 167 . 1 1 16 16 PRO HD3 H 1 3.726 0.004 . . . . . . 16 PRO HD3 . 25502 1 168 . 1 1 16 16 PRO CA C 13 64.546 0.023 . . . . . . 16 PRO CA . 25502 1 169 . 1 1 16 16 PRO CB C 13 32.178 0.015 . . . . . . 16 PRO CB . 25502 1 170 . 1 1 16 16 PRO CG C 13 27.534 0.008 . . . . . . 16 PRO CG . 25502 1 171 . 1 1 16 16 PRO CD C 13 50.906 0.055 . . . . . . 16 PRO CD . 25502 1 172 . 1 1 17 17 LEU H H 1 9.189 0.006 . . . . . . 17 LEU H . 25502 1 173 . 1 1 17 17 LEU HA H 1 4.687 0.006 . . . . . . 17 LEU HA . 25502 1 174 . 1 1 17 17 LEU HB2 H 1 1.603 0.010 . . . . . . 17 LEU HB2 . 25502 1 175 . 1 1 17 17 LEU HB3 H 1 1.418 0.009 . . . . . . 17 LEU HB3 . 25502 1 176 . 1 1 17 17 LEU HG H 1 1.564 0.007 . . . . . . 17 LEU HG . 25502 1 177 . 1 1 17 17 LEU HD11 H 1 0.985 0.008 . . . . . . 17 LEU QD1 . 25502 1 178 . 1 1 17 17 LEU HD12 H 1 0.985 0.008 . . . . . . 17 LEU QD1 . 25502 1 179 . 1 1 17 17 LEU HD13 H 1 0.985 0.008 . . . . . . 17 LEU QD1 . 25502 1 180 . 1 1 17 17 LEU HD21 H 1 0.826 0.003 . . . . . . 17 LEU QD2 . 25502 1 181 . 1 1 17 17 LEU HD22 H 1 0.826 0.003 . . . . . . 17 LEU QD2 . 25502 1 182 . 1 1 17 17 LEU HD23 H 1 0.826 0.003 . . . . . . 17 LEU QD2 . 25502 1 183 . 1 1 17 17 LEU CA C 13 55.348 0.000 . . . . . . 17 LEU CA . 25502 1 184 . 1 1 17 17 LEU CB C 13 44.157 0.083 . . . . . . 17 LEU CB . 25502 1 185 . 1 1 17 17 LEU CD1 C 13 25.716 0.010 . . . . . . 17 LEU CD1 . 25502 1 186 . 1 1 17 17 LEU N N 15 125.784 0.050 . . . . . . 17 LEU N . 25502 1 187 . 1 1 18 18 GLY H H 1 7.256 0.013 . . . . . . 18 GLY H . 25502 1 188 . 1 1 18 18 GLY HA2 H 1 4.262 0.004 . . . . . . 18 GLY HA2 . 25502 1 189 . 1 1 18 18 GLY HA3 H 1 3.955 0.006 . . . . . . 18 GLY HA3 . 25502 1 190 . 1 1 18 18 GLY CA C 13 44.969 0.010 . . . . . . 18 GLY CA . 25502 1 191 . 1 1 18 18 GLY N N 15 102.200 0.055 . . . . . . 18 GLY N . 25502 1 192 . 1 1 19 19 ARG H H 1 8.320 0.002 . . . . . . 19 ARG H . 25502 1 193 . 1 1 19 19 ARG HA H 1 5.622 0.008 . . . . . . 19 ARG HA . 25502 1 194 . 1 1 19 19 ARG HB2 H 1 1.992 0.005 . . . . . . 19 ARG HB2 . 25502 1 195 . 1 1 19 19 ARG HB3 H 1 1.620 0.007 . . . . . . 19 ARG HB3 . 25502 1 196 . 1 1 19 19 ARG HG2 H 1 1.606 0.001 . . . . . . 19 ARG HG2 . 25502 1 197 . 1 1 19 19 ARG HG3 H 1 1.461 0.011 . . . . . . 19 ARG HG3 . 25502 1 198 . 1 1 19 19 ARG HD2 H 1 2.776 0.013 . . . . . . 19 ARG HD2 . 25502 1 199 . 1 1 19 19 ARG HD3 H 1 2.669 0.010 . . . . . . 19 ARG HD3 . 25502 1 200 . 1 1 19 19 ARG HE H 1 9.025 0.001 . . . . . . 19 ARG HE . 25502 1 201 . 1 1 19 19 ARG CA C 13 55.015 0.086 . . . . . . 19 ARG CA . 25502 1 202 . 1 1 19 19 ARG CB C 13 33.340 0.090 . . . . . . 19 ARG CB . 25502 1 203 . 1 1 19 19 ARG CG C 13 26.902 0.003 . . . . . . 19 ARG CG . 25502 1 204 . 1 1 19 19 ARG CD C 13 43.101 0.099 . . . . . . 19 ARG CD . 25502 1 205 . 1 1 19 19 ARG N N 15 120.995 0.025 . . . . . . 19 ARG N . 25502 1 206 . 1 1 19 19 ARG NE N 15 85.905 0.009 . . . . . . 19 ARG NE . 25502 1 207 . 1 1 20 20 VAL H H 1 9.364 0.011 . . . . . . 20 VAL H . 25502 1 208 . 1 1 20 20 VAL HA H 1 4.603 0.004 . . . . . . 20 VAL HA . 25502 1 209 . 1 1 20 20 VAL HB H 1 1.738 0.008 . . . . . . 20 VAL HB . 25502 1 210 . 1 1 20 20 VAL HG11 H 1 0.513 0.006 . . . . . . 20 VAL QG1 . 25502 1 211 . 1 1 20 20 VAL HG12 H 1 0.513 0.006 . . . . . . 20 VAL QG1 . 25502 1 212 . 1 1 20 20 VAL HG13 H 1 0.513 0.006 . . . . . . 20 VAL QG1 . 25502 1 213 . 1 1 20 20 VAL HG21 H 1 0.852 0.002 . . . . . . 20 VAL QG2 . 25502 1 214 . 1 1 20 20 VAL HG22 H 1 0.852 0.002 . . . . . . 20 VAL QG2 . 25502 1 215 . 1 1 20 20 VAL HG23 H 1 0.852 0.002 . . . . . . 20 VAL QG2 . 25502 1 216 . 1 1 20 20 VAL CA C 13 59.941 0.081 . . . . . . 20 VAL CA . 25502 1 217 . 1 1 20 20 VAL CB C 13 34.883 0.087 . . . . . . 20 VAL CB . 25502 1 218 . 1 1 20 20 VAL CG1 C 13 22.132 0.005 . . . . . . 20 VAL CG1 . 25502 1 219 . 1 1 20 20 VAL CG2 C 13 21.897 0.061 . . . . . . 20 VAL CG2 . 25502 1 220 . 1 1 20 20 VAL N N 15 126.616 0.050 . . . . . . 20 VAL N . 25502 1 221 . 1 1 21 21 SER H H 1 8.768 0.002 . . . . . . 21 SER H . 25502 1 222 . 1 1 21 21 SER HA H 1 5.515 0.006 . . . . . . 21 SER HA . 25502 1 223 . 1 1 21 21 SER HB2 H 1 3.732 0.010 . . . . . . 21 SER HB2 . 25502 1 224 . 1 1 21 21 SER HB3 H 1 3.565 0.008 . . . . . . 21 SER HB3 . 25502 1 225 . 1 1 21 21 SER CA C 13 55.317 0.070 . . . . . . 21 SER CA . 25502 1 226 . 1 1 21 21 SER CB C 13 66.791 0.015 . . . . . . 21 SER CB . 25502 1 227 . 1 1 21 21 SER N N 15 120.061 0.090 . . . . . . 21 SER N . 25502 1 228 . 1 1 22 22 PHE H H 1 9.508 0.009 . . . . . . 22 PHE H . 25502 1 229 . 1 1 22 22 PHE HA H 1 5.237 0.008 . . . . . . 22 PHE HA . 25502 1 230 . 1 1 22 22 PHE HB2 H 1 2.300 0.007 . . . . . . 22 PHE HB2 . 25502 1 231 . 1 1 22 22 PHE HB3 H 1 2.429 0.002 . . . . . . 22 PHE HB3 . 25502 1 232 . 1 1 22 22 PHE HD1 H 1 6.525 0.005 . . . . . . 22 PHE QD . 25502 1 233 . 1 1 22 22 PHE HD2 H 1 6.525 0.005 . . . . . . 22 PHE QD . 25502 1 234 . 1 1 22 22 PHE HE1 H 1 6.155 0.004 . . . . . . 22 PHE QE . 25502 1 235 . 1 1 22 22 PHE HE2 H 1 6.155 0.004 . . . . . . 22 PHE QE . 25502 1 236 . 1 1 22 22 PHE HZ H 1 6.637 0.008 . . . . . . 22 PHE HZ . 25502 1 237 . 1 1 22 22 PHE CA C 13 55.688 0.030 . . . . . . 22 PHE CA . 25502 1 238 . 1 1 22 22 PHE CB C 13 42.574 0.053 . . . . . . 22 PHE CB . 25502 1 239 . 1 1 22 22 PHE N N 15 118.878 0.060 . . . . . . 22 PHE N . 25502 1 240 . 1 1 23 23 GLU H H 1 8.740 0.009 . . . . . . 23 GLU H . 25502 1 241 . 1 1 23 23 GLU HA H 1 4.749 0.006 . . . . . . 23 GLU HA . 25502 1 242 . 1 1 23 23 GLU HB2 H 1 1.821 0.019 . . . . . . 23 GLU HB2 . 25502 1 243 . 1 1 23 23 GLU HB3 H 1 1.682 0.001 . . . . . . 23 GLU HB3 . 25502 1 244 . 1 1 23 23 GLU HG2 H 1 2.190 0.004 . . . . . . 23 GLU HG2 . 25502 1 245 . 1 1 23 23 GLU HG3 H 1 1.798 0.009 . . . . . . 23 GLU HG3 . 25502 1 246 . 1 1 23 23 GLU CA C 13 54.949 0.020 . . . . . . 23 GLU CA . 25502 1 247 . 1 1 23 23 GLU CB C 13 31.629 0.000 . . . . . . 23 GLU CB . 25502 1 248 . 1 1 23 23 GLU CG C 13 36.461 0.096 . . . . . . 23 GLU CG . 25502 1 249 . 1 1 23 23 GLU N N 15 122.926 0.075 . . . . . . 23 GLU N . 25502 1 250 . 1 1 24 24 LEU H H 1 8.185 0.002 . . . . . . 24 LEU H . 25502 1 251 . 1 1 24 24 LEU HA H 1 4.697 0.004 . . . . . . 24 LEU HA . 25502 1 252 . 1 1 24 24 LEU HB2 H 1 1.881 0.011 . . . . . . 24 LEU HB2 . 25502 1 253 . 1 1 24 24 LEU HB3 H 1 1.232 0.006 . . . . . . 24 LEU HB3 . 25502 1 254 . 1 1 24 24 LEU HG H 1 1.697 0.011 . . . . . . 24 LEU HG . 25502 1 255 . 1 1 24 24 LEU HD11 H 1 1.102 0.006 . . . . . . 24 LEU QD1 . 25502 1 256 . 1 1 24 24 LEU HD12 H 1 1.102 0.006 . . . . . . 24 LEU QD1 . 25502 1 257 . 1 1 24 24 LEU HD13 H 1 1.102 0.006 . . . . . . 24 LEU QD1 . 25502 1 258 . 1 1 24 24 LEU HD21 H 1 0.461 0.003 . . . . . . 24 LEU QD2 . 25502 1 259 . 1 1 24 24 LEU HD22 H 1 0.461 0.003 . . . . . . 24 LEU QD2 . 25502 1 260 . 1 1 24 24 LEU HD23 H 1 0.461 0.003 . . . . . . 24 LEU QD2 . 25502 1 261 . 1 1 24 24 LEU CA C 13 51.551 0.020 . . . . . . 24 LEU CA . 25502 1 262 . 1 1 24 24 LEU CB C 13 43.120 0.063 . . . . . . 24 LEU CB . 25502 1 263 . 1 1 24 24 LEU CG C 13 26.879 0.002 . . . . . . 24 LEU CG . 25502 1 264 . 1 1 24 24 LEU CD1 C 13 26.654 0.003 . . . . . . 24 LEU CD1 . 25502 1 265 . 1 1 24 24 LEU CD2 C 13 23.050 0.002 . . . . . . 24 LEU CD2 . 25502 1 266 . 1 1 24 24 LEU N N 15 122.262 0.025 . . . . . . 24 LEU N . 25502 1 267 . 1 1 25 25 PHE H H 1 8.815 0.011 . . . . . . 25 PHE H . 25502 1 268 . 1 1 25 25 PHE HA H 1 5.108 0.002 . . . . . . 25 PHE HA . 25502 1 269 . 1 1 25 25 PHE HB2 H 1 2.668 0.007 . . . . . . 25 PHE HB2 . 25502 1 270 . 1 1 25 25 PHE HB3 H 1 3.256 0.004 . . . . . . 25 PHE HB3 . 25502 1 271 . 1 1 25 25 PHE HD1 H 1 6.873 0.010 . . . . . . 25 PHE QD . 25502 1 272 . 1 1 25 25 PHE HD2 H 1 6.873 0.010 . . . . . . 25 PHE QD . 25502 1 273 . 1 1 25 25 PHE HE1 H 1 6.990 0.011 . . . . . . 25 PHE QE . 25502 1 274 . 1 1 25 25 PHE HE2 H 1 6.990 0.011 . . . . . . 25 PHE QE . 25502 1 275 . 1 1 25 25 PHE HZ H 1 6.966 0.012 . . . . . . 25 PHE HZ . 25502 1 276 . 1 1 25 25 PHE CA C 13 54.290 0.002 . . . . . . 25 PHE CA . 25502 1 277 . 1 1 25 25 PHE CB C 13 35.961 0.084 . . . . . . 25 PHE CB . 25502 1 278 . 1 1 25 25 PHE N N 15 124.423 0.022 . . . . . . 25 PHE N . 25502 1 279 . 1 1 26 26 ALA H H 1 8.433 0.005 . . . . . . 26 ALA H . 25502 1 280 . 1 1 26 26 ALA HA H 1 3.771 0.003 . . . . . . 26 ALA HA . 25502 1 281 . 1 1 26 26 ALA HB1 H 1 1.506 0.006 . . . . . . 26 ALA QB . 25502 1 282 . 1 1 26 26 ALA HB2 H 1 1.506 0.006 . . . . . . 26 ALA QB . 25502 1 283 . 1 1 26 26 ALA HB3 H 1 1.506 0.006 . . . . . . 26 ALA QB . 25502 1 284 . 1 1 26 26 ALA CA C 13 54.286 0.096 . . . . . . 26 ALA CA . 25502 1 285 . 1 1 26 26 ALA CB C 13 18.625 0.002 . . . . . . 26 ALA CB . 25502 1 286 . 1 1 26 26 ALA N N 15 128.683 0.082 . . . . . . 26 ALA N . 25502 1 287 . 1 1 27 27 ASP H H 1 9.052 0.003 . . . . . . 27 ASP H . 25502 1 288 . 1 1 27 27 ASP HA H 1 4.243 0.006 . . . . . . 27 ASP HA . 25502 1 289 . 1 1 27 27 ASP HB2 H 1 2.842 0.009 . . . . . . 27 ASP HB2 . 25502 1 290 . 1 1 27 27 ASP HB3 H 1 2.730 0.005 . . . . . . 27 ASP HB3 . 25502 1 291 . 1 1 27 27 ASP CA C 13 55.328 0.120 . . . . . . 27 ASP CA . 25502 1 292 . 1 1 27 27 ASP CB C 13 38.855 0.005 . . . . . . 27 ASP CB . 25502 1 293 . 1 1 27 27 ASP N N 15 114.069 0.089 . . . . . . 27 ASP N . 25502 1 294 . 1 1 28 28 LYS H H 1 7.545 0.003 . . . . . . 28 LYS H . 25502 1 295 . 1 1 28 28 LYS HA H 1 4.571 0.007 . . . . . . 28 LYS HA . 25502 1 296 . 1 1 28 28 LYS HB2 H 1 1.771 0.001 . . . . . . 28 LYS QB . 25502 1 297 . 1 1 28 28 LYS HB3 H 1 1.771 0.001 . . . . . . 28 LYS QB . 25502 1 298 . 1 1 28 28 LYS HG2 H 1 1.391 0.013 . . . . . . 28 LYS HG2 . 25502 1 299 . 1 1 28 28 LYS HG3 H 1 1.383 0.011 . . . . . . 28 LYS HG3 . 25502 1 300 . 1 1 28 28 LYS HD2 H 1 1.566 0.004 . . . . . . 28 LYS HD2 . 25502 1 301 . 1 1 28 28 LYS HD3 H 1 1.408 0.004 . . . . . . 28 LYS HD3 . 25502 1 302 . 1 1 28 28 LYS HE2 H 1 2.829 0.008 . . . . . . 28 LYS QE . 25502 1 303 . 1 1 28 28 LYS HE3 H 1 2.829 0.008 . . . . . . 28 LYS QE . 25502 1 304 . 1 1 28 28 LYS CA C 13 56.232 0.035 . . . . . . 28 LYS CA . 25502 1 305 . 1 1 28 28 LYS CB C 13 35.922 0.008 . . . . . . 28 LYS CB . 25502 1 306 . 1 1 28 28 LYS CG C 13 24.831 0.006 . . . . . . 28 LYS CG . 25502 1 307 . 1 1 28 28 LYS CD C 13 28.421 0.005 . . . . . . 28 LYS CD . 25502 1 308 . 1 1 28 28 LYS CE C 13 41.734 0.005 . . . . . . 28 LYS CE . 25502 1 309 . 1 1 28 28 LYS N N 15 117.763 0.088 . . . . . . 28 LYS N . 25502 1 310 . 1 1 29 29 VAL H H 1 8.368 0.012 . . . . . . 29 VAL H . 25502 1 311 . 1 1 29 29 VAL HA H 1 4.451 0.002 . . . . . . 29 VAL HA . 25502 1 312 . 1 1 29 29 VAL HB H 1 2.576 0.010 . . . . . . 29 VAL HB . 25502 1 313 . 1 1 29 29 VAL HG11 H 1 0.995 0.007 . . . . . . 29 VAL QG1 . 25502 1 314 . 1 1 29 29 VAL HG12 H 1 0.995 0.007 . . . . . . 29 VAL QG1 . 25502 1 315 . 1 1 29 29 VAL HG13 H 1 0.995 0.007 . . . . . . 29 VAL QG1 . 25502 1 316 . 1 1 29 29 VAL HG21 H 1 1.304 0.007 . . . . . . 29 VAL QG2 . 25502 1 317 . 1 1 29 29 VAL HG22 H 1 1.304 0.007 . . . . . . 29 VAL QG2 . 25502 1 318 . 1 1 29 29 VAL HG23 H 1 1.304 0.007 . . . . . . 29 VAL QG2 . 25502 1 319 . 1 1 29 29 VAL CA C 13 58.089 0.086 . . . . . . 29 VAL CA . 25502 1 320 . 1 1 29 29 VAL CB C 13 31.745 0.006 . . . . . . 29 VAL CB . 25502 1 321 . 1 1 29 29 VAL CG1 C 13 25.217 0.006 . . . . . . 29 VAL CG1 . 25502 1 322 . 1 1 29 29 VAL CG2 C 13 20.581 0.004 . . . . . . 29 VAL CG2 . 25502 1 323 . 1 1 29 29 VAL N N 15 114.212 0.088 . . . . . . 29 VAL N . 25502 1 324 . 1 1 30 30 PRO HA H 1 4.395 0.002 . . . . . . 30 PRO HA . 25502 1 325 . 1 1 30 30 PRO HB2 H 1 1.959 0.017 . . . . . . 30 PRO HB2 . 25502 1 326 . 1 1 30 30 PRO HB3 H 1 2.610 0.007 . . . . . . 30 PRO HB3 . 25502 1 327 . 1 1 30 30 PRO HG2 H 1 2.067 0.017 . . . . . . 30 PRO HG2 . 25502 1 328 . 1 1 30 30 PRO HG3 H 1 2.102 0.007 . . . . . . 30 PRO HG3 . 25502 1 329 . 1 1 30 30 PRO HD2 H 1 3.540 0.002 . . . . . . 30 PRO HD2 . 25502 1 330 . 1 1 30 30 PRO HD3 H 1 3.097 0.008 . . . . . . 30 PRO HD3 . 25502 1 331 . 1 1 30 30 PRO CA C 13 66.083 0.006 . . . . . . 30 PRO CA . 25502 1 332 . 1 1 30 30 PRO CB C 13 31.304 0.008 . . . . . . 30 PRO CB . 25502 1 333 . 1 1 30 30 PRO CG C 13 27.233 0.006 . . . . . . 30 PRO CG . 25502 1 334 . 1 1 30 30 PRO CD C 13 50.491 0.069 . . . . . . 30 PRO CD . 25502 1 335 . 1 1 31 31 LYS H H 1 10.663 0.002 . . . . . . 31 LYS H . 25502 1 336 . 1 1 31 31 LYS HA H 1 4.007 0.007 . . . . . . 31 LYS HA . 25502 1 337 . 1 1 31 31 LYS HB2 H 1 1.695 0.003 . . . . . . 31 LYS HB2 . 25502 1 338 . 1 1 31 31 LYS HB3 H 1 1.536 0.009 . . . . . . 31 LYS HB3 . 25502 1 339 . 1 1 31 31 LYS HG2 H 1 1.117 0.009 . . . . . . 31 LYS HG2 . 25502 1 340 . 1 1 31 31 LYS HG3 H 1 0.891 0.007 . . . . . . 31 LYS HG3 . 25502 1 341 . 1 1 31 31 LYS HD2 H 1 1.416 0.007 . . . . . . 31 LYS HD2 . 25502 1 342 . 1 1 31 31 LYS HD3 H 1 1.312 0.008 . . . . . . 31 LYS HD3 . 25502 1 343 . 1 1 31 31 LYS HE2 H 1 2.075 0.014 . . . . . . 31 LYS HE2 . 25502 1 344 . 1 1 31 31 LYS HE3 H 1 1.858 0.017 . . . . . . 31 LYS HE3 . 25502 1 345 . 1 1 31 31 LYS CA C 13 60.356 0.107 . . . . . . 31 LYS CA . 25502 1 346 . 1 1 31 31 LYS CB C 13 32.279 0.002 . . . . . . 31 LYS CB . 25502 1 347 . 1 1 31 31 LYS CG C 13 26.446 0.008 . . . . . . 31 LYS CG . 25502 1 348 . 1 1 31 31 LYS CD C 13 29.560 0.008 . . . . . . 31 LYS CD . 25502 1 349 . 1 1 31 31 LYS CE C 13 41.238 0.008 . . . . . . 31 LYS CE . 25502 1 350 . 1 1 31 31 LYS N N 15 123.500 0.078 . . . . . . 31 LYS N . 25502 1 351 . 1 1 32 32 THR H H 1 10.283 0.013 . . . . . . 32 THR H . 25502 1 352 . 1 1 32 32 THR HA H 1 3.988 0.004 . . . . . . 32 THR HA . 25502 1 353 . 1 1 32 32 THR HB H 1 4.160 0.008 . . . . . . 32 THR HB . 25502 1 354 . 1 1 32 32 THR HG1 H 1 7.753 0.002 . . . . . . 32 THR HG1 . 25502 1 355 . 1 1 32 32 THR HG21 H 1 0.921 0.005 . . . . . . 32 THR QG2 . 25502 1 356 . 1 1 32 32 THR HG22 H 1 0.921 0.005 . . . . . . 32 THR QG2 . 25502 1 357 . 1 1 32 32 THR HG23 H 1 0.921 0.005 . . . . . . 32 THR QG2 . 25502 1 358 . 1 1 32 32 THR CA C 13 67.678 0.008 . . . . . . 32 THR CA . 25502 1 359 . 1 1 32 32 THR CB C 13 68.897 0.008 . . . . . . 32 THR CB . 25502 1 360 . 1 1 32 32 THR CG2 C 13 22.221 0.008 . . . . . . 32 THR CG2 . 25502 1 361 . 1 1 32 32 THR N N 15 123.707 0.088 . . . . . . 32 THR N . 25502 1 362 . 1 1 33 33 ALA H H 1 9.281 0.007 . . . . . . 33 ALA H . 25502 1 363 . 1 1 33 33 ALA HA H 1 4.037 0.009 . . . . . . 33 ALA HA . 25502 1 364 . 1 1 33 33 ALA HB1 H 1 1.436 0.004 . . . . . . 33 ALA QB . 25502 1 365 . 1 1 33 33 ALA HB2 H 1 1.436 0.004 . . . . . . 33 ALA QB . 25502 1 366 . 1 1 33 33 ALA HB3 H 1 1.436 0.004 . . . . . . 33 ALA QB . 25502 1 367 . 1 1 33 33 ALA CA C 13 55.867 0.070 . . . . . . 33 ALA CA . 25502 1 368 . 1 1 33 33 ALA CB C 13 18.235 0.008 . . . . . . 33 ALA CB . 25502 1 369 . 1 1 33 33 ALA N N 15 125.366 0.088 . . . . . . 33 ALA N . 25502 1 370 . 1 1 34 34 GLU H H 1 8.027 0.004 . . . . . . 34 GLU H . 25502 1 371 . 1 1 34 34 GLU HA H 1 4.509 0.008 . . . . . . 34 GLU HA . 25502 1 372 . 1 1 34 34 GLU HB2 H 1 2.262 0.007 . . . . . . 34 GLU HB2 . 25502 1 373 . 1 1 34 34 GLU HB3 H 1 1.750 0.004 . . . . . . 34 GLU HB3 . 25502 1 374 . 1 1 34 34 GLU HG2 H 1 2.459 0.017 . . . . . . 34 GLU HG2 . 25502 1 375 . 1 1 34 34 GLU HG3 H 1 2.028 0.010 . . . . . . 34 GLU HG3 . 25502 1 376 . 1 1 34 34 GLU CA C 13 57.886 0.065 . . . . . . 34 GLU CA . 25502 1 377 . 1 1 34 34 GLU CB C 13 27.925 0.007 . . . . . . 34 GLU CB . 25502 1 378 . 1 1 34 34 GLU CG C 13 33.577 0.072 . . . . . . 34 GLU CG . 25502 1 379 . 1 1 34 34 GLU N N 15 117.040 0.088 . . . . . . 34 GLU N . 25502 1 380 . 1 1 35 35 ASN H H 1 7.139 0.002 . . . . . . 35 ASN H . 25502 1 381 . 1 1 35 35 ASN HA H 1 4.054 0.004 . . . . . . 35 ASN HA . 25502 1 382 . 1 1 35 35 ASN HB2 H 1 2.400 0.004 . . . . . . 35 ASN HB2 . 25502 1 383 . 1 1 35 35 ASN HB3 H 1 2.931 0.005 . . . . . . 35 ASN HB3 . 25502 1 384 . 1 1 35 35 ASN HD21 H 1 8.981 0.003 . . . . . . 35 ASN HD21 . 25502 1 385 . 1 1 35 35 ASN HD22 H 1 6.797 0.003 . . . . . . 35 ASN HD22 . 25502 1 386 . 1 1 35 35 ASN CA C 13 56.631 0.055 . . . . . . 35 ASN CA . 25502 1 387 . 1 1 35 35 ASN CB C 13 39.465 0.069 . . . . . . 35 ASN CB . 25502 1 388 . 1 1 35 35 ASN N N 15 115.398 0.056 . . . . . . 35 ASN N . 25502 1 389 . 1 1 35 35 ASN ND2 N 15 115.042 0.009 . . . . . . 35 ASN ND2 . 25502 1 390 . 1 1 36 36 PHE H H 1 7.012 0.008 . . . . . . 36 PHE H . 25502 1 391 . 1 1 36 36 PHE HA H 1 4.109 0.012 . . . . . . 36 PHE HA . 25502 1 392 . 1 1 36 36 PHE HB2 H 1 3.049 0.008 . . . . . . 36 PHE HB2 . 25502 1 393 . 1 1 36 36 PHE HB3 H 1 2.956 0.003 . . . . . . 36 PHE HB3 . 25502 1 394 . 1 1 36 36 PHE HD1 H 1 6.423 0.008 . . . . . . 36 PHE QD . 25502 1 395 . 1 1 36 36 PHE HD2 H 1 6.423 0.008 . . . . . . 36 PHE QD . 25502 1 396 . 1 1 36 36 PHE HE1 H 1 5.559 0.004 . . . . . . 36 PHE QE . 25502 1 397 . 1 1 36 36 PHE HE2 H 1 5.559 0.004 . . . . . . 36 PHE QE . 25502 1 398 . 1 1 36 36 PHE CA C 13 61.391 0.002 . . . . . . 36 PHE CA . 25502 1 399 . 1 1 36 36 PHE CB C 13 40.013 0.002 . . . . . . 36 PHE CB . 25502 1 400 . 1 1 36 36 PHE N N 15 117.607 0.054 . . . . . . 36 PHE N . 25502 1 401 . 1 1 37 37 ARG H H 1 8.935 0.010 . . . . . . 37 ARG H . 25502 1 402 . 1 1 37 37 ARG HA H 1 3.632 0.005 . . . . . . 37 ARG HA . 25502 1 403 . 1 1 37 37 ARG HB2 H 1 1.943 0.014 . . . . . . 37 ARG HB2 . 25502 1 404 . 1 1 37 37 ARG HB3 H 1 1.833 0.005 . . . . . . 37 ARG HB3 . 25502 1 405 . 1 1 37 37 ARG HG2 H 1 1.495 0.011 . . . . . . 37 ARG HG2 . 25502 1 406 . 1 1 37 37 ARG HG3 H 1 1.010 0.010 . . . . . . 37 ARG HG3 . 25502 1 407 . 1 1 37 37 ARG HD2 H 1 3.534 0.005 . . . . . . 37 ARG HD2 . 25502 1 408 . 1 1 37 37 ARG HD3 H 1 2.813 0.003 . . . . . . 37 ARG HD3 . 25502 1 409 . 1 1 37 37 ARG HE H 1 8.907 0.002 . . . . . . 37 ARG HE . 25502 1 410 . 1 1 37 37 ARG CA C 13 60.381 0.048 . . . . . . 37 ARG CA . 25502 1 411 . 1 1 37 37 ARG CB C 13 29.860 0.006 . . . . . . 37 ARG CB . 25502 1 412 . 1 1 37 37 ARG CD C 13 41.075 0.079 . . . . . . 37 ARG CD . 25502 1 413 . 1 1 37 37 ARG N N 15 120.804 0.078 . . . . . . 37 ARG N . 25502 1 414 . 1 1 37 37 ARG NE N 15 118.446 0.006 . . . . . . 37 ARG NE . 25502 1 415 . 1 1 38 38 ALA H H 1 8.687 0.003 . . . . . . 38 ALA H . 25502 1 416 . 1 1 38 38 ALA HA H 1 4.069 0.005 . . . . . . 38 ALA HA . 25502 1 417 . 1 1 38 38 ALA HB1 H 1 1.239 0.006 . . . . . . 38 ALA QB . 25502 1 418 . 1 1 38 38 ALA HB2 H 1 1.239 0.006 . . . . . . 38 ALA QB . 25502 1 419 . 1 1 38 38 ALA HB3 H 1 1.239 0.006 . . . . . . 38 ALA QB . 25502 1 420 . 1 1 38 38 ALA CA C 13 54.340 0.006 . . . . . . 38 ALA CA . 25502 1 421 . 1 1 38 38 ALA CB C 13 18.235 0.006 . . . . . . 38 ALA CB . 25502 1 422 . 1 1 38 38 ALA N N 15 118.869 0.006 . . . . . . 38 ALA N . 25502 1 423 . 1 1 39 39 LEU H H 1 8.173 0.017 . . . . . . 39 LEU H . 25502 1 424 . 1 1 39 39 LEU HA H 1 3.744 0.003 . . . . . . 39 LEU HA . 25502 1 425 . 1 1 39 39 LEU HB2 H 1 1.359 0.010 . . . . . . 39 LEU HB2 . 25502 1 426 . 1 1 39 39 LEU HB3 H 1 -0.328 0.006 . . . . . . 39 LEU HB3 . 25502 1 427 . 1 1 39 39 LEU HG H 1 1.754 0.005 . . . . . . 39 LEU HG . 25502 1 428 . 1 1 39 39 LEU HD11 H 1 0.873 0.009 . . . . . . 39 LEU QD1 . 25502 1 429 . 1 1 39 39 LEU HD12 H 1 0.873 0.009 . . . . . . 39 LEU QD1 . 25502 1 430 . 1 1 39 39 LEU HD13 H 1 0.873 0.009 . . . . . . 39 LEU QD1 . 25502 1 431 . 1 1 39 39 LEU HD21 H 1 0.533 0.002 . . . . . . 39 LEU QD2 . 25502 1 432 . 1 1 39 39 LEU HD22 H 1 0.533 0.002 . . . . . . 39 LEU QD2 . 25502 1 433 . 1 1 39 39 LEU HD23 H 1 0.533 0.002 . . . . . . 39 LEU QD2 . 25502 1 434 . 1 1 39 39 LEU CA C 13 57.115 0.006 . . . . . . 39 LEU CA . 25502 1 435 . 1 1 39 39 LEU CB C 13 41.026 0.099 . . . . . . 39 LEU CB . 25502 1 436 . 1 1 39 39 LEU CG C 13 26.156 0.006 . . . . . . 39 LEU CG . 25502 1 437 . 1 1 39 39 LEU CD1 C 13 26.654 0.008 . . . . . . 39 LEU CD1 . 25502 1 438 . 1 1 39 39 LEU CD2 C 13 24.159 0.006 . . . . . . 39 LEU CD2 . 25502 1 439 . 1 1 39 39 LEU N N 15 120.488 0.006 . . . . . . 39 LEU N . 25502 1 440 . 1 1 40 40 SER H H 1 7.900 0.006 . . . . . . 40 SER H . 25502 1 441 . 1 1 40 40 SER HA H 1 4.444 0.003 . . . . . . 40 SER HA . 25502 1 442 . 1 1 40 40 SER HB2 H 1 4.227 0.011 . . . . . . 40 SER HB2 . 25502 1 443 . 1 1 40 40 SER HB3 H 1 3.529 0.007 . . . . . . 40 SER HB3 . 25502 1 444 . 1 1 40 40 SER HG H 1 3.437 0.003 . . . . . . 40 SER HG . 25502 1 445 . 1 1 40 40 SER CA C 13 62.334 0.006 . . . . . . 40 SER CA . 25502 1 446 . 1 1 40 40 SER CB C 13 62.884 0.103 . . . . . . 40 SER CB . 25502 1 447 . 1 1 40 40 SER N N 15 118.952 0.006 . . . . . . 40 SER N . 25502 1 448 . 1 1 41 41 THR H H 1 7.974 0.009 . . . . . . 41 THR H . 25502 1 449 . 1 1 41 41 THR HA H 1 4.288 0.005 . . . . . . 41 THR HA . 25502 1 450 . 1 1 41 41 THR HB H 1 4.472 0.009 . . . . . . 41 THR HB . 25502 1 451 . 1 1 41 41 THR HG1 H 1 6.692 0.028 . . . . . . 41 THR HG1 . 25502 1 452 . 1 1 41 41 THR HG21 H 1 1.319 0.007 . . . . . . 41 THR QG2 . 25502 1 453 . 1 1 41 41 THR HG22 H 1 1.319 0.007 . . . . . . 41 THR QG2 . 25502 1 454 . 1 1 41 41 THR HG23 H 1 1.319 0.007 . . . . . . 41 THR QG2 . 25502 1 455 . 1 1 41 41 THR CA C 13 62.810 0.091 . . . . . . 41 THR CA . 25502 1 456 . 1 1 41 41 THR CB C 13 69.221 0.006 . . . . . . 41 THR CB . 25502 1 457 . 1 1 41 41 THR CG2 C 13 22.342 0.006 . . . . . . 41 THR CG2 . 25502 1 458 . 1 1 41 41 THR N N 15 108.208 0.006 . . . . . . 41 THR N . 25502 1 459 . 1 1 42 42 GLY H H 1 7.582 0.006 . . . . . . 42 GLY H . 25502 1 460 . 1 1 42 42 GLY HA2 H 1 3.870 0.014 . . . . . . 42 GLY HA2 . 25502 1 461 . 1 1 42 42 GLY HA3 H 1 3.485 0.011 . . . . . . 42 GLY HA3 . 25502 1 462 . 1 1 42 42 GLY CA C 13 45.757 0.006 . . . . . . 42 GLY CA . 25502 1 463 . 1 1 42 42 GLY N N 15 108.122 0.006 . . . . . . 42 GLY N . 25502 1 464 . 1 1 43 43 GLU H H 1 8.009 0.004 . . . . . . 43 GLU H . 25502 1 465 . 1 1 43 43 GLU HA H 1 4.120 0.009 . . . . . . 43 GLU HA . 25502 1 466 . 1 1 43 43 GLU HB2 H 1 2.202 0.007 . . . . . . 43 GLU HB2 . 25502 1 467 . 1 1 43 43 GLU HB3 H 1 2.044 0.008 . . . . . . 43 GLU HB3 . 25502 1 468 . 1 1 43 43 GLU HG2 H 1 2.133 0.014 . . . . . . 43 GLU HG2 . 25502 1 469 . 1 1 43 43 GLU HG3 H 1 1.790 0.007 . . . . . . 43 GLU HG3 . 25502 1 470 . 1 1 43 43 GLU CA C 13 58.357 0.006 . . . . . . 43 GLU CA . 25502 1 471 . 1 1 43 43 GLU CB C 13 29.942 0.002 . . . . . . 43 GLU CB . 25502 1 472 . 1 1 43 43 GLU CG C 13 35.210 0.013 . . . . . . 43 GLU CG . 25502 1 473 . 1 1 43 43 GLU N N 15 118.454 0.006 . . . . . . 43 GLU N . 25502 1 474 . 1 1 44 44 LYS H H 1 9.102 0.001 . . . . . . 44 LYS H . 25502 1 475 . 1 1 44 44 LYS HA H 1 4.281 0.008 . . . . . . 44 LYS HA . 25502 1 476 . 1 1 44 44 LYS HB2 H 1 1.612 0.009 . . . . . . 44 LYS HB2 . 25502 1 477 . 1 1 44 44 LYS HB3 H 1 0.896 0.003 . . . . . . 44 LYS HB3 . 25502 1 478 . 1 1 44 44 LYS HG2 H 1 1.037 0.004 . . . . . . 44 LYS QG . 25502 1 479 . 1 1 44 44 LYS HG3 H 1 1.037 0.004 . . . . . . 44 LYS QG . 25502 1 480 . 1 1 44 44 LYS HD2 H 1 1.440 0.006 . . . . . . 44 LYS QD . 25502 1 481 . 1 1 44 44 LYS HD3 H 1 1.440 0.006 . . . . . . 44 LYS QD . 25502 1 482 . 1 1 44 44 LYS HE2 H 1 2.828 0.007 . . . . . . 44 LYS HE2 . 25502 1 483 . 1 1 44 44 LYS HE3 H 1 2.673 0.002 . . . . . . 44 LYS HE3 . 25502 1 484 . 1 1 44 44 LYS CA C 13 54.120 0.006 . . . . . . 44 LYS CA . 25502 1 485 . 1 1 44 44 LYS CB C 13 30.296 0.006 . . . . . . 44 LYS CB . 25502 1 486 . 1 1 44 44 LYS CG C 13 24.767 0.006 . . . . . . 44 LYS CG . 25502 1 487 . 1 1 44 44 LYS CD C 13 27.283 0.006 . . . . . . 44 LYS CD . 25502 1 488 . 1 1 44 44 LYS CE C 13 42.257 0.006 . . . . . . 44 LYS CE . 25502 1 489 . 1 1 44 44 LYS N N 15 118.055 0.006 . . . . . . 44 LYS N . 25502 1 490 . 1 1 45 45 GLY H H 1 7.939 0.001 . . . . . . 45 GLY H . 25502 1 491 . 1 1 45 45 GLY HA2 H 1 4.298 0.008 . . . . . . 45 GLY HA2 . 25502 1 492 . 1 1 45 45 GLY HA3 H 1 3.547 0.011 . . . . . . 45 GLY HA3 . 25502 1 493 . 1 1 45 45 GLY CA C 13 44.531 0.129 . . . . . . 45 GLY CA . 25502 1 494 . 1 1 45 45 GLY N N 15 105.305 0.006 . . . . . . 45 GLY N . 25502 1 495 . 1 1 46 46 PHE H H 1 6.413 0.001 . . . . . . 46 PHE H . 25502 1 496 . 1 1 46 46 PHE HA H 1 4.624 0.001 . . . . . . 46 PHE HA . 25502 1 497 . 1 1 46 46 PHE HB2 H 1 3.114 0.005 . . . . . . 46 PHE HB2 . 25502 1 498 . 1 1 46 46 PHE HB3 H 1 2.706 0.001 . . . . . . 46 PHE HB3 . 25502 1 499 . 1 1 46 46 PHE HD1 H 1 6.614 0.006 . . . . . . 46 PHE QD . 25502 1 500 . 1 1 46 46 PHE HD2 H 1 6.614 0.006 . . . . . . 46 PHE QD . 25502 1 501 . 1 1 46 46 PHE HE1 H 1 6.975 0.009 . . . . . . 46 PHE QE . 25502 1 502 . 1 1 46 46 PHE HE2 H 1 6.975 0.009 . . . . . . 46 PHE QE . 25502 1 503 . 1 1 46 46 PHE HZ H 1 7.073 0.012 . . . . . . 46 PHE HZ . 25502 1 504 . 1 1 46 46 PHE CA C 13 53.881 0.006 . . . . . . 46 PHE CA . 25502 1 505 . 1 1 46 46 PHE CB C 13 39.468 0.068 . . . . . . 46 PHE CB . 25502 1 506 . 1 1 46 46 PHE N N 15 113.461 0.006 . . . . . . 46 PHE N . 25502 1 507 . 1 1 47 47 GLY H H 1 7.686 0.006 . . . . . . 47 GLY H . 25502 1 508 . 1 1 47 47 GLY HA2 H 1 4.343 0.010 . . . . . . 47 GLY HA2 . 25502 1 509 . 1 1 47 47 GLY HA3 H 1 2.528 0.008 . . . . . . 47 GLY HA3 . 25502 1 510 . 1 1 47 47 GLY CA C 13 45.458 0.110 . . . . . . 47 GLY CA . 25502 1 511 . 1 1 47 47 GLY N N 15 104.416 0.006 . . . . . . 47 GLY N . 25502 1 512 . 1 1 48 48 TYR H H 1 6.887 0.018 . . . . . . 48 TYR H . 25502 1 513 . 1 1 48 48 TYR HA H 1 4.208 0.007 . . . . . . 48 TYR HA . 25502 1 514 . 1 1 48 48 TYR HB2 H 1 2.645 0.005 . . . . . . 48 TYR HB2 . 25502 1 515 . 1 1 48 48 TYR HB3 H 1 2.819 0.006 . . . . . . 48 TYR HB3 . 25502 1 516 . 1 1 48 48 TYR HD1 H 1 6.764 0.022 . . . . . . 48 TYR QD . 25502 1 517 . 1 1 48 48 TYR HD2 H 1 6.764 0.022 . . . . . . 48 TYR QD . 25502 1 518 . 1 1 48 48 TYR HE1 H 1 6.160 0.005 . . . . . . 48 TYR QE . 25502 1 519 . 1 1 48 48 TYR HE2 H 1 6.160 0.005 . . . . . . 48 TYR QE . 25502 1 520 . 1 1 48 48 TYR CA C 13 57.039 0.046 . . . . . . 48 TYR CA . 25502 1 521 . 1 1 48 48 TYR CB C 13 38.419 0.004 . . . . . . 48 TYR CB . 25502 1 522 . 1 1 48 48 TYR N N 15 113.530 0.006 . . . . . . 48 TYR N . 25502 1 523 . 1 1 49 49 LYS H H 1 8.474 0.001 . . . . . . 49 LYS H . 25502 1 524 . 1 1 49 49 LYS HA H 1 3.595 0.004 . . . . . . 49 LYS HA . 25502 1 525 . 1 1 49 49 LYS HB2 H 1 1.978 0.012 . . . . . . 49 LYS HB2 . 25502 1 526 . 1 1 49 49 LYS HB3 H 1 1.592 0.006 . . . . . . 49 LYS HB3 . 25502 1 527 . 1 1 49 49 LYS HG2 H 1 1.307 0.013 . . . . . . 49 LYS HG2 . 25502 1 528 . 1 1 49 49 LYS HG3 H 1 1.241 0.011 . . . . . . 49 LYS HG3 . 25502 1 529 . 1 1 49 49 LYS HD2 H 1 1.935 0.007 . . . . . . 49 LYS HD2 . 25502 1 530 . 1 1 49 49 LYS HD3 H 1 1.767 0.006 . . . . . . 49 LYS HD3 . 25502 1 531 . 1 1 49 49 LYS HE2 H 1 3.233 0.004 . . . . . . 49 LYS HE2 . 25502 1 532 . 1 1 49 49 LYS HE3 H 1 3.057 0.007 . . . . . . 49 LYS HE3 . 25502 1 533 . 1 1 49 49 LYS CA C 13 60.882 0.006 . . . . . . 49 LYS CA . 25502 1 534 . 1 1 49 49 LYS CB C 13 31.168 0.008 . . . . . . 49 LYS CB . 25502 1 535 . 1 1 49 49 LYS CG C 13 25.346 0.006 . . . . . . 49 LYS CG . 25502 1 536 . 1 1 49 49 LYS CD C 13 29.734 0.005 . . . . . . 49 LYS CD . 25502 1 537 . 1 1 49 49 LYS CE C 13 41.825 0.006 . . . . . . 49 LYS CE . 25502 1 538 . 1 1 49 49 LYS N N 15 124.631 0.006 . . . . . . 49 LYS N . 25502 1 539 . 1 1 50 50 GLY H H 1 9.482 0.001 . . . . . . 50 GLY H . 25502 1 540 . 1 1 50 50 GLY HA2 H 1 4.392 0.007 . . . . . . 50 GLY HA2 . 25502 1 541 . 1 1 50 50 GLY HA3 H 1 3.698 0.006 . . . . . . 50 GLY HA3 . 25502 1 542 . 1 1 50 50 GLY CA C 13 45.041 0.003 . . . . . . 50 GLY CA . 25502 1 543 . 1 1 50 50 GLY N N 15 117.591 0.006 . . . . . . 50 GLY N . 25502 1 544 . 1 1 51 51 SER H H 1 8.397 0.006 . . . . . . 51 SER H . 25502 1 545 . 1 1 51 51 SER HA H 1 4.658 0.006 . . . . . . 51 SER HA . 25502 1 546 . 1 1 51 51 SER HB2 H 1 4.317 0.013 . . . . . . 51 SER HB2 . 25502 1 547 . 1 1 51 51 SER HB3 H 1 4.199 0.007 . . . . . . 51 SER HB3 . 25502 1 548 . 1 1 51 51 SER HG H 1 4.885 0.006 . . . . . . 51 SER HG . 25502 1 549 . 1 1 51 51 SER CA C 13 58.682 0.006 . . . . . . 51 SER CA . 25502 1 550 . 1 1 51 51 SER CB C 13 64.607 0.070 . . . . . . 51 SER CB . 25502 1 551 . 1 1 51 51 SER N N 15 116.156 0.006 . . . . . . 51 SER N . 25502 1 552 . 1 1 52 52 CYS H H 1 9.858 0.001 . . . . . . 52 CYS H . 25502 1 553 . 1 1 52 52 CYS HA H 1 5.895 0.010 . . . . . . 52 CYS HA . 25502 1 554 . 1 1 52 52 CYS HB2 H 1 3.035 0.012 . . . . . . 52 CYS HB2 . 25502 1 555 . 1 1 52 52 CYS HB3 H 1 3.036 0.014 . . . . . . 52 CYS HB3 . 25502 1 556 . 1 1 52 52 CYS CA C 13 55.965 0.006 . . . . . . 52 CYS CA . 25502 1 557 . 1 1 52 52 CYS CB C 13 31.719 0.006 . . . . . . 52 CYS CB . 25502 1 558 . 1 1 52 52 CYS N N 15 114.800 0.006 . . . . . . 52 CYS N . 25502 1 559 . 1 1 53 53 PHE H H 1 8.702 0.001 . . . . . . 53 PHE H . 25502 1 560 . 1 1 53 53 PHE HA H 1 4.853 0.006 . . . . . . 53 PHE HA . 25502 1 561 . 1 1 53 53 PHE HB2 H 1 2.882 0.013 . . . . . . 53 PHE HB2 . 25502 1 562 . 1 1 53 53 PHE HB3 H 1 2.630 0.010 . . . . . . 53 PHE HB3 . 25502 1 563 . 1 1 53 53 PHE HD1 H 1 6.896 0.004 . . . . . . 53 PHE QD . 25502 1 564 . 1 1 53 53 PHE HD2 H 1 6.896 0.004 . . . . . . 53 PHE QD . 25502 1 565 . 1 1 53 53 PHE HE1 H 1 7.187 0.009 . . . . . . 53 PHE QE . 25502 1 566 . 1 1 53 53 PHE HE2 H 1 7.187 0.009 . . . . . . 53 PHE QE . 25502 1 567 . 1 1 53 53 PHE HZ H 1 7.367 0.008 . . . . . . 53 PHE HZ . 25502 1 568 . 1 1 53 53 PHE CA C 13 58.083 0.006 . . . . . . 53 PHE CA . 25502 1 569 . 1 1 53 53 PHE CB C 13 38.728 0.006 . . . . . . 53 PHE CB . 25502 1 570 . 1 1 53 53 PHE N N 15 122.839 0.006 . . . . . . 53 PHE N . 25502 1 571 . 1 1 54 54 HIS H H 1 7.623 0.006 . . . . . . 54 HIS H . 25502 1 572 . 1 1 54 54 HIS HA H 1 4.706 0.003 . . . . . . 54 HIS HA . 25502 1 573 . 1 1 54 54 HIS HB2 H 1 3.272 0.006 . . . . . . 54 HIS HB2 . 25502 1 574 . 1 1 54 54 HIS HB3 H 1 2.819 0.009 . . . . . . 54 HIS HB3 . 25502 1 575 . 1 1 54 54 HIS HD2 H 1 6.843 0.004 . . . . . . 54 HIS HD2 . 25502 1 576 . 1 1 54 54 HIS CA C 13 56.985 0.006 . . . . . . 54 HIS CA . 25502 1 577 . 1 1 54 54 HIS CB C 13 31.344 0.002 . . . . . . 54 HIS CB . 25502 1 578 . 1 1 54 54 HIS N N 15 119.944 0.006 . . . . . . 54 HIS N . 25502 1 579 . 1 1 55 55 ARG H H 1 7.031 0.011 . . . . . . 55 ARG H . 25502 1 580 . 1 1 55 55 ARG HA H 1 5.099 0.008 . . . . . . 55 ARG HA . 25502 1 581 . 1 1 55 55 ARG HB2 H 1 1.383 0.005 . . . . . . 55 ARG HB2 . 25502 1 582 . 1 1 55 55 ARG HB3 H 1 1.245 0.004 . . . . . . 55 ARG HB3 . 25502 1 583 . 1 1 55 55 ARG HG2 H 1 1.559 0.007 . . . . . . 55 ARG HG2 . 25502 1 584 . 1 1 55 55 ARG HG3 H 1 1.216 0.016 . . . . . . 55 ARG HG3 . 25502 1 585 . 1 1 55 55 ARG HD2 H 1 3.164 0.006 . . . . . . 55 ARG HD2 . 25502 1 586 . 1 1 55 55 ARG HD3 H 1 3.121 0.017 . . . . . . 55 ARG HD3 . 25502 1 587 . 1 1 55 55 ARG HE H 1 7.114 0.006 . . . . . . 55 ARG HE . 25502 1 588 . 1 1 55 55 ARG CA C 13 54.703 0.004 . . . . . . 55 ARG CA . 25502 1 589 . 1 1 55 55 ARG CB C 13 33.771 0.054 . . . . . . 55 ARG CB . 25502 1 590 . 1 1 55 55 ARG CG C 13 28.017 0.006 . . . . . . 55 ARG CG . 25502 1 591 . 1 1 55 55 ARG CD C 13 43.502 0.088 . . . . . . 55 ARG CD . 25502 1 592 . 1 1 55 55 ARG N N 15 122.758 0.006 . . . . . . 55 ARG N . 25502 1 593 . 1 1 55 55 ARG NE N 15 83.912 0.006 . . . . . . 55 ARG NE . 25502 1 594 . 1 1 56 56 ILE H H 1 9.166 0.004 . . . . . . 56 ILE H . 25502 1 595 . 1 1 56 56 ILE HA H 1 4.589 0.010 . . . . . . 56 ILE HA . 25502 1 596 . 1 1 56 56 ILE HB H 1 1.574 0.011 . . . . . . 56 ILE HB . 25502 1 597 . 1 1 56 56 ILE HG12 H 1 1.556 0.014 . . . . . . 56 ILE HG12 . 25502 1 598 . 1 1 56 56 ILE HG13 H 1 0.979 0.015 . . . . . . 56 ILE HG13 . 25502 1 599 . 1 1 56 56 ILE HG21 H 1 1.003 0.006 . . . . . . 56 ILE QG2 . 25502 1 600 . 1 1 56 56 ILE HG22 H 1 1.003 0.006 . . . . . . 56 ILE QG2 . 25502 1 601 . 1 1 56 56 ILE HG23 H 1 1.003 0.006 . . . . . . 56 ILE QG2 . 25502 1 602 . 1 1 56 56 ILE HD11 H 1 0.847 0.004 . . . . . . 56 ILE QD1 . 25502 1 603 . 1 1 56 56 ILE HD12 H 1 0.847 0.004 . . . . . . 56 ILE QD1 . 25502 1 604 . 1 1 56 56 ILE HD13 H 1 0.847 0.004 . . . . . . 56 ILE QD1 . 25502 1 605 . 1 1 56 56 ILE CA C 13 61.451 0.006 . . . . . . 56 ILE CA . 25502 1 606 . 1 1 56 56 ILE CB C 13 41.632 0.037 . . . . . . 56 ILE CB . 25502 1 607 . 1 1 56 56 ILE CG1 C 13 27.118 0.005 . . . . . . 56 ILE CG1 . 25502 1 608 . 1 1 56 56 ILE CG2 C 13 17.572 0.006 . . . . . . 56 ILE CG2 . 25502 1 609 . 1 1 56 56 ILE CD1 C 13 14.283 0.006 . . . . . . 56 ILE CD1 . 25502 1 610 . 1 1 56 56 ILE N N 15 126.170 0.006 . . . . . . 56 ILE N . 25502 1 611 . 1 1 57 57 ILE H H 1 8.718 0.009 . . . . . . 57 ILE H . 25502 1 612 . 1 1 57 57 ILE HA H 1 5.197 0.009 . . . . . . 57 ILE HA . 25502 1 613 . 1 1 57 57 ILE HB H 1 1.906 0.006 . . . . . . 57 ILE HB . 25502 1 614 . 1 1 57 57 ILE HG12 H 1 1.454 0.008 . . . . . . 57 ILE HG12 . 25502 1 615 . 1 1 57 57 ILE HG13 H 1 1.148 0.007 . . . . . . 57 ILE HG13 . 25502 1 616 . 1 1 57 57 ILE HG21 H 1 1.111 0.006 . . . . . . 57 ILE QG2 . 25502 1 617 . 1 1 57 57 ILE HG22 H 1 1.111 0.006 . . . . . . 57 ILE QG2 . 25502 1 618 . 1 1 57 57 ILE HG23 H 1 1.111 0.006 . . . . . . 57 ILE QG2 . 25502 1 619 . 1 1 57 57 ILE HD11 H 1 0.917 0.008 . . . . . . 57 ILE QD1 . 25502 1 620 . 1 1 57 57 ILE HD12 H 1 0.917 0.008 . . . . . . 57 ILE QD1 . 25502 1 621 . 1 1 57 57 ILE HD13 H 1 0.917 0.008 . . . . . . 57 ILE QD1 . 25502 1 622 . 1 1 57 57 ILE CA C 13 57.614 0.170 . . . . . . 57 ILE CA . 25502 1 623 . 1 1 57 57 ILE CB C 13 40.015 0.006 . . . . . . 57 ILE CB . 25502 1 624 . 1 1 57 57 ILE CG1 C 13 17.469 0.006 . . . . . . 57 ILE CG1 . 25502 1 625 . 1 1 57 57 ILE CG2 C 13 17.497 0.006 . . . . . . 57 ILE CG2 . 25502 1 626 . 1 1 57 57 ILE CD1 C 13 13.444 0.006 . . . . . . 57 ILE CD1 . 25502 1 627 . 1 1 57 57 ILE N N 15 127.731 0.006 . . . . . . 57 ILE N . 25502 1 628 . 1 1 58 58 PRO HA H 1 4.324 0.013 . . . . . . 58 PRO HA . 25502 1 629 . 1 1 58 58 PRO HB2 H 1 1.811 0.025 . . . . . . 58 PRO HB2 . 25502 1 630 . 1 1 58 58 PRO HB3 H 1 2.196 0.011 . . . . . . 58 PRO HB3 . 25502 1 631 . 1 1 58 58 PRO HG2 H 1 2.037 0.007 . . . . . . 58 PRO HG2 . 25502 1 632 . 1 1 58 58 PRO HG3 H 1 1.863 0.013 . . . . . . 58 PRO HG3 . 25502 1 633 . 1 1 58 58 PRO HD2 H 1 4.002 0.011 . . . . . . 58 PRO HD2 . 25502 1 634 . 1 1 58 58 PRO HD3 H 1 3.448 0.005 . . . . . . 58 PRO HD3 . 25502 1 635 . 1 1 58 58 PRO CA C 13 62.949 0.051 . . . . . . 58 PRO CA . 25502 1 636 . 1 1 58 58 PRO CB C 13 31.911 0.006 . . . . . . 58 PRO CB . 25502 1 637 . 1 1 58 58 PRO CG C 13 26.912 0.003 . . . . . . 58 PRO CG . 25502 1 638 . 1 1 58 58 PRO CD C 13 52.130 0.063 . . . . . . 58 PRO CD . 25502 1 639 . 1 1 59 59 GLY H H 1 9.679 0.006 . . . . . . 59 GLY H . 25502 1 640 . 1 1 59 59 GLY HA2 H 1 4.037 0.004 . . . . . . 59 GLY HA2 . 25502 1 641 . 1 1 59 59 GLY HA3 H 1 3.794 0.012 . . . . . . 59 GLY HA3 . 25502 1 642 . 1 1 59 59 GLY CA C 13 45.178 0.006 . . . . . . 59 GLY CA . 25502 1 643 . 1 1 59 59 GLY N N 15 113.877 0.006 . . . . . . 59 GLY N . 25502 1 644 . 1 1 60 60 PHE H H 1 8.095 0.006 . . . . . . 60 PHE H . 25502 1 645 . 1 1 60 60 PHE HA H 1 5.093 0.011 . . . . . . 60 PHE HA . 25502 1 646 . 1 1 60 60 PHE HB2 H 1 3.152 0.007 . . . . . . 60 PHE HB2 . 25502 1 647 . 1 1 60 60 PHE HB3 H 1 3.028 0.005 . . . . . . 60 PHE HB3 . 25502 1 648 . 1 1 60 60 PHE HD1 H 1 7.271 0.008 . . . . . . 60 PHE QD . 25502 1 649 . 1 1 60 60 PHE HD2 H 1 7.271 0.008 . . . . . . 60 PHE QD . 25502 1 650 . 1 1 60 60 PHE HE1 H 1 7.156 0.013 . . . . . . 60 PHE QE . 25502 1 651 . 1 1 60 60 PHE HE2 H 1 7.156 0.013 . . . . . . 60 PHE QE . 25502 1 652 . 1 1 60 60 PHE CA C 13 56.745 0.089 . . . . . . 60 PHE CA . 25502 1 653 . 1 1 60 60 PHE CB C 13 39.693 0.063 . . . . . . 60 PHE CB . 25502 1 654 . 1 1 60 60 PHE N N 15 118.955 0.006 . . . . . . 60 PHE N . 25502 1 655 . 1 1 61 61 MET H H 1 8.088 0.001 . . . . . . 61 MET H . 25502 1 656 . 1 1 61 61 MET HA H 1 5.311 0.010 . . . . . . 61 MET HA . 25502 1 657 . 1 1 61 61 MET HB2 H 1 1.399 0.014 . . . . . . 61 MET HB2 . 25502 1 658 . 1 1 61 61 MET HB3 H 1 2.149 0.010 . . . . . . 61 MET HB3 . 25502 1 659 . 1 1 61 61 MET HE1 H 1 1.260 0.008 . . . . . . 61 MET QE . 25502 1 660 . 1 1 61 61 MET HE2 H 1 1.260 0.008 . . . . . . 61 MET QE . 25502 1 661 . 1 1 61 61 MET HE3 H 1 1.260 0.008 . . . . . . 61 MET QE . 25502 1 662 . 1 1 61 61 MET CA C 13 54.802 0.006 . . . . . . 61 MET CA . 25502 1 663 . 1 1 61 61 MET CB C 13 34.892 0.006 . . . . . . 61 MET CB . 25502 1 664 . 1 1 61 61 MET CG C 13 28.910 0.006 . . . . . . 61 MET CG . 25502 1 665 . 1 1 61 61 MET CE C 13 18.295 0.006 . . . . . . 61 MET CE . 25502 1 666 . 1 1 61 61 MET N N 15 110.963 0.006 . . . . . . 61 MET N . 25502 1 667 . 1 1 62 62 CYS H H 1 8.474 0.001 . . . . . . 62 CYS H . 25502 1 668 . 1 1 62 62 CYS HA H 1 4.873 0.004 . . . . . . 62 CYS HA . 25502 1 669 . 1 1 62 62 CYS HB2 H 1 2.969 0.012 . . . . . . 62 CYS HB2 . 25502 1 670 . 1 1 62 62 CYS HB3 H 1 2.488 0.010 . . . . . . 62 CYS HB3 . 25502 1 671 . 1 1 62 62 CYS HG H 1 1.618 0.018 . . . . . . 62 CYS HG . 25502 1 672 . 1 1 62 62 CYS CA C 13 57.335 0.006 . . . . . . 62 CYS CA . 25502 1 673 . 1 1 62 62 CYS N N 15 114.627 0.006 . . . . . . 62 CYS N . 25502 1 674 . 1 1 63 63 GLN H H 1 9.651 0.003 . . . . . . 63 GLN H . 25502 1 675 . 1 1 63 63 GLN HA H 1 5.376 0.007 . . . . . . 63 GLN HA . 25502 1 676 . 1 1 63 63 GLN HB2 H 1 2.145 0.004 . . . . . . 63 GLN HB2 . 25502 1 677 . 1 1 63 63 GLN HB3 H 1 1.794 0.008 . . . . . . 63 GLN HB3 . 25502 1 678 . 1 1 63 63 GLN HG2 H 1 2.534 0.013 . . . . . . 63 GLN HG2 . 25502 1 679 . 1 1 63 63 GLN HG3 H 1 1.980 0.006 . . . . . . 63 GLN HG3 . 25502 1 680 . 1 1 63 63 GLN HE21 H 1 6.979 0.006 . . . . . . 63 GLN QE2 . 25502 1 681 . 1 1 63 63 GLN HE22 H 1 6.979 0.006 . . . . . . 63 GLN QE2 . 25502 1 682 . 1 1 63 63 GLN CA C 13 54.524 0.104 . . . . . . 63 GLN CA . 25502 1 683 . 1 1 63 63 GLN CB C 13 30.400 0.006 . . . . . . 63 GLN CB . 25502 1 684 . 1 1 63 63 GLN CG C 13 33.050 0.050 . . . . . . 63 GLN CG . 25502 1 685 . 1 1 63 63 GLN N N 15 126.463 0.006 . . . . . . 63 GLN N . 25502 1 686 . 1 1 63 63 GLN NE2 N 15 109.141 0.006 . . . . . . 63 GLN NE2 . 25502 1 687 . 1 1 64 64 GLY H H 1 7.352 0.010 . . . . . . 64 GLY H . 25502 1 688 . 1 1 64 64 GLY HA2 H 1 3.394 1.041 . . . . . . 64 GLY HA2 . 25502 1 689 . 1 1 64 64 GLY HA3 H 1 4.711 0.006 . . . . . . 64 GLY HA3 . 25502 1 690 . 1 1 64 64 GLY CA C 13 44.400 0.010 . . . . . . 64 GLY CA . 25502 1 691 . 1 1 64 64 GLY N N 15 110.531 0.006 . . . . . . 64 GLY N . 25502 1 692 . 1 1 65 65 GLY H H 1 9.292 0.006 . . . . . . 65 GLY H . 25502 1 693 . 1 1 65 65 GLY HA2 H 1 3.784 0.001 . . . . . . 65 GLY HA2 . 25502 1 694 . 1 1 65 65 GLY HA3 H 1 4.773 0.001 . . . . . . 65 GLY HA3 . 25502 1 695 . 1 1 65 65 GLY CA C 13 46.425 0.005 . . . . . . 65 GLY CA . 25502 1 696 . 1 1 65 65 GLY N N 15 105.572 0.006 . . . . . . 65 GLY N . 25502 1 697 . 1 1 66 66 ASP H H 1 9.910 0.006 . . . . . . 66 ASP H . 25502 1 698 . 1 1 66 66 ASP HA H 1 4.290 0.007 . . . . . . 66 ASP HA . 25502 1 699 . 1 1 66 66 ASP HB2 H 1 2.929 0.005 . . . . . . 66 ASP HB2 . 25502 1 700 . 1 1 66 66 ASP HB3 H 1 1.699 0.006 . . . . . . 66 ASP HB3 . 25502 1 701 . 1 1 66 66 ASP CA C 13 51.505 0.006 . . . . . . 66 ASP CA . 25502 1 702 . 1 1 66 66 ASP CB C 13 38.702 0.037 . . . . . . 66 ASP CB . 25502 1 703 . 1 1 66 66 ASP N N 15 123.656 0.006 . . . . . . 66 ASP N . 25502 1 704 . 1 1 67 67 PHE H H 1 6.624 0.001 . . . . . . 67 PHE H . 25502 1 705 . 1 1 67 67 PHE HA H 1 4.597 0.004 . . . . . . 67 PHE HA . 25502 1 706 . 1 1 67 67 PHE HB2 H 1 3.920 0.005 . . . . . . 67 PHE HB2 . 25502 1 707 . 1 1 67 67 PHE HB3 H 1 2.570 0.008 . . . . . . 67 PHE HB3 . 25502 1 708 . 1 1 67 67 PHE HD1 H 1 7.180 0.009 . . . . . . 67 PHE QD . 25502 1 709 . 1 1 67 67 PHE HD2 H 1 7.180 0.009 . . . . . . 67 PHE QD . 25502 1 710 . 1 1 67 67 PHE HE1 H 1 7.318 0.005 . . . . . . 67 PHE QE . 25502 1 711 . 1 1 67 67 PHE HE2 H 1 7.318 0.005 . . . . . . 67 PHE QE . 25502 1 712 . 1 1 67 67 PHE HZ H 1 7.411 0.008 . . . . . . 67 PHE HZ . 25502 1 713 . 1 1 67 67 PHE CA C 13 55.784 0.006 . . . . . . 67 PHE CA . 25502 1 714 . 1 1 67 67 PHE CB C 13 39.357 0.038 . . . . . . 67 PHE CB . 25502 1 715 . 1 1 67 67 PHE N N 15 115.914 0.006 . . . . . . 67 PHE N . 25502 1 716 . 1 1 68 68 THR H H 1 7.320 0.006 . . . . . . 68 THR H . 25502 1 717 . 1 1 68 68 THR HA H 1 4.638 0.004 . . . . . . 68 THR HA . 25502 1 718 . 1 1 68 68 THR HB H 1 4.096 0.008 . . . . . . 68 THR HB . 25502 1 719 . 1 1 68 68 THR HG21 H 1 0.679 0.010 . . . . . . 68 THR QG2 . 25502 1 720 . 1 1 68 68 THR HG22 H 1 0.679 0.010 . . . . . . 68 THR QG2 . 25502 1 721 . 1 1 68 68 THR HG23 H 1 0.679 0.010 . . . . . . 68 THR QG2 . 25502 1 722 . 1 1 68 68 THR CA C 13 61.621 0.006 . . . . . . 68 THR CA . 25502 1 723 . 1 1 68 68 THR CB C 13 68.789 0.097 . . . . . . 68 THR CB . 25502 1 724 . 1 1 68 68 THR CG2 C 13 22.780 0.006 . . . . . . 68 THR CG2 . 25502 1 725 . 1 1 68 68 THR N N 15 108.853 0.006 . . . . . . 68 THR N . 25502 1 726 . 1 1 69 69 ARG H H 1 8.655 0.006 . . . . . . 69 ARG H . 25502 1 727 . 1 1 69 69 ARG HA H 1 4.362 0.010 . . . . . . 69 ARG HA . 25502 1 728 . 1 1 69 69 ARG HB2 H 1 1.872 0.004 . . . . . . 69 ARG HB2 . 25502 1 729 . 1 1 69 69 ARG HB3 H 1 1.602 0.007 . . . . . . 69 ARG HB3 . 25502 1 730 . 1 1 69 69 ARG HG2 H 1 1.459 0.011 . . . . . . 69 ARG HG2 . 25502 1 731 . 1 1 69 69 ARG HG3 H 1 1.369 0.006 . . . . . . 69 ARG HG3 . 25502 1 732 . 1 1 69 69 ARG HD2 H 1 3.055 0.006 . . . . . . 69 ARG HD2 . 25502 1 733 . 1 1 69 69 ARG HD3 H 1 2.944 0.005 . . . . . . 69 ARG HD3 . 25502 1 734 . 1 1 69 69 ARG CA C 13 55.028 0.006 . . . . . . 69 ARG CA . 25502 1 735 . 1 1 69 69 ARG CB C 13 31.703 0.006 . . . . . . 69 ARG CB . 25502 1 736 . 1 1 69 69 ARG CG C 13 26.514 0.006 . . . . . . 69 ARG CG . 25502 1 737 . 1 1 69 69 ARG CD C 13 42.942 0.006 . . . . . . 69 ARG CD . 25502 1 738 . 1 1 69 69 ARG N N 15 121.780 0.006 . . . . . . 69 ARG N . 25502 1 739 . 1 1 70 70 HIS H H 1 6.838 0.006 . . . . . . 70 HIS H . 25502 1 740 . 1 1 70 70 HIS HA H 1 4.398 0.009 . . . . . . 70 HIS HA . 25502 1 741 . 1 1 70 70 HIS HB2 H 1 3.219 0.002 . . . . . . 70 HIS QB . 25502 1 742 . 1 1 70 70 HIS HB3 H 1 3.219 0.002 . . . . . . 70 HIS QB . 25502 1 743 . 1 1 70 70 HIS HD2 H 1 6.650 0.004 . . . . . . 70 HIS HD2 . 25502 1 744 . 1 1 70 70 HIS CA C 13 57.135 0.006 . . . . . . 70 HIS CA . 25502 1 745 . 1 1 70 70 HIS CB C 13 28.434 0.006 . . . . . . 70 HIS CB . 25502 1 746 . 1 1 70 70 HIS N N 15 112.009 0.006 . . . . . . 70 HIS N . 25502 1 747 . 1 1 71 71 ASN H H 1 7.519 0.006 . . . . . . 71 ASN H . 25502 1 748 . 1 1 71 71 ASN HA H 1 4.595 0.003 . . . . . . 71 ASN HA . 25502 1 749 . 1 1 71 71 ASN HB2 H 1 3.138 0.005 . . . . . . 71 ASN HB2 . 25502 1 750 . 1 1 71 71 ASN HB3 H 1 2.655 0.009 . . . . . . 71 ASN HB3 . 25502 1 751 . 1 1 71 71 ASN HD21 H 1 7.630 0.006 . . . . . . 71 ASN HD21 . 25502 1 752 . 1 1 71 71 ASN HD22 H 1 6.778 0.006 . . . . . . 71 ASN HD22 . 25502 1 753 . 1 1 71 71 ASN CA C 13 52.160 0.006 . . . . . . 71 ASN CA . 25502 1 754 . 1 1 71 71 ASN CB C 13 38.707 0.006 . . . . . . 71 ASN CB . 25502 1 755 . 1 1 71 71 ASN N N 15 112.340 0.006 . . . . . . 71 ASN N . 25502 1 756 . 1 1 71 71 ASN ND2 N 15 110.308 0.008 . . . . . . 71 ASN ND2 . 25502 1 757 . 1 1 72 72 GLY H H 1 9.619 0.001 . . . . . . 72 GLY H . 25502 1 758 . 1 1 72 72 GLY HA2 H 1 4.399 0.004 . . . . . . 72 GLY HA2 . 25502 1 759 . 1 1 72 72 GLY HA3 H 1 3.165 0.013 . . . . . . 72 GLY HA3 . 25502 1 760 . 1 1 72 72 GLY CA C 13 44.573 0.007 . . . . . . 72 GLY CA . 25502 1 761 . 1 1 72 72 GLY N N 15 110.239 0.006 . . . . . . 72 GLY N . 25502 1 762 . 1 1 73 73 THR H H 1 7.930 0.006 . . . . . . 73 THR H . 25502 1 763 . 1 1 73 73 THR HA H 1 4.487 0.009 . . . . . . 73 THR HA . 25502 1 764 . 1 1 73 73 THR HB H 1 4.252 0.007 . . . . . . 73 THR HB . 25502 1 765 . 1 1 73 73 THR HG1 H 1 5.773 0.006 . . . . . . 73 THR HG1 . 25502 1 766 . 1 1 73 73 THR HG21 H 1 1.024 0.005 . . . . . . 73 THR QG2 . 25502 1 767 . 1 1 73 73 THR HG22 H 1 1.024 0.005 . . . . . . 73 THR QG2 . 25502 1 768 . 1 1 73 73 THR HG23 H 1 1.024 0.005 . . . . . . 73 THR QG2 . 25502 1 769 . 1 1 73 73 THR CA C 13 62.070 0.006 . . . . . . 73 THR CA . 25502 1 770 . 1 1 73 73 THR CB C 13 70.762 0.006 . . . . . . 73 THR CB . 25502 1 771 . 1 1 73 73 THR CG2 C 13 20.925 0.006 . . . . . . 73 THR CG2 . 25502 1 772 . 1 1 73 73 THR N N 15 111.802 0.006 . . . . . . 73 THR N . 25502 1 773 . 1 1 74 74 GLY H H 1 8.669 0.006 . . . . . . 74 GLY H . 25502 1 774 . 1 1 74 74 GLY HA2 H 1 4.466 0.015 . . . . . . 74 GLY HA2 . 25502 1 775 . 1 1 74 74 GLY HA3 H 1 3.464 0.005 . . . . . . 74 GLY HA3 . 25502 1 776 . 1 1 74 74 GLY CA C 13 44.908 0.098 . . . . . . 74 GLY CA . 25502 1 777 . 1 1 74 74 GLY N N 15 113.668 0.006 . . . . . . 74 GLY N . 25502 1 778 . 1 1 75 75 GLY H H 1 8.066 0.002 . . . . . . 75 GLY H . 25502 1 779 . 1 1 75 75 GLY HA2 H 1 4.551 0.014 . . . . . . 75 GLY HA2 . 25502 1 780 . 1 1 75 75 GLY HA3 H 1 2.537 0.003 . . . . . . 75 GLY HA3 . 25502 1 781 . 1 1 75 75 GLY CA C 13 43.037 0.067 . . . . . . 75 GLY CA . 25502 1 782 . 1 1 75 75 GLY N N 15 108.813 0.006 . . . . . . 75 GLY N . 25502 1 783 . 1 1 76 76 LYS H H 1 6.981 0.001 . . . . . . 76 LYS H . 25502 1 784 . 1 1 76 76 LYS HA H 1 4.585 0.001 . . . . . . 76 LYS HA . 25502 1 785 . 1 1 76 76 LYS HB2 H 1 1.547 0.003 . . . . . . 76 LYS HB2 . 25502 1 786 . 1 1 76 76 LYS HB3 H 1 1.887 0.013 . . . . . . 76 LYS HB3 . 25502 1 787 . 1 1 76 76 LYS HG2 H 1 0.976 0.006 . . . . . . 76 LYS HG2 . 25502 1 788 . 1 1 76 76 LYS HG3 H 1 0.916 0.010 . . . . . . 76 LYS HG3 . 25502 1 789 . 1 1 76 76 LYS HD2 H 1 1.195 0.006 . . . . . . 76 LYS HD2 . 25502 1 790 . 1 1 76 76 LYS HD3 H 1 1.198 0.011 . . . . . . 76 LYS HD3 . 25502 1 791 . 1 1 76 76 LYS HE2 H 1 2.170 0.004 . . . . . . 76 LYS HE2 . 25502 1 792 . 1 1 76 76 LYS HE3 H 1 1.508 0.019 . . . . . . 76 LYS HE3 . 25502 1 793 . 1 1 76 76 LYS CA C 13 55.707 0.006 . . . . . . 76 LYS CA . 25502 1 794 . 1 1 76 76 LYS CB C 13 34.515 0.051 . . . . . . 76 LYS CB . 25502 1 795 . 1 1 76 76 LYS CG C 13 23.270 0.006 . . . . . . 76 LYS CG . 25502 1 796 . 1 1 76 76 LYS CD C 13 29.256 0.006 . . . . . . 76 LYS CD . 25502 1 797 . 1 1 76 76 LYS CE C 13 41.093 0.158 . . . . . . 76 LYS CE . 25502 1 798 . 1 1 76 76 LYS N N 15 115.526 0.006 . . . . . . 76 LYS N . 25502 1 799 . 1 1 77 77 SER HA H 1 5.185 0.009 . . . . . . 77 SER HA . 25502 1 800 . 1 1 77 77 SER HB2 H 1 4.247 0.010 . . . . . . 77 SER QB . 25502 1 801 . 1 1 77 77 SER HB3 H 1 4.247 0.010 . . . . . . 77 SER QB . 25502 1 802 . 1 1 77 77 SER HG H 1 5.102 0.003 . . . . . . 77 SER HG . 25502 1 803 . 1 1 77 77 SER CA C 13 56.816 0.006 . . . . . . 77 SER CA . 25502 1 804 . 1 1 77 77 SER CB C 13 69.687 0.006 . . . . . . 77 SER CB . 25502 1 805 . 1 1 77 77 SER N N 15 114.105 0.006 . . . . . . 77 SER N . 25502 1 806 . 1 1 78 78 ILE H H 1 8.557 0.001 . . . . . . 78 ILE H . 25502 1 807 . 1 1 78 78 ILE HA H 1 4.170 0.007 . . . . . . 78 ILE HA . 25502 1 808 . 1 1 78 78 ILE HB H 1 1.700 0.010 . . . . . . 78 ILE HB . 25502 1 809 . 1 1 78 78 ILE HG12 H 1 0.644 0.011 . . . . . . 78 ILE HG12 . 25502 1 810 . 1 1 78 78 ILE HG13 H 1 -0.470 0.005 . . . . . . 78 ILE HG13 . 25502 1 811 . 1 1 78 78 ILE HG21 H 1 0.715 0.005 . . . . . . 78 ILE QG2 . 25502 1 812 . 1 1 78 78 ILE HG22 H 1 0.715 0.005 . . . . . . 78 ILE QG2 . 25502 1 813 . 1 1 78 78 ILE HG23 H 1 0.715 0.005 . . . . . . 78 ILE QG2 . 25502 1 814 . 1 1 78 78 ILE HD11 H 1 0.475 0.005 . . . . . . 78 ILE QD1 . 25502 1 815 . 1 1 78 78 ILE HD12 H 1 0.475 0.005 . . . . . . 78 ILE QD1 . 25502 1 816 . 1 1 78 78 ILE HD13 H 1 0.475 0.005 . . . . . . 78 ILE QD1 . 25502 1 817 . 1 1 78 78 ILE CA C 13 63.517 0.000 . . . . . . 78 ILE CA . 25502 1 818 . 1 1 78 78 ILE CB C 13 37.308 0.024 . . . . . . 78 ILE CB . 25502 1 819 . 1 1 78 78 ILE CG1 C 13 22.957 0.014 . . . . . . 78 ILE CG1 . 25502 1 820 . 1 1 78 78 ILE CG2 C 13 17.477 0.006 . . . . . . 78 ILE CG2 . 25502 1 821 . 1 1 78 78 ILE CD1 C 13 14.024 0.006 . . . . . . 78 ILE CD1 . 25502 1 822 . 1 1 78 78 ILE N N 15 110.963 0.006 . . . . . . 78 ILE N . 25502 1 823 . 1 1 79 79 TYR H H 1 8.007 0.006 . . . . . . 79 TYR H . 25502 1 824 . 1 1 79 79 TYR HA H 1 4.667 0.008 . . . . . . 79 TYR HA . 25502 1 825 . 1 1 79 79 TYR HB2 H 1 2.328 0.004 . . . . . . 79 TYR HB2 . 25502 1 826 . 1 1 79 79 TYR HB3 H 1 3.428 0.007 . . . . . . 79 TYR HB3 . 25502 1 827 . 1 1 79 79 TYR HD1 H 1 6.410 0.004 . . . . . . 79 TYR QD . 25502 1 828 . 1 1 79 79 TYR HD2 H 1 6.410 0.004 . . . . . . 79 TYR QD . 25502 1 829 . 1 1 79 79 TYR HE1 H 1 6.086 0.007 . . . . . . 79 TYR QE . 25502 1 830 . 1 1 79 79 TYR HE2 H 1 6.086 0.007 . . . . . . 79 TYR QE . 25502 1 831 . 1 1 79 79 TYR CA C 13 56.147 0.006 . . . . . . 79 TYR CA . 25502 1 832 . 1 1 79 79 TYR CB C 13 38.725 0.129 . . . . . . 79 TYR CB . 25502 1 833 . 1 1 79 79 TYR N N 15 120.472 0.006 . . . . . . 79 TYR N . 25502 1 834 . 1 1 80 80 GLY H H 1 7.115 0.006 . . . . . . 80 GLY H . 25502 1 835 . 1 1 80 80 GLY HA2 H 1 4.602 0.006 . . . . . . 80 GLY HA2 . 25502 1 836 . 1 1 80 80 GLY HA3 H 1 3.790 0.005 . . . . . . 80 GLY HA3 . 25502 1 837 . 1 1 80 80 GLY CA C 13 43.748 0.053 . . . . . . 80 GLY CA . 25502 1 838 . 1 1 80 80 GLY N N 15 106.402 0.006 . . . . . . 80 GLY N . 25502 1 839 . 1 1 81 81 GLU H H 1 8.878 0.006 . . . . . . 81 GLU H . 25502 1 840 . 1 1 81 81 GLU HA H 1 3.946 0.020 . . . . . . 81 GLU HA . 25502 1 841 . 1 1 81 81 GLU HB2 H 1 2.071 0.004 . . . . . . 81 GLU HB2 . 25502 1 842 . 1 1 81 81 GLU HB3 H 1 2.070 0.004 . . . . . . 81 GLU HB3 . 25502 1 843 . 1 1 81 81 GLU HG2 H 1 2.345 0.012 . . . . . . 81 GLU HG2 . 25502 1 844 . 1 1 81 81 GLU HG3 H 1 2.242 0.012 . . . . . . 81 GLU HG3 . 25502 1 845 . 1 1 81 81 GLU CA C 13 60.138 0.006 . . . . . . 81 GLU CA . 25502 1 846 . 1 1 81 81 GLU CB C 13 30.108 0.006 . . . . . . 81 GLU CB . 25502 1 847 . 1 1 81 81 GLU CG C 13 36.450 0.105 . . . . . . 81 GLU CG . 25502 1 848 . 1 1 81 81 GLU N N 15 122.838 0.006 . . . . . . 81 GLU N . 25502 1 849 . 1 1 82 82 LYS H H 1 7.799 0.001 . . . . . . 82 LYS H . 25502 1 850 . 1 1 82 82 LYS HA H 1 5.525 0.028 . . . . . . 82 LYS HA . 25502 1 851 . 1 1 82 82 LYS HB2 H 1 1.645 0.015 . . . . . . 82 LYS HB2 . 25502 1 852 . 1 1 82 82 LYS HB3 H 1 1.557 0.005 . . . . . . 82 LYS HB3 . 25502 1 853 . 1 1 82 82 LYS HG2 H 1 1.244 0.013 . . . . . . 82 LYS QG . 25502 1 854 . 1 1 82 82 LYS HG3 H 1 1.244 0.013 . . . . . . 82 LYS QG . 25502 1 855 . 1 1 82 82 LYS HD2 H 1 1.508 0.006 . . . . . . 82 LYS HD2 . 25502 1 856 . 1 1 82 82 LYS HD3 H 1 1.546 0.006 . . . . . . 82 LYS HD3 . 25502 1 857 . 1 1 82 82 LYS HE2 H 1 2.909 0.006 . . . . . . 82 LYS HE2 . 25502 1 858 . 1 1 82 82 LYS HE3 H 1 2.908 0.006 . . . . . . 82 LYS HE3 . 25502 1 859 . 1 1 82 82 LYS CA C 13 53.775 0.112 . . . . . . 82 LYS CA . 25502 1 860 . 1 1 82 82 LYS CB C 13 36.311 0.006 . . . . . . 82 LYS CB . 25502 1 861 . 1 1 82 82 LYS CG C 13 24.278 0.006 . . . . . . 82 LYS CG . 25502 1 862 . 1 1 82 82 LYS CD C 13 28.990 0.006 . . . . . . 82 LYS CD . 25502 1 863 . 1 1 82 82 LYS CE C 13 42.004 0.006 . . . . . . 82 LYS CE . 25502 1 864 . 1 1 83 83 PHE H H 1 9.147 0.006 . . . . . . 83 PHE H . 25502 1 865 . 1 1 83 83 PHE HA H 1 4.945 0.005 . . . . . . 83 PHE HA . 25502 1 866 . 1 1 83 83 PHE HB2 H 1 3.015 0.004 . . . . . . 83 PHE QB . 25502 1 867 . 1 1 83 83 PHE HB3 H 1 3.015 0.004 . . . . . . 83 PHE QB . 25502 1 868 . 1 1 83 83 PHE HD1 H 1 7.325 0.019 . . . . . . 83 PHE QD . 25502 1 869 . 1 1 83 83 PHE HD2 H 1 7.325 0.019 . . . . . . 83 PHE QD . 25502 1 870 . 1 1 83 83 PHE HE1 H 1 7.512 0.008 . . . . . . 83 PHE QE . 25502 1 871 . 1 1 83 83 PHE HE2 H 1 7.512 0.008 . . . . . . 83 PHE QE . 25502 1 872 . 1 1 83 83 PHE HZ H 1 7.388 0.002 . . . . . . 83 PHE HZ . 25502 1 873 . 1 1 83 83 PHE CA C 13 55.737 0.006 . . . . . . 83 PHE CA . 25502 1 874 . 1 1 83 83 PHE CB C 13 41.294 0.006 . . . . . . 83 PHE CB . 25502 1 875 . 1 1 83 83 PHE N N 15 116.432 0.006 . . . . . . 83 PHE N . 25502 1 876 . 1 1 84 84 GLU H H 1 9.252 0.003 . . . . . . 84 GLU H . 25502 1 877 . 1 1 84 84 GLU HA H 1 3.802 0.002 . . . . . . 84 GLU HA . 25502 1 878 . 1 1 84 84 GLU HB2 H 1 2.018 0.005 . . . . . . 84 GLU HB2 . 25502 1 879 . 1 1 84 84 GLU HB3 H 1 1.831 0.009 . . . . . . 84 GLU HB3 . 25502 1 880 . 1 1 84 84 GLU HG2 H 1 2.279 0.005 . . . . . . 84 GLU HG2 . 25502 1 881 . 1 1 84 84 GLU HG3 H 1 2.049 0.010 . . . . . . 84 GLU HG3 . 25502 1 882 . 1 1 84 84 GLU CA C 13 56.197 0.006 . . . . . . 84 GLU CA . 25502 1 883 . 1 1 84 84 GLU CB C 13 29.105 0.015 . . . . . . 84 GLU CB . 25502 1 884 . 1 1 84 84 GLU CG C 13 35.276 0.089 . . . . . . 84 GLU CG . 25502 1 885 . 1 1 84 84 GLU N N 15 119.352 0.006 . . . . . . 84 GLU N . 25502 1 886 . 1 1 85 85 ASP H H 1 8.593 0.001 . . . . . . 85 ASP H . 25502 1 887 . 1 1 85 85 ASP HA H 1 4.226 0.006 . . . . . . 85 ASP HA . 25502 1 888 . 1 1 85 85 ASP HB2 H 1 2.402 0.005 . . . . . . 85 ASP HB2 . 25502 1 889 . 1 1 85 85 ASP HB3 H 1 1.916 0.004 . . . . . . 85 ASP HB3 . 25502 1 890 . 1 1 85 85 ASP CA C 13 53.974 0.096 . . . . . . 85 ASP CA . 25502 1 891 . 1 1 85 85 ASP CB C 13 40.785 0.044 . . . . . . 85 ASP CB . 25502 1 892 . 1 1 85 85 ASP N N 15 118.583 0.006 . . . . . . 85 ASP N . 25502 1 893 . 1 1 86 86 GLU H H 1 9.461 0.002 . . . . . . 86 GLU H . 25502 1 894 . 1 1 86 86 GLU HA H 1 3.795 0.006 . . . . . . 86 GLU HA . 25502 1 895 . 1 1 86 86 GLU HB2 H 1 2.121 0.012 . . . . . . 86 GLU HB2 . 25502 1 896 . 1 1 86 86 GLU HB3 H 1 1.826 0.004 . . . . . . 86 GLU HB3 . 25502 1 897 . 1 1 86 86 GLU HG2 H 1 2.357 0.001 . . . . . . 86 GLU QG . 25502 1 898 . 1 1 86 86 GLU HG3 H 1 2.357 0.001 . . . . . . 86 GLU QG . 25502 1 899 . 1 1 86 86 GLU CA C 13 60.273 0.104 . . . . . . 86 GLU CA . 25502 1 900 . 1 1 86 86 GLU CB C 13 31.639 0.006 . . . . . . 86 GLU CB . 25502 1 901 . 1 1 86 86 GLU CG C 13 35.114 0.006 . . . . . . 86 GLU CG . 25502 1 902 . 1 1 86 86 GLU N N 15 131.488 0.006 . . . . . . 86 GLU N . 25502 1 903 . 1 1 87 87 ASN H H 1 7.044 0.002 . . . . . . 87 ASN H . 25502 1 904 . 1 1 87 87 ASN HA H 1 4.130 0.006 . . . . . . 87 ASN HA . 25502 1 905 . 1 1 87 87 ASN HB2 H 1 2.739 0.006 . . . . . . 87 ASN HB2 . 25502 1 906 . 1 1 87 87 ASN HB3 H 1 3.449 0.006 . . . . . . 87 ASN HB3 . 25502 1 907 . 1 1 87 87 ASN HD21 H 1 7.956 0.003 . . . . . . 87 ASN HD21 . 25502 1 908 . 1 1 87 87 ASN HD22 H 1 6.891 0.005 . . . . . . 87 ASN HD22 . 25502 1 909 . 1 1 87 87 ASN CA C 13 52.589 0.006 . . . . . . 87 ASN CA . 25502 1 910 . 1 1 87 87 ASN CB C 13 39.349 0.076 . . . . . . 87 ASN CB . 25502 1 911 . 1 1 87 87 ASN N N 15 106.549 0.006 . . . . . . 87 ASN N . 25502 1 912 . 1 1 87 87 ASN ND2 N 15 116.687 0.004 . . . . . . 87 ASN ND2 . 25502 1 913 . 1 1 88 88 PHE H H 1 8.319 0.013 . . . . . . 88 PHE H . 25502 1 914 . 1 1 88 88 PHE HA H 1 5.927 0.004 . . . . . . 88 PHE HA . 25502 1 915 . 1 1 88 88 PHE HB2 H 1 3.528 0.007 . . . . . . 88 PHE HB2 . 25502 1 916 . 1 1 88 88 PHE HB3 H 1 2.534 0.008 . . . . . . 88 PHE HB3 . 25502 1 917 . 1 1 88 88 PHE HD1 H 1 7.252 0.009 . . . . . . 88 PHE QD . 25502 1 918 . 1 1 88 88 PHE HD2 H 1 7.252 0.009 . . . . . . 88 PHE QD . 25502 1 919 . 1 1 88 88 PHE HE1 H 1 6.858 0.009 . . . . . . 88 PHE QE . 25502 1 920 . 1 1 88 88 PHE HE2 H 1 6.858 0.009 . . . . . . 88 PHE QE . 25502 1 921 . 1 1 88 88 PHE CA C 13 55.688 0.006 . . . . . . 88 PHE CA . 25502 1 922 . 1 1 88 88 PHE CB C 13 38.820 0.079 . . . . . . 88 PHE CB . 25502 1 923 . 1 1 88 88 PHE N N 15 112.731 0.006 . . . . . . 88 PHE N . 25502 1 924 . 1 1 89 89 ILE H H 1 8.302 0.001 . . . . . . 89 ILE H . 25502 1 925 . 1 1 89 89 ILE HA H 1 3.652 0.009 . . . . . . 89 ILE HA . 25502 1 926 . 1 1 89 89 ILE HB H 1 1.543 0.004 . . . . . . 89 ILE HB . 25502 1 927 . 1 1 89 89 ILE HG12 H 1 1.481 0.009 . . . . . . 89 ILE HG12 . 25502 1 928 . 1 1 89 89 ILE HG13 H 1 1.148 0.012 . . . . . . 89 ILE HG13 . 25502 1 929 . 1 1 89 89 ILE HG21 H 1 0.842 0.007 . . . . . . 89 ILE QG2 . 25502 1 930 . 1 1 89 89 ILE HG22 H 1 0.842 0.007 . . . . . . 89 ILE QG2 . 25502 1 931 . 1 1 89 89 ILE HG23 H 1 0.842 0.007 . . . . . . 89 ILE QG2 . 25502 1 932 . 1 1 89 89 ILE HD11 H 1 0.904 0.009 . . . . . . 89 ILE QD1 . 25502 1 933 . 1 1 89 89 ILE HD12 H 1 0.904 0.009 . . . . . . 89 ILE QD1 . 25502 1 934 . 1 1 89 89 ILE HD13 H 1 0.904 0.009 . . . . . . 89 ILE QD1 . 25502 1 935 . 1 1 89 89 ILE CA C 13 64.887 0.092 . . . . . . 89 ILE CA . 25502 1 936 . 1 1 89 89 ILE CB C 13 38.939 0.081 . . . . . . 89 ILE CB . 25502 1 937 . 1 1 89 89 ILE CG1 C 13 29.236 0.004 . . . . . . 89 ILE CG1 . 25502 1 938 . 1 1 89 89 ILE CG2 C 13 16.828 0.006 . . . . . . 89 ILE CG2 . 25502 1 939 . 1 1 89 89 ILE CD1 C 13 13.560 0.006 . . . . . . 89 ILE CD1 . 25502 1 940 . 1 1 89 89 ILE N N 15 119.556 0.006 . . . . . . 89 ILE N . 25502 1 941 . 1 1 90 90 LEU H H 1 7.746 0.002 . . . . . . 90 LEU H . 25502 1 942 . 1 1 90 90 LEU HA H 1 4.456 0.003 . . . . . . 90 LEU HA . 25502 1 943 . 1 1 90 90 LEU HB2 H 1 1.816 0.006 . . . . . . 90 LEU HB2 . 25502 1 944 . 1 1 90 90 LEU HB3 H 1 1.367 0.008 . . . . . . 90 LEU HB3 . 25502 1 945 . 1 1 90 90 LEU HG H 1 1.447 0.011 . . . . . . 90 LEU HG . 25502 1 946 . 1 1 90 90 LEU HD11 H 1 0.750 0.006 . . . . . . 90 LEU QD1 . 25502 1 947 . 1 1 90 90 LEU HD12 H 1 0.750 0.006 . . . . . . 90 LEU QD1 . 25502 1 948 . 1 1 90 90 LEU HD13 H 1 0.750 0.006 . . . . . . 90 LEU QD1 . 25502 1 949 . 1 1 90 90 LEU HD21 H 1 0.649 0.009 . . . . . . 90 LEU QD2 . 25502 1 950 . 1 1 90 90 LEU HD22 H 1 0.649 0.009 . . . . . . 90 LEU QD2 . 25502 1 951 . 1 1 90 90 LEU HD23 H 1 0.649 0.009 . . . . . . 90 LEU QD2 . 25502 1 952 . 1 1 90 90 LEU CA C 13 54.185 0.006 . . . . . . 90 LEU CA . 25502 1 953 . 1 1 90 90 LEU CB C 13 41.910 0.072 . . . . . . 90 LEU CB . 25502 1 954 . 1 1 90 90 LEU CG C 13 27.021 0.006 . . . . . . 90 LEU CG . 25502 1 955 . 1 1 90 90 LEU CD1 C 13 26.708 0.080 . . . . . . 90 LEU CD1 . 25502 1 956 . 1 1 90 90 LEU CD2 C 13 22.451 0.010 . . . . . . 90 LEU CD2 . 25502 1 957 . 1 1 90 90 LEU N N 15 116.951 0.006 . . . . . . 90 LEU N . 25502 1 958 . 1 1 91 91 LYS H H 1 8.057 0.002 . . . . . . 91 LYS H . 25502 1 959 . 1 1 91 91 LYS HA H 1 4.628 0.009 . . . . . . 91 LYS HA . 25502 1 960 . 1 1 91 91 LYS HB2 H 1 1.539 0.009 . . . . . . 91 LYS HB2 . 25502 1 961 . 1 1 91 91 LYS HB3 H 1 2.265 0.001 . . . . . . 91 LYS HB3 . 25502 1 962 . 1 1 91 91 LYS HG2 H 1 1.446 0.004 . . . . . . 91 LYS HG2 . 25502 1 963 . 1 1 91 91 LYS HG3 H 1 1.344 0.006 . . . . . . 91 LYS HG3 . 25502 1 964 . 1 1 91 91 LYS HD2 H 1 1.619 0.004 . . . . . . 91 LYS HD2 . 25502 1 965 . 1 1 91 91 LYS HD3 H 1 1.569 0.010 . . . . . . 91 LYS HD3 . 25502 1 966 . 1 1 91 91 LYS HE2 H 1 3.006 0.009 . . . . . . 91 LYS HE2 . 25502 1 967 . 1 1 91 91 LYS HE3 H 1 3.001 0.001 . . . . . . 91 LYS HE3 . 25502 1 968 . 1 1 91 91 LYS CA C 13 54.315 0.006 . . . . . . 91 LYS CA . 25502 1 969 . 1 1 91 91 LYS CB C 13 34.550 0.014 . . . . . . 91 LYS CB . 25502 1 970 . 1 1 91 91 LYS CG C 13 25.726 0.006 . . . . . . 91 LYS CG . 25502 1 971 . 1 1 91 91 LYS CD C 13 28.125 0.003 . . . . . . 91 LYS CD . 25502 1 972 . 1 1 91 91 LYS CE C 13 42.294 0.006 . . . . . . 91 LYS CE . 25502 1 973 . 1 1 91 91 LYS N N 15 118.722 0.000 . . . . . . 91 LYS N . 25502 1 974 . 1 1 92 92 HIS H H 1 10.706 0.006 . . . . . . 92 HIS H . 25502 1 975 . 1 1 92 92 HIS HA H 1 4.342 0.005 . . . . . . 92 HIS HA . 25502 1 976 . 1 1 92 92 HIS HB2 H 1 2.880 0.005 . . . . . . 92 HIS HB2 . 25502 1 977 . 1 1 92 92 HIS HB3 H 1 3.144 0.008 . . . . . . 92 HIS HB3 . 25502 1 978 . 1 1 92 92 HIS HD1 H 1 12.134 0.001 . . . . . . 92 HIS HD1 . 25502 1 979 . 1 1 92 92 HIS HD2 H 1 6.745 0.009 . . . . . . 92 HIS HD2 . 25502 1 980 . 1 1 92 92 HIS HE1 H 1 8.051 0.016 . . . . . . 92 HIS HE1 . 25502 1 981 . 1 1 92 92 HIS CA C 13 56.756 0.006 . . . . . . 92 HIS CA . 25502 1 982 . 1 1 92 92 HIS CB C 13 25.895 0.010 . . . . . . 92 HIS CB . 25502 1 983 . 1 1 92 92 HIS N N 15 122.221 0.006 . . . . . . 92 HIS N . 25502 1 984 . 1 1 93 93 THR H H 1 7.261 0.004 . . . . . . 93 THR H . 25502 1 985 . 1 1 93 93 THR HA H 1 4.004 0.009 . . . . . . 93 THR HA . 25502 1 986 . 1 1 93 93 THR HB H 1 4.439 0.012 . . . . . . 93 THR HB . 25502 1 987 . 1 1 93 93 THR HG21 H 1 1.206 0.008 . . . . . . 93 THR QG2 . 25502 1 988 . 1 1 93 93 THR HG22 H 1 1.206 0.008 . . . . . . 93 THR QG2 . 25502 1 989 . 1 1 93 93 THR HG23 H 1 1.206 0.008 . . . . . . 93 THR QG2 . 25502 1 990 . 1 1 93 93 THR CA C 13 63.018 0.006 . . . . . . 93 THR CA . 25502 1 991 . 1 1 93 93 THR CB C 13 69.341 0.006 . . . . . . 93 THR CB . 25502 1 992 . 1 1 93 93 THR CG2 C 13 22.595 0.006 . . . . . . 93 THR CG2 . 25502 1 993 . 1 1 93 93 THR N N 15 110.178 0.006 . . . . . . 93 THR N . 25502 1 994 . 1 1 94 94 GLY H H 1 7.489 0.004 . . . . . . 94 GLY H . 25502 1 995 . 1 1 94 94 GLY HA2 H 1 4.368 0.010 . . . . . . 94 GLY HA2 . 25502 1 996 . 1 1 94 94 GLY HA3 H 1 3.640 0.005 . . . . . . 94 GLY HA3 . 25502 1 997 . 1 1 94 94 GLY CA C 13 45.454 0.048 . . . . . . 94 GLY CA . 25502 1 998 . 1 1 94 94 GLY N N 15 106.990 0.006 . . . . . . 94 GLY N . 25502 1 999 . 1 1 95 95 PRO HA H 1 3.804 0.008 . . . . . . 95 PRO HA . 25502 1 1000 . 1 1 95 95 PRO HB2 H 1 1.840 0.011 . . . . . . 95 PRO HB2 . 25502 1 1001 . 1 1 95 95 PRO HB3 H 1 2.016 0.005 . . . . . . 95 PRO HB3 . 25502 1 1002 . 1 1 95 95 PRO HG2 H 1 2.122 0.009 . . . . . . 95 PRO HG2 . 25502 1 1003 . 1 1 95 95 PRO HG3 H 1 1.833 0.006 . . . . . . 95 PRO HG3 . 25502 1 1004 . 1 1 95 95 PRO HD2 H 1 3.607 0.010 . . . . . . 95 PRO HD2 . 25502 1 1005 . 1 1 95 95 PRO HD3 H 1 3.393 0.007 . . . . . . 95 PRO HD3 . 25502 1 1006 . 1 1 95 95 PRO CA C 13 62.539 0.006 . . . . . . 95 PRO CA . 25502 1 1007 . 1 1 95 95 PRO CB C 13 31.959 0.006 . . . . . . 95 PRO CB . 25502 1 1008 . 1 1 95 95 PRO CG C 13 27.321 0.006 . . . . . . 95 PRO CG . 25502 1 1009 . 1 1 95 95 PRO CD C 13 49.688 0.059 . . . . . . 95 PRO CD . 25502 1 1010 . 1 1 96 96 GLY H H 1 9.271 0.002 . . . . . . 96 GLY H . 25502 1 1011 . 1 1 96 96 GLY HA2 H 1 4.569 0.010 . . . . . . 96 GLY HA2 . 25502 1 1012 . 1 1 96 96 GLY HA3 H 1 3.331 0.004 . . . . . . 96 GLY HA3 . 25502 1 1013 . 1 1 96 96 GLY CA C 13 44.829 0.006 . . . . . . 96 GLY CA . 25502 1 1014 . 1 1 96 96 GLY N N 15 109.908 0.006 . . . . . . 96 GLY N . 25502 1 1015 . 1 1 97 97 ILE H H 1 6.765 0.003 . . . . . . 97 ILE H . 25502 1 1016 . 1 1 97 97 ILE HA H 1 4.115 0.006 . . . . . . 97 ILE HA . 25502 1 1017 . 1 1 97 97 ILE HB H 1 2.226 0.005 . . . . . . 97 ILE HB . 25502 1 1018 . 1 1 97 97 ILE HG12 H 1 1.805 0.007 . . . . . . 97 ILE HG12 . 25502 1 1019 . 1 1 97 97 ILE HG13 H 1 1.651 0.013 . . . . . . 97 ILE HG13 . 25502 1 1020 . 1 1 97 97 ILE HG21 H 1 0.981 0.002 . . . . . . 97 ILE QG2 . 25502 1 1021 . 1 1 97 97 ILE HG22 H 1 0.981 0.002 . . . . . . 97 ILE QG2 . 25502 1 1022 . 1 1 97 97 ILE HG23 H 1 0.981 0.002 . . . . . . 97 ILE QG2 . 25502 1 1023 . 1 1 97 97 ILE HD11 H 1 0.966 0.016 . . . . . . 97 ILE QD1 . 25502 1 1024 . 1 1 97 97 ILE HD12 H 1 0.966 0.016 . . . . . . 97 ILE QD1 . 25502 1 1025 . 1 1 97 97 ILE HD13 H 1 0.966 0.016 . . . . . . 97 ILE QD1 . 25502 1 1026 . 1 1 97 97 ILE CA C 13 59.311 0.031 . . . . . . 97 ILE CA . 25502 1 1027 . 1 1 97 97 ILE CB C 13 37.758 0.006 . . . . . . 97 ILE CB . 25502 1 1028 . 1 1 97 97 ILE CG1 C 13 28.868 0.006 . . . . . . 97 ILE CG1 . 25502 1 1029 . 1 1 97 97 ILE CG2 C 13 20.192 0.006 . . . . . . 97 ILE CG2 . 25502 1 1030 . 1 1 97 97 ILE CD1 C 13 8.988 0.006 . . . . . . 97 ILE CD1 . 25502 1 1031 . 1 1 97 97 ILE N N 15 121.176 0.006 . . . . . . 97 ILE N . 25502 1 1032 . 1 1 98 98 LEU H H 1 7.872 0.008 . . . . . . 98 LEU H . 25502 1 1033 . 1 1 98 98 LEU HA H 1 4.998 0.006 . . . . . . 98 LEU HA . 25502 1 1034 . 1 1 98 98 LEU HB2 H 1 0.151 0.015 . . . . . . 98 LEU HB2 . 25502 1 1035 . 1 1 98 98 LEU HB3 H 1 0.085 0.009 . . . . . . 98 LEU HB3 . 25502 1 1036 . 1 1 98 98 LEU HG H 1 0.404 0.020 . . . . . . 98 LEU HG . 25502 1 1037 . 1 1 98 98 LEU HD11 H 1 -0.170 0.009 . . . . . . 98 LEU QD1 . 25502 1 1038 . 1 1 98 98 LEU HD12 H 1 -0.170 0.009 . . . . . . 98 LEU QD1 . 25502 1 1039 . 1 1 98 98 LEU HD13 H 1 -0.170 0.009 . . . . . . 98 LEU QD1 . 25502 1 1040 . 1 1 98 98 LEU HD21 H 1 -0.601 0.014 . . . . . . 98 LEU QD2 . 25502 1 1041 . 1 1 98 98 LEU HD22 H 1 -0.601 0.014 . . . . . . 98 LEU QD2 . 25502 1 1042 . 1 1 98 98 LEU HD23 H 1 -0.601 0.014 . . . . . . 98 LEU QD2 . 25502 1 1043 . 1 1 98 98 LEU CA C 13 53.233 0.071 . . . . . . 98 LEU CA . 25502 1 1044 . 1 1 98 98 LEU CB C 13 43.625 0.091 . . . . . . 98 LEU CB . 25502 1 1045 . 1 1 98 98 LEU CG C 13 26.355 0.006 . . . . . . 98 LEU CG . 25502 1 1046 . 1 1 98 98 LEU CD1 C 13 24.144 0.008 . . . . . . 98 LEU CD1 . 25502 1 1047 . 1 1 98 98 LEU CD2 C 13 25.056 0.006 . . . . . . 98 LEU CD2 . 25502 1 1048 . 1 1 98 98 LEU N N 15 128.477 0.006 . . . . . . 98 LEU N . 25502 1 1049 . 1 1 99 99 SER H H 1 8.285 0.002 . . . . . . 99 SER H . 25502 1 1050 . 1 1 99 99 SER HA H 1 5.316 0.005 . . . . . . 99 SER HA . 25502 1 1051 . 1 1 99 99 SER HB2 H 1 3.094 0.158 . . . . . . 99 SER HB2 . 25502 1 1052 . 1 1 99 99 SER HB3 H 1 2.863 0.030 . . . . . . 99 SER HB3 . 25502 1 1053 . 1 1 99 99 SER CA C 13 54.909 0.006 . . . . . . 99 SER CA . 25502 1 1054 . 1 1 99 99 SER CB C 13 65.380 0.072 . . . . . . 99 SER CB . 25502 1 1055 . 1 1 99 99 SER N N 15 118.325 0.006 . . . . . . 99 SER N . 25502 1 1056 . 1 1 100 100 MET H H 1 8.544 0.003 . . . . . . 100 MET H . 25502 1 1057 . 1 1 100 100 MET HA H 1 5.259 0.008 . . . . . . 100 MET HA . 25502 1 1058 . 1 1 100 100 MET HB2 H 1 2.568 0.008 . . . . . . 100 MET HB2 . 25502 1 1059 . 1 1 100 100 MET HB3 H 1 2.289 0.009 . . . . . . 100 MET HB3 . 25502 1 1060 . 1 1 100 100 MET HG2 H 1 2.792 0.010 . . . . . . 100 MET HG2 . 25502 1 1061 . 1 1 100 100 MET HG3 H 1 2.429 0.008 . . . . . . 100 MET HG3 . 25502 1 1062 . 1 1 100 100 MET HE1 H 1 2.079 0.004 . . . . . . 100 MET QE . 25502 1 1063 . 1 1 100 100 MET HE2 H 1 2.079 0.004 . . . . . . 100 MET QE . 25502 1 1064 . 1 1 100 100 MET HE3 H 1 2.079 0.004 . . . . . . 100 MET QE . 25502 1 1065 . 1 1 100 100 MET CA C 13 53.800 0.059 . . . . . . 100 MET CA . 25502 1 1066 . 1 1 100 100 MET CB C 13 30.960 0.006 . . . . . . 100 MET CB . 25502 1 1067 . 1 1 100 100 MET CG C 13 31.929 0.034 . . . . . . 100 MET CG . 25502 1 1068 . 1 1 100 100 MET CE C 13 16.109 0.006 . . . . . . 100 MET CE . 25502 1 1069 . 1 1 100 100 MET N N 15 122.826 0.006 . . . . . . 100 MET N . 25502 1 1070 . 1 1 101 101 ALA H H 1 7.999 0.002 . . . . . . 101 ALA H . 25502 1 1071 . 1 1 101 101 ALA HA H 1 4.276 0.022 . . . . . . 101 ALA HA . 25502 1 1072 . 1 1 101 101 ALA HB1 H 1 1.104 0.013 . . . . . . 101 ALA QB . 25502 1 1073 . 1 1 101 101 ALA HB2 H 1 1.104 0.013 . . . . . . 101 ALA QB . 25502 1 1074 . 1 1 101 101 ALA HB3 H 1 1.104 0.013 . . . . . . 101 ALA QB . 25502 1 1075 . 1 1 101 101 ALA CA C 13 51.498 0.125 . . . . . . 101 ALA CA . 25502 1 1076 . 1 1 101 101 ALA CB C 13 19.403 0.006 . . . . . . 101 ALA CB . 25502 1 1077 . 1 1 101 101 ALA N N 15 125.971 0.006 . . . . . . 101 ALA N . 25502 1 1078 . 1 1 102 102 ASN H H 1 8.097 0.006 . . . . . . 102 ASN H . 25502 1 1079 . 1 1 102 102 ASN HA H 1 4.576 0.011 . . . . . . 102 ASN HA . 25502 1 1080 . 1 1 102 102 ASN HB2 H 1 3.250 0.010 . . . . . . 102 ASN HB2 . 25502 1 1081 . 1 1 102 102 ASN HB3 H 1 2.894 0.019 . . . . . . 102 ASN HB3 . 25502 1 1082 . 1 1 102 102 ASN HD21 H 1 7.887 0.006 . . . . . . 102 ASN HD21 . 25502 1 1083 . 1 1 102 102 ASN HD22 H 1 6.162 0.006 . . . . . . 102 ASN HD22 . 25502 1 1084 . 1 1 102 102 ASN CA C 13 53.841 0.006 . . . . . . 102 ASN CA . 25502 1 1085 . 1 1 102 102 ASN CB C 13 40.379 0.081 . . . . . . 102 ASN CB . 25502 1 1086 . 1 1 102 102 ASN N N 15 113.207 0.006 . . . . . . 102 ASN N . 25502 1 1087 . 1 1 102 102 ASN ND2 N 15 119.431 0.001 . . . . . . 102 ASN ND2 . 25502 1 1088 . 1 1 103 103 ALA H H 1 8.787 0.001 . . . . . . 103 ALA H . 25502 1 1089 . 1 1 103 103 ALA HA H 1 4.785 0.007 . . . . . . 103 ALA HA . 25502 1 1090 . 1 1 103 103 ALA HB1 H 1 1.303 0.006 . . . . . . 103 ALA QB . 25502 1 1091 . 1 1 103 103 ALA HB2 H 1 1.303 0.006 . . . . . . 103 ALA QB . 25502 1 1092 . 1 1 103 103 ALA HB3 H 1 1.303 0.006 . . . . . . 103 ALA QB . 25502 1 1093 . 1 1 103 103 ALA CA C 13 50.154 0.006 . . . . . . 103 ALA CA . 25502 1 1094 . 1 1 103 103 ALA CB C 13 19.029 0.006 . . . . . . 103 ALA CB . 25502 1 1095 . 1 1 103 103 ALA N N 15 123.056 0.006 . . . . . . 103 ALA N . 25502 1 1096 . 1 1 104 104 GLY H H 1 8.111 0.006 . . . . . . 104 GLY H . 25502 1 1097 . 1 1 104 104 GLY HA2 H 1 4.596 0.006 . . . . . . 104 GLY HA2 . 25502 1 1098 . 1 1 104 104 GLY HA3 H 1 3.713 0.011 . . . . . . 104 GLY HA3 . 25502 1 1099 . 1 1 104 104 GLY CA C 13 43.409 0.086 . . . . . . 104 GLY CA . 25502 1 1100 . 1 1 104 104 GLY N N 15 108.942 0.006 . . . . . . 104 GLY N . 25502 1 1101 . 1 1 105 105 PRO HA H 1 4.327 0.004 . . . . . . 105 PRO HA . 25502 1 1102 . 1 1 105 105 PRO HB2 H 1 1.803 0.006 . . . . . . 105 PRO HB2 . 25502 1 1103 . 1 1 105 105 PRO HB3 H 1 2.323 0.006 . . . . . . 105 PRO HB3 . 25502 1 1104 . 1 1 105 105 PRO HG2 H 1 2.110 0.006 . . . . . . 105 PRO HG2 . 25502 1 1105 . 1 1 105 105 PRO HG3 H 1 1.953 0.007 . . . . . . 105 PRO HG3 . 25502 1 1106 . 1 1 105 105 PRO HD2 H 1 3.605 0.009 . . . . . . 105 PRO HD2 . 25502 1 1107 . 1 1 105 105 PRO HD3 H 1 3.517 0.004 . . . . . . 105 PRO HD3 . 25502 1 1108 . 1 1 105 105 PRO CA C 13 63.883 0.096 . . . . . . 105 PRO CA . 25502 1 1109 . 1 1 105 105 PRO CB C 13 31.902 0.003 . . . . . . 105 PRO CB . 25502 1 1110 . 1 1 105 105 PRO CG C 13 27.573 0.000 . . . . . . 105 PRO CG . 25502 1 1111 . 1 1 105 105 PRO CD C 13 49.236 0.061 . . . . . . 105 PRO CD . 25502 1 1112 . 1 1 106 106 ASN H H 1 8.866 0.002 . . . . . . 106 ASN H . 25502 1 1113 . 1 1 106 106 ASN HA H 1 3.997 0.006 . . . . . . 106 ASN HA . 25502 1 1114 . 1 1 106 106 ASN HB2 H 1 3.084 0.009 . . . . . . 106 ASN HB2 . 25502 1 1115 . 1 1 106 106 ASN HB3 H 1 2.662 0.006 . . . . . . 106 ASN HB3 . 25502 1 1116 . 1 1 106 106 ASN HD21 H 1 7.740 0.003 . . . . . . 106 ASN HD21 . 25502 1 1117 . 1 1 106 106 ASN HD22 H 1 7.081 0.002 . . . . . . 106 ASN HD22 . 25502 1 1118 . 1 1 106 106 ASN CA C 13 54.103 0.104 . . . . . . 106 ASN CA . 25502 1 1119 . 1 1 106 106 ASN CB C 13 36.992 0.122 . . . . . . 106 ASN CB . 25502 1 1120 . 1 1 106 106 ASN N N 15 118.866 0.006 . . . . . . 106 ASN N . 25502 1 1121 . 1 1 106 106 ASN ND2 N 15 116.035 0.008 . . . . . . 106 ASN ND2 . 25502 1 1122 . 1 1 107 107 THR H H 1 10.165 0.003 . . . . . . 107 THR H . 25502 1 1123 . 1 1 107 107 THR HA H 1 4.434 0.014 . . . . . . 107 THR HA . 25502 1 1124 . 1 1 107 107 THR HB H 1 4.383 0.013 . . . . . . 107 THR HB . 25502 1 1125 . 1 1 107 107 THR HG1 H 1 4.673 0.011 . . . . . . 107 THR HG1 . 25502 1 1126 . 1 1 107 107 THR HG21 H 1 0.882 0.006 . . . . . . 107 THR QG2 . 25502 1 1127 . 1 1 107 107 THR HG22 H 1 0.882 0.006 . . . . . . 107 THR QG2 . 25502 1 1128 . 1 1 107 107 THR HG23 H 1 0.882 0.006 . . . . . . 107 THR QG2 . 25502 1 1129 . 1 1 107 107 THR CA C 13 60.040 0.006 . . . . . . 107 THR CA . 25502 1 1130 . 1 1 107 107 THR CG2 C 13 21.011 0.006 . . . . . . 107 THR CG2 . 25502 1 1131 . 1 1 107 107 THR N N 15 109.971 0.006 . . . . . . 107 THR N . 25502 1 1132 . 1 1 108 108 ASN H H 1 7.349 0.006 . . . . . . 108 ASN H . 25502 1 1133 . 1 1 108 108 ASN HA H 1 4.215 0.013 . . . . . . 108 ASN HA . 25502 1 1134 . 1 1 108 108 ASN HB2 H 1 1.544 0.012 . . . . . . 108 ASN HB2 . 25502 1 1135 . 1 1 108 108 ASN HB3 H 1 0.920 0.008 . . . . . . 108 ASN HB3 . 25502 1 1136 . 1 1 108 108 ASN HD21 H 1 5.749 0.006 . . . . . . 108 ASN HD21 . 25502 1 1137 . 1 1 108 108 ASN HD22 H 1 7.446 0.006 . . . . . . 108 ASN HD22 . 25502 1 1138 . 1 1 108 108 ASN CA C 13 55.448 0.006 . . . . . . 108 ASN CA . 25502 1 1139 . 1 1 108 108 ASN CB C 13 39.600 0.001 . . . . . . 108 ASN CB . 25502 1 1140 . 1 1 108 108 ASN N N 15 120.251 0.006 . . . . . . 108 ASN N . 25502 1 1141 . 1 1 108 108 ASN ND2 N 15 112.748 0.013 . . . . . . 108 ASN ND2 . 25502 1 1142 . 1 1 109 109 GLY H H 1 9.188 0.017 . . . . . . 109 GLY H . 25502 1 1143 . 1 1 109 109 GLY HA2 H 1 4.595 0.007 . . . . . . 109 GLY HA2 . 25502 1 1144 . 1 1 109 109 GLY HA3 H 1 3.627 0.007 . . . . . . 109 GLY HA3 . 25502 1 1145 . 1 1 109 109 GLY CA C 13 46.039 0.006 . . . . . . 109 GLY CA . 25502 1 1146 . 1 1 109 109 GLY N N 15 110.632 0.006 . . . . . . 109 GLY N . 25502 1 1147 . 1 1 110 110 SER H H 1 8.738 0.003 . . . . . . 110 SER H . 25502 1 1148 . 1 1 110 110 SER HA H 1 4.698 0.009 . . . . . . 110 SER HA . 25502 1 1149 . 1 1 110 110 SER HB2 H 1 4.604 0.005 . . . . . . 110 SER HB2 . 25502 1 1150 . 1 1 110 110 SER HB3 H 1 4.382 0.017 . . . . . . 110 SER HB3 . 25502 1 1151 . 1 1 110 110 SER HG H 1 4.926 0.006 . . . . . . 110 SER HG . 25502 1 1152 . 1 1 110 110 SER CA C 13 57.454 0.006 . . . . . . 110 SER CA . 25502 1 1153 . 1 1 110 110 SER CB C 13 65.964 0.001 . . . . . . 110 SER CB . 25502 1 1154 . 1 1 110 110 SER N N 15 116.806 0.006 . . . . . . 110 SER N . 25502 1 1155 . 1 1 111 111 GLN H H 1 8.388 0.006 . . . . . . 111 GLN H . 25502 1 1156 . 1 1 111 111 GLN HA H 1 5.168 0.005 . . . . . . 111 GLN HA . 25502 1 1157 . 1 1 111 111 GLN HB2 H 1 2.199 0.009 . . . . . . 111 GLN HB2 . 25502 1 1158 . 1 1 111 111 GLN HB3 H 1 2.069 0.006 . . . . . . 111 GLN HB3 . 25502 1 1159 . 1 1 111 111 GLN HG2 H 1 2.433 0.009 . . . . . . 111 GLN HG2 . 25502 1 1160 . 1 1 111 111 GLN HG3 H 1 1.843 0.009 . . . . . . 111 GLN HG3 . 25502 1 1161 . 1 1 111 111 GLN HE21 H 1 7.299 0.003 . . . . . . 111 GLN HE21 . 25502 1 1162 . 1 1 111 111 GLN HE22 H 1 6.186 0.003 . . . . . . 111 GLN HE22 . 25502 1 1163 . 1 1 111 111 GLN CA C 13 57.494 0.006 . . . . . . 111 GLN CA . 25502 1 1164 . 1 1 111 111 GLN CB C 13 31.632 0.006 . . . . . . 111 GLN CB . 25502 1 1165 . 1 1 111 111 GLN CG C 13 35.244 0.094 . . . . . . 111 GLN CG . 25502 1 1166 . 1 1 111 111 GLN N N 15 124.263 0.006 . . . . . . 111 GLN N . 25502 1 1167 . 1 1 111 111 GLN NE2 N 15 110.985 0.013 . . . . . . 111 GLN NE2 . 25502 1 1168 . 1 1 112 112 PHE H H 1 8.058 0.006 . . . . . . 112 PHE H . 25502 1 1169 . 1 1 112 112 PHE HA H 1 5.714 0.014 . . . . . . 112 PHE HA . 25502 1 1170 . 1 1 112 112 PHE HB2 H 1 3.279 0.009 . . . . . . 112 PHE QB . 25502 1 1171 . 1 1 112 112 PHE HB3 H 1 3.279 0.009 . . . . . . 112 PHE QB . 25502 1 1172 . 1 1 112 112 PHE HE1 H 1 6.769 0.020 . . . . . . 112 PHE QE . 25502 1 1173 . 1 1 112 112 PHE HE2 H 1 6.769 0.020 . . . . . . 112 PHE QE . 25502 1 1174 . 1 1 112 112 PHE CA C 13 55.447 0.068 . . . . . . 112 PHE CA . 25502 1 1175 . 1 1 112 112 PHE CB C 13 43.000 0.006 . . . . . . 112 PHE CB . 25502 1 1176 . 1 1 112 112 PHE N N 15 117.560 0.006 . . . . . . 112 PHE N . 25502 1 1177 . 1 1 113 113 PHE H H 1 9.795 0.005 . . . . . . 113 PHE H . 25502 1 1178 . 1 1 113 113 PHE HA H 1 5.670 0.007 . . . . . . 113 PHE HA . 25502 1 1179 . 1 1 113 113 PHE HB2 H 1 2.885 0.012 . . . . . . 113 PHE HB2 . 25502 1 1180 . 1 1 113 113 PHE HB3 H 1 2.832 0.010 . . . . . . 113 PHE HB3 . 25502 1 1181 . 1 1 113 113 PHE HD1 H 1 6.817 0.012 . . . . . . 113 PHE QD . 25502 1 1182 . 1 1 113 113 PHE HD2 H 1 6.817 0.012 . . . . . . 113 PHE QD . 25502 1 1183 . 1 1 113 113 PHE HE1 H 1 6.750 0.007 . . . . . . 113 PHE QE . 25502 1 1184 . 1 1 113 113 PHE HE2 H 1 6.750 0.007 . . . . . . 113 PHE QE . 25502 1 1185 . 1 1 113 113 PHE HZ H 1 6.894 0.011 . . . . . . 113 PHE HZ . 25502 1 1186 . 1 1 113 113 PHE CA C 13 54.437 0.107 . . . . . . 113 PHE CA . 25502 1 1187 . 1 1 113 113 PHE CB C 13 42.617 0.002 . . . . . . 113 PHE CB . 25502 1 1188 . 1 1 113 113 PHE N N 15 116.199 0.006 . . . . . . 113 PHE N . 25502 1 1189 . 1 1 114 114 ILE H H 1 9.098 0.006 . . . . . . 114 ILE H . 25502 1 1190 . 1 1 114 114 ILE HA H 1 4.794 0.006 . . . . . . 114 ILE HA . 25502 1 1191 . 1 1 114 114 ILE HB H 1 1.801 0.010 . . . . . . 114 ILE HB . 25502 1 1192 . 1 1 114 114 ILE HG12 H 1 2.058 0.185 . . . . . . 114 ILE HG12 . 25502 1 1193 . 1 1 114 114 ILE HG13 H 1 1.084 0.008 . . . . . . 114 ILE HG13 . 25502 1 1194 . 1 1 114 114 ILE HG21 H 1 0.838 0.004 . . . . . . 114 ILE QG2 . 25502 1 1195 . 1 1 114 114 ILE HG22 H 1 0.838 0.004 . . . . . . 114 ILE QG2 . 25502 1 1196 . 1 1 114 114 ILE HG23 H 1 0.838 0.004 . . . . . . 114 ILE QG2 . 25502 1 1197 . 1 1 114 114 ILE HD11 H 1 1.205 0.006 . . . . . . 114 ILE QD1 . 25502 1 1198 . 1 1 114 114 ILE HD12 H 1 1.205 0.006 . . . . . . 114 ILE QD1 . 25502 1 1199 . 1 1 114 114 ILE HD13 H 1 1.205 0.006 . . . . . . 114 ILE QD1 . 25502 1 1200 . 1 1 114 114 ILE CA C 13 60.060 0.006 . . . . . . 114 ILE CA . 25502 1 1201 . 1 1 114 114 ILE CB C 13 40.162 0.099 . . . . . . 114 ILE CB . 25502 1 1202 . 1 1 114 114 ILE CG1 C 13 27.167 0.003 . . . . . . 114 ILE CG1 . 25502 1 1203 . 1 1 114 114 ILE CD1 C 13 14.958 0.006 . . . . . . 114 ILE CD1 . 25502 1 1204 . 1 1 114 114 ILE N N 15 118.391 0.006 . . . . . . 114 ILE N . 25502 1 1205 . 1 1 115 115 CYS H H 1 9.597 0.009 . . . . . . 115 CYS H . 25502 1 1206 . 1 1 115 115 CYS HA H 1 4.752 0.004 . . . . . . 115 CYS HA . 25502 1 1207 . 1 1 115 115 CYS HB2 H 1 3.095 0.008 . . . . . . 115 CYS HB2 . 25502 1 1208 . 1 1 115 115 CYS HB3 H 1 3.468 0.021 . . . . . . 115 CYS HB3 . 25502 1 1209 . 1 1 115 115 CYS CA C 13 60.672 0.006 . . . . . . 115 CYS CA . 25502 1 1210 . 1 1 115 115 CYS CB C 13 42.738 0.010 . . . . . . 115 CYS CB . 25502 1 1211 . 1 1 115 115 CYS N N 15 125.271 0.006 . . . . . . 115 CYS N . 25502 1 1212 . 1 1 116 116 THR H H 1 8.947 0.006 . . . . . . 116 THR H . 25502 1 1213 . 1 1 116 116 THR HA H 1 4.324 0.009 . . . . . . 116 THR HA . 25502 1 1214 . 1 1 116 116 THR HB H 1 4.425 0.012 . . . . . . 116 THR HB . 25502 1 1215 . 1 1 116 116 THR HG21 H 1 0.824 0.004 . . . . . . 116 THR QG2 . 25502 1 1216 . 1 1 116 116 THR HG22 H 1 0.824 0.004 . . . . . . 116 THR QG2 . 25502 1 1217 . 1 1 116 116 THR HG23 H 1 0.824 0.004 . . . . . . 116 THR QG2 . 25502 1 1218 . 1 1 116 116 THR CA C 13 60.720 0.067 . . . . . . 116 THR CA . 25502 1 1219 . 1 1 116 116 THR CB C 13 66.502 0.006 . . . . . . 116 THR CB . 25502 1 1220 . 1 1 116 116 THR N N 15 115.478 0.006 . . . . . . 116 THR N . 25502 1 1221 . 1 1 117 117 ALA H H 1 7.602 0.008 . . . . . . 117 ALA H . 25502 1 1222 . 1 1 117 117 ALA HA H 1 4.358 0.006 . . . . . . 117 ALA HA . 25502 1 1223 . 1 1 117 117 ALA HB1 H 1 1.412 0.007 . . . . . . 117 ALA QB . 25502 1 1224 . 1 1 117 117 ALA HB2 H 1 1.412 0.007 . . . . . . 117 ALA QB . 25502 1 1225 . 1 1 117 117 ALA HB3 H 1 1.412 0.007 . . . . . . 117 ALA QB . 25502 1 1226 . 1 1 117 117 ALA CA C 13 50.511 0.108 . . . . . . 117 ALA CA . 25502 1 1227 . 1 1 117 117 ALA CB C 13 22.608 0.006 . . . . . . 117 ALA CB . 25502 1 1228 . 1 1 117 117 ALA N N 15 121.996 0.006 . . . . . . 117 ALA N . 25502 1 1229 . 1 1 118 118 LYS H H 1 8.690 0.002 . . . . . . 118 LYS H . 25502 1 1230 . 1 1 118 118 LYS HA H 1 3.779 0.003 . . . . . . 118 LYS HA . 25502 1 1231 . 1 1 118 118 LYS HB2 H 1 1.959 0.010 . . . . . . 118 LYS HB2 . 25502 1 1232 . 1 1 118 118 LYS HB3 H 1 1.632 0.007 . . . . . . 118 LYS HB3 . 25502 1 1233 . 1 1 118 118 LYS HG2 H 1 1.504 0.010 . . . . . . 118 LYS HG2 . 25502 1 1234 . 1 1 118 118 LYS HG3 H 1 1.500 0.007 . . . . . . 118 LYS HG3 . 25502 1 1235 . 1 1 118 118 LYS HD2 H 1 1.743 0.006 . . . . . . 118 LYS QD . 25502 1 1236 . 1 1 118 118 LYS HD3 H 1 1.743 0.006 . . . . . . 118 LYS QD . 25502 1 1237 . 1 1 118 118 LYS HE2 H 1 3.016 0.007 . . . . . . 118 LYS QE . 25502 1 1238 . 1 1 118 118 LYS HE3 H 1 3.016 0.007 . . . . . . 118 LYS QE . 25502 1 1239 . 1 1 118 118 LYS CA C 13 57.664 0.006 . . . . . . 118 LYS CA . 25502 1 1240 . 1 1 118 118 LYS CB C 13 32.499 0.002 . . . . . . 118 LYS CB . 25502 1 1241 . 1 1 118 118 LYS CG C 13 24.577 0.006 . . . . . . 118 LYS CG . 25502 1 1242 . 1 1 118 118 LYS CD C 13 29.529 0.000 . . . . . . 118 LYS CD . 25502 1 1243 . 1 1 118 118 LYS CE C 13 41.735 0.006 . . . . . . 118 LYS CE . 25502 1 1244 . 1 1 118 118 LYS N N 15 119.550 0.006 . . . . . . 118 LYS N . 25502 1 1245 . 1 1 119 119 THR H H 1 7.328 0.006 . . . . . . 119 THR H . 25502 1 1246 . 1 1 119 119 THR HA H 1 3.623 0.005 . . . . . . 119 THR HA . 25502 1 1247 . 1 1 119 119 THR HB H 1 2.815 0.009 . . . . . . 119 THR HB . 25502 1 1248 . 1 1 119 119 THR HG1 H 1 3.054 0.019 . . . . . . 119 THR HG1 . 25502 1 1249 . 1 1 119 119 THR HG21 H 1 0.974 0.006 . . . . . . 119 THR QG2 . 25502 1 1250 . 1 1 119 119 THR HG22 H 1 0.974 0.006 . . . . . . 119 THR QG2 . 25502 1 1251 . 1 1 119 119 THR HG23 H 1 0.974 0.006 . . . . . . 119 THR QG2 . 25502 1 1252 . 1 1 119 119 THR CA C 13 57.088 0.103 . . . . . . 119 THR CA . 25502 1 1253 . 1 1 119 119 THR N N 15 118.759 0.006 . . . . . . 119 THR N . 25502 1 1254 . 1 1 120 120 GLU H H 1 9.092 0.001 . . . . . . 120 GLU H . 25502 1 1255 . 1 1 120 120 GLU HA H 1 4.120 0.007 . . . . . . 120 GLU HA . 25502 1 1256 . 1 1 120 120 GLU HB2 H 1 2.189 0.006 . . . . . . 120 GLU HB2 . 25502 1 1257 . 1 1 120 120 GLU HB3 H 1 2.114 0.009 . . . . . . 120 GLU HB3 . 25502 1 1258 . 1 1 120 120 GLU HG2 H 1 2.508 0.011 . . . . . . 120 GLU HG2 . 25502 1 1259 . 1 1 120 120 GLU HG3 H 1 2.399 0.013 . . . . . . 120 GLU HG3 . 25502 1 1260 . 1 1 120 120 GLU CA C 13 59.072 0.006 . . . . . . 120 GLU CA . 25502 1 1261 . 1 1 120 120 GLU CG C 13 35.378 0.054 . . . . . . 120 GLU CG . 25502 1 1262 . 1 1 120 120 GLU N N 15 124.407 0.006 . . . . . . 120 GLU N . 25502 1 1263 . 1 1 121 121 TRP H H 1 7.251 0.007 . . . . . . 121 TRP H . 25502 1 1264 . 1 1 121 121 TRP HA H 1 4.653 0.007 . . . . . . 121 TRP HA . 25502 1 1265 . 1 1 121 121 TRP HB2 H 1 3.375 0.009 . . . . . . 121 TRP HB2 . 25502 1 1266 . 1 1 121 121 TRP HB3 H 1 3.326 0.011 . . . . . . 121 TRP HB3 . 25502 1 1267 . 1 1 121 121 TRP HD1 H 1 7.019 0.005 . . . . . . 121 TRP HD1 . 25502 1 1268 . 1 1 121 121 TRP HE1 H 1 9.697 0.005 . . . . . . 121 TRP HE1 . 25502 1 1269 . 1 1 121 121 TRP HE3 H 1 7.660 0.010 . . . . . . 121 TRP HE3 . 25502 1 1270 . 1 1 121 121 TRP HZ2 H 1 6.607 0.020 . . . . . . 121 TRP HZ2 . 25502 1 1271 . 1 1 121 121 TRP HZ3 H 1 7.316 0.016 . . . . . . 121 TRP HZ3 . 25502 1 1272 . 1 1 121 121 TRP HH2 H 1 7.116 0.008 . . . . . . 121 TRP HH2 . 25502 1 1273 . 1 1 121 121 TRP CA C 13 59.461 0.006 . . . . . . 121 TRP CA . 25502 1 1274 . 1 1 121 121 TRP CB C 13 26.750 0.009 . . . . . . 121 TRP CB . 25502 1 1275 . 1 1 121 121 TRP N N 15 117.495 0.006 . . . . . . 121 TRP N . 25502 1 1276 . 1 1 121 121 TRP NE1 N 15 129.802 0.006 . . . . . . 121 TRP NE1 . 25502 1 1277 . 1 1 122 122 LEU H H 1 7.019 0.019 . . . . . . 122 LEU H . 25502 1 1278 . 1 1 122 122 LEU HA H 1 4.251 0.011 . . . . . . 122 LEU HA . 25502 1 1279 . 1 1 122 122 LEU HB2 H 1 0.110 0.006 . . . . . . 122 LEU HB2 . 25502 1 1280 . 1 1 122 122 LEU HB3 H 1 1.164 0.033 . . . . . . 122 LEU HB3 . 25502 1 1281 . 1 1 122 122 LEU HG H 1 0.369 0.007 . . . . . . 122 LEU HG . 25502 1 1282 . 1 1 122 122 LEU HD11 H 1 0.373 0.007 . . . . . . 122 LEU QD1 . 25502 1 1283 . 1 1 122 122 LEU HD12 H 1 0.373 0.007 . . . . . . 122 LEU QD1 . 25502 1 1284 . 1 1 122 122 LEU HD13 H 1 0.373 0.007 . . . . . . 122 LEU QD1 . 25502 1 1285 . 1 1 122 122 LEU HD21 H 1 0.676 0.022 . . . . . . 122 LEU QD2 . 25502 1 1286 . 1 1 122 122 LEU HD22 H 1 0.676 0.022 . . . . . . 122 LEU QD2 . 25502 1 1287 . 1 1 122 122 LEU HD23 H 1 0.676 0.022 . . . . . . 122 LEU QD2 . 25502 1 1288 . 1 1 122 122 LEU CA C 13 54.500 0.006 . . . . . . 122 LEU CA . 25502 1 1289 . 1 1 122 122 LEU CB C 13 38.899 0.024 . . . . . . 122 LEU CB . 25502 1 1290 . 1 1 122 122 LEU CG C 13 25.995 0.006 . . . . . . 122 LEU CG . 25502 1 1291 . 1 1 122 122 LEU N N 15 119.528 0.006 . . . . . . 122 LEU N . 25502 1 1292 . 1 1 123 123 ASP H H 1 7.607 0.002 . . . . . . 123 ASP H . 25502 1 1293 . 1 1 123 123 ASP HA H 1 5.165 0.012 . . . . . . 123 ASP HA . 25502 1 1294 . 1 1 123 123 ASP HB2 H 1 2.927 0.004 . . . . . . 123 ASP HB2 . 25502 1 1295 . 1 1 123 123 ASP HB3 H 1 2.692 0.011 . . . . . . 123 ASP HB3 . 25502 1 1296 . 1 1 123 123 ASP CA C 13 55.856 0.006 . . . . . . 123 ASP CA . 25502 1 1297 . 1 1 123 123 ASP CB C 13 39.372 0.046 . . . . . . 123 ASP CB . 25502 1 1298 . 1 1 123 123 ASP N N 15 121.832 0.006 . . . . . . 123 ASP N . 25502 1 1299 . 1 1 124 124 GLY H H 1 9.522 0.019 . . . . . . 124 GLY H . 25502 1 1300 . 1 1 124 124 GLY HA2 H 1 3.888 0.005 . . . . . . 124 GLY HA2 . 25502 1 1301 . 1 1 124 124 GLY HA3 H 1 2.877 0.002 . . . . . . 124 GLY HA3 . 25502 1 1302 . 1 1 124 124 GLY CA C 13 45.023 0.006 . . . . . . 124 GLY CA . 25502 1 1303 . 1 1 124 124 GLY N N 15 110.836 0.006 . . . . . . 124 GLY N . 25502 1 1304 . 1 1 125 125 LYS H H 1 7.727 0.006 . . . . . . 125 LYS H . 25502 1 1305 . 1 1 125 125 LYS HA H 1 4.109 0.001 . . . . . . 125 LYS HA . 25502 1 1306 . 1 1 125 125 LYS HB2 H 1 1.817 0.007 . . . . . . 125 LYS HB2 . 25502 1 1307 . 1 1 125 125 LYS HB3 H 1 1.684 0.016 . . . . . . 125 LYS HB3 . 25502 1 1308 . 1 1 125 125 LYS HG2 H 1 1.248 0.010 . . . . . . 125 LYS HG2 . 25502 1 1309 . 1 1 125 125 LYS HG3 H 1 1.220 0.008 . . . . . . 125 LYS HG3 . 25502 1 1310 . 1 1 125 125 LYS HD2 H 1 1.675 0.006 . . . . . . 125 LYS QD . 25502 1 1311 . 1 1 125 125 LYS HD3 H 1 1.675 0.006 . . . . . . 125 LYS QD . 25502 1 1312 . 1 1 125 125 LYS HE2 H 1 3.003 0.008 . . . . . . 125 LYS QE . 25502 1 1313 . 1 1 125 125 LYS HE3 H 1 3.003 0.008 . . . . . . 125 LYS QE . 25502 1 1314 . 1 1 125 125 LYS CA C 13 56.248 0.131 . . . . . . 125 LYS CA . 25502 1 1315 . 1 1 125 125 LYS CB C 13 35.389 0.040 . . . . . . 125 LYS CB . 25502 1 1316 . 1 1 125 125 LYS CD C 13 28.980 0.006 . . . . . . 125 LYS CD . 25502 1 1317 . 1 1 125 125 LYS CE C 13 42.014 0.006 . . . . . . 125 LYS CE . 25502 1 1318 . 1 1 125 125 LYS N N 15 115.016 0.006 . . . . . . 125 LYS N . 25502 1 1319 . 1 1 126 126 HIS H H 1 7.571 0.006 . . . . . . 126 HIS H . 25502 1 1320 . 1 1 126 126 HIS HA H 1 4.799 0.001 . . . . . . 126 HIS HA . 25502 1 1321 . 1 1 126 126 HIS HB2 H 1 3.186 0.003 . . . . . . 126 HIS HB2 . 25502 1 1322 . 1 1 126 126 HIS HB3 H 1 3.990 0.002 . . . . . . 126 HIS HB3 . 25502 1 1323 . 1 1 126 126 HIS HD1 H 1 8.175 0.006 . . . . . . 126 HIS HD1 . 25502 1 1324 . 1 1 126 126 HIS HD2 H 1 6.941 0.026 . . . . . . 126 HIS HD2 . 25502 1 1325 . 1 1 126 126 HIS CA C 13 54.559 0.006 . . . . . . 126 HIS CA . 25502 1 1326 . 1 1 126 126 HIS N N 15 119.223 0.006 . . . . . . 126 HIS N . 25502 1 1327 . 1 1 127 127 VAL H H 1 8.474 0.001 . . . . . . 127 VAL H . 25502 1 1328 . 1 1 127 127 VAL HA H 1 4.258 0.003 . . . . . . 127 VAL HA . 25502 1 1329 . 1 1 127 127 VAL HB H 1 1.997 0.006 . . . . . . 127 VAL HB . 25502 1 1330 . 1 1 127 127 VAL HG11 H 1 1.133 0.004 . . . . . . 127 VAL QG1 . 25502 1 1331 . 1 1 127 127 VAL HG12 H 1 1.133 0.004 . . . . . . 127 VAL QG1 . 25502 1 1332 . 1 1 127 127 VAL HG13 H 1 1.133 0.004 . . . . . . 127 VAL QG1 . 25502 1 1333 . 1 1 127 127 VAL HG21 H 1 1.023 0.004 . . . . . . 127 VAL QG2 . 25502 1 1334 . 1 1 127 127 VAL HG22 H 1 1.023 0.004 . . . . . . 127 VAL QG2 . 25502 1 1335 . 1 1 127 127 VAL HG23 H 1 1.023 0.004 . . . . . . 127 VAL QG2 . 25502 1 1336 . 1 1 127 127 VAL CA C 13 63.647 0.006 . . . . . . 127 VAL CA . 25502 1 1337 . 1 1 127 127 VAL CB C 13 33.416 0.006 . . . . . . 127 VAL CB . 25502 1 1338 . 1 1 127 127 VAL N N 15 124.730 0.006 . . . . . . 127 VAL N . 25502 1 1339 . 1 1 128 128 VAL H H 1 9.470 0.004 . . . . . . 128 VAL H . 25502 1 1340 . 1 1 128 128 VAL HA H 1 4.150 0.007 . . . . . . 128 VAL HA . 25502 1 1341 . 1 1 128 128 VAL HB H 1 1.703 0.008 . . . . . . 128 VAL HB . 25502 1 1342 . 1 1 128 128 VAL HG11 H 1 0.079 0.003 . . . . . . 128 VAL QG1 . 25502 1 1343 . 1 1 128 128 VAL HG12 H 1 0.079 0.003 . . . . . . 128 VAL QG1 . 25502 1 1344 . 1 1 128 128 VAL HG13 H 1 0.079 0.003 . . . . . . 128 VAL QG1 . 25502 1 1345 . 1 1 128 128 VAL HG21 H 1 0.927 0.012 . . . . . . 128 VAL QG2 . 25502 1 1346 . 1 1 128 128 VAL HG22 H 1 0.927 0.012 . . . . . . 128 VAL QG2 . 25502 1 1347 . 1 1 128 128 VAL HG23 H 1 0.927 0.012 . . . . . . 128 VAL QG2 . 25502 1 1348 . 1 1 128 128 VAL CB C 13 31.369 0.006 . . . . . . 128 VAL CB . 25502 1 1349 . 1 1 128 128 VAL N N 15 132.814 0.006 . . . . . . 128 VAL N . 25502 1 1350 . 1 1 129 129 PHE H H 1 8.086 0.012 . . . . . . 129 PHE H . 25502 1 1351 . 1 1 129 129 PHE HA H 1 5.253 0.005 . . . . . . 129 PHE HA . 25502 1 1352 . 1 1 129 129 PHE HB2 H 1 3.106 0.008 . . . . . . 129 PHE HB2 . 25502 1 1353 . 1 1 129 129 PHE HB3 H 1 2.496 0.006 . . . . . . 129 PHE HB3 . 25502 1 1354 . 1 1 129 129 PHE CA C 13 55.907 0.006 . . . . . . 129 PHE CA . 25502 1 1355 . 1 1 129 129 PHE CB C 13 42.456 0.054 . . . . . . 129 PHE CB . 25502 1 1356 . 1 1 129 129 PHE N N 15 117.478 0.006 . . . . . . 129 PHE N . 25502 1 1357 . 1 1 130 130 GLY H H 1 7.297 0.004 . . . . . . 130 GLY H . 25502 1 1358 . 1 1 130 130 GLY HA2 H 1 3.156 0.004 . . . . . . 130 GLY HA2 . 25502 1 1359 . 1 1 130 130 GLY HA3 H 1 2.980 0.005 . . . . . . 130 GLY HA3 . 25502 1 1360 . 1 1 130 130 GLY CA C 13 46.394 0.058 . . . . . . 130 GLY CA . 25502 1 1361 . 1 1 130 130 GLY N N 15 110.497 0.006 . . . . . . 130 GLY N . 25502 1 1362 . 1 1 131 131 LYS H H 1 8.353 0.008 . . . . . . 131 LYS H . 25502 1 1363 . 1 1 131 131 LYS HA H 1 5.207 0.005 . . . . . . 131 LYS HA . 25502 1 1364 . 1 1 131 131 LYS HB2 H 1 1.816 0.006 . . . . . . 131 LYS HB2 . 25502 1 1365 . 1 1 131 131 LYS HB3 H 1 1.818 0.007 . . . . . . 131 LYS HB3 . 25502 1 1366 . 1 1 131 131 LYS HG2 H 1 1.498 0.006 . . . . . . 131 LYS HG2 . 25502 1 1367 . 1 1 131 131 LYS HG3 H 1 1.039 0.005 . . . . . . 131 LYS HG3 . 25502 1 1368 . 1 1 131 131 LYS HD2 H 1 1.773 0.015 . . . . . . 131 LYS HD2 . 25502 1 1369 . 1 1 131 131 LYS HD3 H 1 1.676 0.010 . . . . . . 131 LYS HD3 . 25502 1 1370 . 1 1 131 131 LYS HE2 H 1 2.967 0.012 . . . . . . 131 LYS HE2 . 25502 1 1371 . 1 1 131 131 LYS HE3 H 1 2.965 0.007 . . . . . . 131 LYS HE3 . 25502 1 1372 . 1 1 131 131 LYS CA C 13 54.795 0.062 . . . . . . 131 LYS CA . 25502 1 1373 . 1 1 131 131 LYS CB C 13 35.852 0.006 . . . . . . 131 LYS CB . 25502 1 1374 . 1 1 131 131 LYS CD C 13 29.339 0.010 . . . . . . 131 LYS CD . 25502 1 1375 . 1 1 131 131 LYS CE C 13 41.917 0.127 . . . . . . 131 LYS CE . 25502 1 1376 . 1 1 131 131 LYS N N 15 115.059 0.006 . . . . . . 131 LYS N . 25502 1 1377 . 1 1 132 132 VAL H H 1 9.015 0.011 . . . . . . 132 VAL H . 25502 1 1378 . 1 1 132 132 VAL HA H 1 3.888 0.010 . . . . . . 132 VAL HA . 25502 1 1379 . 1 1 132 132 VAL HB H 1 1.911 0.002 . . . . . . 132 VAL HB . 25502 1 1380 . 1 1 132 132 VAL HG11 H 1 0.588 0.005 . . . . . . 132 VAL QG1 . 25502 1 1381 . 1 1 132 132 VAL HG12 H 1 0.588 0.005 . . . . . . 132 VAL QG1 . 25502 1 1382 . 1 1 132 132 VAL HG13 H 1 0.588 0.005 . . . . . . 132 VAL QG1 . 25502 1 1383 . 1 1 132 132 VAL HG21 H 1 1.031 0.004 . . . . . . 132 VAL QG2 . 25502 1 1384 . 1 1 132 132 VAL HG22 H 1 1.031 0.004 . . . . . . 132 VAL QG2 . 25502 1 1385 . 1 1 132 132 VAL HG23 H 1 1.031 0.004 . . . . . . 132 VAL QG2 . 25502 1 1386 . 1 1 132 132 VAL CA C 13 63.947 0.020 . . . . . . 132 VAL CA . 25502 1 1387 . 1 1 132 132 VAL CB C 13 32.547 0.006 . . . . . . 132 VAL CB . 25502 1 1388 . 1 1 132 132 VAL CG2 C 13 22.931 0.006 . . . . . . 132 VAL CG2 . 25502 1 1389 . 1 1 132 132 VAL N N 15 123.802 0.006 . . . . . . 132 VAL N . 25502 1 1390 . 1 1 133 133 LYS H H 1 9.469 0.002 . . . . . . 133 LYS H . 25502 1 1391 . 1 1 133 133 LYS HA H 1 4.424 0.007 . . . . . . 133 LYS HA . 25502 1 1392 . 1 1 133 133 LYS HB2 H 1 1.709 0.014 . . . . . . 133 LYS HB2 . 25502 1 1393 . 1 1 133 133 LYS HB3 H 1 1.636 0.005 . . . . . . 133 LYS HB3 . 25502 1 1394 . 1 1 133 133 LYS HG2 H 1 1.443 0.003 . . . . . . 133 LYS HG2 . 25502 1 1395 . 1 1 133 133 LYS HG3 H 1 1.301 0.010 . . . . . . 133 LYS HG3 . 25502 1 1396 . 1 1 133 133 LYS HD2 H 1 1.620 0.006 . . . . . . 133 LYS QD . 25502 1 1397 . 1 1 133 133 LYS HD3 H 1 1.620 0.006 . . . . . . 133 LYS QD . 25502 1 1398 . 1 1 133 133 LYS HE2 H 1 2.951 0.008 . . . . . . 133 LYS QE . 25502 1 1399 . 1 1 133 133 LYS HE3 H 1 2.951 0.008 . . . . . . 133 LYS QE . 25502 1 1400 . 1 1 133 133 LYS CA C 13 56.659 0.006 . . . . . . 133 LYS CA . 25502 1 1401 . 1 1 133 133 LYS CB C 13 33.867 0.066 . . . . . . 133 LYS CB . 25502 1 1402 . 1 1 133 133 LYS CG C 13 24.588 0.010 . . . . . . 133 LYS CG . 25502 1 1403 . 1 1 133 133 LYS CE C 13 41.326 0.006 . . . . . . 133 LYS CE . 25502 1 1404 . 1 1 133 133 LYS N N 15 131.324 0.006 . . . . . . 133 LYS N . 25502 1 1405 . 1 1 134 134 GLU H H 1 7.543 0.002 . . . . . . 134 GLU H . 25502 1 1406 . 1 1 134 134 GLU HA H 1 4.559 0.006 . . . . . . 134 GLU HA . 25502 1 1407 . 1 1 134 134 GLU HB2 H 1 1.946 0.005 . . . . . . 134 GLU HB2 . 25502 1 1408 . 1 1 134 134 GLU HB3 H 1 1.850 0.007 . . . . . . 134 GLU HB3 . 25502 1 1409 . 1 1 134 134 GLU HG2 H 1 2.182 0.009 . . . . . . 134 GLU HG2 . 25502 1 1410 . 1 1 134 134 GLU HG3 H 1 2.151 0.012 . . . . . . 134 GLU HG3 . 25502 1 1411 . 1 1 134 134 GLU CA C 13 55.148 0.006 . . . . . . 134 GLU CA . 25502 1 1412 . 1 1 134 134 GLU CB C 13 32.736 0.027 . . . . . . 134 GLU CB . 25502 1 1413 . 1 1 134 134 GLU CG C 13 36.572 0.002 . . . . . . 134 GLU CG . 25502 1 1414 . 1 1 134 134 GLU N N 15 118.178 0.006 . . . . . . 134 GLU N . 25502 1 1415 . 1 1 135 135 GLY H H 1 8.693 0.006 . . . . . . 135 GLY H . 25502 1 1416 . 1 1 135 135 GLY HA2 H 1 4.731 0.009 . . . . . . 135 GLY HA2 . 25502 1 1417 . 1 1 135 135 GLY HA3 H 1 3.980 0.003 . . . . . . 135 GLY HA3 . 25502 1 1418 . 1 1 135 135 GLY CA C 13 45.867 0.030 . . . . . . 135 GLY CA . 25502 1 1419 . 1 1 135 135 GLY N N 15 107.767 0.006 . . . . . . 135 GLY N . 25502 1 1420 . 1 1 136 136 MET H H 1 8.790 0.015 . . . . . . 136 MET H . 25502 1 1421 . 1 1 136 136 MET HA H 1 4.437 0.005 . . . . . . 136 MET HA . 25502 1 1422 . 1 1 136 136 MET HB2 H 1 1.919 0.014 . . . . . . 136 MET HB2 . 25502 1 1423 . 1 1 136 136 MET HB3 H 1 2.090 0.005 . . . . . . 136 MET HB3 . 25502 1 1424 . 1 1 136 136 MET HG2 H 1 2.758 0.006 . . . . . . 136 MET HG2 . 25502 1 1425 . 1 1 136 136 MET HG3 H 1 2.593 0.006 . . . . . . 136 MET HG3 . 25502 1 1426 . 1 1 136 136 MET HE1 H 1 1.981 0.005 . . . . . . 136 MET QE . 25502 1 1427 . 1 1 136 136 MET HE2 H 1 1.981 0.005 . . . . . . 136 MET QE . 25502 1 1428 . 1 1 136 136 MET HE3 H 1 1.981 0.005 . . . . . . 136 MET QE . 25502 1 1429 . 1 1 136 136 MET CA C 13 56.659 0.006 . . . . . . 136 MET CA . 25502 1 1430 . 1 1 136 136 MET CB C 13 30.025 0.002 . . . . . . 136 MET CB . 25502 1 1431 . 1 1 136 136 MET CG C 13 32.855 0.109 . . . . . . 136 MET CG . 25502 1 1432 . 1 1 136 136 MET CE C 13 17.147 0.006 . . . . . . 136 MET CE . 25502 1 1433 . 1 1 136 136 MET N N 15 122.307 0.006 . . . . . . 136 MET N . 25502 1 1434 . 1 1 137 137 ASN H H 1 8.849 0.003 . . . . . . 137 ASN H . 25502 1 1435 . 1 1 137 137 ASN HA H 1 4.450 0.004 . . . . . . 137 ASN HA . 25502 1 1436 . 1 1 137 137 ASN HB2 H 1 2.814 0.010 . . . . . . 137 ASN HB2 . 25502 1 1437 . 1 1 137 137 ASN HB3 H 1 2.782 0.021 . . . . . . 137 ASN HB3 . 25502 1 1438 . 1 1 137 137 ASN HD21 H 1 7.755 0.003 . . . . . . 137 ASN HD21 . 25502 1 1439 . 1 1 137 137 ASN HD22 H 1 7.028 0.006 . . . . . . 137 ASN HD22 . 25502 1 1440 . 1 1 137 137 ASN CA C 13 55.926 0.114 . . . . . . 137 ASN CA . 25502 1 1441 . 1 1 137 137 ASN CB C 13 35.817 0.005 . . . . . . 137 ASN CB . 25502 1 1442 . 1 1 137 137 ASN N N 15 114.221 0.006 . . . . . . 137 ASN N . 25502 1 1443 . 1 1 137 137 ASN ND2 N 15 114.611 0.003 . . . . . . 137 ASN ND2 . 25502 1 1444 . 1 1 138 138 ILE H H 1 7.642 0.002 . . . . . . 138 ILE H . 25502 1 1445 . 1 1 138 138 ILE HA H 1 3.750 0.004 . . . . . . 138 ILE HA . 25502 1 1446 . 1 1 138 138 ILE HB H 1 2.441 0.006 . . . . . . 138 ILE HB . 25502 1 1447 . 1 1 138 138 ILE HG12 H 1 1.507 0.010 . . . . . . 138 ILE HG12 . 25502 1 1448 . 1 1 138 138 ILE HG13 H 1 1.275 0.009 . . . . . . 138 ILE HG13 . 25502 1 1449 . 1 1 138 138 ILE HG21 H 1 0.630 0.006 . . . . . . 138 ILE QG2 . 25502 1 1450 . 1 1 138 138 ILE HG22 H 1 0.630 0.006 . . . . . . 138 ILE QG2 . 25502 1 1451 . 1 1 138 138 ILE HG23 H 1 0.630 0.006 . . . . . . 138 ILE QG2 . 25502 1 1452 . 1 1 138 138 ILE HD11 H 1 0.653 0.003 . . . . . . 138 ILE QD1 . 25502 1 1453 . 1 1 138 138 ILE HD12 H 1 0.653 0.003 . . . . . . 138 ILE QD1 . 25502 1 1454 . 1 1 138 138 ILE HD13 H 1 0.653 0.003 . . . . . . 138 ILE QD1 . 25502 1 1455 . 1 1 138 138 ILE CA C 13 61.331 0.006 . . . . . . 138 ILE CA . 25502 1 1456 . 1 1 138 138 ILE CB C 13 34.340 0.055 . . . . . . 138 ILE CB . 25502 1 1457 . 1 1 138 138 ILE CG1 C 13 26.972 0.006 . . . . . . 138 ILE CG1 . 25502 1 1458 . 1 1 138 138 ILE N N 15 123.949 0.006 . . . . . . 138 ILE N . 25502 1 1459 . 1 1 139 139 VAL H H 1 7.244 0.006 . . . . . . 139 VAL H . 25502 1 1460 . 1 1 139 139 VAL HA H 1 3.844 0.007 . . . . . . 139 VAL HA . 25502 1 1461 . 1 1 139 139 VAL HB H 1 2.444 0.014 . . . . . . 139 VAL HB . 25502 1 1462 . 1 1 139 139 VAL HG11 H 1 0.805 0.004 . . . . . . 139 VAL QG1 . 25502 1 1463 . 1 1 139 139 VAL HG12 H 1 0.805 0.004 . . . . . . 139 VAL QG1 . 25502 1 1464 . 1 1 139 139 VAL HG13 H 1 0.805 0.004 . . . . . . 139 VAL QG1 . 25502 1 1465 . 1 1 139 139 VAL HG21 H 1 1.019 0.009 . . . . . . 139 VAL QG2 . 25502 1 1466 . 1 1 139 139 VAL HG22 H 1 1.019 0.009 . . . . . . 139 VAL QG2 . 25502 1 1467 . 1 1 139 139 VAL HG23 H 1 1.019 0.009 . . . . . . 139 VAL QG2 . 25502 1 1468 . 1 1 139 139 VAL CA C 13 66.031 0.058 . . . . . . 139 VAL CA . 25502 1 1469 . 1 1 139 139 VAL CB C 13 30.976 0.006 . . . . . . 139 VAL CB . 25502 1 1470 . 1 1 139 139 VAL CG2 C 13 23.070 0.006 . . . . . . 139 VAL CG2 . 25502 1 1471 . 1 1 139 139 VAL N N 15 121.654 0.006 . . . . . . 139 VAL N . 25502 1 1472 . 1 1 140 140 GLU H H 1 8.291 0.013 . . . . . . 140 GLU H . 25502 1 1473 . 1 1 140 140 GLU HA H 1 4.043 0.005 . . . . . . 140 GLU HA . 25502 1 1474 . 1 1 140 140 GLU HB2 H 1 2.070 0.012 . . . . . . 140 GLU HB2 . 25502 1 1475 . 1 1 140 140 GLU HB3 H 1 1.965 0.007 . . . . . . 140 GLU HB3 . 25502 1 1476 . 1 1 140 140 GLU HG2 H 1 2.405 0.005 . . . . . . 140 GLU HG2 . 25502 1 1477 . 1 1 140 140 GLU HG3 H 1 2.204 0.005 . . . . . . 140 GLU HG3 . 25502 1 1478 . 1 1 140 140 GLU CA C 13 59.162 0.080 . . . . . . 140 GLU CA . 25502 1 1479 . 1 1 140 140 GLU CB C 13 29.419 0.006 . . . . . . 140 GLU CB . 25502 1 1480 . 1 1 140 140 GLU CG C 13 36.854 0.094 . . . . . . 140 GLU CG . 25502 1 1481 . 1 1 140 140 GLU N N 15 117.078 0.006 . . . . . . 140 GLU N . 25502 1 1482 . 1 1 141 141 ALA H H 1 7.495 0.004 . . . . . . 141 ALA H . 25502 1 1483 . 1 1 141 141 ALA HA H 1 4.061 0.010 . . . . . . 141 ALA HA . 25502 1 1484 . 1 1 141 141 ALA HB1 H 1 1.586 0.004 . . . . . . 141 ALA QB . 25502 1 1485 . 1 1 141 141 ALA HB2 H 1 1.586 0.004 . . . . . . 141 ALA QB . 25502 1 1486 . 1 1 141 141 ALA HB3 H 1 1.586 0.004 . . . . . . 141 ALA QB . 25502 1 1487 . 1 1 141 141 ALA CA C 13 54.729 0.006 . . . . . . 141 ALA CA . 25502 1 1488 . 1 1 141 141 ALA CB C 13 18.016 0.006 . . . . . . 141 ALA CB . 25502 1 1489 . 1 1 141 141 ALA N N 15 120.813 0.006 . . . . . . 141 ALA N . 25502 1 1490 . 1 1 142 142 MET H H 1 8.259 0.011 . . . . . . 142 MET H . 25502 1 1491 . 1 1 142 142 MET HA H 1 3.938 0.004 . . . . . . 142 MET HA . 25502 1 1492 . 1 1 142 142 MET HB2 H 1 2.511 0.009 . . . . . . 142 MET HB2 . 25502 1 1493 . 1 1 142 142 MET HB3 H 1 1.930 0.008 . . . . . . 142 MET HB3 . 25502 1 1494 . 1 1 142 142 MET HG2 H 1 2.259 0.004 . . . . . . 142 MET HG2 . 25502 1 1495 . 1 1 142 142 MET HG3 H 1 2.618 0.006 . . . . . . 142 MET HG3 . 25502 1 1496 . 1 1 142 142 MET HE1 H 1 1.155 0.005 . . . . . . 142 MET QE . 25502 1 1497 . 1 1 142 142 MET HE2 H 1 1.155 0.005 . . . . . . 142 MET QE . 25502 1 1498 . 1 1 142 142 MET HE3 H 1 1.155 0.005 . . . . . . 142 MET QE . 25502 1 1499 . 1 1 142 142 MET CA C 13 59.610 0.079 . . . . . . 142 MET CA . 25502 1 1500 . 1 1 142 142 MET CB C 13 33.678 0.052 . . . . . . 142 MET CB . 25502 1 1501 . 1 1 142 142 MET CE C 13 14.399 0.006 . . . . . . 142 MET CE . 25502 1 1502 . 1 1 142 142 MET N N 15 117.301 0.006 . . . . . . 142 MET N . 25502 1 1503 . 1 1 143 143 GLU H H 1 7.832 0.010 . . . . . . 143 GLU H . 25502 1 1504 . 1 1 143 143 GLU HA H 1 3.716 0.009 . . . . . . 143 GLU HA . 25502 1 1505 . 1 1 143 143 GLU HB2 H 1 2.139 0.012 . . . . . . 143 GLU HB2 . 25502 1 1506 . 1 1 143 143 GLU HB3 H 1 1.963 0.011 . . . . . . 143 GLU HB3 . 25502 1 1507 . 1 1 143 143 GLU HG2 H 1 2.044 0.006 . . . . . . 143 GLU HG2 . 25502 1 1508 . 1 1 143 143 GLU HG3 H 1 2.344 0.010 . . . . . . 143 GLU HG3 . 25502 1 1509 . 1 1 143 143 GLU CA C 13 59.182 0.100 . . . . . . 143 GLU CA . 25502 1 1510 . 1 1 143 143 GLU CB C 13 30.271 0.006 . . . . . . 143 GLU CB . 25502 1 1511 . 1 1 143 143 GLU CG C 13 37.791 0.073 . . . . . . 143 GLU CG . 25502 1 1512 . 1 1 143 143 GLU N N 15 116.052 0.006 . . . . . . 143 GLU N . 25502 1 1513 . 1 1 144 144 ARG H H 1 7.034 0.004 . . . . . . 144 ARG H . 25502 1 1514 . 1 1 144 144 ARG HA H 1 3.922 0.012 . . . . . . 144 ARG HA . 25502 1 1515 . 1 1 144 144 ARG HB2 H 1 1.458 0.012 . . . . . . 144 ARG HB2 . 25502 1 1516 . 1 1 144 144 ARG HB3 H 1 1.366 0.007 . . . . . . 144 ARG HB3 . 25502 1 1517 . 1 1 144 144 ARG HG2 H 1 1.596 0.016 . . . . . . 144 ARG HG2 . 25502 1 1518 . 1 1 144 144 ARG HG3 H 1 1.461 0.010 . . . . . . 144 ARG HG3 . 25502 1 1519 . 1 1 144 144 ARG HD2 H 1 3.050 0.012 . . . . . . 144 ARG QD . 25502 1 1520 . 1 1 144 144 ARG HD3 H 1 3.050 0.012 . . . . . . 144 ARG QD . 25502 1 1521 . 1 1 144 144 ARG HE H 1 7.104 0.006 . . . . . . 144 ARG HE . 25502 1 1522 . 1 1 144 144 ARG CA C 13 57.542 0.089 . . . . . . 144 ARG CA . 25502 1 1523 . 1 1 144 144 ARG CB C 13 29.303 0.001 . . . . . . 144 ARG CB . 25502 1 1524 . 1 1 144 144 ARG CG C 13 27.478 0.005 . . . . . . 144 ARG CG . 25502 1 1525 . 1 1 144 144 ARG CD C 13 43.073 0.006 . . . . . . 144 ARG CD . 25502 1 1526 . 1 1 144 144 ARG N N 15 114.357 0.006 . . . . . . 144 ARG N . 25502 1 1527 . 1 1 144 144 ARG NE N 15 84.775 0.006 . . . . . . 144 ARG NE . 25502 1 1528 . 1 1 145 145 PHE H H 1 7.624 0.004 . . . . . . 145 PHE H . 25502 1 1529 . 1 1 145 145 PHE HA H 1 4.793 0.006 . . . . . . 145 PHE HA . 25502 1 1530 . 1 1 145 145 PHE HB2 H 1 2.907 0.010 . . . . . . 145 PHE HB2 . 25502 1 1531 . 1 1 145 145 PHE HB3 H 1 3.536 0.008 . . . . . . 145 PHE HB3 . 25502 1 1532 . 1 1 145 145 PHE HD1 H 1 7.289 0.017 . . . . . . 145 PHE QD . 25502 1 1533 . 1 1 145 145 PHE HD2 H 1 7.289 0.017 . . . . . . 145 PHE QD . 25502 1 1534 . 1 1 145 145 PHE HE1 H 1 7.165 0.016 . . . . . . 145 PHE QE . 25502 1 1535 . 1 1 145 145 PHE HE2 H 1 7.165 0.016 . . . . . . 145 PHE QE . 25502 1 1536 . 1 1 145 145 PHE CA C 13 57.614 0.006 . . . . . . 145 PHE CA . 25502 1 1537 . 1 1 145 145 PHE CB C 13 38.913 0.077 . . . . . . 145 PHE CB . 25502 1 1538 . 1 1 145 145 PHE N N 15 115.146 0.006 . . . . . . 145 PHE N . 25502 1 1539 . 1 1 146 146 GLY H H 1 7.514 0.013 . . . . . . 146 GLY H . 25502 1 1540 . 1 1 146 146 GLY HA2 H 1 4.615 0.011 . . . . . . 146 GLY HA2 . 25502 1 1541 . 1 1 146 146 GLY HA3 H 1 3.625 0.008 . . . . . . 146 GLY HA3 . 25502 1 1542 . 1 1 146 146 GLY CA C 13 44.149 0.006 . . . . . . 146 GLY CA . 25502 1 1543 . 1 1 146 146 GLY N N 15 104.498 0.006 . . . . . . 146 GLY N . 25502 1 1544 . 1 1 147 147 SER H H 1 8.190 0.020 . . . . . . 147 SER H . 25502 1 1545 . 1 1 147 147 SER HA H 1 4.755 0.004 . . . . . . 147 SER HA . 25502 1 1546 . 1 1 147 147 SER HB2 H 1 4.159 0.007 . . . . . . 147 SER HB2 . 25502 1 1547 . 1 1 147 147 SER HB3 H 1 4.047 0.011 . . . . . . 147 SER HB3 . 25502 1 1548 . 1 1 147 147 SER CA C 13 58.033 0.006 . . . . . . 147 SER CA . 25502 1 1549 . 1 1 147 147 SER N N 15 109.815 0.000 . . . . . . 147 SER N . 25502 1 1550 . 1 1 148 148 ARG H H 1 8.795 0.006 . . . . . . 148 ARG H . 25502 1 1551 . 1 1 148 148 ARG HA H 1 4.167 0.008 . . . . . . 148 ARG HA . 25502 1 1552 . 1 1 148 148 ARG HB2 H 1 1.915 0.014 . . . . . . 148 ARG HB2 . 25502 1 1553 . 1 1 148 148 ARG HB3 H 1 1.877 0.003 . . . . . . 148 ARG HB3 . 25502 1 1554 . 1 1 148 148 ARG HG2 H 1 1.736 0.009 . . . . . . 148 ARG HG2 . 25502 1 1555 . 1 1 148 148 ARG HG3 H 1 1.701 0.012 . . . . . . 148 ARG HG3 . 25502 1 1556 . 1 1 148 148 ARG HD2 H 1 3.222 0.007 . . . . . . 148 ARG QD . 25502 1 1557 . 1 1 148 148 ARG HD3 H 1 3.222 0.007 . . . . . . 148 ARG QD . 25502 1 1558 . 1 1 148 148 ARG CA C 13 59.491 0.006 . . . . . . 148 ARG CA . 25502 1 1559 . 1 1 148 148 ARG CB C 13 29.662 0.002 . . . . . . 148 ARG CB . 25502 1 1560 . 1 1 148 148 ARG CG C 13 26.917 0.006 . . . . . . 148 ARG CG . 25502 1 1561 . 1 1 148 148 ARG CD C 13 42.993 0.006 . . . . . . 148 ARG CD . 25502 1 1562 . 1 1 148 148 ARG N N 15 119.789 0.006 . . . . . . 148 ARG N . 25502 1 1563 . 1 1 149 149 ASN H H 1 7.841 0.006 . . . . . . 149 ASN H . 25502 1 1564 . 1 1 149 149 ASN HA H 1 4.834 0.002 . . . . . . 149 ASN HA . 25502 1 1565 . 1 1 149 149 ASN HB2 H 1 3.171 0.010 . . . . . . 149 ASN HB2 . 25502 1 1566 . 1 1 149 149 ASN HB3 H 1 2.807 0.006 . . . . . . 149 ASN HB3 . 25502 1 1567 . 1 1 149 149 ASN HD21 H 1 7.528 0.006 . . . . . . 149 ASN HD21 . 25502 1 1568 . 1 1 149 149 ASN HD22 H 1 6.724 0.002 . . . . . . 149 ASN HD22 . 25502 1 1569 . 1 1 149 149 ASN CA C 13 52.120 0.006 . . . . . . 149 ASN CA . 25502 1 1570 . 1 1 149 149 ASN CB C 13 38.241 0.105 . . . . . . 149 ASN CB . 25502 1 1571 . 1 1 149 149 ASN N N 15 111.378 0.006 . . . . . . 149 ASN N . 25502 1 1572 . 1 1 149 149 ASN ND2 N 15 110.005 0.006 . . . . . . 149 ASN ND2 . 25502 1 1573 . 1 1 150 150 GLY H H 1 8.040 0.006 . . . . . . 150 GLY H . 25502 1 1574 . 1 1 150 150 GLY HA2 H 1 4.105 0.011 . . . . . . 150 GLY HA2 . 25502 1 1575 . 1 1 150 150 GLY HA3 H 1 3.936 0.010 . . . . . . 150 GLY HA3 . 25502 1 1576 . 1 1 150 150 GLY CA C 13 44.897 0.072 . . . . . . 150 GLY CA . 25502 1 1577 . 1 1 150 150 GLY N N 15 109.893 0.006 . . . . . . 150 GLY N . 25502 1 1578 . 1 1 151 151 LYS H H 1 7.525 0.002 . . . . . . 151 LYS H . 25502 1 1579 . 1 1 151 151 LYS HA H 1 4.405 0.012 . . . . . . 151 LYS HA . 25502 1 1580 . 1 1 151 151 LYS HB2 H 1 1.877 0.003 . . . . . . 151 LYS HB2 . 25502 1 1581 . 1 1 151 151 LYS HB3 H 1 1.820 0.008 . . . . . . 151 LYS HB3 . 25502 1 1582 . 1 1 151 151 LYS HG2 H 1 1.531 0.009 . . . . . . 151 LYS HG2 . 25502 1 1583 . 1 1 151 151 LYS HG3 H 1 1.479 0.000 . . . . . . 151 LYS HG3 . 25502 1 1584 . 1 1 151 151 LYS HD2 H 1 1.778 0.004 . . . . . . 151 LYS HD2 . 25502 1 1585 . 1 1 151 151 LYS HD3 H 1 1.748 0.016 . . . . . . 151 LYS HD3 . 25502 1 1586 . 1 1 151 151 LYS HE2 H 1 3.054 0.004 . . . . . . 151 LYS QE . 25502 1 1587 . 1 1 151 151 LYS HE3 H 1 3.054 0.004 . . . . . . 151 LYS QE . 25502 1 1588 . 1 1 151 151 LYS CA C 13 57.045 0.006 . . . . . . 151 LYS CA . 25502 1 1589 . 1 1 151 151 LYS CB C 13 32.269 0.006 . . . . . . 151 LYS CB . 25502 1 1590 . 1 1 151 151 LYS CG C 13 24.820 0.003 . . . . . . 151 LYS CG . 25502 1 1591 . 1 1 151 151 LYS CD C 13 28.840 0.006 . . . . . . 151 LYS CD . 25502 1 1592 . 1 1 151 151 LYS CE C 13 41.945 0.006 . . . . . . 151 LYS CE . 25502 1 1593 . 1 1 151 151 LYS N N 15 119.608 0.006 . . . . . . 151 LYS N . 25502 1 1594 . 1 1 152 152 THR H H 1 8.823 0.021 . . . . . . 152 THR H . 25502 1 1595 . 1 1 152 152 THR HA H 1 5.532 0.006 . . . . . . 152 THR HA . 25502 1 1596 . 1 1 152 152 THR HB H 1 4.632 0.001 . . . . . . 152 THR HB . 25502 1 1597 . 1 1 152 152 THR HG1 H 1 5.012 0.006 . . . . . . 152 THR HG1 . 25502 1 1598 . 1 1 152 152 THR HG21 H 1 1.336 0.008 . . . . . . 152 THR QG2 . 25502 1 1599 . 1 1 152 152 THR HG22 H 1 1.336 0.008 . . . . . . 152 THR QG2 . 25502 1 1600 . 1 1 152 152 THR HG23 H 1 1.336 0.008 . . . . . . 152 THR QG2 . 25502 1 1601 . 1 1 152 152 THR CA C 13 59.953 0.108 . . . . . . 152 THR CA . 25502 1 1602 . 1 1 152 152 THR CB C 13 71.108 0.006 . . . . . . 152 THR CB . 25502 1 1603 . 1 1 152 152 THR N N 15 116.317 0.006 . . . . . . 152 THR N . 25502 1 1604 . 1 1 153 153 SER H H 1 9.412 0.006 . . . . . . 153 SER H . 25502 1 1605 . 1 1 153 153 SER HA H 1 4.456 0.006 . . . . . . 153 SER HA . 25502 1 1606 . 1 1 153 153 SER HB2 H 1 4.149 0.010 . . . . . . 153 SER HB2 . 25502 1 1607 . 1 1 153 153 SER HB3 H 1 4.021 0.008 . . . . . . 153 SER HB3 . 25502 1 1608 . 1 1 153 153 SER CA C 13 58.712 0.006 . . . . . . 153 SER CA . 25502 1 1609 . 1 1 153 153 SER CB C 13 63.477 0.006 . . . . . . 153 SER CB . 25502 1 1610 . 1 1 153 153 SER N N 15 116.804 0.006 . . . . . . 153 SER N . 25502 1 1611 . 1 1 154 154 LYS H H 1 7.527 0.004 . . . . . . 154 LYS H . 25502 1 1612 . 1 1 154 154 LYS HA H 1 4.532 0.008 . . . . . . 154 LYS HA . 25502 1 1613 . 1 1 154 154 LYS HB2 H 1 1.415 0.008 . . . . . . 154 LYS HB2 . 25502 1 1614 . 1 1 154 154 LYS HB3 H 1 0.829 0.008 . . . . . . 154 LYS HB3 . 25502 1 1615 . 1 1 154 154 LYS HG2 H 1 1.427 0.007 . . . . . . 154 LYS HG2 . 25502 1 1616 . 1 1 154 154 LYS HG3 H 1 1.177 0.012 . . . . . . 154 LYS HG3 . 25502 1 1617 . 1 1 154 154 LYS HD2 H 1 1.435 0.005 . . . . . . 154 LYS HD2 . 25502 1 1618 . 1 1 154 154 LYS HD3 H 1 1.136 0.013 . . . . . . 154 LYS HD3 . 25502 1 1619 . 1 1 154 154 LYS HE2 H 1 2.988 0.016 . . . . . . 154 LYS HE2 . 25502 1 1620 . 1 1 154 154 LYS HE3 H 1 2.892 0.009 . . . . . . 154 LYS HE3 . 25502 1 1621 . 1 1 154 154 LYS CA C 13 54.400 0.006 . . . . . . 154 LYS CA . 25502 1 1622 . 1 1 154 154 LYS CB C 13 38.406 0.095 . . . . . . 154 LYS CB . 25502 1 1623 . 1 1 154 154 LYS CG C 13 26.171 0.003 . . . . . . 154 LYS CG . 25502 1 1624 . 1 1 154 154 LYS CD C 13 29.206 0.004 . . . . . . 154 LYS CD . 25502 1 1625 . 1 1 154 154 LYS CE C 13 42.297 0.061 . . . . . . 154 LYS CE . 25502 1 1626 . 1 1 154 154 LYS N N 15 119.068 0.006 . . . . . . 154 LYS N . 25502 1 1627 . 1 1 155 155 LYS H H 1 8.791 0.008 . . . . . . 155 LYS H . 25502 1 1628 . 1 1 155 155 LYS HA H 1 4.313 0.005 . . . . . . 155 LYS HA . 25502 1 1629 . 1 1 155 155 LYS HB2 H 1 1.781 0.008 . . . . . . 155 LYS HB2 . 25502 1 1630 . 1 1 155 155 LYS HB3 H 1 1.873 0.006 . . . . . . 155 LYS HB3 . 25502 1 1631 . 1 1 155 155 LYS HG2 H 1 1.407 0.011 . . . . . . 155 LYS HG2 . 25502 1 1632 . 1 1 155 155 LYS HG3 H 1 1.308 0.008 . . . . . . 155 LYS HG3 . 25502 1 1633 . 1 1 155 155 LYS HD2 H 1 1.661 0.004 . . . . . . 155 LYS QD . 25502 1 1634 . 1 1 155 155 LYS HD3 H 1 1.661 0.004 . . . . . . 155 LYS QD . 25502 1 1635 . 1 1 155 155 LYS HE2 H 1 2.926 0.010 . . . . . . 155 LYS HE2 . 25502 1 1636 . 1 1 155 155 LYS HE3 H 1 2.902 0.006 . . . . . . 155 LYS HE3 . 25502 1 1637 . 1 1 155 155 LYS CA C 13 56.147 0.006 . . . . . . 155 LYS CA . 25502 1 1638 . 1 1 155 155 LYS CB C 13 31.988 0.006 . . . . . . 155 LYS CB . 25502 1 1639 . 1 1 155 155 LYS CG C 13 24.775 0.006 . . . . . . 155 LYS CG . 25502 1 1640 . 1 1 155 155 LYS CD C 13 28.761 0.006 . . . . . . 155 LYS CD . 25502 1 1641 . 1 1 155 155 LYS CE C 13 41.535 0.006 . . . . . . 155 LYS CE . 25502 1 1642 . 1 1 155 155 LYS N N 15 121.541 0.006 . . . . . . 155 LYS N . 25502 1 1643 . 1 1 156 156 ILE H H 1 9.606 0.010 . . . . . . 156 ILE H . 25502 1 1644 . 1 1 156 156 ILE HA H 1 5.093 0.008 . . . . . . 156 ILE HA . 25502 1 1645 . 1 1 156 156 ILE HB H 1 2.347 0.012 . . . . . . 156 ILE HB . 25502 1 1646 . 1 1 156 156 ILE HG12 H 1 1.480 0.018 . . . . . . 156 ILE HG12 . 25502 1 1647 . 1 1 156 156 ILE HG13 H 1 1.441 0.009 . . . . . . 156 ILE HG13 . 25502 1 1648 . 1 1 156 156 ILE HG21 H 1 0.917 0.010 . . . . . . 156 ILE QG2 . 25502 1 1649 . 1 1 156 156 ILE HG22 H 1 0.917 0.010 . . . . . . 156 ILE QG2 . 25502 1 1650 . 1 1 156 156 ILE HG23 H 1 0.917 0.010 . . . . . . 156 ILE QG2 . 25502 1 1651 . 1 1 156 156 ILE HD11 H 1 0.637 0.004 . . . . . . 156 ILE QD1 . 25502 1 1652 . 1 1 156 156 ILE HD12 H 1 0.637 0.004 . . . . . . 156 ILE QD1 . 25502 1 1653 . 1 1 156 156 ILE HD13 H 1 0.637 0.004 . . . . . . 156 ILE QD1 . 25502 1 1654 . 1 1 156 156 ILE CA C 13 59.264 0.096 . . . . . . 156 ILE CA . 25502 1 1655 . 1 1 156 156 ILE CB C 13 36.840 0.006 . . . . . . 156 ILE CB . 25502 1 1656 . 1 1 156 156 ILE CG1 C 13 26.714 0.006 . . . . . . 156 ILE CG1 . 25502 1 1657 . 1 1 156 156 ILE CG2 C 13 19.044 0.006 . . . . . . 156 ILE CG2 . 25502 1 1658 . 1 1 156 156 ILE N N 15 133.980 0.006 . . . . . . 156 ILE N . 25502 1 1659 . 1 1 157 157 THR H H 1 9.233 0.013 . . . . . . 157 THR H . 25502 1 1660 . 1 1 157 157 THR HA H 1 5.274 0.009 . . . . . . 157 THR HA . 25502 1 1661 . 1 1 157 157 THR HB H 1 3.889 0.007 . . . . . . 157 THR HB . 25502 1 1662 . 1 1 157 157 THR HG21 H 1 0.995 0.004 . . . . . . 157 THR QG2 . 25502 1 1663 . 1 1 157 157 THR HG22 H 1 0.995 0.004 . . . . . . 157 THR QG2 . 25502 1 1664 . 1 1 157 157 THR HG23 H 1 0.995 0.004 . . . . . . 157 THR QG2 . 25502 1 1665 . 1 1 157 157 THR CA C 13 59.475 0.044 . . . . . . 157 THR CA . 25502 1 1666 . 1 1 157 157 THR CB C 13 72.475 0.006 . . . . . . 157 THR CB . 25502 1 1667 . 1 1 157 157 THR CG2 C 13 22.401 0.006 . . . . . . 157 THR CG2 . 25502 1 1668 . 1 1 157 157 THR N N 15 116.977 0.006 . . . . . . 157 THR N . 25502 1 1669 . 1 1 158 158 ILE H H 1 8.580 0.009 . . . . . . 158 ILE H . 25502 1 1670 . 1 1 158 158 ILE HA H 1 4.242 0.005 . . . . . . 158 ILE HA . 25502 1 1671 . 1 1 158 158 ILE HB H 1 1.671 0.006 . . . . . . 158 ILE HB . 25502 1 1672 . 1 1 158 158 ILE HG12 H 1 1.411 0.006 . . . . . . 158 ILE HG12 . 25502 1 1673 . 1 1 158 158 ILE HG13 H 1 0.338 0.010 . . . . . . 158 ILE HG13 . 25502 1 1674 . 1 1 158 158 ILE HG21 H 1 0.312 0.007 . . . . . . 158 ILE QG2 . 25502 1 1675 . 1 1 158 158 ILE HG22 H 1 0.312 0.007 . . . . . . 158 ILE QG2 . 25502 1 1676 . 1 1 158 158 ILE HG23 H 1 0.312 0.007 . . . . . . 158 ILE QG2 . 25502 1 1677 . 1 1 158 158 ILE HD11 H 1 -0.139 0.003 . . . . . . 158 ILE QD1 . 25502 1 1678 . 1 1 158 158 ILE HD12 H 1 -0.139 0.003 . . . . . . 158 ILE QD1 . 25502 1 1679 . 1 1 158 158 ILE HD13 H 1 -0.139 0.003 . . . . . . 158 ILE QD1 . 25502 1 1680 . 1 1 158 158 ILE CA C 13 60.868 0.068 . . . . . . 158 ILE CA . 25502 1 1681 . 1 1 158 158 ILE CB C 13 36.790 0.006 . . . . . . 158 ILE CB . 25502 1 1682 . 1 1 158 158 ILE CG1 C 13 28.277 0.008 . . . . . . 158 ILE CG1 . 25502 1 1683 . 1 1 158 158 ILE CG2 C 13 18.295 0.006 . . . . . . 158 ILE CG2 . 25502 1 1684 . 1 1 158 158 ILE N N 15 121.529 0.006 . . . . . . 158 ILE N . 25502 1 1685 . 1 1 159 159 ALA H H 1 8.873 0.003 . . . . . . 159 ALA H . 25502 1 1686 . 1 1 159 159 ALA HA H 1 4.124 0.006 . . . . . . 159 ALA HA . 25502 1 1687 . 1 1 159 159 ALA HB1 H 1 1.291 0.007 . . . . . . 159 ALA QB . 25502 1 1688 . 1 1 159 159 ALA HB2 H 1 1.291 0.007 . . . . . . 159 ALA QB . 25502 1 1689 . 1 1 159 159 ALA HB3 H 1 1.291 0.007 . . . . . . 159 ALA QB . 25502 1 1690 . 1 1 159 159 ALA CA C 13 54.073 0.082 . . . . . . 159 ALA CA . 25502 1 1691 . 1 1 159 159 ALA CB C 13 19.013 0.006 . . . . . . 159 ALA CB . 25502 1 1692 . 1 1 159 159 ALA N N 15 132.313 0.006 . . . . . . 159 ALA N . 25502 1 1693 . 1 1 160 160 ASP H H 1 8.066 0.001 . . . . . . 160 ASP H . 25502 1 1694 . 1 1 160 160 ASP HA H 1 4.890 0.003 . . . . . . 160 ASP HA . 25502 1 1695 . 1 1 160 160 ASP HB2 H 1 2.961 0.005 . . . . . . 160 ASP HB2 . 25502 1 1696 . 1 1 160 160 ASP HB3 H 1 2.863 0.007 . . . . . . 160 ASP HB3 . 25502 1 1697 . 1 1 160 160 ASP CA C 13 52.639 0.006 . . . . . . 160 ASP CA . 25502 1 1698 . 1 1 160 160 ASP CB C 13 43.587 0.061 . . . . . . 160 ASP CB . 25502 1 1699 . 1 1 160 160 ASP N N 15 111.257 0.006 . . . . . . 160 ASP N . 25502 1 1700 . 1 1 161 161 CYS H H 1 8.591 0.006 . . . . . . 161 CYS H . 25502 1 1701 . 1 1 161 161 CYS HA H 1 4.544 0.003 . . . . . . 161 CYS HA . 25502 1 1702 . 1 1 161 161 CYS HB2 H 1 3.213 0.010 . . . . . . 161 CYS HB2 . 25502 1 1703 . 1 1 161 161 CYS HB3 H 1 3.104 0.016 . . . . . . 161 CYS HB3 . 25502 1 1704 . 1 1 161 161 CYS CA C 13 55.148 0.006 . . . . . . 161 CYS CA . 25502 1 1705 . 1 1 161 161 CYS CB C 13 31.137 0.003 . . . . . . 161 CYS CB . 25502 1 1706 . 1 1 161 161 CYS N N 15 115.837 0.006 . . . . . . 161 CYS N . 25502 1 1707 . 1 1 162 162 GLY H H 1 6.844 0.004 . . . . . . 162 GLY H . 25502 1 1708 . 1 1 162 162 GLY HA2 H 1 3.897 0.007 . . . . . . 162 GLY HA2 . 25502 1 1709 . 1 1 162 162 GLY HA3 H 1 3.544 0.004 . . . . . . 162 GLY HA3 . 25502 1 1710 . 1 1 162 162 GLY CA C 13 45.349 0.095 . . . . . . 162 GLY CA . 25502 1 1711 . 1 1 162 162 GLY N N 15 103.888 0.006 . . . . . . 162 GLY N . 25502 1 1712 . 1 1 163 163 GLN H H 1 9.066 0.001 . . . . . . 163 GLN H . 25502 1 1713 . 1 1 163 163 GLN HA H 1 5.069 0.003 . . . . . . 163 GLN HA . 25502 1 1714 . 1 1 163 163 GLN HB2 H 1 1.966 0.013 . . . . . . 163 GLN HB2 . 25502 1 1715 . 1 1 163 163 GLN HB3 H 1 1.753 0.007 . . . . . . 163 GLN HB3 . 25502 1 1716 . 1 1 163 163 GLN HG2 H 1 2.573 0.007 . . . . . . 163 GLN HG2 . 25502 1 1717 . 1 1 163 163 GLN HG3 H 1 2.478 0.016 . . . . . . 163 GLN HG3 . 25502 1 1718 . 1 1 163 163 GLN HE21 H 1 8.145 0.009 . . . . . . 163 GLN HE21 . 25502 1 1719 . 1 1 163 163 GLN HE22 H 1 7.183 0.004 . . . . . . 163 GLN HE22 . 25502 1 1720 . 1 1 163 163 GLN CA C 13 54.809 0.006 . . . . . . 163 GLN CA . 25502 1 1721 . 1 1 163 163 GLN CB C 13 30.590 0.003 . . . . . . 163 GLN CB . 25502 1 1722 . 1 1 163 163 GLN CG C 13 33.356 0.200 . . . . . . 163 GLN CG . 25502 1 1723 . 1 1 163 163 GLN N N 15 120.718 0.006 . . . . . . 163 GLN N . 25502 1 1724 . 1 1 163 163 GLN NE2 N 15 110.553 0.004 . . . . . . 163 GLN NE2 . 25502 1 1725 . 1 1 164 164 LEU H H 1 8.593 0.002 . . . . . . 164 LEU H . 25502 1 1726 . 1 1 164 164 LEU HA H 1 4.607 0.006 . . . . . . 164 LEU HA . 25502 1 1727 . 1 1 164 164 LEU HB2 H 1 1.623 0.008 . . . . . . 164 LEU HB2 . 25502 1 1728 . 1 1 164 164 LEU HB3 H 1 1.621 0.007 . . . . . . 164 LEU HB3 . 25502 1 1729 . 1 1 164 164 LEU HG H 1 1.650 0.006 . . . . . . 164 LEU HG . 25502 1 1730 . 1 1 164 164 LEU HD11 H 1 0.744 0.004 . . . . . . 164 LEU QD1 . 25502 1 1731 . 1 1 164 164 LEU HD12 H 1 0.744 0.004 . . . . . . 164 LEU QD1 . 25502 1 1732 . 1 1 164 164 LEU HD13 H 1 0.744 0.004 . . . . . . 164 LEU QD1 . 25502 1 1733 . 1 1 164 164 LEU HD21 H 1 0.838 0.006 . . . . . . 164 LEU QD2 . 25502 1 1734 . 1 1 164 164 LEU HD22 H 1 0.838 0.006 . . . . . . 164 LEU QD2 . 25502 1 1735 . 1 1 164 164 LEU HD23 H 1 0.838 0.006 . . . . . . 164 LEU QD2 . 25502 1 1736 . 1 1 164 164 LEU CA C 13 54.739 0.006 . . . . . . 164 LEU CA . 25502 1 1737 . 1 1 164 164 LEU CB C 13 43.362 0.060 . . . . . . 164 LEU CB . 25502 1 1738 . 1 1 164 164 LEU CG C 13 27.093 0.006 . . . . . . 164 LEU CG . 25502 1 1739 . 1 1 164 164 LEU N N 15 125.816 0.006 . . . . . . 164 LEU N . 25502 1 1740 . 1 1 165 165 GLU H H 1 8.132 0.010 . . . . . . 165 GLU H . 25502 1 1741 . 1 1 165 165 GLU HA H 1 4.161 0.005 . . . . . . 165 GLU HA . 25502 1 1742 . 1 1 165 165 GLU HB2 H 1 2.087 0.004 . . . . . . 165 GLU HB2 . 25502 1 1743 . 1 1 165 165 GLU HB3 H 1 1.923 0.005 . . . . . . 165 GLU HB3 . 25502 1 1744 . 1 1 165 165 GLU HG2 H 1 2.197 0.001 . . . . . . 165 GLU QG . 25502 1 1745 . 1 1 165 165 GLU HG3 H 1 2.197 0.001 . . . . . . 165 GLU QG . 25502 1 1746 . 1 1 165 165 GLU CA C 13 57.904 0.006 . . . . . . 165 GLU CA . 25502 1 1747 . 1 1 165 165 GLU CB C 13 31.620 0.006 . . . . . . 165 GLU CB . 25502 1 1748 . 1 1 165 165 GLU CG C 13 36.770 0.006 . . . . . . 165 GLU CG . 25502 1 1749 . 1 1 165 165 GLU N N 15 125.923 0.006 . . . . . . 165 GLU N . 25502 1 stop_ save_