################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7125 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 $sample_1 isotropic 7125 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 VAL HG11 H 1 0.712 0.016 . 2 . . . . 1 VAL HG1# . 7125 1 2 . 1 1 1 1 VAL HG12 H 1 0.712 0.016 . 2 . . . . 1 VAL HG1# . 7125 1 3 . 1 1 1 1 VAL HG13 H 1 0.712 0.016 . 2 . . . . 1 VAL HG1# . 7125 1 4 . 1 1 1 1 VAL CG1 C 13 20.596 0.045 . 2 . . . . 1 VAL CG1 . 7125 1 5 . 1 1 2 2 LEU HA H 1 4.619 0.004 . 1 . . . . 2 LEU HA . 7125 1 6 . 1 1 2 2 LEU HB2 H 1 1.762 0.022 . 2 . . . . 2 LEU HB2 . 7125 1 7 . 1 1 2 2 LEU HB3 H 1 1.550 0.009 . 2 . . . . 2 LEU HB3 . 7125 1 8 . 1 1 2 2 LEU HG H 1 1.846 0.008 . 1 . . . . 2 LEU HG . 7125 1 9 . 1 1 2 2 LEU HD11 H 1 0.889 0.013 . 2 . . . . 2 LEU HD1 . 7125 1 10 . 1 1 2 2 LEU HD12 H 1 0.889 0.013 . 2 . . . . 2 LEU HD1 . 7125 1 11 . 1 1 2 2 LEU HD13 H 1 0.889 0.013 . 2 . . . . 2 LEU HD1 . 7125 1 12 . 1 1 2 2 LEU HD21 H 1 1.017 0.010 . 2 . . . . 2 LEU HD2 . 7125 1 13 . 1 1 2 2 LEU HD22 H 1 1.017 0.010 . 2 . . . . 2 LEU HD2 . 7125 1 14 . 1 1 2 2 LEU HD23 H 1 1.017 0.010 . 2 . . . . 2 LEU HD2 . 7125 1 15 . 1 1 2 2 LEU CA C 13 54.825 0.079 . 1 . . . . 2 LEU CA . 7125 1 16 . 1 1 2 2 LEU CB C 13 43.310 0.079 . 1 . . . . 2 LEU CB . 7125 1 17 . 1 1 2 2 LEU CG C 13 28.300 0.156 . 1 . . . . 2 LEU CG . 7125 1 18 . 1 1 2 2 LEU CD1 C 13 24.724 0.103 . 2 . . . . 2 LEU CD1 . 7125 1 19 . 1 1 2 2 LEU CD2 C 13 26.410 0.051 . 2 . . . . 2 LEU CD2 . 7125 1 20 . 1 1 3 3 SER H H 1 9.855 0.011 . 1 . . . . 3 SER HN . 7125 1 21 . 1 1 3 3 SER CA C 13 56.771 0.000 . 1 . . . . 3 SER CA . 7125 1 22 . 1 1 3 3 SER N N 15 121.907 0.051 . 1 . . . . 3 SER N . 7125 1 23 . 1 1 5 5 ALA HA H 1 4.067 0.004 . 1 . . . . 5 ALA HA . 7125 1 24 . 1 1 5 5 ALA HB1 H 1 1.298 0.011 . 1 . . . . 5 ALA HB# . 7125 1 25 . 1 1 5 5 ALA HB2 H 1 1.298 0.011 . 1 . . . . 5 ALA HB# . 7125 1 26 . 1 1 5 5 ALA HB3 H 1 1.298 0.011 . 1 . . . . 5 ALA HB# . 7125 1 27 . 1 1 5 5 ALA CA C 13 55.050 0.134 . 1 . . . . 5 ALA CA . 7125 1 28 . 1 1 5 5 ALA CB C 13 18.425 0.085 . 1 . . . . 5 ALA CB . 7125 1 29 . 1 1 6 6 ASP H H 1 8.199 0.010 . 1 . . . . 6 ASP HN . 7125 1 30 . 1 1 6 6 ASP HA H 1 4.700 0.000 . 1 . . . . 6 ASP HA . 7125 1 31 . 1 1 6 6 ASP HB2 H 1 3.142 0.000 . 2 . . . . 6 ASP HB1 . 7125 1 32 . 1 1 6 6 ASP HB3 H 1 2.611 0.000 . 2 . . . . 6 ASP HB2 . 7125 1 33 . 1 1 6 6 ASP CA C 13 57.720 0.098 . 1 . . . . 6 ASP CA . 7125 1 34 . 1 1 6 6 ASP CB C 13 42.291 0.014 . 1 . . . . 6 ASP CB . 7125 1 35 . 1 1 6 6 ASP N N 15 118.496 0.056 . 1 . . . . 6 ASP N . 7125 1 36 . 1 1 7 7 LYS H H 1 8.066 0.009 . 1 . . . . 7 LYS HN . 7125 1 37 . 1 1 7 7 LYS HA H 1 3.653 0.012 . 1 . . . . 7 LYS HA . 7125 1 38 . 1 1 7 7 LYS HB2 H 1 1.892 0.051 . 2 . . . . 7 LYS HB2 . 7125 1 39 . 1 1 7 7 LYS HD2 H 1 1.638 0.000 . 2 . . . . 7 LYS HD1 . 7125 1 40 . 1 1 7 7 LYS HE2 H 1 2.759 0.012 . 2 . . . . 7 LYS HE2 . 7125 1 41 . 1 1 7 7 LYS CA C 13 61.360 0.089 . 1 . . . . 7 LYS CA . 7125 1 42 . 1 1 7 7 LYS CB C 13 31.936 0.168 . 1 . . . . 7 LYS CB . 7125 1 43 . 1 1 7 7 LYS CD C 13 29.794 0.000 . 1 . . . . 7 LYS CD . 7125 1 44 . 1 1 7 7 LYS CE C 13 42.069 0.029 . 1 . . . . 7 LYS CE . 7125 1 45 . 1 1 7 7 LYS N N 15 118.779 0.061 . 1 . . . . 7 LYS N . 7125 1 46 . 1 1 8 8 THR H H 1 8.040 0.010 . 1 . . . . 8 THR HN . 7125 1 47 . 1 1 8 8 THR HA H 1 3.806 0.006 . 1 . . . . 8 THR HA . 7125 1 48 . 1 1 8 8 THR HB H 1 4.216 0.004 . 1 . . . . 8 THR HB . 7125 1 49 . 1 1 8 8 THR HG21 H 1 1.209 0.020 . 1 . . . . 8 THR HG2# . 7125 1 50 . 1 1 8 8 THR HG22 H 1 1.209 0.020 . 1 . . . . 8 THR HG2# . 7125 1 51 . 1 1 8 8 THR HG23 H 1 1.209 0.020 . 1 . . . . 8 THR HG2# . 7125 1 52 . 1 1 8 8 THR CA C 13 66.926 0.096 . 1 . . . . 8 THR CA . 7125 1 53 . 1 1 8 8 THR CB C 13 68.798 0.060 . 1 . . . . 8 THR CB . 7125 1 54 . 1 1 8 8 THR CG2 C 13 22.093 0.062 . 1 . . . . 8 THR CG2 . 7125 1 55 . 1 1 8 8 THR N N 15 115.941 0.035 . 1 . . . . 8 THR N . 7125 1 56 . 1 1 9 9 ASN H H 1 8.431 0.019 . 1 . . . . 9 ASN HN . 7125 1 57 . 1 1 9 9 ASN HA H 1 4.511 0.011 . 1 . . . . 9 ASN HA . 7125 1 58 . 1 1 9 9 ASN HB2 H 1 3.205 0.032 . 2 . . . . 9 ASN HB2 . 7125 1 59 . 1 1 9 9 ASN HB3 H 1 2.514 0.000 . 2 . . . . 9 ASN HB3 . 7125 1 60 . 1 1 9 9 ASN CA C 13 55.787 0.168 . 1 . . . . 9 ASN CA . 7125 1 61 . 1 1 9 9 ASN CB C 13 38.215 0.081 . 1 . . . . 9 ASN CB . 7125 1 62 . 1 1 9 9 ASN N N 15 121.249 0.056 . 1 . . . . 9 ASN N . 7125 1 63 . 1 1 10 10 VAL H H 1 8.492 0.006 . 1 . . . . 10 VAL HN . 7125 1 64 . 1 1 10 10 VAL HA H 1 3.426 0.014 . 1 . . . . 10 VAL HA . 7125 1 65 . 1 1 10 10 VAL HB H 1 1.848 0.007 . 1 . . . . 10 VAL HB . 7125 1 66 . 1 1 10 10 VAL HG11 H 1 0.817 0.016 . 2 . . . . 10 VAL HG1# . 7125 1 67 . 1 1 10 10 VAL HG12 H 1 0.817 0.016 . 2 . . . . 10 VAL HG1# . 7125 1 68 . 1 1 10 10 VAL HG13 H 1 0.817 0.016 . 2 . . . . 10 VAL HG1# . 7125 1 69 . 1 1 10 10 VAL HG21 H 1 0.133 0.005 . 2 . . . . 10 VAL HG2# . 7125 1 70 . 1 1 10 10 VAL HG22 H 1 0.133 0.005 . 2 . . . . 10 VAL HG2# . 7125 1 71 . 1 1 10 10 VAL HG23 H 1 0.133 0.005 . 2 . . . . 10 VAL HG2# . 7125 1 72 . 1 1 10 10 VAL CA C 13 67.317 0.080 . 1 . . . . 10 VAL CA . 7125 1 73 . 1 1 10 10 VAL CB C 13 31.659 0.068 . 1 . . . . 10 VAL CB . 7125 1 74 . 1 1 10 10 VAL CG1 C 13 24.146 0.128 . 2 . . . . 10 VAL CG1 . 7125 1 75 . 1 1 10 10 VAL CG2 C 13 21.105 0.103 . 2 . . . . 10 VAL CG2 . 7125 1 76 . 1 1 10 10 VAL N N 15 119.653 0.054 . 1 . . . . 10 VAL N . 7125 1 77 . 1 1 11 11 LYS H H 1 8.027 0.010 . 1 . . . . 11 LYS HN . 7125 1 78 . 1 1 11 11 LYS HA H 1 3.797 0.017 . 1 . . . . 11 LYS HA . 7125 1 79 . 1 1 11 11 LYS HB2 H 1 1.840 0.013 . 2 . . . . 11 LYS HB2 . 7125 1 80 . 1 1 11 11 LYS HG2 H 1 1.488 0.019 . 2 . . . . 11 LYS HG2 . 7125 1 81 . 1 1 11 11 LYS HG3 H 1 1.308 0.001 . 2 . . . . 11 LYS HG3 . 7125 1 82 . 1 1 11 11 LYS HD2 H 1 1.600 0.017 . 2 . . . . 11 LYS HD2 . 7125 1 83 . 1 1 11 11 LYS HD3 H 1 1.807 0.002 . 2 . . . . 11 LYS HD3 . 7125 1 84 . 1 1 11 11 LYS HE2 H 1 2.876 0.003 . 2 . . . . 11 LYS HE2 . 7125 1 85 . 1 1 11 11 LYS CA C 13 60.534 0.084 . 1 . . . . 11 LYS CA . 7125 1 86 . 1 1 11 11 LYS CB C 13 32.730 0.095 . 1 . . . . 11 LYS CB . 7125 1 87 . 1 1 11 11 LYS CG C 13 26.532 0.096 . 1 . . . . 11 LYS CG . 7125 1 88 . 1 1 11 11 LYS CD C 13 29.907 0.081 . 1 . . . . 11 LYS CD . 7125 1 89 . 1 1 11 11 LYS CE C 13 42.266 0.058 . 1 . . . . 11 LYS CE . 7125 1 90 . 1 1 11 11 LYS N N 15 118.608 0.053 . 1 . . . . 11 LYS N . 7125 1 91 . 1 1 12 12 ALA H H 1 8.247 0.006 . 1 . . . . 12 ALA HN . 7125 1 92 . 1 1 12 12 ALA HA H 1 4.137 0.023 . 1 . . . . 12 ALA HA . 7125 1 93 . 1 1 12 12 ALA HB1 H 1 1.541 0.005 . 1 . . . . 12 ALA HB# . 7125 1 94 . 1 1 12 12 ALA HB2 H 1 1.541 0.005 . 1 . . . . 12 ALA HB# . 7125 1 95 . 1 1 12 12 ALA HB3 H 1 1.541 0.005 . 1 . . . . 12 ALA HB# . 7125 1 96 . 1 1 12 12 ALA CA C 13 55.086 0.088 . 1 . . . . 12 ALA CA . 7125 1 97 . 1 1 12 12 ALA CB C 13 18.299 0.096 . 1 . . . . 12 ALA CB . 7125 1 98 . 1 1 12 12 ALA N N 15 121.859 0.033 . 1 . . . . 12 ALA N . 7125 1 99 . 1 1 13 13 ALA H H 1 8.276 0.004 . 1 . . . . 13 ALA HN . 7125 1 100 . 1 1 13 13 ALA HA H 1 4.112 0.013 . 1 . . . . 13 ALA HA . 7125 1 101 . 1 1 13 13 ALA HB1 H 1 1.497 0.016 . 1 . . . . 13 ALA HB# . 7125 1 102 . 1 1 13 13 ALA HB2 H 1 1.497 0.016 . 1 . . . . 13 ALA HB# . 7125 1 103 . 1 1 13 13 ALA HB3 H 1 1.497 0.016 . 1 . . . . 13 ALA HB# . 7125 1 104 . 1 1 13 13 ALA CA C 13 55.424 0.146 . 1 . . . . 13 ALA CA . 7125 1 105 . 1 1 13 13 ALA CB C 13 18.477 0.077 . 1 . . . . 13 ALA CB . 7125 1 106 . 1 1 13 13 ALA N N 15 120.871 0.030 . 1 . . . . 13 ALA N . 7125 1 107 . 1 1 14 14 TRP H H 1 9.104 0.005 . 1 . . . . 14 TRP HN . 7125 1 108 . 1 1 14 14 TRP HA H 1 4.224 0.020 . 1 . . . . 14 TRP HA . 7125 1 109 . 1 1 14 14 TRP HB2 H 1 3.190 0.040 . 2 . . . . 14 TRP HB2 . 7125 1 110 . 1 1 14 14 TRP HB3 H 1 3.303 0.000 . 2 . . . . 14 TRP HB3 . 7125 1 111 . 1 1 14 14 TRP HD1 H 1 7.269 0.004 . 1 . . . . 14 TRP HD1 . 7125 1 112 . 1 1 14 14 TRP HE1 H 1 10.418 0.010 . 1 . . . . 14 TRP HE1 . 7125 1 113 . 1 1 14 14 TRP HE3 H 1 7.218 0.005 . 1 . . . . 14 TRP HE3 . 7125 1 114 . 1 1 14 14 TRP HZ2 H 1 7.492 0.005 . 1 . . . . 14 TRP HZ2 . 7125 1 115 . 1 1 14 14 TRP HZ3 H 1 6.886 0.015 . 1 . . . . 14 TRP HZ3 . 7125 1 116 . 1 1 14 14 TRP HH2 H 1 6.922 0.006 . 1 . . . . 14 TRP HH2 . 7125 1 117 . 1 1 14 14 TRP CA C 13 60.104 0.073 . 1 . . . . 14 TRP CA . 7125 1 118 . 1 1 14 14 TRP CB C 13 29.331 0.142 . 1 . . . . 14 TRP CB . 7125 1 119 . 1 1 14 14 TRP CD1 C 13 126.651 0.147 . 1 . . . . 14 TRP CD1 . 7125 1 120 . 1 1 14 14 TRP CE3 C 13 119.535 0.025 . 1 . . . . 14 TRP CE3 . 7125 1 121 . 1 1 14 14 TRP CZ2 C 13 114.716 0.120 . 1 . . . . 14 TRP CZ2 . 7125 1 122 . 1 1 14 14 TRP CZ3 C 13 120.451 0.045 . 1 . . . . 14 TRP CZ3 . 7125 1 123 . 1 1 14 14 TRP CH2 C 13 122.811 0.086 . 1 . . . . 14 TRP CH2 . 7125 1 124 . 1 1 14 14 TRP N N 15 117.681 0.077 . 1 . . . . 14 TRP N . 7125 1 125 . 1 1 14 14 TRP NE1 N 15 129.654 0.023 . 1 . . . . 14 TRP NE1 . 7125 1 126 . 1 1 15 15 GLY H H 1 8.036 0.012 . 1 . . . . 15 GLY HN . 7125 1 127 . 1 1 15 15 GLY HA2 H 1 3.915 0.001 . 2 . . . . 15 GLY HA2 . 7125 1 128 . 1 1 15 15 GLY CA C 13 46.894 0.067 . 1 . . . . 15 GLY CA . 7125 1 129 . 1 1 15 15 GLY N N 15 105.952 0.055 . 1 . . . . 15 GLY N . 7125 1 130 . 1 1 16 16 LYS H H 1 7.333 0.009 . 1 . . . . 16 LYS HN . 7125 1 131 . 1 1 16 16 LYS HA H 1 4.135 0.008 . 1 . . . . 16 LYS HA . 7125 1 132 . 1 1 16 16 LYS HB2 H 1 1.992 0.012 . 2 . . . . 16 LYS HB2 . 7125 1 133 . 1 1 16 16 LYS HB3 H 1 1.856 0.001 . 2 . . . . 16 LYS HB3 . 7125 1 134 . 1 1 16 16 LYS HG2 H 1 1.537 0.008 . 2 . . . . 16 LYS HG2 . 7125 1 135 . 1 1 16 16 LYS HG3 H 1 1.492 0.018 . 2 . . . . 16 LYS HG3 . 7125 1 136 . 1 1 16 16 LYS HD2 H 1 1.632 0.005 . 2 . . . . 16 LYS HD2 . 7125 1 137 . 1 1 16 16 LYS HD3 H 1 1.575 0.000 . 2 . . . . 16 LYS HD3 . 7125 1 138 . 1 1 16 16 LYS HE2 H 1 2.946 0.010 . 2 . . . . 16 LYS HE2 . 7125 1 139 . 1 1 16 16 LYS CA C 13 56.998 0.071 . 1 . . . . 16 LYS CA . 7125 1 140 . 1 1 16 16 LYS CB C 13 32.049 0.110 . 1 . . . . 16 LYS CB . 7125 1 141 . 1 1 16 16 LYS CG C 13 25.020 0.134 . 1 . . . . 16 LYS CG . 7125 1 142 . 1 1 16 16 LYS CD C 13 28.335 0.049 . 1 . . . . 16 LYS CD . 7125 1 143 . 1 1 16 16 LYS CE C 13 42.237 0.031 . 1 . . . . 16 LYS CE . 7125 1 144 . 1 1 16 16 LYS N N 15 119.990 0.026 . 1 . . . . 16 LYS N . 7125 1 145 . 1 1 17 17 VAL H H 1 7.515 0.007 . 1 . . . . 17 VAL HN . 7125 1 146 . 1 1 17 17 VAL HA H 1 3.277 0.010 . 1 . . . . 17 VAL HA . 7125 1 147 . 1 1 17 17 VAL HB H 1 1.554 0.011 . 1 . . . . 17 VAL HB . 7125 1 148 . 1 1 17 17 VAL HG11 H 1 0.529 0.010 . 2 . . . . 17 VAL HG1# . 7125 1 149 . 1 1 17 17 VAL HG12 H 1 0.529 0.010 . 2 . . . . 17 VAL HG1# . 7125 1 150 . 1 1 17 17 VAL HG13 H 1 0.529 0.010 . 2 . . . . 17 VAL HG1# . 7125 1 151 . 1 1 17 17 VAL HG21 H 1 -0.017 0.008 . 2 . . . . 17 VAL HG2# . 7125 1 152 . 1 1 17 17 VAL HG22 H 1 -0.017 0.008 . 2 . . . . 17 VAL HG2# . 7125 1 153 . 1 1 17 17 VAL HG23 H 1 -0.017 0.008 . 2 . . . . 17 VAL HG2# . 7125 1 154 . 1 1 17 17 VAL CA C 13 66.444 0.055 . 1 . . . . 17 VAL CA . 7125 1 155 . 1 1 17 17 VAL CB C 13 31.037 0.089 . 1 . . . . 17 VAL CB . 7125 1 156 . 1 1 17 17 VAL CG1 C 13 22.606 0.091 . 2 . . . . 17 VAL CG1 . 7125 1 157 . 1 1 17 17 VAL CG2 C 13 20.377 0.106 . 2 . . . . 17 VAL CG2 . 7125 1 158 . 1 1 17 17 VAL N N 15 121.012 0.042 . 1 . . . . 17 VAL N . 7125 1 159 . 1 1 18 18 GLY H H 1 7.202 0.007 . 1 . . . . 18 GLY HN . 7125 1 160 . 1 1 18 18 GLY HA2 H 1 3.607 0.018 . 2 . . . . 18 GLY HA2 . 7125 1 161 . 1 1 18 18 GLY CA C 13 47.329 0.067 . 1 . . . . 18 GLY CA . 7125 1 162 . 1 1 18 18 GLY N N 15 102.927 0.038 . 1 . . . . 18 GLY N . 7125 1 163 . 1 1 19 19 ALA HA H 1 4.096 0.007 . 1 . . . . 19 ALA HA . 7125 1 164 . 1 1 19 19 ALA HB1 H 1 1.158 0.012 . 1 . . . . 19 ALA HB# . 7125 1 165 . 1 1 19 19 ALA HB2 H 1 1.158 0.012 . 1 . . . . 19 ALA HB# . 7125 1 166 . 1 1 19 19 ALA HB3 H 1 1.158 0.012 . 1 . . . . 19 ALA HB# . 7125 1 167 . 1 1 19 19 ALA CA C 13 53.424 0.065 . 1 . . . . 19 ALA CA . 7125 1 168 . 1 1 19 19 ALA CB C 13 18.346 0.074 . 1 . . . . 19 ALA CB . 7125 1 169 . 1 1 20 20 HIS H H 1 7.775 0.009 . 1 . . . . 20 HIS HN . 7125 1 170 . 1 1 20 20 HIS HA H 1 4.336 0.016 . 1 . . . . 20 HIS HA . 7125 1 171 . 1 1 20 20 HIS HB2 H 1 2.367 0.008 . 2 . . . . 20 HIS HB2 . 7125 1 172 . 1 1 20 20 HIS HB3 H 1 1.993 0.000 . 2 . . . . 20 HIS HB3 . 7125 1 173 . 1 1 20 20 HIS HD2 H 1 7.110 0.011 . 1 . . . . 20 HIS HD2 . 7125 1 174 . 1 1 20 20 HIS HE1 H 1 8.079 0.000 . 1 . . . . 20 HIS HE1 . 7125 1 175 . 1 1 20 20 HIS CA C 13 55.806 0.154 . 1 . . . . 20 HIS CA . 7125 1 176 . 1 1 20 20 HIS CB C 13 29.046 0.059 . 1 . . . . 20 HIS CB . 7125 1 177 . 1 1 20 20 HIS CD2 C 13 121.690 0.093 . 1 . . . . 20 HIS CD2 . 7125 1 178 . 1 1 20 20 HIS CE1 C 13 137.887 0.000 . 1 . . . . 20 HIS CE1 . 7125 1 179 . 1 1 20 20 HIS N N 15 115.262 0.057 . 1 . . . . 20 HIS N . 7125 1 180 . 1 1 21 21 ALA H H 1 7.026 0.007 . 1 . . . . 21 ALA HN . 7125 1 181 . 1 1 21 21 ALA HA H 1 3.133 0.011 . 1 . . . . 21 ALA HA . 7125 1 182 . 1 1 21 21 ALA HB1 H 1 1.272 0.010 . 1 . . . . 21 ALA HB# . 7125 1 183 . 1 1 21 21 ALA HB2 H 1 1.272 0.010 . 1 . . . . 21 ALA HB# . 7125 1 184 . 1 1 21 21 ALA HB3 H 1 1.272 0.010 . 1 . . . . 21 ALA HB# . 7125 1 185 . 1 1 21 21 ALA CA C 13 56.702 0.072 . 1 . . . . 21 ALA CA . 7125 1 186 . 1 1 21 21 ALA CB C 13 18.621 0.124 . 1 . . . . 21 ALA CB . 7125 1 187 . 1 1 21 21 ALA N N 15 121.980 0.060 . 1 . . . . 21 ALA N . 7125 1 188 . 1 1 22 22 GLY H H 1 8.487 0.009 . 1 . . . . 22 GLY HN . 7125 1 189 . 1 1 22 22 GLY HA2 H 1 3.652 0.038 . 2 . . . . 22 GLY HA2 . 7125 1 190 . 1 1 22 22 GLY CA C 13 47.598 0.205 . 1 . . . . 22 GLY CA . 7125 1 191 . 1 1 22 22 GLY N N 15 104.309 0.148 . 1 . . . . 22 GLY N . 7125 1 192 . 1 1 23 23 GLU H H 1 7.747 0.007 . 1 . . . . 23 GLU HN . 7125 1 193 . 1 1 23 23 GLU HA H 1 3.926 0.005 . 1 . . . . 23 GLU HA . 7125 1 194 . 1 1 23 23 GLU HB2 H 1 1.976 0.018 . 2 . . . . 23 GLU HB2 . 7125 1 195 . 1 1 23 23 GLU HB3 H 1 1.918 0.006 . 2 . . . . 23 GLU HB3 . 7125 1 196 . 1 1 23 23 GLU HG2 H 1 2.207 0.016 . 2 . . . . 23 GLU HG2 . 7125 1 197 . 1 1 23 23 GLU HG3 H 1 2.162 0.000 . 2 . . . . 23 GLU HG3 . 7125 1 198 . 1 1 23 23 GLU CA C 13 59.204 0.074 . 1 . . . . 23 GLU CA . 7125 1 199 . 1 1 23 23 GLU CB C 13 29.158 0.100 . 1 . . . . 23 GLU CB . 7125 1 200 . 1 1 23 23 GLU CG C 13 36.198 0.091 . 1 . . . . 23 GLU CG . 7125 1 201 . 1 1 23 23 GLU N N 15 124.174 0.064 . 1 . . . . 23 GLU N . 7125 1 202 . 1 1 24 24 TYR H H 1 8.012 0.012 . 1 . . . . 24 TYR HN . 7125 1 203 . 1 1 24 24 TYR HA H 1 4.313 0.008 . 1 . . . . 24 TYR HA . 7125 1 204 . 1 1 24 24 TYR HD1 H 1 6.321 0.009 . 3 . . . . 24 TYR HD1 . 7125 1 205 . 1 1 24 24 TYR HE1 H 1 6.101 0.003 . 3 . . . . 24 TYR HE1 . 7125 1 206 . 1 1 24 24 TYR CA C 13 57.295 0.074 . 1 . . . . 24 TYR CA . 7125 1 207 . 1 1 24 24 TYR CD1 C 13 130.717 0.171 . 3 . . . . 24 TYR CD1 . 7125 1 208 . 1 1 24 24 TYR CE1 C 13 117.524 0.065 . 3 . . . . 24 TYR CE1 . 7125 1 209 . 1 1 24 24 TYR N N 15 120.893 0.087 . 1 . . . . 24 TYR N . 7125 1 210 . 1 1 25 25 GLY H H 1 8.843 0.009 . 1 . . . . 25 GLY HN . 7125 1 211 . 1 1 25 25 GLY HA2 H 1 3.237 0.001 . 2 . . . . 25 GLY HA2 . 7125 1 212 . 1 1 25 25 GLY HA3 H 1 3.634 0.013 . 2 . . . . 25 GLY HA3 . 7125 1 213 . 1 1 25 25 GLY CA C 13 46.897 0.094 . 1 . . . . 25 GLY CA . 7125 1 214 . 1 1 25 25 GLY N N 15 107.738 0.046 . 1 . . . . 25 GLY N . 7125 1 215 . 1 1 26 26 ALA H H 1 7.772 0.004 . 1 . . . . 26 ALA HN . 7125 1 216 . 1 1 26 26 ALA HA H 1 3.587 0.013 . 1 . . . . 26 ALA HA . 7125 1 217 . 1 1 26 26 ALA HB1 H 1 1.416 0.012 . 1 . . . . 26 ALA HB# . 7125 1 218 . 1 1 26 26 ALA HB2 H 1 1.416 0.012 . 1 . . . . 26 ALA HB# . 7125 1 219 . 1 1 26 26 ALA HB3 H 1 1.416 0.012 . 1 . . . . 26 ALA HB# . 7125 1 220 . 1 1 26 26 ALA CA C 13 55.071 0.069 . 1 . . . . 26 ALA CA . 7125 1 221 . 1 1 26 26 ALA CB C 13 19.366 0.088 . 1 . . . . 26 ALA CB . 7125 1 222 . 1 1 26 26 ALA N N 15 121.351 0.024 . 1 . . . . 26 ALA N . 7125 1 223 . 1 1 27 27 GLU H H 1 7.903 0.008 . 1 . . . . 27 GLU HN . 7125 1 224 . 1 1 27 27 GLU HA H 1 3.938 0.008 . 1 . . . . 27 GLU HA . 7125 1 225 . 1 1 27 27 GLU HB2 H 1 2.211 0.014 . 2 . . . . 27 GLU HB2 . 7125 1 226 . 1 1 27 27 GLU HG2 H 1 2.408 0.000 . 2 . . . . 27 GLU HG2 . 7125 1 227 . 1 1 27 27 GLU CA C 13 59.248 0.099 . 1 . . . . 27 GLU CA . 7125 1 228 . 1 1 27 27 GLU CB C 13 29.494 0.048 . 1 . . . . 27 GLU CB . 7125 1 229 . 1 1 27 27 GLU CG C 13 37.646 0.000 . 1 . . . . 27 GLU CG . 7125 1 230 . 1 1 27 27 GLU N N 15 119.488 0.039 . 1 . . . . 27 GLU N . 7125 1 231 . 1 1 28 28 ALA H H 1 8.371 0.007 . 1 . . . . 28 ALA HN . 7125 1 232 . 1 1 28 28 ALA HA H 1 3.470 0.019 . 1 . . . . 28 ALA HA . 7125 1 233 . 1 1 28 28 ALA HB1 H 1 1.130 0.008 . 1 . . . . 28 ALA HB# . 7125 1 234 . 1 1 28 28 ALA HB2 H 1 1.130 0.008 . 1 . . . . 28 ALA HB# . 7125 1 235 . 1 1 28 28 ALA HB3 H 1 1.130 0.008 . 1 . . . . 28 ALA HB# . 7125 1 236 . 1 1 28 28 ALA CA C 13 55.939 0.083 . 1 . . . . 28 ALA CA . 7125 1 237 . 1 1 28 28 ALA CB C 13 17.804 0.111 . 1 . . . . 28 ALA CB . 7125 1 238 . 1 1 28 28 ALA N N 15 121.871 0.054 . 1 . . . . 28 ALA N . 7125 1 239 . 1 1 29 29 LEU H H 1 7.076 0.007 . 1 . . . . 29 LEU HN . 7125 1 240 . 1 1 29 29 LEU HA H 1 2.934 0.010 . 1 . . . . 29 LEU HA . 7125 1 241 . 1 1 29 29 LEU HB2 H 1 1.370 0.000 . 2 . . . . 29 LEU HB1 . 7125 1 242 . 1 1 29 29 LEU HB3 H 1 1.444 0.000 . 2 . . . . 29 LEU HB2 . 7125 1 243 . 1 1 29 29 LEU HG H 1 0.966 0.005 . 1 . . . . 29 LEU HG . 7125 1 244 . 1 1 29 29 LEU HD11 H 1 -0.221 0.006 . 2 . . . . 29 LEU HD1 . 7125 1 245 . 1 1 29 29 LEU HD12 H 1 -0.221 0.006 . 2 . . . . 29 LEU HD1 . 7125 1 246 . 1 1 29 29 LEU HD13 H 1 -0.221 0.006 . 2 . . . . 29 LEU HD1 . 7125 1 247 . 1 1 29 29 LEU HD21 H 1 -0.851 0.009 . 2 . . . . 29 LEU HD2 . 7125 1 248 . 1 1 29 29 LEU HD22 H 1 -0.851 0.009 . 2 . . . . 29 LEU HD2 . 7125 1 249 . 1 1 29 29 LEU HD23 H 1 -0.851 0.009 . 2 . . . . 29 LEU HD2 . 7125 1 250 . 1 1 29 29 LEU CA C 13 57.627 0.143 . 1 . . . . 29 LEU CA . 7125 1 251 . 1 1 29 29 LEU CB C 13 40.606 0.084 . 1 . . . . 29 LEU CB . 7125 1 252 . 1 1 29 29 LEU CG C 13 25.906 0.187 . 1 . . . . 29 LEU CG . 7125 1 253 . 1 1 29 29 LEU CD1 C 13 26.459 0.103 . 2 . . . . 29 LEU CD1 . 7125 1 254 . 1 1 29 29 LEU CD2 C 13 21.185 0.059 . 2 . . . . 29 LEU CD2 . 7125 1 255 . 1 1 29 29 LEU N N 15 115.704 0.044 . 1 . . . . 29 LEU N . 7125 1 256 . 1 1 30 30 GLU H H 1 7.838 0.003 . 1 . . . . 30 GLU HN . 7125 1 257 . 1 1 30 30 GLU HA H 1 3.797 0.015 . 1 . . . . 30 GLU HA . 7125 1 258 . 1 1 30 30 GLU HB2 H 1 1.999 0.011 . 2 . . . . 30 GLU HB2 . 7125 1 259 . 1 1 30 30 GLU HG2 H 1 2.409 0.014 . 2 . . . . 30 GLU HG2 . 7125 1 260 . 1 1 30 30 GLU HG3 H 1 1.967 0.011 . 2 . . . . 30 GLU HG3 . 7125 1 261 . 1 1 30 30 GLU CA C 13 60.610 0.141 . 1 . . . . 30 GLU CA . 7125 1 262 . 1 1 30 30 GLU CB C 13 29.695 0.089 . 1 . . . . 30 GLU CB . 7125 1 263 . 1 1 30 30 GLU CG C 13 36.901 0.124 . 1 . . . . 30 GLU CG . 7125 1 264 . 1 1 30 30 GLU N N 15 118.191 0.057 . 1 . . . . 30 GLU N . 7125 1 265 . 1 1 31 31 ARG H H 1 8.711 0.004 . 1 . . . . 31 ARG HN . 7125 1 266 . 1 1 31 31 ARG HA H 1 3.688 0.052 . 1 . . . . 31 ARG HA . 7125 1 267 . 1 1 31 31 ARG CA C 13 60.694 0.016 . 1 . . . . 31 ARG CA . 7125 1 268 . 1 1 31 31 ARG N N 15 116.389 0.049 . 1 . . . . 31 ARG N . 7125 1 269 . 1 1 32 32 MET H H 1 7.981 0.004 . 1 . . . . 32 MET HN . 7125 1 270 . 1 1 32 32 MET HA H 1 4.044 0.011 . 1 . . . . 32 MET HA . 7125 1 271 . 1 1 32 32 MET HE1 H 1 1.151 0.010 . 1 . . . . 32 MET HE# . 7125 1 272 . 1 1 32 32 MET HE2 H 1 1.151 0.010 . 1 . . . . 32 MET HE# . 7125 1 273 . 1 1 32 32 MET HE3 H 1 1.151 0.010 . 1 . . . . 32 MET HE# . 7125 1 274 . 1 1 32 32 MET CA C 13 60.566 0.074 . 1 . . . . 32 MET CA . 7125 1 275 . 1 1 32 32 MET CE C 13 16.122 0.089 . 1 . . . . 32 MET CE . 7125 1 276 . 1 1 32 32 MET N N 15 123.049 0.036 . 1 . . . . 32 MET N . 7125 1 277 . 1 1 33 33 PHE H H 1 8.427 0.008 . 1 . . . . 33 PHE HN . 7125 1 278 . 1 1 33 33 PHE HA H 1 4.300 0.001 . 1 . . . . 33 PHE HA . 7125 1 279 . 1 1 33 33 PHE HB2 H 1 2.871 0.000 . 2 . . . . 33 PHE HB1 . 7125 1 280 . 1 1 33 33 PHE HB3 H 1 2.860 0.000 . 2 . . . . 33 PHE HB2 . 7125 1 281 . 1 1 33 33 PHE HD1 H 1 6.923 0.000 . 3 . . . . 33 PHE HD1 . 7125 1 282 . 1 1 33 33 PHE CA C 13 58.757 0.109 . 1 . . . . 33 PHE CA . 7125 1 283 . 1 1 33 33 PHE CB C 13 38.125 0.005 . 1 . . . . 33 PHE CB . 7125 1 284 . 1 1 33 33 PHE CD1 C 13 131.065 0.000 . 3 . . . . 33 PHE CD1 . 7125 1 285 . 1 1 33 33 PHE N N 15 118.363 0.081 . 1 . . . . 33 PHE N . 7125 1 286 . 1 1 34 34 LEU H H 1 7.683 0.010 . 1 . . . . 34 LEU HN . 7125 1 287 . 1 1 34 34 LEU HA H 1 4.161 0.014 . 1 . . . . 34 LEU HA . 7125 1 288 . 1 1 34 34 LEU HB2 H 1 1.294 0.011 . 2 . . . . 34 LEU HB2 . 7125 1 289 . 1 1 34 34 LEU HB3 H 1 1.543 0.017 . 2 . . . . 34 LEU HB3 . 7125 1 290 . 1 1 34 34 LEU HG H 1 1.709 0.013 . 1 . . . . 34 LEU HG . 7125 1 291 . 1 1 34 34 LEU HD11 H 1 0.713 0.013 . 2 . . . . 34 LEU HD1 . 7125 1 292 . 1 1 34 34 LEU HD12 H 1 0.713 0.013 . 2 . . . . 34 LEU HD1 . 7125 1 293 . 1 1 34 34 LEU HD13 H 1 0.713 0.013 . 2 . . . . 34 LEU HD1 . 7125 1 294 . 1 1 34 34 LEU HD21 H 1 0.735 0.013 . 2 . . . . 34 LEU HD2 . 7125 1 295 . 1 1 34 34 LEU HD22 H 1 0.735 0.013 . 2 . . . . 34 LEU HD2 . 7125 1 296 . 1 1 34 34 LEU HD23 H 1 0.735 0.013 . 2 . . . . 34 LEU HD2 . 7125 1 297 . 1 1 34 34 LEU CA C 13 56.883 0.121 . 1 . . . . 34 LEU CA . 7125 1 298 . 1 1 34 34 LEU CB C 13 43.305 0.108 . 1 . . . . 34 LEU CB . 7125 1 299 . 1 1 34 34 LEU CG C 13 27.268 0.136 . 1 . . . . 34 LEU CG . 7125 1 300 . 1 1 34 34 LEU CD1 C 13 25.605 0.078 . 2 . . . . 34 LEU CD1 . 7125 1 301 . 1 1 34 34 LEU CD2 C 13 23.591 0.093 . 2 . . . . 34 LEU CD2 . 7125 1 302 . 1 1 34 34 LEU N N 15 114.109 0.050 . 1 . . . . 34 LEU N . 7125 1 303 . 1 1 35 35 SER H H 1 7.983 0.012 . 1 . . . . 35 SER HN . 7125 1 304 . 1 1 35 35 SER HA H 1 3.824 0.014 . 1 . . . . 35 SER HA . 7125 1 305 . 1 1 35 35 SER HB2 H 1 3.389 0.036 . 2 . . . . 35 SER HB2 . 7125 1 306 . 1 1 35 35 SER CA C 13 62.956 0.100 . 1 . . . . 35 SER CA . 7125 1 307 . 1 1 35 35 SER CB C 13 64.530 0.071 . 1 . . . . 35 SER CB . 7125 1 308 . 1 1 35 35 SER N N 15 112.887 0.064 . 1 . . . . 35 SER N . 7125 1 309 . 1 1 36 36 PHE H H 1 8.381 0.007 . 1 . . . . 36 PHE HN . 7125 1 310 . 1 1 36 36 PHE HA H 1 5.366 0.009 . 1 . . . . 36 PHE HA . 7125 1 311 . 1 1 36 36 PHE HB2 H 1 3.233 0.000 . 2 . . . . 36 PHE HB2 . 7125 1 312 . 1 1 36 36 PHE HD1 H 1 7.323 0.051 . 3 . . . . 36 PHE HD1 . 7125 1 313 . 1 1 36 36 PHE CA C 13 54.600 0.131 . 1 . . . . 36 PHE CA . 7125 1 314 . 1 1 36 36 PHE CB C 13 39.552 0.000 . 1 . . . . 36 PHE CB . 7125 1 315 . 1 1 36 36 PHE CD1 C 13 134.665 0.501 . 3 . . . . 36 PHE CD1 . 7125 1 316 . 1 1 36 36 PHE N N 15 117.621 0.048 . 1 . . . . 36 PHE N . 7125 1 317 . 1 1 37 37 PRO HG2 H 1 2.070 0.020 . 2 . . . . 37 PRO HG2 . 7125 1 318 . 1 1 37 37 PRO HD2 H 1 3.418 0.005 . 2 . . . . 37 PRO HD1 . 7125 1 319 . 1 1 37 37 PRO HD3 H 1 3.804 0.022 . 2 . . . . 37 PRO HD2 . 7125 1 320 . 1 1 37 37 PRO CG C 13 27.602 0.099 . 1 . . . . 37 PRO CG . 7125 1 321 . 1 1 37 37 PRO CD C 13 50.837 0.137 . 1 . . . . 37 PRO CD . 7125 1 322 . 1 1 38 38 THR H H 1 8.376 0.008 . 1 . . . . 38 THR HN . 7125 1 323 . 1 1 38 38 THR HA H 1 4.105 0.014 . 1 . . . . 38 THR HA . 7125 1 324 . 1 1 38 38 THR HB H 1 4.484 0.007 . 1 . . . . 38 THR HB . 7125 1 325 . 1 1 38 38 THR HG21 H 1 1.348 0.013 . 1 . . . . 38 THR HG2# . 7125 1 326 . 1 1 38 38 THR HG22 H 1 1.348 0.013 . 1 . . . . 38 THR HG2# . 7125 1 327 . 1 1 38 38 THR HG23 H 1 1.348 0.013 . 1 . . . . 38 THR HG2# . 7125 1 328 . 1 1 38 38 THR CA C 13 65.837 0.054 . 1 . . . . 38 THR CA . 7125 1 329 . 1 1 38 38 THR CB C 13 68.101 0.011 . 1 . . . . 38 THR CB . 7125 1 330 . 1 1 38 38 THR CG2 C 13 23.270 0.092 . 1 . . . . 38 THR CG2 . 7125 1 331 . 1 1 38 38 THR N N 15 113.016 0.107 . 1 . . . . 38 THR N . 7125 1 332 . 1 1 39 39 THR H H 1 8.885 0.005 . 1 . . . . 39 THR HN . 7125 1 333 . 1 1 39 39 THR HA H 1 4.471 0.012 . 1 . . . . 39 THR HA . 7125 1 334 . 1 1 39 39 THR HB H 1 4.571 0.010 . 1 . . . . 39 THR HB . 7125 1 335 . 1 1 39 39 THR HG21 H 1 1.815 0.007 . 1 . . . . 39 THR HG2# . 7125 1 336 . 1 1 39 39 THR HG22 H 1 1.815 0.007 . 1 . . . . 39 THR HG2# . 7125 1 337 . 1 1 39 39 THR HG23 H 1 1.815 0.007 . 1 . . . . 39 THR HG2# . 7125 1 338 . 1 1 39 39 THR CA C 13 66.703 0.103 . 1 . . . . 39 THR CA . 7125 1 339 . 1 1 39 39 THR CB C 13 70.912 0.062 . 1 . . . . 39 THR CB . 7125 1 340 . 1 1 39 39 THR CG2 C 13 23.180 0.061 . 1 . . . . 39 THR CG2 . 7125 1 341 . 1 1 39 39 THR N N 15 115.055 0.096 . 1 . . . . 39 THR N . 7125 1 342 . 1 1 40 40 LYS H H 1 7.791 0.007 . 1 . . . . 40 LYS HN . 7125 1 343 . 1 1 40 40 LYS HA H 1 3.904 0.009 . 1 . . . . 40 LYS HA . 7125 1 344 . 1 1 40 40 LYS HB2 H 1 2.003 0.000 . 2 . . . . 40 LYS HB2 . 7125 1 345 . 1 1 40 40 LYS HB3 H 1 1.747 0.000 . 2 . . . . 40 LYS HB3 . 7125 1 346 . 1 1 40 40 LYS HG2 H 1 1.075 0.000 . 2 . . . . 40 LYS HG2 . 7125 1 347 . 1 1 40 40 LYS HG3 H 1 1.811 0.000 . 2 . . . . 40 LYS HG3 . 7125 1 348 . 1 1 40 40 LYS HD2 H 1 1.662 0.000 . 2 . . . . 40 LYS HD1 . 7125 1 349 . 1 1 40 40 LYS HD3 H 1 1.731 0.000 . 2 . . . . 40 LYS HD2 . 7125 1 350 . 1 1 40 40 LYS HE2 H 1 2.880 0.017 . 2 . . . . 40 LYS HE2 . 7125 1 351 . 1 1 40 40 LYS CA C 13 59.840 0.055 . 1 . . . . 40 LYS CA . 7125 1 352 . 1 1 40 40 LYS CB C 13 29.569 0.036 . 1 . . . . 40 LYS CB . 7125 1 353 . 1 1 40 40 LYS CG C 13 26.450 0.009 . 1 . . . . 40 LYS CG . 7125 1 354 . 1 1 40 40 LYS CD C 13 29.771 0.029 . 1 . . . . 40 LYS CD . 7125 1 355 . 1 1 40 40 LYS CE C 13 41.798 0.017 . 1 . . . . 40 LYS CE . 7125 1 356 . 1 1 40 40 LYS N N 15 118.342 0.047 . 1 . . . . 40 LYS N . 7125 1 357 . 1 1 41 41 THR H H 1 7.833 0.006 . 1 . . . . 41 THR HN . 7125 1 358 . 1 1 41 41 THR HA H 1 4.050 0.024 . 1 . . . . 41 THR HA . 7125 1 359 . 1 1 41 41 THR HB H 1 4.255 0.014 . 1 . . . . 41 THR HB . 7125 1 360 . 1 1 41 41 THR HG21 H 1 1.183 0.007 . 1 . . . . 41 THR HG2# . 7125 1 361 . 1 1 41 41 THR HG22 H 1 1.183 0.007 . 1 . . . . 41 THR HG2# . 7125 1 362 . 1 1 41 41 THR HG23 H 1 1.183 0.007 . 1 . . . . 41 THR HG2# . 7125 1 363 . 1 1 41 41 THR CA C 13 64.608 0.047 . 1 . . . . 41 THR CA . 7125 1 364 . 1 1 41 41 THR CB C 13 69.505 0.027 . 1 . . . . 41 THR CB . 7125 1 365 . 1 1 41 41 THR CG2 C 13 21.443 0.112 . 1 . . . . 41 THR CG2 . 7125 1 366 . 1 1 41 41 THR N N 15 111.203 0.086 . 1 . . . . 41 THR N . 7125 1 367 . 1 1 42 42 TYR H H 1 7.512 0.007 . 1 . . . . 42 TYR HN . 7125 1 368 . 1 1 42 42 TYR HA H 1 4.474 0.010 . 1 . . . . 42 TYR HA . 7125 1 369 . 1 1 42 42 TYR HD1 H 1 7.699 0.008 . 3 . . . . 42 TYR HD1 . 7125 1 370 . 1 1 42 42 TYR HE1 H 1 7.120 0.003 . 3 . . . . 42 TYR HE1 . 7125 1 371 . 1 1 42 42 TYR CA C 13 60.613 0.029 . 1 . . . . 42 TYR CA . 7125 1 372 . 1 1 42 42 TYR CD1 C 13 133.178 0.164 . 3 . . . . 42 TYR CD1 . 7125 1 373 . 1 1 42 42 TYR CE1 C 13 121.710 0.042 . 3 . . . . 42 TYR CE1 . 7125 1 374 . 1 1 42 42 TYR N N 15 116.894 0.037 . 1 . . . . 42 TYR N . 7125 1 375 . 1 1 43 43 PHE H H 1 7.835 0.009 . 1 . . . . 43 PHE HN . 7125 1 376 . 1 1 43 43 PHE HA H 1 4.861 0.000 . 1 . . . . 43 PHE HA . 7125 1 377 . 1 1 43 43 PHE HB2 H 1 2.337 0.004 . 2 . . . . 43 PHE HB2 . 7125 1 378 . 1 1 43 43 PHE HD1 H 1 6.098 0.000 . 3 . . . . 43 PHE HD1 . 7125 1 379 . 1 1 43 43 PHE CA C 13 55.335 0.015 . 1 . . . . 43 PHE CA . 7125 1 380 . 1 1 43 43 PHE CB C 13 40.195 0.060 . 1 . . . . 43 PHE CB . 7125 1 381 . 1 1 43 43 PHE CD1 C 13 132.720 0.000 . 3 . . . . 43 PHE CD1 . 7125 1 382 . 1 1 43 43 PHE N N 15 116.967 0.080 . 1 . . . . 43 PHE N . 7125 1 383 . 1 1 44 44 PRO HA H 1 4.457 0.000 . 1 . . . . 44 PRO HA . 7125 1 384 . 1 1 44 44 PRO HG2 H 1 2.058 0.000 . 2 . . . . 44 PRO HG1 . 7125 1 385 . 1 1 44 44 PRO HD2 H 1 3.793 0.052 . 2 . . . . 44 PRO HD2 . 7125 1 386 . 1 1 44 44 PRO CA C 13 65.444 0.036 . 1 . . . . 44 PRO CA . 7125 1 387 . 1 1 44 44 PRO CG C 13 27.490 0.000 . 1 . . . . 44 PRO CG . 7125 1 388 . 1 1 44 44 PRO CD C 13 50.697 0.016 . 1 . . . . 44 PRO CD . 7125 1 389 . 1 1 45 45 HIS H H 1 9.554 0.012 . 1 . . . . 45 HIS HN . 7125 1 390 . 1 1 45 45 HIS HA H 1 4.830 0.014 . 1 . . . . 45 HIS HA . 7125 1 391 . 1 1 45 45 HIS HB2 H 1 3.275 0.026 . 2 . . . . 45 HIS HB2 . 7125 1 392 . 1 1 45 45 HIS HB3 H 1 3.184 0.000 . 2 . . . . 45 HIS HB3 . 7125 1 393 . 1 1 45 45 HIS HE1 H 1 7.902 0.007 . 1 . . . . 45 HIS HE1 . 7125 1 394 . 1 1 45 45 HIS CA C 13 55.482 0.104 . 1 . . . . 45 HIS CA . 7125 1 395 . 1 1 45 45 HIS CB C 13 30.010 0.030 . 1 . . . . 45 HIS CB . 7125 1 396 . 1 1 45 45 HIS CE1 C 13 138.606 0.029 . 1 . . . . 45 HIS CE1 . 7125 1 397 . 1 1 45 45 HIS N N 15 116.698 0.080 . 1 . . . . 45 HIS N . 7125 1 398 . 1 1 46 46 PHE H H 1 7.501 0.004 . 1 . . . . 46 PHE HN . 7125 1 399 . 1 1 46 46 PHE HA H 1 4.614 0.028 . 1 . . . . 46 PHE HA . 7125 1 400 . 1 1 46 46 PHE HB2 H 1 2.263 0.000 . 2 . . . . 46 PHE HB2 . 7125 1 401 . 1 1 46 46 PHE HB3 H 1 3.086 0.000 . 2 . . . . 46 PHE HB3 . 7125 1 402 . 1 1 46 46 PHE HD1 H 1 6.439 0.018 . 3 . . . . 46 PHE HD1 . 7125 1 403 . 1 1 46 46 PHE HE1 H 1 6.769 0.010 . 3 . . . . 46 PHE HE1 . 7125 1 404 . 1 1 46 46 PHE CA C 13 55.952 0.079 . 1 . . . . 46 PHE CA . 7125 1 405 . 1 1 46 46 PHE CB C 13 40.294 0.005 . 1 . . . . 46 PHE CB . 7125 1 406 . 1 1 46 46 PHE CD1 C 13 129.576 0.139 . 3 . . . . 46 PHE CD1 . 7125 1 407 . 1 1 46 46 PHE CE1 C 13 131.690 0.076 . 3 . . . . 46 PHE CE1 . 7125 1 408 . 1 1 46 46 PHE N N 15 122.647 0.077 . 1 . . . . 46 PHE N . 7125 1 409 . 1 1 47 47 ASP H H 1 7.930 0.005 . 1 . . . . 47 ASP HN . 7125 1 410 . 1 1 47 47 ASP HA H 1 4.555 0.015 . 1 . . . . 47 ASP HA . 7125 1 411 . 1 1 47 47 ASP HB2 H 1 2.748 0.036 . 2 . . . . 47 ASP HB2 . 7125 1 412 . 1 1 47 47 ASP HB3 H 1 2.770 0.000 . 2 . . . . 47 ASP HB3 . 7125 1 413 . 1 1 47 47 ASP CA C 13 53.658 0.059 . 1 . . . . 47 ASP CA . 7125 1 414 . 1 1 47 47 ASP CB C 13 40.234 0.158 . 1 . . . . 47 ASP CB . 7125 1 415 . 1 1 47 47 ASP N N 15 119.257 0.063 . 1 . . . . 47 ASP N . 7125 1 416 . 1 1 48 48 LEU H H 1 8.528 0.008 . 1 . . . . 48 LEU HN . 7125 1 417 . 1 1 48 48 LEU HA H 1 4.361 0.081 . 1 . . . . 48 LEU HA . 7125 1 418 . 1 1 48 48 LEU HB2 H 1 1.312 0.033 . 2 . . . . 48 LEU HB2 . 7125 1 419 . 1 1 48 48 LEU HG H 1 1.282 0.008 . 1 . . . . 48 LEU HG . 7125 1 420 . 1 1 48 48 LEU HD11 H 1 -0.113 0.011 . 2 . . . . 48 LEU HD1 . 7125 1 421 . 1 1 48 48 LEU HD12 H 1 -0.113 0.011 . 2 . . . . 48 LEU HD1 . 7125 1 422 . 1 1 48 48 LEU HD13 H 1 -0.113 0.011 . 2 . . . . 48 LEU HD1 . 7125 1 423 . 1 1 48 48 LEU HD21 H 1 0.258 0.009 . 2 . . . . 48 LEU HD2 . 7125 1 424 . 1 1 48 48 LEU HD22 H 1 0.258 0.009 . 2 . . . . 48 LEU HD2 . 7125 1 425 . 1 1 48 48 LEU HD23 H 1 0.258 0.009 . 2 . . . . 48 LEU HD2 . 7125 1 426 . 1 1 48 48 LEU CA C 13 53.589 0.049 . 1 . . . . 48 LEU CA . 7125 1 427 . 1 1 48 48 LEU CB C 13 40.677 0.122 . 1 . . . . 48 LEU CB . 7125 1 428 . 1 1 48 48 LEU CG C 13 25.700 0.050 . 1 . . . . 48 LEU CG . 7125 1 429 . 1 1 48 48 LEU CD1 C 13 23.987 0.117 . 2 . . . . 48 LEU CD1 . 7125 1 430 . 1 1 48 48 LEU CD2 C 13 25.796 0.087 . 2 . . . . 48 LEU CD2 . 7125 1 431 . 1 1 48 48 LEU N N 15 128.099 0.038 . 1 . . . . 48 LEU N . 7125 1 432 . 1 1 49 49 SER H H 1 8.194 0.007 . 1 . . . . 49 SER HN . 7125 1 433 . 1 1 49 49 SER HA H 1 4.085 0.009 . 1 . . . . 49 SER HA . 7125 1 434 . 1 1 49 49 SER HB2 H 1 3.888 0.023 . 2 . . . . 49 SER HB2 . 7125 1 435 . 1 1 49 49 SER HB3 H 1 3.807 0.000 . 2 . . . . 49 SER HB3 . 7125 1 436 . 1 1 49 49 SER CA C 13 59.294 0.042 . 1 . . . . 49 SER CA . 7125 1 437 . 1 1 49 49 SER CB C 13 64.211 0.038 . 1 . . . . 49 SER CB . 7125 1 438 . 1 1 49 49 SER N N 15 117.233 0.060 . 1 . . . . 49 SER N . 7125 1 439 . 1 1 50 50 HIS HA H 1 4.306 0.009 . 1 . . . . 50 HIS HA . 7125 1 440 . 1 1 50 50 HIS HB2 H 1 3.129 0.006 . 2 . . . . 50 HIS HB2 . 7125 1 441 . 1 1 50 50 HIS HB3 H 1 2.983 0.009 . 2 . . . . 50 HIS HB3 . 7125 1 442 . 1 1 50 50 HIS HD2 H 1 7.003 0.001 . 1 . . . . 50 HIS HD2 . 7125 1 443 . 1 1 50 50 HIS HE1 H 1 8.025 0.000 . 1 . . . . 50 HIS HE1 . 7125 1 444 . 1 1 50 50 HIS CA C 13 58.051 0.040 . 1 . . . . 50 HIS CA . 7125 1 445 . 1 1 50 50 HIS CB C 13 28.953 0.038 . 1 . . . . 50 HIS CB . 7125 1 446 . 1 1 50 50 HIS CD2 C 13 121.651 0.037 . 1 . . . . 50 HIS CD2 . 7125 1 447 . 1 1 50 50 HIS CE1 C 13 138.349 0.000 . 1 . . . . 50 HIS CE1 . 7125 1 448 . 1 1 51 51 GLY H H 1 9.002 0.008 . 1 . . . . 51 GLY HN . 7125 1 449 . 1 1 51 51 GLY HA2 H 1 3.771 0.010 . 2 . . . . 51 GLY HA2 . 7125 1 450 . 1 1 51 51 GLY HA3 H 1 3.350 0.022 . 2 . . . . 51 GLY HA3 . 7125 1 451 . 1 1 51 51 GLY CA C 13 45.301 0.078 . 1 . . . . 51 GLY CA . 7125 1 452 . 1 1 51 51 GLY N N 15 116.049 0.042 . 1 . . . . 51 GLY N . 7125 1 453 . 1 1 52 52 SER H H 1 7.433 0.006 . 1 . . . . 52 SER HN . 7125 1 454 . 1 1 52 52 SER HA H 1 4.046 0.013 . 1 . . . . 52 SER HA . 7125 1 455 . 1 1 52 52 SER HB2 H 1 4.071 0.020 . 2 . . . . 52 SER HB2 . 7125 1 456 . 1 1 52 52 SER HB3 H 1 3.631 0.005 . 2 . . . . 52 SER HB3 . 7125 1 457 . 1 1 52 52 SER CA C 13 57.185 0.061 . 1 . . . . 52 SER CA . 7125 1 458 . 1 1 52 52 SER CB C 13 64.964 0.123 . 1 . . . . 52 SER CB . 7125 1 459 . 1 1 52 52 SER N N 15 114.415 0.026 . 1 . . . . 52 SER N . 7125 1 460 . 1 1 53 53 ALA H H 1 9.088 0.013 . 1 . . . . 53 ALA HN . 7125 1 461 . 1 1 53 53 ALA HA H 1 4.006 0.026 . 1 . . . . 53 ALA HA . 7125 1 462 . 1 1 53 53 ALA HB1 H 1 1.415 0.015 . 1 . . . . 53 ALA HB# . 7125 1 463 . 1 1 53 53 ALA HB2 H 1 1.415 0.015 . 1 . . . . 53 ALA HB# . 7125 1 464 . 1 1 53 53 ALA HB3 H 1 1.415 0.015 . 1 . . . . 53 ALA HB# . 7125 1 465 . 1 1 53 53 ALA CA C 13 54.943 0.099 . 1 . . . . 53 ALA CA . 7125 1 466 . 1 1 53 53 ALA CB C 13 18.293 0.084 . 1 . . . . 53 ALA CB . 7125 1 467 . 1 1 53 53 ALA N N 15 131.667 0.068 . 1 . . . . 53 ALA N . 7125 1 468 . 1 1 54 54 GLN H H 1 8.298 0.008 . 1 . . . . 54 GLN HN . 7125 1 469 . 1 1 54 54 GLN HA H 1 3.885 0.013 . 1 . . . . 54 GLN HA . 7125 1 470 . 1 1 54 54 GLN HB2 H 1 1.721 0.031 . 2 . . . . 54 GLN HB2 . 7125 1 471 . 1 1 54 54 GLN HB3 H 1 1.252 0.015 . 2 . . . . 54 GLN HB3 . 7125 1 472 . 1 1 54 54 GLN HG2 H 1 2.108 0.017 . 2 . . . . 54 GLN HG2 . 7125 1 473 . 1 1 54 54 GLN HG3 H 1 1.685 0.011 . 2 . . . . 54 GLN HG3 . 7125 1 474 . 1 1 54 54 GLN HE21 H 1 6.645 0.000 . 2 . . . . 54 GLN HE21 . 7125 1 475 . 1 1 54 54 GLN HE22 H 1 7.270 0.018 . 2 . . . . 54 GLN HE22 . 7125 1 476 . 1 1 54 54 GLN CA C 13 59.033 0.067 . 1 . . . . 54 GLN CA . 7125 1 477 . 1 1 54 54 GLN CB C 13 28.800 0.106 . 1 . . . . 54 GLN CB . 7125 1 478 . 1 1 54 54 GLN CG C 13 34.239 0.071 . 1 . . . . 54 GLN CG . 7125 1 479 . 1 1 54 54 GLN N N 15 120.096 0.080 . 1 . . . . 54 GLN N . 7125 1 480 . 1 1 54 54 GLN NE2 N 15 113.068 0.112 . 1 . . . . 54 GLN NE2 . 7125 1 481 . 1 1 55 55 VAL H H 1 7.540 0.007 . 1 . . . . 55 VAL HN . 7125 1 482 . 1 1 55 55 VAL HA H 1 3.212 0.012 . 1 . . . . 55 VAL HA . 7125 1 483 . 1 1 55 55 VAL HB H 1 1.964 0.017 . 1 . . . . 55 VAL HB . 7125 1 484 . 1 1 55 55 VAL HG11 H 1 0.764 0.006 . 2 . . . . 55 VAL HG1# . 7125 1 485 . 1 1 55 55 VAL HG12 H 1 0.764 0.006 . 2 . . . . 55 VAL HG1# . 7125 1 486 . 1 1 55 55 VAL HG13 H 1 0.764 0.006 . 2 . . . . 55 VAL HG1# . 7125 1 487 . 1 1 55 55 VAL HG21 H 1 0.961 0.006 . 2 . . . . 55 VAL HG2# . 7125 1 488 . 1 1 55 55 VAL HG22 H 1 0.961 0.006 . 2 . . . . 55 VAL HG2# . 7125 1 489 . 1 1 55 55 VAL HG23 H 1 0.961 0.006 . 2 . . . . 55 VAL HG2# . 7125 1 490 . 1 1 55 55 VAL CA C 13 67.423 0.116 . 1 . . . . 55 VAL CA . 7125 1 491 . 1 1 55 55 VAL CB C 13 31.825 0.119 . 1 . . . . 55 VAL CB . 7125 1 492 . 1 1 55 55 VAL CG1 C 13 22.032 0.110 . 2 . . . . 55 VAL CG1 . 7125 1 493 . 1 1 55 55 VAL CG2 C 13 24.524 0.105 . 2 . . . . 55 VAL CG2 . 7125 1 494 . 1 1 55 55 VAL N N 15 121.775 0.062 . 1 . . . . 55 VAL N . 7125 1 495 . 1 1 56 56 LYS H H 1 7.735 0.009 . 1 . . . . 56 LYS HN . 7125 1 496 . 1 1 56 56 LYS HA H 1 3.770 0.023 . 1 . . . . 56 LYS HA . 7125 1 497 . 1 1 56 56 LYS HB2 H 1 1.728 0.018 . 2 . . . . 56 LYS HB2 . 7125 1 498 . 1 1 56 56 LYS HB3 H 1 1.683 0.008 . 2 . . . . 56 LYS HB3 . 7125 1 499 . 1 1 56 56 LYS HG2 H 1 1.337 0.019 . 2 . . . . 56 LYS HG2 . 7125 1 500 . 1 1 56 56 LYS HG3 H 1 1.176 0.006 . 2 . . . . 56 LYS HG3 . 7125 1 501 . 1 1 56 56 LYS HD2 H 1 1.475 0.016 . 2 . . . . 56 LYS HD2 . 7125 1 502 . 1 1 56 56 LYS HE2 H 1 2.784 0.020 . 2 . . . . 56 LYS HE2 . 7125 1 503 . 1 1 56 56 LYS CA C 13 60.067 0.070 . 1 . . . . 56 LYS CA . 7125 1 504 . 1 1 56 56 LYS CB C 13 32.208 0.071 . 1 . . . . 56 LYS CB . 7125 1 505 . 1 1 56 56 LYS CG C 13 25.460 0.082 . 1 . . . . 56 LYS CG . 7125 1 506 . 1 1 56 56 LYS CD C 13 29.348 0.080 . 1 . . . . 56 LYS CD . 7125 1 507 . 1 1 56 56 LYS CE C 13 41.978 0.030 . 1 . . . . 56 LYS CE . 7125 1 508 . 1 1 56 56 LYS N N 15 120.062 0.092 . 1 . . . . 56 LYS N . 7125 1 509 . 1 1 57 57 GLY H H 1 8.256 0.003 . 1 . . . . 57 GLY HN . 7125 1 510 . 1 1 57 57 GLY HA2 H 1 3.857 0.018 . 2 . . . . 57 GLY HA2 . 7125 1 511 . 1 1 57 57 GLY HA3 H 1 3.985 0.000 . 2 . . . . 57 GLY HA3 . 7125 1 512 . 1 1 57 57 GLY CA C 13 46.985 0.064 . 1 . . . . 57 GLY CA . 7125 1 513 . 1 1 57 57 GLY N N 15 106.072 0.055 . 1 . . . . 57 GLY N . 7125 1 514 . 1 1 58 58 HIS H H 1 8.185 0.008 . 1 . . . . 58 HIS HN . 7125 1 515 . 1 1 58 58 HIS HA H 1 3.902 0.031 . 1 . . . . 58 HIS HA . 7125 1 516 . 1 1 58 58 HIS HB2 H 1 2.952 0.016 . 2 . . . . 58 HIS HB2 . 7125 1 517 . 1 1 58 58 HIS HB3 H 1 2.251 0.010 . 2 . . . . 58 HIS HB3 . 7125 1 518 . 1 1 58 58 HIS HD2 H 1 4.500 0.005 . 1 . . . . 58 HIS HD2 . 7125 1 519 . 1 1 58 58 HIS HE1 H 1 8.269 0.004 . 1 . . . . 58 HIS HE1 . 7125 1 520 . 1 1 58 58 HIS CA C 13 60.148 0.114 . 1 . . . . 58 HIS CA . 7125 1 521 . 1 1 58 58 HIS CB C 13 31.116 0.125 . 1 . . . . 58 HIS CB . 7125 1 522 . 1 1 58 58 HIS CD2 C 13 114.291 0.000 . 1 . . . . 58 HIS CD2 . 7125 1 523 . 1 1 58 58 HIS CE1 C 13 139.059 0.040 . 1 . . . . 58 HIS CE1 . 7125 1 524 . 1 1 58 58 HIS N N 15 124.485 0.067 . 1 . . . . 58 HIS N . 7125 1 525 . 1 1 59 59 GLY H H 1 8.556 0.008 . 1 . . . . 59 GLY HN . 7125 1 526 . 1 1 59 59 GLY HA2 H 1 3.164 0.037 . 2 . . . . 59 GLY HA2 . 7125 1 527 . 1 1 59 59 GLY HA3 H 1 2.741 0.002 . 2 . . . . 59 GLY HA3 . 7125 1 528 . 1 1 59 59 GLY CA C 13 46.493 0.146 . 1 . . . . 59 GLY CA . 7125 1 529 . 1 1 59 59 GLY N N 15 105.531 0.129 . 1 . . . . 59 GLY N . 7125 1 530 . 1 1 60 60 LYS H H 1 7.072 0.010 . 1 . . . . 60 LYS HN . 7125 1 531 . 1 1 60 60 LYS HA H 1 3.944 0.012 . 1 . . . . 60 LYS HA . 7125 1 532 . 1 1 60 60 LYS HB2 H 1 1.994 0.005 . 2 . . . . 60 LYS HB2 . 7125 1 533 . 1 1 60 60 LYS HB3 H 1 1.817 0.000 . 2 . . . . 60 LYS HB3 . 7125 1 534 . 1 1 60 60 LYS HG2 H 1 1.421 0.004 . 2 . . . . 60 LYS HG2 . 7125 1 535 . 1 1 60 60 LYS HD2 H 1 1.757 0.000 . 2 . . . . 60 LYS HD2 . 7125 1 536 . 1 1 60 60 LYS HD3 H 1 1.567 0.000 . 2 . . . . 60 LYS HD3 . 7125 1 537 . 1 1 60 60 LYS HE2 H 1 3.032 0.000 . 2 . . . . 60 LYS HE2 . 7125 1 538 . 1 1 60 60 LYS CA C 13 59.699 0.156 . 1 . . . . 60 LYS CA . 7125 1 539 . 1 1 60 60 LYS CB C 13 32.224 0.091 . 1 . . . . 60 LYS CB . 7125 1 540 . 1 1 60 60 LYS CG C 13 25.270 0.093 . 1 . . . . 60 LYS CG . 7125 1 541 . 1 1 60 60 LYS CD C 13 29.046 0.034 . 1 . . . . 60 LYS CD . 7125 1 542 . 1 1 60 60 LYS CE C 13 42.315 0.000 . 1 . . . . 60 LYS CE . 7125 1 543 . 1 1 60 60 LYS N N 15 120.115 0.026 . 1 . . . . 60 LYS N . 7125 1 544 . 1 1 61 61 LYS H H 1 6.982 0.008 . 1 . . . . 61 LYS HN . 7125 1 545 . 1 1 61 61 LYS HA H 1 4.297 0.011 . 1 . . . . 61 LYS HA . 7125 1 546 . 1 1 61 61 LYS HB2 H 1 1.967 0.000 . 2 . . . . 61 LYS HB2 . 7125 1 547 . 1 1 61 61 LYS HB3 H 1 1.558 0.000 . 2 . . . . 61 LYS HB3 . 7125 1 548 . 1 1 61 61 LYS HG2 H 1 1.644 0.000 . 2 . . . . 61 LYS HG2 . 7125 1 549 . 1 1 61 61 LYS HE2 H 1 3.096 0.000 . 2 . . . . 61 LYS HE1 . 7125 1 550 . 1 1 61 61 LYS CA C 13 60.359 0.040 . 1 . . . . 61 LYS CA . 7125 1 551 . 1 1 61 61 LYS CB C 13 32.181 0.078 . 1 . . . . 61 LYS CB . 7125 1 552 . 1 1 61 61 LYS CG C 13 26.141 0.000 . 1 . . . . 61 LYS CG . 7125 1 553 . 1 1 61 61 LYS CE C 13 42.556 0.000 . 1 . . . . 61 LYS CE . 7125 1 554 . 1 1 61 61 LYS N N 15 118.339 0.048 . 1 . . . . 61 LYS N . 7125 1 555 . 1 1 62 62 VAL H H 1 7.751 0.006 . 1 . . . . 62 VAL HN . 7125 1 556 . 1 1 62 62 VAL HA H 1 3.637 0.020 . 1 . . . . 62 VAL HA . 7125 1 557 . 1 1 62 62 VAL HB H 1 1.222 0.012 . 1 . . . . 62 VAL HB . 7125 1 558 . 1 1 62 62 VAL HG11 H 1 -1.763 0.011 . 2 . . . . 62 VAL HG1# . 7125 1 559 . 1 1 62 62 VAL HG12 H 1 -1.763 0.011 . 2 . . . . 62 VAL HG1# . 7125 1 560 . 1 1 62 62 VAL HG13 H 1 -1.763 0.011 . 2 . . . . 62 VAL HG1# . 7125 1 561 . 1 1 62 62 VAL HG21 H 1 0.100 0.006 . 2 . . . . 62 VAL HG2# . 7125 1 562 . 1 1 62 62 VAL HG22 H 1 0.100 0.006 . 2 . . . . 62 VAL HG2# . 7125 1 563 . 1 1 62 62 VAL HG23 H 1 0.100 0.006 . 2 . . . . 62 VAL HG2# . 7125 1 564 . 1 1 62 62 VAL CA C 13 67.140 0.057 . 1 . . . . 62 VAL CA . 7125 1 565 . 1 1 62 62 VAL CB C 13 31.590 0.105 . 1 . . . . 62 VAL CB . 7125 1 566 . 1 1 62 62 VAL CG1 C 13 21.526 0.122 . 2 . . . . 62 VAL CG1 . 7125 1 567 . 1 1 62 62 VAL CG2 C 13 19.117 0.114 . 2 . . . . 62 VAL CG2 . 7125 1 568 . 1 1 62 62 VAL N N 15 120.323 0.072 . 1 . . . . 62 VAL N . 7125 1 569 . 1 1 63 63 ALA H H 1 8.145 0.012 . 1 . . . . 63 ALA HN . 7125 1 570 . 1 1 63 63 ALA HA H 1 4.174 0.014 . 1 . . . . 63 ALA HA . 7125 1 571 . 1 1 63 63 ALA HB1 H 1 1.516 0.018 . 1 . . . . 63 ALA HB# . 7125 1 572 . 1 1 63 63 ALA HB2 H 1 1.516 0.018 . 1 . . . . 63 ALA HB# . 7125 1 573 . 1 1 63 63 ALA HB3 H 1 1.516 0.018 . 1 . . . . 63 ALA HB# . 7125 1 574 . 1 1 63 63 ALA CA C 13 56.071 0.100 . 1 . . . . 63 ALA CA . 7125 1 575 . 1 1 63 63 ALA CB C 13 19.501 0.128 . 1 . . . . 63 ALA CB . 7125 1 576 . 1 1 63 63 ALA N N 15 120.978 0.028 . 1 . . . . 63 ALA N . 7125 1 577 . 1 1 64 64 ASP H H 1 8.913 0.007 . 1 . . . . 64 ASP HN . 7125 1 578 . 1 1 64 64 ASP HA H 1 4.592 0.012 . 1 . . . . 64 ASP HA . 7125 1 579 . 1 1 64 64 ASP HB2 H 1 3.023 0.007 . 2 . . . . 64 ASP HB2 . 7125 1 580 . 1 1 64 64 ASP HB3 H 1 2.827 0.022 . 2 . . . . 64 ASP HB3 . 7125 1 581 . 1 1 64 64 ASP CA C 13 57.765 0.093 . 1 . . . . 64 ASP CA . 7125 1 582 . 1 1 64 64 ASP CB C 13 40.032 0.140 . 1 . . . . 64 ASP CB . 7125 1 583 . 1 1 64 64 ASP N N 15 119.821 0.033 . 1 . . . . 64 ASP N . 7125 1 584 . 1 1 65 65 ALA H H 1 8.331 0.007 . 1 . . . . 65 ALA HN . 7125 1 585 . 1 1 65 65 ALA HA H 1 4.682 0.021 . 1 . . . . 65 ALA HA . 7125 1 586 . 1 1 65 65 ALA HB1 H 1 2.431 0.007 . 1 . . . . 65 ALA HB# . 7125 1 587 . 1 1 65 65 ALA HB2 H 1 2.431 0.007 . 1 . . . . 65 ALA HB# . 7125 1 588 . 1 1 65 65 ALA HB3 H 1 2.431 0.007 . 1 . . . . 65 ALA HB# . 7125 1 589 . 1 1 65 65 ALA CA C 13 55.588 0.099 . 1 . . . . 65 ALA CA . 7125 1 590 . 1 1 65 65 ALA CB C 13 20.331 0.090 . 1 . . . . 65 ALA CB . 7125 1 591 . 1 1 65 65 ALA N N 15 124.579 0.036 . 1 . . . . 65 ALA N . 7125 1 592 . 1 1 66 66 LEU H H 1 8.482 0.007 . 1 . . . . 66 LEU HN . 7125 1 593 . 1 1 66 66 LEU HA H 1 4.186 0.012 . 1 . . . . 66 LEU HA . 7125 1 594 . 1 1 66 66 LEU HB2 H 1 0.775 0.000 . 2 . . . . 66 LEU HB2 . 7125 1 595 . 1 1 66 66 LEU HB3 H 1 2.263 0.003 . 2 . . . . 66 LEU HB3 . 7125 1 596 . 1 1 66 66 LEU HG H 1 2.231 0.000 . 1 . . . . 66 LEU HG . 7125 1 597 . 1 1 66 66 LEU HD11 H 1 0.943 0.017 . 2 . . . . 66 LEU HD1 . 7125 1 598 . 1 1 66 66 LEU HD12 H 1 0.943 0.017 . 2 . . . . 66 LEU HD1 . 7125 1 599 . 1 1 66 66 LEU HD13 H 1 0.943 0.017 . 2 . . . . 66 LEU HD1 . 7125 1 600 . 1 1 66 66 LEU HD21 H 1 0.873 0.023 . 2 . . . . 66 LEU HD2 . 7125 1 601 . 1 1 66 66 LEU HD22 H 1 0.873 0.023 . 2 . . . . 66 LEU HD2 . 7125 1 602 . 1 1 66 66 LEU HD23 H 1 0.873 0.023 . 2 . . . . 66 LEU HD2 . 7125 1 603 . 1 1 66 66 LEU CA C 13 58.446 0.092 . 1 . . . . 66 LEU CA . 7125 1 604 . 1 1 66 66 LEU CB C 13 41.561 0.081 . 1 . . . . 66 LEU CB . 7125 1 605 . 1 1 66 66 LEU CG C 13 27.200 0.000 . 1 . . . . 66 LEU CG . 7125 1 606 . 1 1 66 66 LEU CD1 C 13 23.285 0.160 . 2 . . . . 66 LEU CD1 . 7125 1 607 . 1 1 66 66 LEU CD2 C 13 26.841 0.180 . 2 . . . . 66 LEU CD2 . 7125 1 608 . 1 1 66 66 LEU N N 15 119.336 0.075 . 1 . . . . 66 LEU N . 7125 1 609 . 1 1 67 67 THR H H 1 9.123 0.010 . 1 . . . . 67 THR HN . 7125 1 610 . 1 1 67 67 THR HA H 1 3.839 0.011 . 1 . . . . 67 THR HA . 7125 1 611 . 1 1 67 67 THR HB H 1 4.684 0.025 . 1 . . . . 67 THR HB . 7125 1 612 . 1 1 67 67 THR HG21 H 1 1.441 0.012 . 1 . . . . 67 THR HG2# . 7125 1 613 . 1 1 67 67 THR HG22 H 1 1.441 0.012 . 1 . . . . 67 THR HG2# . 7125 1 614 . 1 1 67 67 THR HG23 H 1 1.441 0.012 . 1 . . . . 67 THR HG2# . 7125 1 615 . 1 1 67 67 THR CA C 13 67.329 0.075 . 1 . . . . 67 THR CA . 7125 1 616 . 1 1 67 67 THR CB C 13 68.787 0.027 . 1 . . . . 67 THR CB . 7125 1 617 . 1 1 67 67 THR CG2 C 13 22.819 0.045 . 1 . . . . 67 THR CG2 . 7125 1 618 . 1 1 67 67 THR N N 15 118.175 0.081 . 1 . . . . 67 THR N . 7125 1 619 . 1 1 68 68 ASN H H 1 8.118 0.009 . 1 . . . . 68 ASN HN . 7125 1 620 . 1 1 68 68 ASN HA H 1 4.719 0.010 . 1 . . . . 68 ASN HA . 7125 1 621 . 1 1 68 68 ASN HB2 H 1 3.163 0.023 . 2 . . . . 68 ASN HB2 . 7125 1 622 . 1 1 68 68 ASN HB3 H 1 3.079 0.020 . 2 . . . . 68 ASN HB3 . 7125 1 623 . 1 1 68 68 ASN HD21 H 1 6.917 0.008 . 1 . . . . 68 ASN HD21 . 7125 1 624 . 1 1 68 68 ASN HD22 H 1 7.782 0.007 . 1 . . . . 68 ASN HD22 . 7125 1 625 . 1 1 68 68 ASN CA C 13 56.645 0.075 . 1 . . . . 68 ASN CA . 7125 1 626 . 1 1 68 68 ASN CB C 13 38.918 0.054 . 1 . . . . 68 ASN CB . 7125 1 627 . 1 1 68 68 ASN N N 15 121.266 0.030 . 1 . . . . 68 ASN N . 7125 1 628 . 1 1 68 68 ASN ND2 N 15 112.723 0.053 . 1 . . . . 68 ASN ND2 . 7125 1 629 . 1 1 69 69 ALA H H 1 8.562 0.008 . 1 . . . . 69 ALA HN . 7125 1 630 . 1 1 69 69 ALA HA H 1 3.873 0.010 . 1 . . . . 69 ALA HA . 7125 1 631 . 1 1 69 69 ALA HB1 H 1 1.730 0.008 . 1 . . . . 69 ALA HB# . 7125 1 632 . 1 1 69 69 ALA HB2 H 1 1.730 0.008 . 1 . . . . 69 ALA HB# . 7125 1 633 . 1 1 69 69 ALA HB3 H 1 1.730 0.008 . 1 . . . . 69 ALA HB# . 7125 1 634 . 1 1 69 69 ALA CA C 13 56.170 0.090 . 1 . . . . 69 ALA CA . 7125 1 635 . 1 1 69 69 ALA CB C 13 18.505 0.052 . 1 . . . . 69 ALA CB . 7125 1 636 . 1 1 69 69 ALA N N 15 123.259 0.050 . 1 . . . . 69 ALA N . 7125 1 637 . 1 1 70 70 VAL H H 1 8.257 0.013 . 1 . . . . 70 VAL HN . 7125 1 638 . 1 1 70 70 VAL HA H 1 3.190 0.021 . 1 . . . . 70 VAL HA . 7125 1 639 . 1 1 70 70 VAL HB H 1 1.939 0.009 . 1 . . . . 70 VAL HB . 7125 1 640 . 1 1 70 70 VAL HG11 H 1 0.151 0.011 . 2 . . . . 70 VAL HG1# . 7125 1 641 . 1 1 70 70 VAL HG12 H 1 0.151 0.011 . 2 . . . . 70 VAL HG1# . 7125 1 642 . 1 1 70 70 VAL HG13 H 1 0.151 0.011 . 2 . . . . 70 VAL HG1# . 7125 1 643 . 1 1 70 70 VAL HG21 H 1 0.733 0.014 . 2 . . . . 70 VAL HG2# . 7125 1 644 . 1 1 70 70 VAL HG22 H 1 0.733 0.014 . 2 . . . . 70 VAL HG2# . 7125 1 645 . 1 1 70 70 VAL HG23 H 1 0.733 0.014 . 2 . . . . 70 VAL HG2# . 7125 1 646 . 1 1 70 70 VAL CA C 13 67.172 0.062 . 1 . . . . 70 VAL CA . 7125 1 647 . 1 1 70 70 VAL CB C 13 32.084 0.072 . 1 . . . . 70 VAL CB . 7125 1 648 . 1 1 70 70 VAL CG1 C 13 23.115 0.133 . 2 . . . . 70 VAL CG1 . 7125 1 649 . 1 1 70 70 VAL CG2 C 13 22.588 0.131 . 2 . . . . 70 VAL CG2 . 7125 1 650 . 1 1 70 70 VAL N N 15 116.721 0.056 . 1 . . . . 70 VAL N . 7125 1 651 . 1 1 71 71 ALA H H 1 7.721 0.014 . 1 . . . . 71 ALA HN . 7125 1 652 . 1 1 71 71 ALA HA H 1 4.021 0.009 . 1 . . . . 71 ALA HA . 7125 1 653 . 1 1 71 71 ALA HB1 H 1 1.371 0.005 . 1 . . . . 71 ALA HB# . 7125 1 654 . 1 1 71 71 ALA HB2 H 1 1.371 0.005 . 1 . . . . 71 ALA HB# . 7125 1 655 . 1 1 71 71 ALA HB3 H 1 1.371 0.005 . 1 . . . . 71 ALA HB# . 7125 1 656 . 1 1 71 71 ALA CA C 13 54.395 0.074 . 1 . . . . 71 ALA CA . 7125 1 657 . 1 1 71 71 ALA CB C 13 18.258 0.105 . 1 . . . . 71 ALA CB . 7125 1 658 . 1 1 71 71 ALA N N 15 120.193 0.063 . 1 . . . . 71 ALA N . 7125 1 659 . 1 1 72 72 HIS H H 1 7.699 0.006 . 1 . . . . 72 HIS HN . 7125 1 660 . 1 1 72 72 HIS HA H 1 4.883 0.009 . 1 . . . . 72 HIS HA . 7125 1 661 . 1 1 72 72 HIS HB2 H 1 2.561 0.000 . 2 . . . . 72 HIS HB2 . 7125 1 662 . 1 1 72 72 HIS HB3 H 1 3.434 0.000 . 2 . . . . 72 HIS HB3 . 7125 1 663 . 1 1 72 72 HIS HD2 H 1 7.403 0.024 . 1 . . . . 72 HIS HD2 . 7125 1 664 . 1 1 72 72 HIS HE1 H 1 8.277 0.004 . 1 . . . . 72 HIS HE1 . 7125 1 665 . 1 1 72 72 HIS CA C 13 55.111 0.061 . 1 . . . . 72 HIS CA . 7125 1 666 . 1 1 72 72 HIS CB C 13 28.473 0.096 . 1 . . . . 72 HIS CB . 7125 1 667 . 1 1 72 72 HIS CD2 C 13 122.232 0.096 . 1 . . . . 72 HIS CD2 . 7125 1 668 . 1 1 72 72 HIS CE1 C 13 137.512 0.032 . 1 . . . . 72 HIS CE1 . 7125 1 669 . 1 1 72 72 HIS N N 15 116.005 0.070 . 1 . . . . 72 HIS N . 7125 1 670 . 1 1 73 73 VAL H H 1 6.665 0.010 . 1 . . . . 73 VAL HN . 7125 1 671 . 1 1 73 73 VAL HA H 1 4.123 0.009 . 1 . . . . 73 VAL HA . 7125 1 672 . 1 1 73 73 VAL HB H 1 2.527 0.008 . 1 . . . . 73 VAL HB . 7125 1 673 . 1 1 73 73 VAL HG11 H 1 0.976 0.006 . 2 . . . . 73 VAL HG1# . 7125 1 674 . 1 1 73 73 VAL HG12 H 1 0.976 0.006 . 2 . . . . 73 VAL HG1# . 7125 1 675 . 1 1 73 73 VAL HG13 H 1 0.976 0.006 . 2 . . . . 73 VAL HG1# . 7125 1 676 . 1 1 73 73 VAL HG21 H 1 1.131 0.007 . 2 . . . . 73 VAL HG2# . 7125 1 677 . 1 1 73 73 VAL HG22 H 1 1.131 0.007 . 2 . . . . 73 VAL HG2# . 7125 1 678 . 1 1 73 73 VAL HG23 H 1 1.131 0.007 . 2 . . . . 73 VAL HG2# . 7125 1 679 . 1 1 73 73 VAL CA C 13 65.464 0.107 . 1 . . . . 73 VAL CA . 7125 1 680 . 1 1 73 73 VAL CB C 13 32.218 0.056 . 1 . . . . 73 VAL CB . 7125 1 681 . 1 1 73 73 VAL CG1 C 13 20.481 0.091 . 2 . . . . 73 VAL CG1 . 7125 1 682 . 1 1 73 73 VAL CG2 C 13 22.814 0.079 . 2 . . . . 73 VAL CG2 . 7125 1 683 . 1 1 73 73 VAL N N 15 119.790 0.028 . 1 . . . . 73 VAL N . 7125 1 684 . 1 1 74 74 ASP H H 1 8.242 0.009 . 1 . . . . 74 ASP HN . 7125 1 685 . 1 1 74 74 ASP HA H 1 4.830 0.019 . 1 . . . . 74 ASP HA . 7125 1 686 . 1 1 74 74 ASP HB2 H 1 2.511 0.014 . 2 . . . . 74 ASP HB2 . 7125 1 687 . 1 1 74 74 ASP HB3 H 1 2.916 0.030 . 2 . . . . 74 ASP HB3 . 7125 1 688 . 1 1 74 74 ASP CA C 13 55.383 0.109 . 1 . . . . 74 ASP CA . 7125 1 689 . 1 1 74 74 ASP CB C 13 41.453 0.125 . 1 . . . . 74 ASP CB . 7125 1 690 . 1 1 74 74 ASP N N 15 119.560 0.030 . 1 . . . . 74 ASP N . 7125 1 691 . 1 1 75 75 ASP H H 1 8.351 0.004 . 1 . . . . 75 ASP HN . 7125 1 692 . 1 1 75 75 ASP HA H 1 5.042 0.012 . 1 . . . . 75 ASP HA . 7125 1 693 . 1 1 75 75 ASP HB2 H 1 2.471 0.005 . 2 . . . . 75 ASP HB2 . 7125 1 694 . 1 1 75 75 ASP HB3 H 1 2.688 0.000 . 2 . . . . 75 ASP HB3 . 7125 1 695 . 1 1 75 75 ASP CA C 13 53.184 0.063 . 1 . . . . 75 ASP CA . 7125 1 696 . 1 1 75 75 ASP CB C 13 41.848 0.019 . 1 . . . . 75 ASP CB . 7125 1 697 . 1 1 75 75 ASP N N 15 122.432 0.053 . 1 . . . . 75 ASP N . 7125 1 698 . 1 1 76 76 MET H H 1 8.672 0.009 . 1 . . . . 76 MET HN . 7125 1 699 . 1 1 76 76 MET HA H 1 4.036 0.013 . 1 . . . . 76 MET HA . 7125 1 700 . 1 1 76 76 MET HB2 H 1 2.919 0.008 . 2 . . . . 76 MET HB2 . 7125 1 701 . 1 1 76 76 MET HB3 H 1 2.325 0.011 . 2 . . . . 76 MET HB3 . 7125 1 702 . 1 1 76 76 MET HG2 H 1 1.796 0.010 . 2 . . . . 76 MET HG2 . 7125 1 703 . 1 1 76 76 MET HG3 H 1 2.342 0.011 . 2 . . . . 76 MET HG3 . 7125 1 704 . 1 1 76 76 MET HE1 H 1 2.063 0.009 . 1 . . . . 76 MET HE# . 7125 1 705 . 1 1 76 76 MET HE2 H 1 2.063 0.009 . 1 . . . . 76 MET HE# . 7125 1 706 . 1 1 76 76 MET HE3 H 1 2.063 0.009 . 1 . . . . 76 MET HE# . 7125 1 707 . 1 1 76 76 MET CA C 13 62.211 0.042 . 1 . . . . 76 MET CA . 7125 1 708 . 1 1 76 76 MET CB C 13 33.988 0.087 . 1 . . . . 76 MET CB . 7125 1 709 . 1 1 76 76 MET CG C 13 33.080 0.090 . 1 . . . . 76 MET CG . 7125 1 710 . 1 1 76 76 MET CE C 13 17.261 0.065 . 1 . . . . 76 MET CE . 7125 1 711 . 1 1 76 76 MET N N 15 121.791 0.088 . 1 . . . . 76 MET N . 7125 1 712 . 1 1 77 77 PRO HD2 H 1 3.757 0.000 . 1 . . . . 77 PRO HD2 . 7125 1 713 . 1 1 77 77 PRO CA C 13 66.096 0.000 . 1 . . . . 77 PRO CA . 7125 1 714 . 1 1 77 77 PRO CD C 13 50.274 0.000 . 1 . . . . 77 PRO CD . 7125 1 715 . 1 1 78 78 ASN H H 1 7.461 0.006 . 1 . . . . 78 ASN HN . 7125 1 716 . 1 1 78 78 ASN HA H 1 4.549 0.012 . 1 . . . . 78 ASN HA . 7125 1 717 . 1 1 78 78 ASN HB2 H 1 2.762 0.019 . 2 . . . . 78 ASN HB2 . 7125 1 718 . 1 1 78 78 ASN HB3 H 1 2.692 0.001 . 2 . . . . 78 ASN HB3 . 7125 1 719 . 1 1 78 78 ASN HD21 H 1 6.912 0.000 . 2 . . . . 78 ASN HD21 . 7125 1 720 . 1 1 78 78 ASN HD22 H 1 8.460 0.000 . 2 . . . . 78 ASN HD22 . 7125 1 721 . 1 1 78 78 ASN CA C 13 55.803 0.128 . 1 . . . . 78 ASN CA . 7125 1 722 . 1 1 78 78 ASN CB C 13 38.961 0.051 . 1 . . . . 78 ASN CB . 7125 1 723 . 1 1 78 78 ASN N N 15 113.172 0.083 . 1 . . . . 78 ASN N . 7125 1 724 . 1 1 78 78 ASN ND2 N 15 115.698 0.001 . 1 . . . . 78 ASN ND2 . 7125 1 725 . 1 1 79 79 ALA H H 1 7.904 0.008 . 1 . . . . 79 ALA HN . 7125 1 726 . 1 1 79 79 ALA HA H 1 4.041 0.016 . 1 . . . . 79 ALA HA . 7125 1 727 . 1 1 79 79 ALA HB1 H 1 1.207 0.033 . 1 . . . . 79 ALA HB# . 7125 1 728 . 1 1 79 79 ALA HB2 H 1 1.207 0.033 . 1 . . . . 79 ALA HB# . 7125 1 729 . 1 1 79 79 ALA HB3 H 1 1.207 0.033 . 1 . . . . 79 ALA HB# . 7125 1 730 . 1 1 79 79 ALA CA C 13 54.884 0.090 . 1 . . . . 79 ALA CA . 7125 1 731 . 1 1 79 79 ALA CB C 13 18.767 0.097 . 1 . . . . 79 ALA CB . 7125 1 732 . 1 1 79 79 ALA N N 15 121.971 0.040 . 1 . . . . 79 ALA N . 7125 1 733 . 1 1 80 80 LEU H H 1 8.091 0.012 . 1 . . . . 80 LEU HN . 7125 1 734 . 1 1 80 80 LEU HA H 1 4.629 0.016 . 1 . . . . 80 LEU HA . 7125 1 735 . 1 1 80 80 LEU HB2 H 1 1.608 0.012 . 2 . . . . 80 LEU HB2 . 7125 1 736 . 1 1 80 80 LEU HG H 1 1.693 0.016 . 1 . . . . 80 LEU HG . 7125 1 737 . 1 1 80 80 LEU HD11 H 1 0.888 0.009 . 2 . . . . 80 LEU HD1 . 7125 1 738 . 1 1 80 80 LEU HD12 H 1 0.888 0.009 . 2 . . . . 80 LEU HD1 . 7125 1 739 . 1 1 80 80 LEU HD13 H 1 0.888 0.009 . 2 . . . . 80 LEU HD1 . 7125 1 740 . 1 1 80 80 LEU HD21 H 1 0.808 0.012 . 2 . . . . 80 LEU HD2 . 7125 1 741 . 1 1 80 80 LEU HD22 H 1 0.808 0.012 . 2 . . . . 80 LEU HD2 . 7125 1 742 . 1 1 80 80 LEU HD23 H 1 0.808 0.012 . 2 . . . . 80 LEU HD2 . 7125 1 743 . 1 1 80 80 LEU CA C 13 53.965 0.109 . 1 . . . . 80 LEU CA . 7125 1 744 . 1 1 80 80 LEU CB C 13 41.544 0.000 . 1 . . . . 80 LEU CB . 7125 1 745 . 1 1 80 80 LEU CG C 13 27.811 0.079 . 1 . . . . 80 LEU CG . 7125 1 746 . 1 1 80 80 LEU CD1 C 13 22.948 0.106 . 2 . . . . 80 LEU CD1 . 7125 1 747 . 1 1 80 80 LEU CD2 C 13 26.517 0.092 . 2 . . . . 80 LEU CD2 . 7125 1 748 . 1 1 80 80 LEU N N 15 113.630 0.070 . 1 . . . . 80 LEU N . 7125 1 749 . 1 1 81 81 SER H H 1 7.102 0.009 . 1 . . . . 81 SER HN . 7125 1 750 . 1 1 81 81 SER HA H 1 4.027 0.018 . 1 . . . . 81 SER HA . 7125 1 751 . 1 1 81 81 SER HB2 H 1 3.961 0.000 . 2 . . . . 81 SER HB2 . 7125 1 752 . 1 1 81 81 SER CA C 13 62.705 0.131 . 1 . . . . 81 SER CA . 7125 1 753 . 1 1 81 81 SER CB C 13 62.777 0.000 . 1 . . . . 81 SER CB . 7125 1 754 . 1 1 81 81 SER N N 15 116.611 0.039 . 1 . . . . 81 SER N . 7125 1 755 . 1 1 82 82 ALA HA H 1 4.153 0.011 . 1 . . . . 82 ALA HA . 7125 1 756 . 1 1 82 82 ALA HB1 H 1 1.400 0.014 . 1 . . . . 82 ALA HB# . 7125 1 757 . 1 1 82 82 ALA HB2 H 1 1.400 0.014 . 1 . . . . 82 ALA HB# . 7125 1 758 . 1 1 82 82 ALA HB3 H 1 1.400 0.014 . 1 . . . . 82 ALA HB# . 7125 1 759 . 1 1 82 82 ALA CA C 13 55.212 0.047 . 1 . . . . 82 ALA CA . 7125 1 760 . 1 1 82 82 ALA CB C 13 18.004 0.071 . 1 . . . . 82 ALA CB . 7125 1 761 . 1 1 83 83 LEU H H 1 7.506 0.008 . 1 . . . . 83 LEU HN . 7125 1 762 . 1 1 83 83 LEU HA H 1 3.704 0.018 . 1 . . . . 83 LEU HA . 7125 1 763 . 1 1 83 83 LEU HB2 H 1 1.674 0.027 . 2 . . . . 83 LEU HB2 . 7125 1 764 . 1 1 83 83 LEU HB3 H 1 0.435 0.019 . 2 . . . . 83 LEU HB3 . 7125 1 765 . 1 1 83 83 LEU HG H 1 1.556 0.021 . 1 . . . . 83 LEU HG . 7125 1 766 . 1 1 83 83 LEU HD11 H 1 0.747 0.005 . 2 . . . . 83 LEU HD1 . 7125 1 767 . 1 1 83 83 LEU HD12 H 1 0.747 0.005 . 2 . . . . 83 LEU HD1 . 7125 1 768 . 1 1 83 83 LEU HD13 H 1 0.747 0.005 . 2 . . . . 83 LEU HD1 . 7125 1 769 . 1 1 83 83 LEU HD21 H 1 1.190 0.007 . 2 . . . . 83 LEU HD2 . 7125 1 770 . 1 1 83 83 LEU HD22 H 1 1.190 0.007 . 2 . . . . 83 LEU HD2 . 7125 1 771 . 1 1 83 83 LEU HD23 H 1 1.190 0.007 . 2 . . . . 83 LEU HD2 . 7125 1 772 . 1 1 83 83 LEU CA C 13 56.177 0.088 . 1 . . . . 83 LEU CA . 7125 1 773 . 1 1 83 83 LEU CB C 13 41.913 0.122 . 1 . . . . 83 LEU CB . 7125 1 774 . 1 1 83 83 LEU CG C 13 26.812 0.127 . 1 . . . . 83 LEU CG . 7125 1 775 . 1 1 83 83 LEU CD1 C 13 23.657 0.121 . 2 . . . . 83 LEU CD1 . 7125 1 776 . 1 1 83 83 LEU CD2 C 13 26.838 0.141 . 2 . . . . 83 LEU CD2 . 7125 1 777 . 1 1 83 83 LEU N N 15 117.731 0.043 . 1 . . . . 83 LEU N . 7125 1 778 . 1 1 84 84 SER H H 1 8.238 0.005 . 1 . . . . 84 SER HN . 7125 1 779 . 1 1 84 84 SER HA H 1 4.045 0.006 . 1 . . . . 84 SER HA . 7125 1 780 . 1 1 84 84 SER HB2 H 1 3.833 0.007 . 2 . . . . 84 SER HB2 . 7125 1 781 . 1 1 84 84 SER CA C 13 60.857 0.054 . 1 . . . . 84 SER CA . 7125 1 782 . 1 1 84 84 SER CB C 13 62.207 0.009 . 1 . . . . 84 SER CB . 7125 1 783 . 1 1 84 84 SER N N 15 121.307 0.068 . 1 . . . . 84 SER N . 7125 1 784 . 1 1 85 85 ASP H H 1 7.622 0.008 . 1 . . . . 85 ASP HN . 7125 1 785 . 1 1 85 85 ASP HA H 1 4.067 0.013 . 1 . . . . 85 ASP HA . 7125 1 786 . 1 1 85 85 ASP HB2 H 1 2.543 0.012 . 2 . . . . 85 ASP HB2 . 7125 1 787 . 1 1 85 85 ASP HB3 H 1 2.502 0.000 . 2 . . . . 85 ASP HB3 . 7125 1 788 . 1 1 85 85 ASP CA C 13 57.984 0.089 . 1 . . . . 85 ASP CA . 7125 1 789 . 1 1 85 85 ASP CB C 13 40.898 0.066 . 1 . . . . 85 ASP CB . 7125 1 790 . 1 1 85 85 ASP N N 15 121.403 0.040 . 1 . . . . 85 ASP N . 7125 1 791 . 1 1 86 86 LEU H H 1 7.072 0.006 . 1 . . . . 86 LEU HN . 7125 1 792 . 1 1 86 86 LEU HA H 1 3.721 0.014 . 1 . . . . 86 LEU HA . 7125 1 793 . 1 1 86 86 LEU HB2 H 1 1.282 0.000 . 2 . . . . 86 LEU HB2 . 7125 1 794 . 1 1 86 86 LEU HG H 1 -0.147 0.007 . 1 . . . . 86 LEU HG . 7125 1 795 . 1 1 86 86 LEU HD11 H 1 0.607 0.014 . 2 . . . . 86 LEU HD1 . 7125 1 796 . 1 1 86 86 LEU HD12 H 1 0.607 0.014 . 2 . . . . 86 LEU HD1 . 7125 1 797 . 1 1 86 86 LEU HD13 H 1 0.607 0.014 . 2 . . . . 86 LEU HD1 . 7125 1 798 . 1 1 86 86 LEU HD21 H 1 -0.040 0.006 . 2 . . . . 86 LEU HD2 . 7125 1 799 . 1 1 86 86 LEU HD22 H 1 -0.040 0.006 . 2 . . . . 86 LEU HD2 . 7125 1 800 . 1 1 86 86 LEU HD23 H 1 -0.040 0.006 . 2 . . . . 86 LEU HD2 . 7125 1 801 . 1 1 86 86 LEU CA C 13 57.826 0.088 . 1 . . . . 86 LEU CA . 7125 1 802 . 1 1 86 86 LEU CB C 13 42.197 0.000 . 1 . . . . 86 LEU CB . 7125 1 803 . 1 1 86 86 LEU CG C 13 26.367 0.016 . 1 . . . . 86 LEU CG . 7125 1 804 . 1 1 86 86 LEU CD1 C 13 23.050 0.058 . 2 . . . . 86 LEU CD1 . 7125 1 805 . 1 1 86 86 LEU CD2 C 13 27.227 0.056 . 2 . . . . 86 LEU CD2 . 7125 1 806 . 1 1 86 86 LEU N N 15 116.255 0.060 . 1 . . . . 86 LEU N . 7125 1 807 . 1 1 87 87 HIS H H 1 7.238 0.004 . 1 . . . . 87 HIS HN . 7125 1 808 . 1 1 87 87 HIS HB3 H 1 2.263 0.000 . 2 . . . . 87 HIS HB3 . 7125 1 809 . 1 1 87 87 HIS HD1 H 1 9.433 0.007 . 1 . . . . 87 HIS HD1 . 7125 1 810 . 1 1 87 87 HIS HD2 H 1 1.000 0.000 . 1 . . . . 87 HIS HD2 . 7125 1 811 . 1 1 87 87 HIS HE1 H 1 1.436 0.008 . 1 . . . . 87 HIS HE1 . 7125 1 812 . 1 1 87 87 HIS CA C 13 61.268 0.000 . 1 . . . . 87 HIS CA . 7125 1 813 . 1 1 87 87 HIS CB C 13 31.087 0.000 . 1 . . . . 87 HIS CB . 7125 1 814 . 1 1 87 87 HIS CD2 C 13 122.957 0.000 . 1 . . . . 87 HIS CD2 . 7125 1 815 . 1 1 87 87 HIS CE1 C 13 132.612 0.108 . 1 . . . . 87 HIS CE1 . 7125 1 816 . 1 1 87 87 HIS N N 15 112.288 0.085 . 1 . . . . 87 HIS N . 7125 1 817 . 1 1 87 87 HIS ND1 N 15 163.386 0.073 . 1 . . . . 87 HIS ND1 . 7125 1 818 . 1 1 87 87 HIS NE2 N 15 218.348 0.000 . 1 . . . . 87 HIS NE2 . 7125 1 819 . 1 1 88 88 ALA HA H 1 4.387 0.009 . 1 . . . . 88 ALA HA . 7125 1 820 . 1 1 88 88 ALA HB1 H 1 0.779 0.031 . 1 . . . . 88 ALA HB# . 7125 1 821 . 1 1 88 88 ALA HB2 H 1 0.779 0.031 . 1 . . . . 88 ALA HB# . 7125 1 822 . 1 1 88 88 ALA HB3 H 1 0.779 0.031 . 1 . . . . 88 ALA HB# . 7125 1 823 . 1 1 88 88 ALA CA C 13 53.506 0.073 . 1 . . . . 88 ALA CA . 7125 1 824 . 1 1 88 88 ALA CB C 13 19.243 0.101 . 1 . . . . 88 ALA CB . 7125 1 825 . 1 1 89 89 HIS H H 1 7.216 0.009 . 1 . . . . 89 HIS HN . 7125 1 826 . 1 1 89 89 HIS HA H 1 4.492 0.006 . 1 . . . . 89 HIS HA . 7125 1 827 . 1 1 89 89 HIS HB2 H 1 3.293 0.035 . 1 . . . . 89 HIS HB2 . 7125 1 828 . 1 1 89 89 HIS HB3 H 1 3.162 0.000 . 1 . . . . 89 HIS HB3 . 7125 1 829 . 1 1 89 89 HIS HD2 H 1 6.925 0.000 . 1 . . . . 89 HIS HD2 . 7125 1 830 . 1 1 89 89 HIS HE1 H 1 7.704 0.000 . 1 . . . . 89 HIS HE1 . 7125 1 831 . 1 1 89 89 HIS CA C 13 58.336 0.056 . 1 . . . . 89 HIS CA . 7125 1 832 . 1 1 89 89 HIS CB C 13 31.158 0.064 . 1 . . . . 89 HIS CB . 7125 1 833 . 1 1 89 89 HIS CD2 C 13 115.699 0.000 . 1 . . . . 89 HIS CD2 . 7125 1 834 . 1 1 89 89 HIS CE1 C 13 138.208 0.000 . 1 . . . . 89 HIS CE1 . 7125 1 835 . 1 1 89 89 HIS N N 15 114.928 0.019 . 1 . . . . 89 HIS N . 7125 1 836 . 1 1 90 90 LYS H H 1 7.430 0.008 . 1 . . . . 90 LYS HN . 7125 1 837 . 1 1 90 90 LYS HA H 1 4.110 0.006 . 1 . . . . 90 LYS HA . 7125 1 838 . 1 1 90 90 LYS HB2 H 1 1.940 0.008 . 2 . . . . 90 LYS HB2 . 7125 1 839 . 1 1 90 90 LYS HG2 H 1 1.337 0.002 . 2 . . . . 90 LYS HG2 . 7125 1 840 . 1 1 90 90 LYS HG3 H 1 1.195 0.002 . 1 . . . . 90 LYS HG3 . 7125 1 841 . 1 1 90 90 LYS HD2 H 1 1.513 0.003 . 2 . . . . 90 LYS HD2 . 7125 1 842 . 1 1 90 90 LYS HE2 H 1 2.865 0.005 . 2 . . . . 90 LYS HE2 . 7125 1 843 . 1 1 90 90 LYS CA C 13 59.003 0.052 . 1 . . . . 90 LYS CA . 7125 1 844 . 1 1 90 90 LYS CB C 13 32.434 0.063 . 1 . . . . 90 LYS CB . 7125 1 845 . 1 1 90 90 LYS CG C 13 25.366 0.031 . 1 . . . . 90 LYS CG . 7125 1 846 . 1 1 90 90 LYS CD C 13 29.103 0.024 . 1 . . . . 90 LYS CD . 7125 1 847 . 1 1 90 90 LYS CE C 13 42.243 0.066 . 1 . . . . 90 LYS CE . 7125 1 848 . 1 1 90 90 LYS N N 15 117.273 0.070 . 1 . . . . 90 LYS N . 7125 1 849 . 1 1 91 91 LEU HA H 1 4.105 0.009 . 1 . . . . 91 LEU HA . 7125 1 850 . 1 1 91 91 LEU HG H 1 1.089 0.009 . 1 . . . . 91 LEU HG . 7125 1 851 . 1 1 91 91 LEU HD11 H 1 0.942 0.005 . 2 . . . . 91 LEU HD1 . 7125 1 852 . 1 1 91 91 LEU HD12 H 1 0.942 0.005 . 2 . . . . 91 LEU HD1 . 7125 1 853 . 1 1 91 91 LEU HD13 H 1 0.942 0.005 . 2 . . . . 91 LEU HD1 . 7125 1 854 . 1 1 91 91 LEU HD21 H 1 -0.654 0.011 . 2 . . . . 91 LEU HD2 . 7125 1 855 . 1 1 91 91 LEU HD22 H 1 -0.654 0.011 . 2 . . . . 91 LEU HD2 . 7125 1 856 . 1 1 91 91 LEU HD23 H 1 -0.654 0.011 . 2 . . . . 91 LEU HD2 . 7125 1 857 . 1 1 91 91 LEU CA C 13 55.968 0.066 . 1 . . . . 91 LEU CA . 7125 1 858 . 1 1 91 91 LEU CG C 13 26.303 0.052 . 1 . . . . 91 LEU CG . 7125 1 859 . 1 1 91 91 LEU CD1 C 13 22.366 0.072 . 2 . . . . 91 LEU CD1 . 7125 1 860 . 1 1 91 91 LEU CD2 C 13 25.302 0.051 . 2 . . . . 91 LEU CD2 . 7125 1 861 . 1 1 92 92 ARG H H 1 6.488 0.010 . 1 . . . . 92 ARG HN . 7125 1 862 . 1 1 92 92 ARG HA H 1 3.884 0.027 . 1 . . . . 92 ARG HA . 7125 1 863 . 1 1 92 92 ARG HB2 H 1 1.356 0.000 . 2 . . . . 92 ARG HB2 . 7125 1 864 . 1 1 92 92 ARG HB3 H 1 1.720 0.000 . 2 . . . . 92 ARG HB3 . 7125 1 865 . 1 1 92 92 ARG HG2 H 1 0.283 0.000 . 2 . . . . 92 ARG HG2 . 7125 1 866 . 1 1 92 92 ARG HG3 H 1 0.974 0.000 . 2 . . . . 92 ARG HG3 . 7125 1 867 . 1 1 92 92 ARG HD2 H 1 3.068 0.000 . 2 . . . . 92 ARG HD2 . 7125 1 868 . 1 1 92 92 ARG CA C 13 57.342 0.065 . 1 . . . . 92 ARG CA . 7125 1 869 . 1 1 92 92 ARG CB C 13 27.795 0.024 . 1 . . . . 92 ARG CB . 7125 1 870 . 1 1 92 92 ARG CG C 13 21.836 0.021 . 1 . . . . 92 ARG CG . 7125 1 871 . 1 1 92 92 ARG CD C 13 44.535 0.000 . 1 . . . . 92 ARG CD . 7125 1 872 . 1 1 92 92 ARG N N 15 111.608 0.052 . 1 . . . . 92 ARG N . 7125 1 873 . 1 1 93 93 VAL H H 1 7.486 0.015 . 1 . . . . 93 VAL HN . 7125 1 874 . 1 1 93 93 VAL HA H 1 3.774 0.008 . 1 . . . . 93 VAL HA . 7125 1 875 . 1 1 93 93 VAL HB H 1 1.402 0.021 . 1 . . . . 93 VAL HB . 7125 1 876 . 1 1 93 93 VAL HG11 H 1 0.547 0.086 . 2 . . . . 93 VAL HG1# . 7125 1 877 . 1 1 93 93 VAL HG12 H 1 0.547 0.086 . 2 . . . . 93 VAL HG1# . 7125 1 878 . 1 1 93 93 VAL HG13 H 1 0.547 0.086 . 2 . . . . 93 VAL HG1# . 7125 1 879 . 1 1 93 93 VAL HG21 H 1 0.284 0.014 . 2 . . . . 93 VAL HG2# . 7125 1 880 . 1 1 93 93 VAL HG22 H 1 0.284 0.014 . 2 . . . . 93 VAL HG2# . 7125 1 881 . 1 1 93 93 VAL HG23 H 1 0.284 0.014 . 2 . . . . 93 VAL HG2# . 7125 1 882 . 1 1 93 93 VAL CA C 13 63.614 0.055 . 1 . . . . 93 VAL CA . 7125 1 883 . 1 1 93 93 VAL CB C 13 32.500 0.086 . 1 . . . . 93 VAL CB . 7125 1 884 . 1 1 93 93 VAL CG1 C 13 22.306 0.200 . 2 . . . . 93 VAL CG1 . 7125 1 885 . 1 1 93 93 VAL CG2 C 13 22.118 0.041 . 2 . . . . 93 VAL CG2 . 7125 1 886 . 1 1 93 93 VAL N N 15 115.834 0.050 . 1 . . . . 93 VAL N . 7125 1 887 . 1 1 94 94 ASP H H 1 7.674 0.022 . 1 . . . . 94 ASP HN . 7125 1 888 . 1 1 94 94 ASP N N 15 129.626 0.049 . 1 . . . . 94 ASP N . 7125 1 889 . 1 1 96 96 VAL H H 1 8.970 0.009 . 1 . . . . 96 VAL HN . 7125 1 890 . 1 1 96 96 VAL HA H 1 3.800 0.011 . 1 . . . . 96 VAL HA . 7125 1 891 . 1 1 96 96 VAL HB H 1 2.052 0.012 . 1 . . . . 96 VAL HB . 7125 1 892 . 1 1 96 96 VAL HG11 H 1 0.870 0.006 . 2 . . . . 96 VAL HG1# . 7125 1 893 . 1 1 96 96 VAL HG12 H 1 0.870 0.006 . 2 . . . . 96 VAL HG1# . 7125 1 894 . 1 1 96 96 VAL HG13 H 1 0.870 0.006 . 2 . . . . 96 VAL HG1# . 7125 1 895 . 1 1 96 96 VAL HG21 H 1 0.925 0.008 . 2 . . . . 96 VAL HG2# . 7125 1 896 . 1 1 96 96 VAL HG22 H 1 0.925 0.008 . 2 . . . . 96 VAL HG2# . 7125 1 897 . 1 1 96 96 VAL HG23 H 1 0.925 0.008 . 2 . . . . 96 VAL HG2# . 7125 1 898 . 1 1 96 96 VAL CA C 13 66.199 0.064 . 1 . . . . 96 VAL CA . 7125 1 899 . 1 1 96 96 VAL CB C 13 31.450 0.094 . 1 . . . . 96 VAL CB . 7125 1 900 . 1 1 96 96 VAL CG1 C 13 20.339 0.075 . 2 . . . . 96 VAL CG1 . 7125 1 901 . 1 1 96 96 VAL CG2 C 13 21.021 0.108 . 2 . . . . 96 VAL CG2 . 7125 1 902 . 1 1 96 96 VAL N N 15 120.185 0.071 . 1 . . . . 96 VAL N . 7125 1 903 . 1 1 97 97 ASN H H 1 8.343 0.008 . 1 . . . . 97 ASN HN . 7125 1 904 . 1 1 97 97 ASN HA H 1 4.442 0.024 . 1 . . . . 97 ASN HA . 7125 1 905 . 1 1 97 97 ASN HB2 H 1 2.536 0.000 . 2 . . . . 97 ASN HB2 . 7125 1 906 . 1 1 97 97 ASN CA C 13 56.937 0.059 . 1 . . . . 97 ASN CA . 7125 1 907 . 1 1 97 97 ASN CB C 13 40.380 0.000 . 1 . . . . 97 ASN CB . 7125 1 908 . 1 1 97 97 ASN N N 15 116.564 0.071 . 1 . . . . 97 ASN N . 7125 1 909 . 1 1 98 98 PHE H H 1 7.900 0.008 . 1 . . . . 98 PHE HN . 7125 1 910 . 1 1 98 98 PHE HA H 1 4.486 0.004 . 1 . . . . 98 PHE HA . 7125 1 911 . 1 1 98 98 PHE HB2 H 1 3.248 0.000 . 2 . . . . 98 PHE HB2 . 7125 1 912 . 1 1 98 98 PHE HD1 H 1 7.523 0.006 . 3 . . . . 98 PHE HD1 . 7125 1 913 . 1 1 98 98 PHE HE1 H 1 6.287 0.007 . 3 . . . . 98 PHE HE1 . 7125 1 914 . 1 1 98 98 PHE CA C 13 63.087 0.028 . 1 . . . . 98 PHE CA . 7125 1 915 . 1 1 98 98 PHE CB C 13 37.034 0.000 . 1 . . . . 98 PHE CB . 7125 1 916 . 1 1 98 98 PHE CD1 C 13 131.314 0.200 . 3 . . . . 98 PHE CD1 . 7125 1 917 . 1 1 98 98 PHE CD2 C 13 131.002 0.000 . 1 . . . . 98 PHE CD2 . 7125 1 918 . 1 1 98 98 PHE CE1 C 13 132.781 0.036 . 3 . . . . 98 PHE CE1 . 7125 1 919 . 1 1 98 98 PHE N N 15 118.456 0.082 . 1 . . . . 98 PHE N . 7125 1 920 . 1 1 99 99 LYS H H 1 7.475 0.020 . 1 . . . . 99 LYS HN . 7125 1 921 . 1 1 99 99 LYS HA H 1 4.366 0.016 . 1 . . . . 99 LYS HA . 7125 1 922 . 1 1 99 99 LYS HB2 H 1 2.059 0.075 . 2 . . . . 99 LYS HB2 . 7125 1 923 . 1 1 99 99 LYS HB3 H 1 1.930 0.020 . 2 . . . . 99 LYS HB3 . 7125 1 924 . 1 1 99 99 LYS HG2 H 1 1.595 0.025 . 2 . . . . 99 LYS HG2 . 7125 1 925 . 1 1 99 99 LYS HD2 H 1 1.726 0.008 . 2 . . . . 99 LYS HD2 . 7125 1 926 . 1 1 99 99 LYS HE2 H 1 2.989 0.015 . 2 . . . . 99 LYS HE2 . 7125 1 927 . 1 1 99 99 LYS CA C 13 59.661 0.051 . 1 . . . . 99 LYS CA . 7125 1 928 . 1 1 99 99 LYS CB C 13 32.067 0.145 . 1 . . . . 99 LYS CB . 7125 1 929 . 1 1 99 99 LYS CG C 13 25.825 0.016 . 1 . . . . 99 LYS CG . 7125 1 930 . 1 1 99 99 LYS CD C 13 29.839 0.024 . 1 . . . . 99 LYS CD . 7125 1 931 . 1 1 99 99 LYS CE C 13 42.173 0.054 . 1 . . . . 99 LYS CE . 7125 1 932 . 1 1 99 99 LYS N N 15 121.173 0.080 . 1 . . . . 99 LYS N . 7125 1 933 . 1 1 100 100 LEU H H 1 7.359 0.005 . 1 . . . . 100 LEU HN . 7125 1 934 . 1 1 100 100 LEU HA H 1 3.868 0.028 . 1 . . . . 100 LEU HA . 7125 1 935 . 1 1 100 100 LEU HB2 H 1 1.814 0.000 . 2 . . . . 100 LEU HB2 . 7125 1 936 . 1 1 100 100 LEU HG H 1 1.807 0.014 . 1 . . . . 100 LEU HG . 7125 1 937 . 1 1 100 100 LEU HD11 H 1 0.678 0.010 . 2 . . . . 100 LEU HD1 . 7125 1 938 . 1 1 100 100 LEU HD12 H 1 0.678 0.010 . 2 . . . . 100 LEU HD1 . 7125 1 939 . 1 1 100 100 LEU HD13 H 1 0.678 0.010 . 2 . . . . 100 LEU HD1 . 7125 1 940 . 1 1 100 100 LEU HD21 H 1 -0.187 0.018 . 2 . . . . 100 LEU HD2 . 7125 1 941 . 1 1 100 100 LEU HD22 H 1 -0.187 0.018 . 2 . . . . 100 LEU HD2 . 7125 1 942 . 1 1 100 100 LEU HD23 H 1 -0.187 0.018 . 2 . . . . 100 LEU HD2 . 7125 1 943 . 1 1 100 100 LEU CA C 13 57.841 0.071 . 1 . . . . 100 LEU CA . 7125 1 944 . 1 1 100 100 LEU CB C 13 43.204 0.000 . 1 . . . . 100 LEU CB . 7125 1 945 . 1 1 100 100 LEU CG C 13 25.280 0.101 . 1 . . . . 100 LEU CG . 7125 1 946 . 1 1 100 100 LEU CD1 C 13 24.765 0.078 . 1 . . . . 100 LEU CD1 . 7125 1 947 . 1 1 100 100 LEU CD2 C 13 19.500 0.090 . 1 . . . . 100 LEU CD2 . 7125 1 948 . 1 1 100 100 LEU N N 15 119.418 0.053 . 1 . . . . 100 LEU N . 7125 1 949 . 1 1 101 101 LEU H H 1 8.197 0.008 . 1 . . . . 101 LEU HN . 7125 1 950 . 1 1 101 101 LEU HA H 1 3.995 0.016 . 1 . . . . 101 LEU HA . 7125 1 951 . 1 1 101 101 LEU HB2 H 1 1.736 0.000 . 2 . . . . 101 LEU HB1 . 7125 1 952 . 1 1 101 101 LEU HB3 H 1 1.953 0.000 . 2 . . . . 101 LEU HB3 . 7125 1 953 . 1 1 101 101 LEU HG H 1 1.411 0.025 . 1 . . . . 101 LEU HG . 7125 1 954 . 1 1 101 101 LEU HD11 H 1 0.218 0.008 . 2 . . . . 101 LEU HD1 . 7125 1 955 . 1 1 101 101 LEU HD12 H 1 0.218 0.008 . 2 . . . . 101 LEU HD1 . 7125 1 956 . 1 1 101 101 LEU HD13 H 1 0.218 0.008 . 2 . . . . 101 LEU HD1 . 7125 1 957 . 1 1 101 101 LEU HD21 H 1 0.358 0.010 . 2 . . . . 101 LEU HD2 . 7125 1 958 . 1 1 101 101 LEU HD22 H 1 0.358 0.010 . 2 . . . . 101 LEU HD2 . 7125 1 959 . 1 1 101 101 LEU HD23 H 1 0.358 0.010 . 2 . . . . 101 LEU HD2 . 7125 1 960 . 1 1 101 101 LEU CA C 13 58.935 0.084 . 1 . . . . 101 LEU CA . 7125 1 961 . 1 1 101 101 LEU CB C 13 41.489 0.313 . 1 . . . . 101 LEU CB . 7125 1 962 . 1 1 101 101 LEU CG C 13 28.151 0.044 . 1 . . . . 101 LEU CG . 7125 1 963 . 1 1 101 101 LEU CD1 C 13 26.420 0.111 . 2 . . . . 101 LEU CD1 . 7125 1 964 . 1 1 101 101 LEU CD2 C 13 22.764 0.120 . 2 . . . . 101 LEU CD2 . 7125 1 965 . 1 1 101 101 LEU N N 15 120.829 0.087 . 1 . . . . 101 LEU N . 7125 1 966 . 1 1 102 102 SER H H 1 8.379 0.005 . 1 . . . . 102 SER HN . 7125 1 967 . 1 1 102 102 SER HA H 1 4.171 0.038 . 1 . . . . 102 SER HA . 7125 1 968 . 1 1 102 102 SER HB2 H 1 4.188 0.000 . 1 . . . . 102 SER HB2 . 7125 1 969 . 1 1 102 102 SER CA C 13 63.694 0.654 . 1 . . . . 102 SER CA . 7125 1 970 . 1 1 102 102 SER CB C 13 63.853 0.000 . 1 . . . . 102 SER CB . 7125 1 971 . 1 1 102 102 SER N N 15 114.839 0.083 . 1 . . . . 102 SER N . 7125 1 972 . 1 1 103 103 HIS H H 1 7.806 0.008 . 1 . . . . 103 HIS HN . 7125 1 973 . 1 1 103 103 HIS HA H 1 4.551 0.010 . 1 . . . . 103 HIS HA . 7125 1 974 . 1 1 103 103 HIS HB2 H 1 3.331 0.029 . 2 . . . . 103 HIS HB2 . 7125 1 975 . 1 1 103 103 HIS HD2 H 1 6.725 0.005 . 1 . . . . 103 HIS HD2 . 7125 1 976 . 1 1 103 103 HIS HE1 H 1 8.130 0.010 . 1 . . . . 103 HIS HE1 . 7125 1 977 . 1 1 103 103 HIS HE2 H 1 12.080 0.009 . 1 . . . . 103 HIS HE2 . 7125 1 978 . 1 1 103 103 HIS CA C 13 60.095 0.044 . 1 . . . . 103 HIS CA . 7125 1 979 . 1 1 103 103 HIS CB C 13 31.279 0.076 . 1 . . . . 103 HIS CB . 7125 1 980 . 1 1 103 103 HIS CD2 C 13 115.747 0.032 . 1 . . . . 103 HIS CD2 . 7125 1 981 . 1 1 103 103 HIS CE1 C 13 139.214 0.038 . 1 . . . . 103 HIS CE1 . 7125 1 982 . 1 1 103 103 HIS N N 15 119.663 0.096 . 1 . . . . 103 HIS N . 7125 1 983 . 1 1 103 103 HIS NE2 N 15 163.856 0.000 . 1 . . . . 103 HIS NE2 . 7125 1 984 . 1 1 104 104 CYS H H 1 7.882 0.006 . 1 . . . . 104 CYS HN . 7125 1 985 . 1 1 104 104 CYS HA H 1 3.764 0.023 . 1 . . . . 104 CYS HA . 7125 1 986 . 1 1 104 104 CYS CA C 13 66.052 0.155 . 1 . . . . 104 CYS CA . 7125 1 987 . 1 1 104 104 CYS N N 15 114.982 0.078 . 1 . . . . 104 CYS N . 7125 1 988 . 1 1 105 105 LEU H H 1 8.904 0.009 . 1 . . . . 105 LEU HN . 7125 1 989 . 1 1 105 105 LEU HA H 1 3.964 0.011 . 1 . . . . 105 LEU HA . 7125 1 990 . 1 1 105 105 LEU HB2 H 1 1.613 0.003 . 2 . . . . 105 LEU HB2 . 7125 1 991 . 1 1 105 105 LEU HB3 H 1 1.864 0.021 . 2 . . . . 105 LEU HB3 . 7125 1 992 . 1 1 105 105 LEU HG H 1 1.517 0.016 . 1 . . . . 105 LEU HG . 7125 1 993 . 1 1 105 105 LEU HD11 H 1 0.849 0.014 . 2 . . . . 105 LEU HD1 . 7125 1 994 . 1 1 105 105 LEU HD12 H 1 0.849 0.014 . 2 . . . . 105 LEU HD1 . 7125 1 995 . 1 1 105 105 LEU HD13 H 1 0.849 0.014 . 2 . . . . 105 LEU HD1 . 7125 1 996 . 1 1 105 105 LEU HD21 H 1 0.872 0.001 . 2 . . . . 105 LEU HD2 . 7125 1 997 . 1 1 105 105 LEU HD22 H 1 0.872 0.001 . 2 . . . . 105 LEU HD2 . 7125 1 998 . 1 1 105 105 LEU HD23 H 1 0.872 0.001 . 2 . . . . 105 LEU HD2 . 7125 1 999 . 1 1 105 105 LEU CA C 13 58.822 0.175 . 1 . . . . 105 LEU CA . 7125 1 1000 . 1 1 105 105 LEU CB C 13 42.013 0.096 . 1 . . . . 105 LEU CB . 7125 1 1001 . 1 1 105 105 LEU CG C 13 27.922 0.083 . 1 . . . . 105 LEU CG . 7125 1 1002 . 1 1 105 105 LEU CD1 C 13 24.998 0.127 . 2 . . . . 105 LEU CD1 . 7125 1 1003 . 1 1 105 105 LEU CD2 C 13 25.208 0.029 . 2 . . . . 105 LEU CD2 . 7125 1 1004 . 1 1 105 105 LEU N N 15 125.054 0.039 . 1 . . . . 105 LEU N . 7125 1 1005 . 1 1 106 106 LEU HA H 1 3.926 0.088 . 1 . . . . 106 LEU HA . 7125 1 1006 . 1 1 106 106 LEU HD11 H 1 0.972 0.000 . 2 . . . . 106 LEU HD1 . 7125 1 1007 . 1 1 106 106 LEU HD12 H 1 0.972 0.000 . 2 . . . . 106 LEU HD1 . 7125 1 1008 . 1 1 106 106 LEU HD13 H 1 0.972 0.000 . 2 . . . . 106 LEU HD1 . 7125 1 1009 . 1 1 106 106 LEU HD21 H 1 1.273 0.000 . 2 . . . . 106 LEU HD2 . 7125 1 1010 . 1 1 106 106 LEU HD22 H 1 1.273 0.000 . 2 . . . . 106 LEU HD2 . 7125 1 1011 . 1 1 106 106 LEU HD23 H 1 1.273 0.000 . 2 . . . . 106 LEU HD2 . 7125 1 1012 . 1 1 106 106 LEU CA C 13 59.277 0.184 . 1 . . . . 106 LEU CA . 7125 1 1013 . 1 1 106 106 LEU CD1 C 13 24.598 0.049 . 2 . . . . 106 LEU CD1 . 7125 1 1014 . 1 1 106 106 LEU CD2 C 13 27.218 0.000 . 2 . . . . 106 LEU CD2 . 7125 1 1015 . 1 1 107 107 VAL H H 1 8.224 0.007 . 1 . . . . 107 VAL HN . 7125 1 1016 . 1 1 107 107 VAL HA H 1 2.939 0.008 . 1 . . . . 107 VAL HA . 7125 1 1017 . 1 1 107 107 VAL HB H 1 1.700 0.020 . 1 . . . . 107 VAL HB . 7125 1 1018 . 1 1 107 107 VAL HG11 H 1 0.675 0.007 . 2 . . . . 107 VAL HG1# . 7125 1 1019 . 1 1 107 107 VAL HG12 H 1 0.675 0.007 . 2 . . . . 107 VAL HG1# . 7125 1 1020 . 1 1 107 107 VAL HG13 H 1 0.675 0.007 . 2 . . . . 107 VAL HG1# . 7125 1 1021 . 1 1 107 107 VAL HG21 H 1 0.518 0.010 . 2 . . . . 107 VAL HG2# . 7125 1 1022 . 1 1 107 107 VAL HG22 H 1 0.518 0.010 . 2 . . . . 107 VAL HG2# . 7125 1 1023 . 1 1 107 107 VAL HG23 H 1 0.518 0.010 . 2 . . . . 107 VAL HG2# . 7125 1 1024 . 1 1 107 107 VAL CA C 13 67.153 0.124 . 1 . . . . 107 VAL CA . 7125 1 1025 . 1 1 107 107 VAL CB C 13 32.279 0.151 . 1 . . . . 107 VAL CB . 7125 1 1026 . 1 1 107 107 VAL CG1 C 13 21.380 0.099 . 2 . . . . 107 VAL CG1 . 7125 1 1027 . 1 1 107 107 VAL CG2 C 13 25.542 0.078 . 2 . . . . 107 VAL CG2 . 7125 1 1028 . 1 1 107 107 VAL N N 15 117.605 0.028 . 1 . . . . 107 VAL N . 7125 1 1029 . 1 1 108 108 THR H H 1 7.164 0.004 . 1 . . . . 108 THR HN . 7125 1 1030 . 1 1 108 108 THR HA H 1 3.433 0.011 . 1 . . . . 108 THR HA . 7125 1 1031 . 1 1 108 108 THR HB H 1 4.235 0.018 . 1 . . . . 108 THR HB . 7125 1 1032 . 1 1 108 108 THR HG21 H 1 1.066 0.014 . 1 . . . . 108 THR HG2# . 7125 1 1033 . 1 1 108 108 THR HG22 H 1 1.066 0.014 . 1 . . . . 108 THR HG2# . 7125 1 1034 . 1 1 108 108 THR HG23 H 1 1.066 0.014 . 1 . . . . 108 THR HG2# . 7125 1 1035 . 1 1 108 108 THR CA C 13 68.102 0.083 . 1 . . . . 108 THR CA . 7125 1 1036 . 1 1 108 108 THR CB C 13 68.941 0.109 . 1 . . . . 108 THR CB . 7125 1 1037 . 1 1 108 108 THR CG2 C 13 20.532 0.124 . 1 . . . . 108 THR CG2 . 7125 1 1038 . 1 1 108 108 THR N N 15 114.891 0.059 . 1 . . . . 108 THR N . 7125 1 1039 . 1 1 109 109 LEU H H 1 8.028 0.005 . 1 . . . . 109 LEU HN . 7125 1 1040 . 1 1 109 109 LEU HA H 1 3.476 0.005 . 1 . . . . 109 LEU HA . 7125 1 1041 . 1 1 109 109 LEU HB2 H 1 1.664 0.005 . 2 . . . . 109 LEU HB2 . 7125 1 1042 . 1 1 109 109 LEU HB3 H 1 1.043 0.000 . 2 . . . . 109 LEU HB3 . 7125 1 1043 . 1 1 109 109 LEU HG H 1 1.844 0.007 . 1 . . . . 109 LEU HG . 7125 1 1044 . 1 1 109 109 LEU HD11 H 1 0.932 0.007 . 2 . . . . 109 LEU HD1 . 7125 1 1045 . 1 1 109 109 LEU HD12 H 1 0.932 0.007 . 2 . . . . 109 LEU HD1 . 7125 1 1046 . 1 1 109 109 LEU HD13 H 1 0.932 0.007 . 2 . . . . 109 LEU HD1 . 7125 1 1047 . 1 1 109 109 LEU HD21 H 1 0.678 0.008 . 2 . . . . 109 LEU HD2 . 7125 1 1048 . 1 1 109 109 LEU HD22 H 1 0.678 0.008 . 2 . . . . 109 LEU HD2 . 7125 1 1049 . 1 1 109 109 LEU HD23 H 1 0.678 0.008 . 2 . . . . 109 LEU HD2 . 7125 1 1050 . 1 1 109 109 LEU CA C 13 58.794 0.127 . 1 . . . . 109 LEU CA . 7125 1 1051 . 1 1 109 109 LEU CB C 13 41.315 0.056 . 1 . . . . 109 LEU CB . 7125 1 1052 . 1 1 109 109 LEU CG C 13 27.595 0.102 . 1 . . . . 109 LEU CG . 7125 1 1053 . 1 1 109 109 LEU CD1 C 13 25.989 0.071 . 2 . . . . 109 LEU CD1 . 7125 1 1054 . 1 1 109 109 LEU CD2 C 13 23.644 0.117 . 2 . . . . 109 LEU CD2 . 7125 1 1055 . 1 1 109 109 LEU N N 15 120.418 0.048 . 1 . . . . 109 LEU N . 7125 1 1056 . 1 1 110 110 ALA H H 1 7.878 0.005 . 1 . . . . 110 ALA HN . 7125 1 1057 . 1 1 110 110 ALA HA H 1 2.748 0.017 . 1 . . . . 110 ALA HA . 7125 1 1058 . 1 1 110 110 ALA HB1 H 1 0.360 0.009 . 1 . . . . 110 ALA HB# . 7125 1 1059 . 1 1 110 110 ALA HB2 H 1 0.360 0.009 . 1 . . . . 110 ALA HB# . 7125 1 1060 . 1 1 110 110 ALA HB3 H 1 0.360 0.009 . 1 . . . . 110 ALA HB# . 7125 1 1061 . 1 1 110 110 ALA CA C 13 55.455 0.117 . 1 . . . . 110 ALA CA . 7125 1 1062 . 1 1 110 110 ALA CB C 13 18.381 0.100 . 1 . . . . 110 ALA CB . 7125 1 1063 . 1 1 110 110 ALA N N 15 121.784 0.071 . 1 . . . . 110 ALA N . 7125 1 1064 . 1 1 111 111 ALA H H 1 7.423 0.006 . 1 . . . . 111 ALA HN . 7125 1 1065 . 1 1 111 111 ALA HA H 1 3.959 0.017 . 1 . . . . 111 ALA HA . 7125 1 1066 . 1 1 111 111 ALA HB1 H 1 0.955 0.006 . 1 . . . . 111 ALA HB# . 7125 1 1067 . 1 1 111 111 ALA HB2 H 1 0.955 0.006 . 1 . . . . 111 ALA HB# . 7125 1 1068 . 1 1 111 111 ALA HB3 H 1 0.955 0.006 . 1 . . . . 111 ALA HB# . 7125 1 1069 . 1 1 111 111 ALA CA C 13 53.483 0.070 . 1 . . . . 111 ALA CA . 7125 1 1070 . 1 1 111 111 ALA CB C 13 18.091 0.092 . 1 . . . . 111 ALA CB . 7125 1 1071 . 1 1 111 111 ALA N N 15 113.280 0.060 . 1 . . . . 111 ALA N . 7125 1 1072 . 1 1 112 112 HIS H H 1 7.230 0.005 . 1 . . . . 112 HIS HN . 7125 1 1073 . 1 1 112 112 HIS HA H 1 4.310 0.005 . 1 . . . . 112 HIS HA . 7125 1 1074 . 1 1 112 112 HIS HB2 H 1 3.108 0.003 . 1 . . . . 112 HIS HB2 . 7125 1 1075 . 1 1 112 112 HIS HD2 H 1 7.153 0.000 . 1 . . . . 112 HIS HD2 . 7125 1 1076 . 1 1 112 112 HIS HE1 H 1 8.252 0.001 . 1 . . . . 112 HIS HE1 . 7125 1 1077 . 1 1 112 112 HIS CA C 13 57.409 0.056 . 1 . . . . 112 HIS CA . 7125 1 1078 . 1 1 112 112 HIS CB C 13 31.152 0.000 . 1 . . . . 112 HIS CB . 7125 1 1079 . 1 1 112 112 HIS CD2 C 13 121.245 0.000 . 1 . . . . 112 HIS CD2 . 7125 1 1080 . 1 1 112 112 HIS CE1 C 13 136.449 0.000 . 1 . . . . 112 HIS CE1 . 7125 1 1081 . 1 1 112 112 HIS N N 15 112.348 0.078 . 1 . . . . 112 HIS N . 7125 1 1082 . 1 1 113 113 LEU H H 1 8.246 0.004 . 1 . . . . 113 LEU HN . 7125 1 1083 . 1 1 113 113 LEU HA H 1 4.965 0.024 . 1 . . . . 113 LEU HA . 7125 1 1084 . 1 1 113 113 LEU HB2 H 1 1.713 0.000 . 2 . . . . 113 LEU HB2 . 7125 1 1085 . 1 1 113 113 LEU HB3 H 1 1.674 0.000 . 2 . . . . 113 LEU HB3 . 7125 1 1086 . 1 1 113 113 LEU HG H 1 1.503 0.009 . 1 . . . . 113 LEU HG . 7125 1 1087 . 1 1 113 113 LEU HD11 H 1 0.770 0.012 . 2 . . . . 113 LEU HD1 . 7125 1 1088 . 1 1 113 113 LEU HD12 H 1 0.770 0.012 . 2 . . . . 113 LEU HD1 . 7125 1 1089 . 1 1 113 113 LEU HD13 H 1 0.770 0.012 . 2 . . . . 113 LEU HD1 . 7125 1 1090 . 1 1 113 113 LEU HD21 H 1 0.846 0.009 . 2 . . . . 113 LEU HD2 . 7125 1 1091 . 1 1 113 113 LEU HD22 H 1 0.846 0.009 . 2 . . . . 113 LEU HD2 . 7125 1 1092 . 1 1 113 113 LEU HD23 H 1 0.846 0.009 . 2 . . . . 113 LEU HD2 . 7125 1 1093 . 1 1 113 113 LEU CA C 13 52.595 0.061 . 1 . . . . 113 LEU CA . 7125 1 1094 . 1 1 113 113 LEU CB C 13 42.233 0.223 . 1 . . . . 113 LEU CB . 7125 1 1095 . 1 1 113 113 LEU CG C 13 26.620 0.018 . 1 . . . . 113 LEU CG . 7125 1 1096 . 1 1 113 113 LEU CD1 C 13 27.339 0.085 . 2 . . . . 113 LEU CD1 . 7125 1 1097 . 1 1 113 113 LEU CD2 C 13 24.590 0.071 . 2 . . . . 113 LEU CD2 . 7125 1 1098 . 1 1 113 113 LEU N N 15 121.163 0.073 . 1 . . . . 113 LEU N . 7125 1 1099 . 1 1 114 114 PRO HG2 H 1 1.944 0.000 . 2 . . . . 114 PRO HG2 . 7125 1 1100 . 1 1 114 114 PRO HD2 H 1 3.604 0.011 . 2 . . . . 114 PRO HD2 . 7125 1 1101 . 1 1 114 114 PRO HD3 H 1 2.981 0.027 . 2 . . . . 114 PRO HD3 . 7125 1 1102 . 1 1 114 114 PRO CA C 13 65.922 0.000 . 1 . . . . 114 PRO CA . 7125 1 1103 . 1 1 114 114 PRO CG C 13 27.593 0.000 . 1 . . . . 114 PRO CG . 7125 1 1104 . 1 1 114 114 PRO CD C 13 50.501 0.138 . 1 . . . . 114 PRO CD . 7125 1 1105 . 1 1 115 115 ALA H H 1 8.308 0.005 . 1 . . . . 115 ALA HN . 7125 1 1106 . 1 1 115 115 ALA HA H 1 4.084 0.012 . 1 . . . . 115 ALA HA . 7125 1 1107 . 1 1 115 115 ALA HB1 H 1 1.325 0.009 . 1 . . . . 115 ALA HB# . 7125 1 1108 . 1 1 115 115 ALA HB2 H 1 1.325 0.009 . 1 . . . . 115 ALA HB# . 7125 1 1109 . 1 1 115 115 ALA HB3 H 1 1.325 0.009 . 1 . . . . 115 ALA HB# . 7125 1 1110 . 1 1 115 115 ALA CA C 13 54.555 0.100 . 1 . . . . 115 ALA CA . 7125 1 1111 . 1 1 115 115 ALA CB C 13 18.511 0.090 . 1 . . . . 115 ALA CB . 7125 1 1112 . 1 1 115 115 ALA N N 15 118.796 0.034 . 1 . . . . 115 ALA N . 7125 1 1113 . 1 1 116 116 GLU H H 1 7.739 0.010 . 1 . . . . 116 GLU HN . 7125 1 1114 . 1 1 116 116 GLU HA H 1 4.327 0.012 . 1 . . . . 116 GLU HA . 7125 1 1115 . 1 1 116 116 GLU HB2 H 1 2.090 0.016 . 1 . . . . 116 GLU HB2 . 7125 1 1116 . 1 1 116 116 GLU HG2 H 1 2.244 0.057 . 1 . . . . 116 GLU HG2 . 7125 1 1117 . 1 1 116 116 GLU HG3 H 1 2.193 0.002 . 1 . . . . 116 GLU HG3 . 7125 1 1118 . 1 1 116 116 GLU CA C 13 56.830 0.054 . 1 . . . . 116 GLU CA . 7125 1 1119 . 1 1 116 116 GLU CB C 13 29.402 0.155 . 1 . . . . 116 GLU CB . 7125 1 1120 . 1 1 116 116 GLU CG C 13 37.116 0.108 . 1 . . . . 116 GLU CG . 7125 1 1121 . 1 1 116 116 GLU N N 15 113.865 0.062 . 1 . . . . 116 GLU N . 7125 1 1122 . 1 1 117 117 PHE H H 1 7.630 0.005 . 1 . . . . 117 PHE HN . 7125 1 1123 . 1 1 117 117 PHE HA H 1 4.276 0.013 . 1 . . . . 117 PHE HA . 7125 1 1124 . 1 1 117 117 PHE HB2 H 1 2.564 0.000 . 2 . . . . 117 PHE HB2 . 7125 1 1125 . 1 1 117 117 PHE HB3 H 1 3.109 0.000 . 2 . . . . 117 PHE HB3 . 7125 1 1126 . 1 1 117 117 PHE HD1 H 1 6.623 0.021 . 3 . . . . 117 PHE HD1 . 7125 1 1127 . 1 1 117 117 PHE HD2 H 1 7.724 0.000 . 3 . . . . 117 PHE HD2 . 7125 1 1128 . 1 1 117 117 PHE HE1 H 1 7.743 0.000 . 3 . . . . 117 PHE HE1 . 7125 1 1129 . 1 1 117 117 PHE CA C 13 57.775 0.094 . 1 . . . . 117 PHE CA . 7125 1 1130 . 1 1 117 117 PHE CB C 13 37.936 0.005 . 1 . . . . 117 PHE CB . 7125 1 1131 . 1 1 117 117 PHE CD1 C 13 131.844 0.019 . 3 . . . . 117 PHE CD1 . 7125 1 1132 . 1 1 117 117 PHE N N 15 122.853 0.067 . 1 . . . . 117 PHE N . 7125 1 1133 . 1 1 118 118 THR H H 1 7.885 0.006 . 1 . . . . 118 THR HN . 7125 1 1134 . 1 1 118 118 THR HA H 1 4.498 0.013 . 1 . . . . 118 THR HA . 7125 1 1135 . 1 1 118 118 THR HB H 1 4.603 0.009 . 1 . . . . 118 THR HB . 7125 1 1136 . 1 1 118 118 THR HG21 H 1 1.184 0.007 . 1 . . . . 118 THR HG2# . 7125 1 1137 . 1 1 118 118 THR HG22 H 1 1.184 0.007 . 1 . . . . 118 THR HG2# . 7125 1 1138 . 1 1 118 118 THR HG23 H 1 1.184 0.007 . 1 . . . . 118 THR HG2# . 7125 1 1139 . 1 1 118 118 THR CA C 13 60.521 0.108 . 1 . . . . 118 THR CA . 7125 1 1140 . 1 1 118 118 THR CB C 13 67.661 0.180 . 1 . . . . 118 THR CB . 7125 1 1141 . 1 1 118 118 THR CG2 C 13 22.426 0.072 . 1 . . . . 118 THR CG2 . 7125 1 1142 . 1 1 118 118 THR N N 15 114.809 0.035 . 1 . . . . 118 THR N . 7125 1 1143 . 1 1 119 119 PRO HA H 1 3.827 0.009 . 1 . . . . 119 PRO HA . 7125 1 1144 . 1 1 119 119 PRO CA C 13 66.734 0.149 . 1 . . . . 119 PRO CA . 7125 1 1145 . 1 1 120 120 ALA H H 1 8.360 0.011 . 1 . . . . 120 ALA HN . 7125 1 1146 . 1 1 120 120 ALA HA H 1 3.808 0.016 . 1 . . . . 120 ALA HA . 7125 1 1147 . 1 1 120 120 ALA HB1 H 1 1.248 0.006 . 1 . . . . 120 ALA HB# . 7125 1 1148 . 1 1 120 120 ALA HB2 H 1 1.248 0.006 . 1 . . . . 120 ALA HB# . 7125 1 1149 . 1 1 120 120 ALA HB3 H 1 1.248 0.006 . 1 . . . . 120 ALA HB# . 7125 1 1150 . 1 1 120 120 ALA CA C 13 54.983 0.100 . 1 . . . . 120 ALA CA . 7125 1 1151 . 1 1 120 120 ALA CB C 13 18.927 0.104 . 1 . . . . 120 ALA CB . 7125 1 1152 . 1 1 120 120 ALA N N 15 116.163 0.053 . 1 . . . . 120 ALA N . 7125 1 1153 . 1 1 121 121 VAL H H 1 7.280 0.011 . 1 . . . . 121 VAL HN . 7125 1 1154 . 1 1 121 121 VAL HA H 1 3.311 0.005 . 1 . . . . 121 VAL HA . 7125 1 1155 . 1 1 121 121 VAL HB H 1 2.048 0.034 . 1 . . . . 121 VAL HB . 7125 1 1156 . 1 1 121 121 VAL HG11 H 1 0.923 0.009 . 2 . . . . 121 VAL HG1# . 7125 1 1157 . 1 1 121 121 VAL HG12 H 1 0.923 0.009 . 2 . . . . 121 VAL HG1# . 7125 1 1158 . 1 1 121 121 VAL HG13 H 1 0.923 0.009 . 2 . . . . 121 VAL HG1# . 7125 1 1159 . 1 1 121 121 VAL HG21 H 1 0.854 0.007 . 2 . . . . 121 VAL HG2# . 7125 1 1160 . 1 1 121 121 VAL HG22 H 1 0.854 0.007 . 2 . . . . 121 VAL HG2# . 7125 1 1161 . 1 1 121 121 VAL HG23 H 1 0.854 0.007 . 2 . . . . 121 VAL HG2# . 7125 1 1162 . 1 1 121 121 VAL CA C 13 67.472 0.079 . 1 . . . . 121 VAL CA . 7125 1 1163 . 1 1 121 121 VAL CB C 13 32.079 0.083 . 1 . . . . 121 VAL CB . 7125 1 1164 . 1 1 121 121 VAL CG1 C 13 24.214 0.111 . 2 . . . . 121 VAL CG1 . 7125 1 1165 . 1 1 121 121 VAL CG2 C 13 21.618 0.129 . 2 . . . . 121 VAL CG2 . 7125 1 1166 . 1 1 121 121 VAL N N 15 119.866 0.056 . 1 . . . . 121 VAL N . 7125 1 1167 . 1 1 122 122 HIS H H 1 8.428 0.004 . 1 . . . . 122 HIS HN . 7125 1 1168 . 1 1 122 122 HIS HA H 1 3.667 0.023 . 1 . . . . 122 HIS HA . 7125 1 1169 . 1 1 122 122 HIS HB2 H 1 2.403 0.000 . 2 . . . . 122 HIS HB2 . 7125 1 1170 . 1 1 122 122 HIS HD2 H 1 6.935 0.000 . 1 . . . . 122 HIS HD2 . 7125 1 1171 . 1 1 122 122 HIS HE1 H 1 7.278 0.006 . 1 . . . . 122 HIS HE1 . 7125 1 1172 . 1 1 122 122 HIS CA C 13 57.845 0.026 . 1 . . . . 122 HIS CA . 7125 1 1173 . 1 1 122 122 HIS CE1 C 13 137.908 0.000 . 1 . . . . 122 HIS CE1 . 7125 1 1174 . 1 1 122 122 HIS N N 15 121.647 0.094 . 1 . . . . 122 HIS N . 7125 1 1175 . 1 1 123 123 ALA H H 1 7.971 0.005 . 1 . . . . 123 ALA HN . 7125 1 1176 . 1 1 123 123 ALA HA H 1 3.834 0.013 . 1 . . . . 123 ALA HA . 7125 1 1177 . 1 1 123 123 ALA HB1 H 1 1.331 0.013 . 1 . . . . 123 ALA HB# . 7125 1 1178 . 1 1 123 123 ALA HB2 H 1 1.331 0.013 . 1 . . . . 123 ALA HB# . 7125 1 1179 . 1 1 123 123 ALA HB3 H 1 1.331 0.013 . 1 . . . . 123 ALA HB# . 7125 1 1180 . 1 1 123 123 ALA CA C 13 55.996 0.087 . 1 . . . . 123 ALA CA . 7125 1 1181 . 1 1 123 123 ALA CB C 13 18.302 0.057 . 1 . . . . 123 ALA CB . 7125 1 1182 . 1 1 123 123 ALA N N 15 120.213 0.048 . 1 . . . . 123 ALA N . 7125 1 1183 . 1 1 124 124 SER H H 1 8.103 0.011 . 1 . . . . 124 SER HN . 7125 1 1184 . 1 1 124 124 SER HA H 1 4.195 0.000 . 1 . . . . 124 SER HA . 7125 1 1185 . 1 1 124 124 SER HB2 H 1 3.329 0.002 . 1 . . . . 124 SER HB2 . 7125 1 1186 . 1 1 124 124 SER CA C 13 63.236 0.021 . 1 . . . . 124 SER CA . 7125 1 1187 . 1 1 124 124 SER CB C 13 67.264 0.026 . 1 . . . . 124 SER CB . 7125 1 1188 . 1 1 124 124 SER N N 15 115.409 0.048 . 1 . . . . 124 SER N . 7125 1 1189 . 1 1 125 125 LEU H H 1 9.150 0.007 . 1 . . . . 125 LEU HN . 7125 1 1190 . 1 1 125 125 LEU HA H 1 4.186 0.005 . 1 . . . . 125 LEU HA . 7125 1 1191 . 1 1 125 125 LEU HB3 H 1 1.898 0.375 . 2 . . . . 125 LEU HB3 . 7125 1 1192 . 1 1 125 125 LEU HG H 1 1.817 0.008 . 1 . . . . 125 LEU HG . 7125 1 1193 . 1 1 125 125 LEU HD11 H 1 0.967 0.009 . 2 . . . . 125 LEU HD1 . 7125 1 1194 . 1 1 125 125 LEU HD12 H 1 0.967 0.009 . 2 . . . . 125 LEU HD1 . 7125 1 1195 . 1 1 125 125 LEU HD13 H 1 0.967 0.009 . 2 . . . . 125 LEU HD1 . 7125 1 1196 . 1 1 125 125 LEU HD21 H 1 0.889 0.007 . 2 . . . . 125 LEU HD2 . 7125 1 1197 . 1 1 125 125 LEU HD22 H 1 0.889 0.007 . 2 . . . . 125 LEU HD2 . 7125 1 1198 . 1 1 125 125 LEU HD23 H 1 0.889 0.007 . 2 . . . . 125 LEU HD2 . 7125 1 1199 . 1 1 125 125 LEU CA C 13 58.366 0.036 . 1 . . . . 125 LEU CA . 7125 1 1200 . 1 1 125 125 LEU CB C 13 43.134 0.063 . 1 . . . . 125 LEU CB . 7125 1 1201 . 1 1 125 125 LEU CG C 13 27.382 0.075 . 1 . . . . 125 LEU CG . 7125 1 1202 . 1 1 125 125 LEU CD1 C 13 23.113 0.159 . 2 . . . . 125 LEU CD1 . 7125 1 1203 . 1 1 125 125 LEU CD2 C 13 27.008 0.088 . 2 . . . . 125 LEU CD2 . 7125 1 1204 . 1 1 125 125 LEU N N 15 121.332 0.062 . 1 . . . . 125 LEU N . 7125 1 1205 . 1 1 126 126 ASP H H 1 8.648 0.012 . 1 . . . . 126 ASP HN . 7125 1 1206 . 1 1 126 126 ASP HA H 1 4.510 0.006 . 1 . . . . 126 ASP HA . 7125 1 1207 . 1 1 126 126 ASP HB2 H 1 2.663 0.012 . 2 . . . . 126 ASP HB2 . 7125 1 1208 . 1 1 126 126 ASP HB3 H 1 2.841 0.000 . 2 . . . . 126 ASP HB3 . 7125 1 1209 . 1 1 126 126 ASP CA C 13 59.102 0.117 . 1 . . . . 126 ASP CA . 7125 1 1210 . 1 1 126 126 ASP CB C 13 43.415 0.000 . 1 . . . . 126 ASP CB . 7125 1 1211 . 1 1 126 126 ASP N N 15 120.637 0.042 . 1 . . . . 126 ASP N . 7125 1 1212 . 1 1 127 127 LYS H H 1 7.955 0.009 . 1 . . . . 127 LYS HN . 7125 1 1213 . 1 1 127 127 LYS HA H 1 4.140 0.019 . 1 . . . . 127 LYS HA . 7125 1 1214 . 1 1 127 127 LYS HB2 H 1 1.914 0.021 . 2 . . . . 127 LYS HB2 . 7125 1 1215 . 1 1 127 127 LYS HG2 H 1 1.971 0.016 . 2 . . . . 127 LYS HG2 . 7125 1 1216 . 1 1 127 127 LYS HG3 H 1 1.536 0.001 . 2 . . . . 127 LYS HG3 . 7125 1 1217 . 1 1 127 127 LYS HD2 H 1 0.871 0.006 . 2 . . . . 127 LYS HD2 . 7125 1 1218 . 1 1 127 127 LYS HE2 H 1 3.015 0.009 . 2 . . . . 127 LYS HE2 . 7125 1 1219 . 1 1 127 127 LYS CA C 13 59.974 0.080 . 1 . . . . 127 LYS CA . 7125 1 1220 . 1 1 127 127 LYS CB C 13 32.748 0.035 . 1 . . . . 127 LYS CB . 7125 1 1221 . 1 1 127 127 LYS CG C 13 25.449 0.128 . 1 . . . . 127 LYS CG . 7125 1 1222 . 1 1 127 127 LYS CD C 13 24.296 0.038 . 1 . . . . 127 LYS CD . 7125 1 1223 . 1 1 127 127 LYS CE C 13 42.570 0.037 . 1 . . . . 127 LYS CE . 7125 1 1224 . 1 1 127 127 LYS N N 15 118.245 0.051 . 1 . . . . 127 LYS N . 7125 1 1225 . 1 1 128 128 PHE H H 1 8.892 0.007 . 1 . . . . 128 PHE HN . 7125 1 1226 . 1 1 128 128 PHE HA H 1 4.235 0.021 . 1 . . . . 128 PHE HA . 7125 1 1227 . 1 1 128 128 PHE HB2 H 1 3.332 0.000 . 2 . . . . 128 PHE HB2 . 7125 1 1228 . 1 1 128 128 PHE HD1 H 1 6.971 0.007 . 3 . . . . 128 PHE HD1 . 7125 1 1229 . 1 1 128 128 PHE HE1 H 1 6.339 0.000 . 3 . . . . 128 PHE HE1 . 7125 1 1230 . 1 1 128 128 PHE CA C 13 61.584 0.110 . 1 . . . . 128 PHE CA . 7125 1 1231 . 1 1 128 128 PHE CB C 13 40.415 0.000 . 1 . . . . 128 PHE CB . 7125 1 1232 . 1 1 128 128 PHE CD1 C 13 131.326 0.054 . 1 . . . . 128 PHE CD1 . 7125 1 1233 . 1 1 128 128 PHE N N 15 122.132 0.030 . 1 . . . . 128 PHE N . 7125 1 1234 . 1 1 129 129 LEU H H 1 8.983 0.007 . 1 . . . . 129 LEU HN . 7125 1 1235 . 1 1 129 129 LEU HA H 1 3.762 0.014 . 1 . . . . 129 LEU HA . 7125 1 1236 . 1 1 129 129 LEU HG H 1 2.162 0.006 . 1 . . . . 129 LEU HG . 7125 1 1237 . 1 1 129 129 LEU HD11 H 1 0.933 0.017 . 2 . . . . 129 LEU HD1 . 7125 1 1238 . 1 1 129 129 LEU HD12 H 1 0.933 0.017 . 2 . . . . 129 LEU HD1 . 7125 1 1239 . 1 1 129 129 LEU HD13 H 1 0.933 0.017 . 2 . . . . 129 LEU HD1 . 7125 1 1240 . 1 1 129 129 LEU HD21 H 1 1.154 0.015 . 2 . . . . 129 LEU HD2 . 7125 1 1241 . 1 1 129 129 LEU HD22 H 1 1.154 0.015 . 2 . . . . 129 LEU HD2 . 7125 1 1242 . 1 1 129 129 LEU HD23 H 1 1.154 0.015 . 2 . . . . 129 LEU HD2 . 7125 1 1243 . 1 1 129 129 LEU CA C 13 58.328 0.116 . 1 . . . . 129 LEU CA . 7125 1 1244 . 1 1 129 129 LEU CG C 13 28.249 0.125 . 1 . . . . 129 LEU CG . 7125 1 1245 . 1 1 129 129 LEU CD1 C 13 22.994 0.103 . 2 . . . . 129 LEU CD1 . 7125 1 1246 . 1 1 129 129 LEU CD2 C 13 26.852 0.124 . 2 . . . . 129 LEU CD2 . 7125 1 1247 . 1 1 129 129 LEU N N 15 120.943 0.079 . 1 . . . . 129 LEU N . 7125 1 1248 . 1 1 130 130 ALA H H 1 8.558 0.017 . 1 . . . . 130 ALA HN . 7125 1 1249 . 1 1 130 130 ALA HA H 1 4.279 0.029 . 1 . . . . 130 ALA HA . 7125 1 1250 . 1 1 130 130 ALA HB1 H 1 1.618 0.009 . 1 . . . . 130 ALA HB# . 7125 1 1251 . 1 1 130 130 ALA HB2 H 1 1.618 0.009 . 1 . . . . 130 ALA HB# . 7125 1 1252 . 1 1 130 130 ALA HB3 H 1 1.618 0.009 . 1 . . . . 130 ALA HB# . 7125 1 1253 . 1 1 130 130 ALA CA C 13 55.652 0.086 . 1 . . . . 130 ALA CA . 7125 1 1254 . 1 1 130 130 ALA CB C 13 17.946 0.087 . 1 . . . . 130 ALA CB . 7125 1 1255 . 1 1 130 130 ALA N N 15 125.565 0.053 . 1 . . . . 130 ALA N . 7125 1 1256 . 1 1 131 131 SER H H 1 8.194 0.002 . 1 . . . . 131 SER HN . 7125 1 1257 . 1 1 131 131 SER HA H 1 4.124 0.017 . 1 . . . . 131 SER HA . 7125 1 1258 . 1 1 131 131 SER HB2 H 1 4.085 0.010 . 1 . . . . 131 SER HB2 . 7125 1 1259 . 1 1 131 131 SER HB3 H 1 3.868 0.023 . 1 . . . . 131 SER HB3 . 7125 1 1260 . 1 1 131 131 SER CA C 13 62.989 0.102 . 1 . . . . 131 SER CA . 7125 1 1261 . 1 1 131 131 SER CB C 13 62.899 0.232 . 1 . . . . 131 SER CB . 7125 1 1262 . 1 1 131 131 SER N N 15 118.251 0.072 . 1 . . . . 131 SER N . 7125 1 1263 . 1 1 132 132 VAL H H 1 8.224 0.005 . 1 . . . . 132 VAL HN . 7125 1 1264 . 1 1 132 132 VAL HA H 1 3.230 0.005 . 1 . . . . 132 VAL HA . 7125 1 1265 . 1 1 132 132 VAL HB H 1 1.944 0.006 . 1 . . . . 132 VAL HB . 7125 1 1266 . 1 1 132 132 VAL HG11 H 1 0.351 0.005 . 2 . . . . 132 VAL HG1# . 7125 1 1267 . 1 1 132 132 VAL HG12 H 1 0.351 0.005 . 2 . . . . 132 VAL HG1# . 7125 1 1268 . 1 1 132 132 VAL HG13 H 1 0.351 0.005 . 2 . . . . 132 VAL HG1# . 7125 1 1269 . 1 1 132 132 VAL HG21 H 1 0.847 0.007 . 2 . . . . 132 VAL HG2# . 7125 1 1270 . 1 1 132 132 VAL HG22 H 1 0.847 0.007 . 2 . . . . 132 VAL HG2# . 7125 1 1271 . 1 1 132 132 VAL HG23 H 1 0.847 0.007 . 2 . . . . 132 VAL HG2# . 7125 1 1272 . 1 1 132 132 VAL CA C 13 66.975 0.105 . 1 . . . . 132 VAL CA . 7125 1 1273 . 1 1 132 132 VAL CB C 13 32.309 0.073 . 1 . . . . 132 VAL CB . 7125 1 1274 . 1 1 132 132 VAL CG1 C 13 23.265 0.089 . 2 . . . . 132 VAL CG1 . 7125 1 1275 . 1 1 132 132 VAL CG2 C 13 22.183 0.079 . 2 . . . . 132 VAL CG2 . 7125 1 1276 . 1 1 132 132 VAL N N 15 122.863 0.093 . 1 . . . . 132 VAL N . 7125 1 1277 . 1 1 133 133 SER H H 1 8.200 0.009 . 1 . . . . 133 SER HN . 7125 1 1278 . 1 1 133 133 SER HA H 1 3.602 0.008 . 1 . . . . 133 SER HA . 7125 1 1279 . 1 1 133 133 SER CA C 13 63.368 0.063 . 1 . . . . 133 SER CA . 7125 1 1280 . 1 1 133 133 SER N N 15 115.171 0.115 . 1 . . . . 133 SER N . 7125 1 1281 . 1 1 134 134 THR H H 1 8.108 0.013 . 1 . . . . 134 THR HN . 7125 1 1282 . 1 1 134 134 THR HA H 1 3.484 0.021 . 1 . . . . 134 THR HA . 7125 1 1283 . 1 1 134 134 THR HB H 1 4.173 0.006 . 1 . . . . 134 THR HB . 7125 1 1284 . 1 1 134 134 THR HG21 H 1 1.046 0.009 . 1 . . . . 134 THR HG2# . 7125 1 1285 . 1 1 134 134 THR HG22 H 1 1.046 0.009 . 1 . . . . 134 THR HG2# . 7125 1 1286 . 1 1 134 134 THR HG23 H 1 1.046 0.009 . 1 . . . . 134 THR HG2# . 7125 1 1287 . 1 1 134 134 THR CA C 13 66.851 0.031 . 1 . . . . 134 THR CA . 7125 1 1288 . 1 1 134 134 THR CB C 13 68.701 0.036 . 1 . . . . 134 THR CB . 7125 1 1289 . 1 1 134 134 THR CG2 C 13 21.747 0.052 . 1 . . . . 134 THR CG2 . 7125 1 1290 . 1 1 134 134 THR N N 15 119.594 0.070 . 1 . . . . 134 THR N . 7125 1 1291 . 1 1 135 135 VAL H H 1 7.432 0.012 . 1 . . . . 135 VAL HN . 7125 1 1292 . 1 1 135 135 VAL HA H 1 3.379 0.012 . 1 . . . . 135 VAL HA . 7125 1 1293 . 1 1 135 135 VAL HB H 1 2.014 0.006 . 1 . . . . 135 VAL HB . 7125 1 1294 . 1 1 135 135 VAL HG11 H 1 0.753 0.000 . 2 . . . . 135 VAL HG1# . 7125 1 1295 . 1 1 135 135 VAL HG12 H 1 0.753 0.000 . 2 . . . . 135 VAL HG1# . 7125 1 1296 . 1 1 135 135 VAL HG13 H 1 0.753 0.000 . 2 . . . . 135 VAL HG1# . 7125 1 1297 . 1 1 135 135 VAL HG21 H 1 0.786 0.006 . 2 . . . . 135 VAL HG2# . 7125 1 1298 . 1 1 135 135 VAL HG22 H 1 0.786 0.006 . 2 . . . . 135 VAL HG2# . 7125 1 1299 . 1 1 135 135 VAL HG23 H 1 0.786 0.006 . 2 . . . . 135 VAL HG2# . 7125 1 1300 . 1 1 135 135 VAL CA C 13 67.138 0.079 . 1 . . . . 135 VAL CA . 7125 1 1301 . 1 1 135 135 VAL CB C 13 31.099 0.050 . 1 . . . . 135 VAL CB . 7125 1 1302 . 1 1 135 135 VAL CG1 C 13 24.208 0.000 . 2 . . . . 135 VAL CG1 . 7125 1 1303 . 1 1 135 135 VAL CG2 C 13 23.453 0.129 . 2 . . . . 135 VAL CG2 . 7125 1 1304 . 1 1 135 135 VAL N N 15 122.485 0.050 . 1 . . . . 135 VAL N . 7125 1 1305 . 1 1 136 136 LEU H H 1 7.681 0.001 . 1 . . . . 136 LEU HN . 7125 1 1306 . 1 1 136 136 LEU HD11 H 1 0.011 0.006 . 2 . . . . 136 LEU HD1 . 7125 1 1307 . 1 1 136 136 LEU HD12 H 1 0.011 0.006 . 2 . . . . 136 LEU HD1 . 7125 1 1308 . 1 1 136 136 LEU HD13 H 1 0.011 0.006 . 2 . . . . 136 LEU HD1 . 7125 1 1309 . 1 1 136 136 LEU HD21 H 1 -0.542 0.010 . 2 . . . . 136 LEU HD2 . 7125 1 1310 . 1 1 136 136 LEU HD22 H 1 -0.542 0.010 . 2 . . . . 136 LEU HD2 . 7125 1 1311 . 1 1 136 136 LEU HD23 H 1 -0.542 0.010 . 2 . . . . 136 LEU HD2 . 7125 1 1312 . 1 1 136 136 LEU CD1 C 13 25.329 0.029 . 2 . . . . 136 LEU CD1 . 7125 1 1313 . 1 1 136 136 LEU CD2 C 13 23.749 0.117 . 2 . . . . 136 LEU CD2 . 7125 1 1314 . 1 1 136 136 LEU N N 15 109.527 0.077 . 1 . . . . 136 LEU N . 7125 1 1315 . 1 1 137 137 THR H H 1 6.703 0.020 . 1 . . . . 137 THR HN . 7125 1 1316 . 1 1 137 137 THR HA H 1 3.951 0.020 . 1 . . . . 137 THR HA . 7125 1 1317 . 1 1 137 137 THR HB H 1 4.228 0.000 . 1 . . . . 137 THR HB . 7125 1 1318 . 1 1 137 137 THR HG21 H 1 0.357 0.010 . 1 . . . . 137 THR HG2# . 7125 1 1319 . 1 1 137 137 THR HG22 H 1 0.357 0.010 . 1 . . . . 137 THR HG2# . 7125 1 1320 . 1 1 137 137 THR HG23 H 1 0.357 0.010 . 1 . . . . 137 THR HG2# . 7125 1 1321 . 1 1 137 137 THR CA C 13 60.520 0.147 . 1 . . . . 137 THR CA . 7125 1 1322 . 1 1 137 137 THR CB C 13 69.917 0.000 . 1 . . . . 137 THR CB . 7125 1 1323 . 1 1 137 137 THR CG2 C 13 22.835 0.057 . 1 . . . . 137 THR CG2 . 7125 1 1324 . 1 1 137 137 THR N N 15 101.553 0.222 . 1 . . . . 137 THR N . 7125 1 1325 . 1 1 138 138 SER H H 1 7.182 0.011 . 1 . . . . 138 SER HN . 7125 1 1326 . 1 1 138 138 SER HA H 1 4.500 0.018 . 1 . . . . 138 SER HA . 7125 1 1327 . 1 1 138 138 SER HB2 H 1 3.905 0.000 . 2 . . . . 138 SER HB2 . 7125 1 1328 . 1 1 138 138 SER CA C 13 59.305 0.024 . 1 . . . . 138 SER CA . 7125 1 1329 . 1 1 138 138 SER CB C 13 65.125 0.000 . 1 . . . . 138 SER CB . 7125 1 1330 . 1 1 138 138 SER N N 15 117.966 0.041 . 1 . . . . 138 SER N . 7125 1 1331 . 1 1 141 141 ARG H H 1 7.341 0.033 . 1 . . . . 141 ARG HN . 7125 1 1332 . 1 1 141 141 ARG HA H 1 4.140 0.011 . 1 . . . . 141 ARG HA . 7125 1 1333 . 1 1 141 141 ARG HB2 H 1 1.728 0.048 . 2 . . . . 141 ARG HB2 . 7125 1 1334 . 1 1 141 141 ARG HB3 H 1 1.595 0.009 . 2 . . . . 141 ARG HB3 . 7125 1 1335 . 1 1 141 141 ARG HG2 H 1 1.424 0.006 . 2 . . . . 141 ARG HG2 . 7125 1 1336 . 1 1 141 141 ARG HD2 H 1 3.046 0.016 . 2 . . . . 141 ARG HD2 . 7125 1 1337 . 1 1 141 141 ARG CA C 13 57.644 0.062 . 1 . . . . 141 ARG CA . 7125 1 1338 . 1 1 141 141 ARG CB C 13 32.002 0.077 . 1 . . . . 141 ARG CB . 7125 1 1339 . 1 1 141 141 ARG CG C 13 27.298 0.064 . 1 . . . . 141 ARG CG . 7125 1 1340 . 1 1 141 141 ARG CD C 13 43.784 0.055 . 1 . . . . 141 ARG CD . 7125 1 1341 . 1 1 141 141 ARG N N 15 125.253 0.122 . 1 . . . . 141 ARG N . 7125 1 1342 . 3 2 1 1 VAL HG11 H 1 0.986 0.000 . 2 . . . . 1 VAL HG1 . 7125 1 1343 . 3 2 1 1 VAL HG12 H 1 0.986 0.000 . 2 . . . . 1 VAL HG1 . 7125 1 1344 . 3 2 1 1 VAL HG13 H 1 0.986 0.000 . 2 . . . . 1 VAL HG1 . 7125 1 1345 . 3 2 1 1 VAL HG21 H 1 0.863 0.000 . 2 . . . . 1 VAL HG2 . 7125 1 1346 . 3 2 1 1 VAL HG22 H 1 0.863 0.000 . 2 . . . . 1 VAL HG2 . 7125 1 1347 . 3 2 1 1 VAL HG23 H 1 0.863 0.000 . 2 . . . . 1 VAL HG2 . 7125 1 1348 . 3 2 1 1 VAL CG1 C 13 21.730 0.000 . 2 . . . . 1 VAL CG1 . 7125 1 1349 . 3 2 1 1 VAL CG2 C 13 21.506 0.000 . 2 . . . . 1 VAL CG2 . 7125 1 1350 . 3 2 2 2 HIS HA H 1 4.723 0.000 . 1 . . . . 2 HIS HA . 7125 1 1351 . 3 2 2 2 HIS HB2 H 1 3.005 0.000 . 2 . . . . 2 HIS HB2 . 7125 1 1352 . 3 2 2 2 HIS HB3 H 1 2.979 0.000 . 2 . . . . 2 HIS HB3 . 7125 1 1353 . 3 2 2 2 HIS HE1 H 1 8.034 0.000 . 1 . . . . 2 HIS HE1 . 7125 1 1354 . 3 2 2 2 HIS CA C 13 55.795 0.000 . 1 . . . . 2 HIS CA . 7125 1 1355 . 3 2 2 2 HIS CB C 13 31.044 0.000 . 1 . . . . 2 HIS CB . 7125 1 1356 . 3 2 2 2 HIS CE1 C 13 137.545 0.000 . 1 . . . . 2 HIS CE1 . 7125 1 1357 . 3 2 3 3 LEU H H 1 8.138 0.011 . 1 . . . . 3 LEU HN . 7125 1 1358 . 3 2 3 3 LEU HA H 1 4.736 0.013 . 1 . . . . 3 LEU HA . 7125 1 1359 . 3 2 3 3 LEU HB2 H 1 1.454 0.013 . 2 . . . . 3 LEU HB2 . 7125 1 1360 . 3 2 3 3 LEU HG H 1 1.509 0.000 . 1 . . . . 3 LEU HG . 7125 1 1361 . 3 2 3 3 LEU HD11 H 1 0.585 0.005 . 2 . . . . 3 LEU HD1 . 7125 1 1362 . 3 2 3 3 LEU HD12 H 1 0.585 0.005 . 2 . . . . 3 LEU HD1 . 7125 1 1363 . 3 2 3 3 LEU HD13 H 1 0.585 0.005 . 2 . . . . 3 LEU HD1 . 7125 1 1364 . 3 2 3 3 LEU HD21 H 1 0.718 0.018 . 2 . . . . 3 LEU HD2 . 7125 1 1365 . 3 2 3 3 LEU HD22 H 1 0.718 0.018 . 2 . . . . 3 LEU HD2 . 7125 1 1366 . 3 2 3 3 LEU HD23 H 1 0.718 0.018 . 2 . . . . 3 LEU HD2 . 7125 1 1367 . 3 2 3 3 LEU CA C 13 53.504 0.000 . 1 . . . . 3 LEU CA . 7125 1 1368 . 3 2 3 3 LEU CB C 13 44.072 0.023 . 1 . . . . 3 LEU CB . 7125 1 1369 . 3 2 3 3 LEU CG C 13 27.728 0.000 . 1 . . . . 3 LEU CG . 7125 1 1370 . 3 2 3 3 LEU CD1 C 13 26.049 0.102 . 2 . . . . 3 LEU CD1 . 7125 1 1371 . 3 2 3 3 LEU CD2 C 13 24.153 0.099 . 2 . . . . 3 LEU CD2 . 7125 1 1372 . 3 2 3 3 LEU N N 15 126.048 0.066 . 1 . . . . 3 LEU N . 7125 1 1373 . 3 2 4 4 THR H H 1 9.219 0.012 . 1 . . . . 4 THR HN . 7125 1 1374 . 3 2 4 4 THR HA H 1 4.480 0.000 . 1 . . . . 4 THR HA . 7125 1 1375 . 3 2 4 4 THR HB H 1 4.736 0.000 . 1 . . . . 4 THR HB . 7125 1 1376 . 3 2 4 4 THR HG21 H 1 1.328 0.012 . 1 . . . . 4 THR HG2# . 7125 1 1377 . 3 2 4 4 THR HG22 H 1 1.328 0.012 . 1 . . . . 4 THR HG2# . 7125 1 1378 . 3 2 4 4 THR HG23 H 1 1.328 0.012 . 1 . . . . 4 THR HG2# . 7125 1 1379 . 3 2 4 4 THR CA C 13 60.800 0.000 . 1 . . . . 4 THR CA . 7125 1 1380 . 3 2 4 4 THR CB C 13 67.838 0.000 . 1 . . . . 4 THR CB . 7125 1 1381 . 3 2 4 4 THR CG2 C 13 22.007 0.022 . 1 . . . . 4 THR CG2 . 7125 1 1382 . 3 2 4 4 THR N N 15 115.319 0.038 . 1 . . . . 4 THR N . 7125 1 1383 . 3 2 5 5 PRO HA H 1 4.147 0.018 . 1 . . . . 5 PRO HA . 7125 1 1384 . 3 2 5 5 PRO HB2 H 1 2.413 0.000 . 2 . . . . 5 PRO HB2 . 7125 1 1385 . 3 2 5 5 PRO HB3 H 1 1.858 0.000 . 2 . . . . 5 PRO HB3 . 7125 1 1386 . 3 2 5 5 PRO HD2 H 1 3.910 0.000 . 2 . . . . 5 PRO HD2 . 7125 1 1387 . 3 2 5 5 PRO CA C 13 66.420 0.086 . 1 . . . . 5 PRO CA . 7125 1 1388 . 3 2 5 5 PRO CB C 13 31.667 0.026 . 1 . . . . 5 PRO CB . 7125 1 1389 . 3 2 5 5 PRO CD C 13 50.109 0.000 . 1 . . . . 5 PRO CD . 7125 1 1390 . 3 2 6 6 GLU H H 1 8.719 0.010 . 1 . . . . 6 GLU HN . 7125 1 1391 . 3 2 6 6 GLU HA H 1 4.009 0.012 . 1 . . . . 6 GLU HA . 7125 1 1392 . 3 2 6 6 GLU HB2 H 1 1.935 0.003 . 2 . . . . 6 GLU HB2 . 7125 1 1393 . 3 2 6 6 GLU HB3 H 1 1.858 0.000 . 2 . . . . 6 GLU HB3 . 7125 1 1394 . 3 2 6 6 GLU HG2 H 1 2.366 0.000 . 2 . . . . 6 GLU HG2 . 7125 1 1395 . 3 2 6 6 GLU HG3 H 1 2.234 0.021 . 2 . . . . 6 GLU HG3 . 7125 1 1396 . 3 2 6 6 GLU CA C 13 60.212 0.076 . 1 . . . . 6 GLU CA . 7125 1 1397 . 3 2 6 6 GLU CB C 13 28.934 0.025 . 1 . . . . 6 GLU CB . 7125 1 1398 . 3 2 6 6 GLU CG C 13 36.919 0.093 . 1 . . . . 6 GLU CG . 7125 1 1399 . 3 2 6 6 GLU N N 15 117.569 0.057 . 1 . . . . 6 GLU N . 7125 1 1400 . 3 2 7 7 GLU H H 1 7.769 0.011 . 1 . . . . 7 GLU HN . 7125 1 1401 . 3 2 7 7 GLU HA H 1 3.855 0.021 . 1 . . . . 7 GLU HA . 7125 1 1402 . 3 2 7 7 GLU HB2 H 1 2.437 0.009 . 2 . . . . 7 GLU HB2 . 7125 1 1403 . 3 2 7 7 GLU HB3 H 1 1.652 0.000 . 2 . . . . 7 GLU HB3 . 7125 1 1404 . 3 2 7 7 GLU HG2 H 1 2.033 0.000 . 2 . . . . 7 GLU HG2 . 7125 1 1405 . 3 2 7 7 GLU CA C 13 59.209 0.074 . 1 . . . . 7 GLU CA . 7125 1 1406 . 3 2 7 7 GLU CB C 13 31.662 0.097 . 1 . . . . 7 GLU CB . 7125 1 1407 . 3 2 7 7 GLU CG C 13 37.584 0.000 . 1 . . . . 7 GLU CG . 7125 1 1408 . 3 2 7 7 GLU N N 15 121.612 0.095 . 1 . . . . 7 GLU N . 7125 1 1409 . 3 2 8 8 LYS H H 1 8.798 0.007 . 1 . . . . 8 LYS HN . 7125 1 1410 . 3 2 8 8 LYS HA H 1 3.587 0.017 . 1 . . . . 8 LYS HA . 7125 1 1411 . 3 2 8 8 LYS HB2 H 1 1.821 0.004 . 2 . . . . 8 LYS HB2 . 7125 1 1412 . 3 2 8 8 LYS HG2 H 1 1.276 0.002 . 2 . . . . 8 LYS HG2 . 7125 1 1413 . 3 2 8 8 LYS HD2 H 1 1.566 0.020 . 2 . . . . 8 LYS HD2 . 7125 1 1414 . 3 2 8 8 LYS HE2 H 1 2.867 0.000 . 2 . . . . 8 LYS HE2 . 7125 1 1415 . 3 2 8 8 LYS CA C 13 60.299 0.083 . 1 . . . . 8 LYS CA . 7125 1 1416 . 3 2 8 8 LYS CB C 13 32.169 0.033 . 1 . . . . 8 LYS CB . 7125 1 1417 . 3 2 8 8 LYS CG C 13 25.876 0.009 . 1 . . . . 8 LYS CG . 7125 1 1418 . 3 2 8 8 LYS CD C 13 29.504 0.005 . 1 . . . . 8 LYS CD . 7125 1 1419 . 3 2 8 8 LYS CE C 13 42.092 0.000 . 1 . . . . 8 LYS CE . 7125 1 1420 . 3 2 8 8 LYS N N 15 119.141 0.039 . 1 . . . . 8 LYS N . 7125 1 1421 . 3 2 9 9 SER H H 1 8.186 0.006 . 1 . . . . 9 SER HN . 7125 1 1422 . 3 2 9 9 SER HA H 1 4.105 0.006 . 1 . . . . 9 SER HA . 7125 1 1423 . 3 2 9 9 SER HB2 H 1 3.907 0.006 . 2 . . . . 9 SER HB2 . 7125 1 1424 . 3 2 9 9 SER CA C 13 61.599 0.142 . 1 . . . . 9 SER CA . 7125 1 1425 . 3 2 9 9 SER CB C 13 62.734 0.086 . 1 . . . . 9 SER CB . 7125 1 1426 . 3 2 9 9 SER N N 15 115.088 0.058 . 1 . . . . 9 SER N . 7125 1 1427 . 3 2 10 10 ALA H H 1 7.651 0.006 . 1 . . . . 10 ALA HN . 7125 1 1428 . 3 2 10 10 ALA HA H 1 4.168 0.005 . 1 . . . . 10 ALA HA . 7125 1 1429 . 3 2 10 10 ALA HB1 H 1 1.450 0.004 . 1 . . . . 10 ALA HB# . 7125 1 1430 . 3 2 10 10 ALA HB2 H 1 1.450 0.004 . 1 . . . . 10 ALA HB# . 7125 1 1431 . 3 2 10 10 ALA HB3 H 1 1.450 0.004 . 1 . . . . 10 ALA HB# . 7125 1 1432 . 3 2 10 10 ALA CA C 13 55.166 0.026 . 1 . . . . 10 ALA CA . 7125 1 1433 . 3 2 10 10 ALA CB C 13 18.547 0.011 . 1 . . . . 10 ALA CB . 7125 1 1434 . 3 2 10 10 ALA N N 15 123.919 0.090 . 1 . . . . 10 ALA N . 7125 1 1435 . 3 2 11 11 VAL H H 1 8.404 0.008 . 1 . . . . 11 VAL HN . 7125 1 1436 . 3 2 11 11 VAL HA H 1 3.811 0.069 . 1 . . . . 11 VAL HA . 7125 1 1437 . 3 2 11 11 VAL HB H 1 1.917 0.012 . 1 . . . . 11 VAL HB . 7125 1 1438 . 3 2 11 11 VAL HG11 H 1 0.492 0.014 . 2 . . . . 11 VAL HG1# . 7125 1 1439 . 3 2 11 11 VAL HG12 H 1 0.492 0.014 . 2 . . . . 11 VAL HG1# . 7125 1 1440 . 3 2 11 11 VAL HG13 H 1 0.492 0.014 . 2 . . . . 11 VAL HG1# . 7125 1 1441 . 3 2 11 11 VAL HG21 H 1 0.425 0.024 . 2 . . . . 11 VAL HG2# . 7125 1 1442 . 3 2 11 11 VAL HG22 H 1 0.425 0.024 . 2 . . . . 11 VAL HG2# . 7125 1 1443 . 3 2 11 11 VAL HG23 H 1 0.425 0.024 . 2 . . . . 11 VAL HG2# . 7125 1 1444 . 3 2 11 11 VAL CA C 13 66.119 0.079 . 1 . . . . 11 VAL CA . 7125 1 1445 . 3 2 11 11 VAL CB C 13 31.829 0.029 . 1 . . . . 11 VAL CB . 7125 1 1446 . 3 2 11 11 VAL CG1 C 13 22.887 0.045 . 2 . . . . 11 VAL CG1 . 7125 1 1447 . 3 2 11 11 VAL CG2 C 13 21.140 0.023 . 2 . . . . 11 VAL CG2 . 7125 1 1448 . 3 2 11 11 VAL N N 15 115.746 0.069 . 1 . . . . 11 VAL N . 7125 1 1449 . 3 2 12 12 THR H H 1 8.403 0.008 . 1 . . . . 12 THR HN . 7125 1 1450 . 3 2 12 12 THR HA H 1 3.923 0.006 . 1 . . . . 12 THR HA . 7125 1 1451 . 3 2 12 12 THR HB H 1 4.272 0.000 . 1 . . . . 12 THR HB . 7125 1 1452 . 3 2 12 12 THR HG21 H 1 1.251 0.018 . 1 . . . . 12 THR HG2# . 7125 1 1453 . 3 2 12 12 THR HG22 H 1 1.251 0.018 . 1 . . . . 12 THR HG2# . 7125 1 1454 . 3 2 12 12 THR HG23 H 1 1.251 0.018 . 1 . . . . 12 THR HG2# . 7125 1 1455 . 3 2 12 12 THR CA C 13 66.429 0.119 . 1 . . . . 12 THR CA . 7125 1 1456 . 3 2 12 12 THR CB C 13 68.906 0.012 . 1 . . . . 12 THR CB . 7125 1 1457 . 3 2 12 12 THR CG2 C 13 21.751 0.045 . 1 . . . . 12 THR CG2 . 7125 1 1458 . 3 2 12 12 THR N N 15 115.532 0.049 . 1 . . . . 12 THR N . 7125 1 1459 . 3 2 13 13 ALA H H 1 8.264 0.014 . 1 . . . . 13 ALA HN . 7125 1 1460 . 3 2 13 13 ALA HA H 1 4.162 0.015 . 1 . . . . 13 ALA HA . 7125 1 1461 . 3 2 13 13 ALA HB1 H 1 1.474 0.016 . 1 . . . . 13 ALA HB# . 7125 1 1462 . 3 2 13 13 ALA HB2 H 1 1.474 0.016 . 1 . . . . 13 ALA HB# . 7125 1 1463 . 3 2 13 13 ALA HB3 H 1 1.474 0.016 . 1 . . . . 13 ALA HB# . 7125 1 1464 . 3 2 13 13 ALA CA C 13 55.321 0.000 . 1 . . . . 13 ALA CA . 7125 1 1465 . 3 2 13 13 ALA CB C 13 18.234 0.059 . 1 . . . . 13 ALA CB . 7125 1 1466 . 3 2 13 13 ALA N N 15 125.746 0.084 . 1 . . . . 13 ALA N . 7125 1 1467 . 3 2 14 14 LEU H H 1 7.232 0.012 . 1 . . . . 14 LEU HN . 7125 1 1468 . 3 2 14 14 LEU HA H 1 3.839 0.019 . 1 . . . . 14 LEU HA . 7125 1 1469 . 3 2 14 14 LEU HB2 H 1 1.669 0.025 . 2 . . . . 14 LEU HB2 . 7125 1 1470 . 3 2 14 14 LEU HG H 1 1.100 0.000 . 1 . . . . 14 LEU HG . 7125 1 1471 . 3 2 14 14 LEU HD11 H 1 0.473 0.010 . 2 . . . . 14 LEU HD1 . 7125 1 1472 . 3 2 14 14 LEU HD12 H 1 0.473 0.010 . 2 . . . . 14 LEU HD1 . 7125 1 1473 . 3 2 14 14 LEU HD13 H 1 0.473 0.010 . 2 . . . . 14 LEU HD1 . 7125 1 1474 . 3 2 14 14 LEU HD21 H 1 0.415 0.016 . 2 . . . . 14 LEU HD2 . 7125 1 1475 . 3 2 14 14 LEU HD22 H 1 0.415 0.016 . 2 . . . . 14 LEU HD2 . 7125 1 1476 . 3 2 14 14 LEU HD23 H 1 0.415 0.016 . 2 . . . . 14 LEU HD2 . 7125 1 1477 . 3 2 14 14 LEU CA C 13 57.955 0.064 . 1 . . . . 14 LEU CA . 7125 1 1478 . 3 2 14 14 LEU CB C 13 41.704 0.053 . 1 . . . . 14 LEU CB . 7125 1 1479 . 3 2 14 14 LEU CG C 13 27.246 0.000 . 1 . . . . 14 LEU CG . 7125 1 1480 . 3 2 14 14 LEU CD1 C 13 25.148 0.052 . 2 . . . . 14 LEU CD1 . 7125 1 1481 . 3 2 14 14 LEU CD2 C 13 25.022 0.070 . 2 . . . . 14 LEU CD2 . 7125 1 1482 . 3 2 14 14 LEU N N 15 117.083 0.049 . 1 . . . . 14 LEU N . 7125 1 1483 . 3 2 15 15 TRP H H 1 8.159 0.008 . 1 . . . . 15 TRP HN . 7125 1 1484 . 3 2 15 15 TRP HA H 1 4.259 0.015 . 1 . . . . 15 TRP HA . 7125 1 1485 . 3 2 15 15 TRP HB2 H 1 3.631 0.009 . 2 . . . . 15 TRP HB2 . 7125 1 1486 . 3 2 15 15 TRP HB3 H 1 3.147 0.004 . 2 . . . . 15 TRP HB3 . 7125 1 1487 . 3 2 15 15 TRP HD1 H 1 7.108 0.001 . 1 . . . . 15 TRP HD1 . 7125 1 1488 . 3 2 15 15 TRP HE1 H 1 10.118 0.006 . 1 . . . . 15 TRP HE1 . 7125 1 1489 . 3 2 15 15 TRP HZ2 H 1 7.539 0.007 . 1 . . . . 15 TRP HZ2 . 7125 1 1490 . 3 2 15 15 TRP HZ3 H 1 8.042 0.002 . 1 . . . . 15 TRP HZ3 . 7125 1 1491 . 3 2 15 15 TRP HH2 H 1 6.815 0.010 . 1 . . . . 15 TRP HH2 . 7125 1 1492 . 3 2 15 15 TRP CA C 13 60.098 0.036 . 1 . . . . 15 TRP CA . 7125 1 1493 . 3 2 15 15 TRP CB C 13 29.496 0.096 . 1 . . . . 15 TRP CB . 7125 1 1494 . 3 2 15 15 TRP CD1 C 13 126.845 0.012 . 1 . . . . 15 TRP CD1 . 7125 1 1495 . 3 2 15 15 TRP CZ2 C 13 113.650 0.059 . 1 . . . . 15 TRP CZ2 . 7125 1 1496 . 3 2 15 15 TRP CZ3 C 13 121.740 0.053 . 1 . . . . 15 TRP CZ3 . 7125 1 1497 . 3 2 15 15 TRP CH2 C 13 123.382 0.059 . 1 . . . . 15 TRP CH2 . 7125 1 1498 . 3 2 15 15 TRP N N 15 119.157 0.058 . 1 . . . . 15 TRP N . 7125 1 1499 . 3 2 15 15 TRP NE1 N 15 127.683 0.062 . 1 . . . . 15 TRP NE1 . 7125 1 1500 . 3 2 16 16 GLY H H 1 7.813 0.018 . 1 . . . . 16 GLY HN . 7125 1 1501 . 3 2 16 16 GLY HA2 H 1 3.990 0.013 . 2 . . . . 16 GLY HA2 . 7125 1 1502 . 3 2 16 16 GLY CA C 13 46.466 0.091 . 1 . . . . 16 GLY CA . 7125 1 1503 . 3 2 16 16 GLY N N 15 101.518 0.032 . 1 . . . . 16 GLY N . 7125 1 1504 . 3 2 17 17 LYS H H 1 7.726 0.012 . 1 . . . . 17 LYS HN . 7125 1 1505 . 3 2 17 17 LYS HA H 1 4.415 0.009 . 1 . . . . 17 LYS HA . 7125 1 1506 . 3 2 17 17 LYS HB2 H 1 2.113 0.000 . 2 . . . . 17 LYS HB2 . 7125 1 1507 . 3 2 17 17 LYS HB3 H 1 2.006 0.000 . 2 . . . . 17 LYS HB3 . 7125 1 1508 . 3 2 17 17 LYS HG2 H 1 1.538 0.003 . 2 . . . . 17 LYS HG2 . 7125 1 1509 . 3 2 17 17 LYS HD2 H 1 1.672 0.024 . 2 . . . . 17 LYS HD2 . 7125 1 1510 . 3 2 17 17 LYS HE2 H 1 2.911 0.000 . 2 . . . . 17 LYS HE2 . 7125 1 1511 . 3 2 17 17 LYS CA C 13 56.011 0.042 . 1 . . . . 17 LYS CA . 7125 1 1512 . 3 2 17 17 LYS CB C 13 33.718 0.093 . 1 . . . . 17 LYS CB . 7125 1 1513 . 3 2 17 17 LYS CG C 13 25.338 0.073 . 1 . . . . 17 LYS CG . 7125 1 1514 . 3 2 17 17 LYS CD C 13 29.951 0.023 . 1 . . . . 17 LYS CD . 7125 1 1515 . 3 2 17 17 LYS CE C 13 42.142 0.000 . 1 . . . . 17 LYS CE . 7125 1 1516 . 3 2 17 17 LYS N N 15 118.173 0.074 . 1 . . . . 17 LYS N . 7125 1 1517 . 3 2 18 18 VAL H H 1 7.247 0.010 . 1 . . . . 18 VAL HN . 7125 1 1518 . 3 2 18 18 VAL HA H 1 3.425 0.002 . 1 . . . . 18 VAL HA . 7125 1 1519 . 3 2 18 18 VAL HB H 1 1.536 0.001 . 1 . . . . 18 VAL HB . 7125 1 1520 . 3 2 18 18 VAL HG11 H 1 0.542 0.028 . 2 . . . . 18 VAL HG1# . 7125 1 1521 . 3 2 18 18 VAL HG12 H 1 0.542 0.028 . 2 . . . . 18 VAL HG1# . 7125 1 1522 . 3 2 18 18 VAL HG13 H 1 0.542 0.028 . 2 . . . . 18 VAL HG1# . 7125 1 1523 . 3 2 18 18 VAL HG21 H 1 0.030 0.010 . 2 . . . . 18 VAL HG2# . 7125 1 1524 . 3 2 18 18 VAL HG22 H 1 0.030 0.010 . 2 . . . . 18 VAL HG2# . 7125 1 1525 . 3 2 18 18 VAL HG23 H 1 0.030 0.010 . 2 . . . . 18 VAL HG2# . 7125 1 1526 . 3 2 18 18 VAL CA C 13 63.458 0.004 . 1 . . . . 18 VAL CA . 7125 1 1527 . 3 2 18 18 VAL CB C 13 32.250 0.047 . 1 . . . . 18 VAL CB . 7125 1 1528 . 3 2 18 18 VAL CG1 C 13 23.237 0.093 . 2 . . . . 18 VAL CG1 . 7125 1 1529 . 3 2 18 18 VAL CG2 C 13 20.558 0.058 . 2 . . . . 18 VAL CG2 . 7125 1 1530 . 3 2 18 18 VAL N N 15 121.555 0.037 . 1 . . . . 18 VAL N . 7125 1 1531 . 3 2 19 19 ASN H H 1 8.345 0.009 . 1 . . . . 19 ASN HN . 7125 1 1532 . 3 2 19 19 ASN HA H 1 4.691 0.004 . 1 . . . . 19 ASN HA . 7125 1 1533 . 3 2 19 19 ASN HB2 H 1 2.710 0.004 . 2 . . . . 19 ASN HB1 . 7125 1 1534 . 3 2 19 19 ASN HB3 H 1 2.864 0.006 . 2 . . . . 19 ASN HB2 . 7125 1 1535 . 3 2 19 19 ASN HD21 H 1 7.482 0.000 . 2 . . . . 19 ASN HD21 . 7125 1 1536 . 3 2 19 19 ASN HD22 H 1 6.989 0.004 . 2 . . . . 19 ASN HD22 . 7125 1 1537 . 3 2 19 19 ASN CA C 13 52.229 0.071 . 1 . . . . 19 ASN CA . 7125 1 1538 . 3 2 19 19 ASN CB C 13 37.071 0.011 . 1 . . . . 19 ASN CB . 7125 1 1539 . 3 2 19 19 ASN N N 15 124.948 0.051 . 1 . . . . 19 ASN N . 7125 1 1540 . 3 2 19 19 ASN ND2 N 15 112.191 0.028 . 1 . . . . 19 ASN ND2 . 7125 1 1541 . 3 2 20 20 VAL H H 1 8.191 0.007 . 1 . . . . 20 VAL HN . 7125 1 1542 . 3 2 20 20 VAL HA H 1 3.476 0.012 . 1 . . . . 20 VAL HA . 7125 1 1543 . 3 2 20 20 VAL HB H 1 2.154 0.004 . 1 . . . . 20 VAL HB . 7125 1 1544 . 3 2 20 20 VAL HG11 H 1 0.875 0.004 . 2 . . . . 20 VAL HG1# . 7125 1 1545 . 3 2 20 20 VAL HG12 H 1 0.875 0.004 . 2 . . . . 20 VAL HG1# . 7125 1 1546 . 3 2 20 20 VAL HG13 H 1 0.875 0.004 . 2 . . . . 20 VAL HG1# . 7125 1 1547 . 3 2 20 20 VAL HG21 H 1 0.887 0.000 . 2 . . . . 20 VAL HG2# . 7125 1 1548 . 3 2 20 20 VAL HG22 H 1 0.887 0.000 . 2 . . . . 20 VAL HG2# . 7125 1 1549 . 3 2 20 20 VAL HG23 H 1 0.887 0.000 . 2 . . . . 20 VAL HG2# . 7125 1 1550 . 3 2 20 20 VAL CA C 13 64.261 0.042 . 1 . . . . 20 VAL CA . 7125 1 1551 . 3 2 20 20 VAL CB C 13 31.248 0.011 . 1 . . . . 20 VAL CB . 7125 1 1552 . 3 2 20 20 VAL CG1 C 13 21.449 0.031 . 2 . . . . 20 VAL CG1 . 7125 1 1553 . 3 2 20 20 VAL CG2 C 13 19.331 0.009 . 2 . . . . 20 VAL CG2 . 7125 1 1554 . 3 2 20 20 VAL N N 15 124.178 0.047 . 1 . . . . 20 VAL N . 7125 1 1555 . 3 2 21 21 ASP H H 1 7.949 0.004 . 1 . . . . 21 ASP HN . 7125 1 1556 . 3 2 21 21 ASP HA H 1 4.414 0.006 . 1 . . . . 21 ASP HA . 7125 1 1557 . 3 2 21 21 ASP HB2 H 1 2.628 0.004 . 2 . . . . 21 ASP HB2 . 7125 1 1558 . 3 2 21 21 ASP CA C 13 56.559 0.000 . 1 . . . . 21 ASP CA . 7125 1 1559 . 3 2 21 21 ASP CB C 13 41.333 0.009 . 1 . . . . 21 ASP CB . 7125 1 1560 . 3 2 21 21 ASP N N 15 119.232 0.047 . 1 . . . . 21 ASP N . 7125 1 1561 . 3 2 22 22 GLU H H 1 7.224 0.006 . 1 . . . . 22 GLU HN . 7125 1 1562 . 3 2 22 22 GLU HA H 1 4.352 0.017 . 1 . . . . 22 GLU HA . 7125 1 1563 . 3 2 22 22 GLU HB2 H 1 1.499 0.016 . 2 . . . . 22 GLU HB2 . 7125 1 1564 . 3 2 22 22 GLU HB3 H 1 2.004 0.029 . 2 . . . . 22 GLU HB3 . 7125 1 1565 . 3 2 22 22 GLU HG2 H 1 2.085 0.033 . 2 . . . . 22 GLU HG2 . 7125 1 1566 . 3 2 22 22 GLU HG3 H 1 1.973 0.000 . 2 . . . . 22 GLU HG3 . 7125 1 1567 . 3 2 22 22 GLU CA C 13 57.206 0.011 . 1 . . . . 22 GLU CA . 7125 1 1568 . 3 2 22 22 GLU CB C 13 32.785 0.117 . 1 . . . . 22 GLU CB . 7125 1 1569 . 3 2 22 22 GLU CG C 13 35.571 0.000 . 1 . . . . 22 GLU CG . 7125 1 1570 . 3 2 22 22 GLU N N 15 117.441 0.038 . 1 . . . . 22 GLU N . 7125 1 1571 . 3 2 23 23 VAL H H 1 7.802 0.014 . 1 . . . . 23 VAL HN . 7125 1 1572 . 3 2 23 23 VAL HA H 1 3.270 0.008 . 1 . . . . 23 VAL HA . 7125 1 1573 . 3 2 23 23 VAL HB H 1 1.335 0.021 . 1 . . . . 23 VAL HB . 7125 1 1574 . 3 2 23 23 VAL HG11 H 1 0.432 0.014 . 2 . . . . 23 VAL HG1# . 7125 1 1575 . 3 2 23 23 VAL HG12 H 1 0.432 0.014 . 2 . . . . 23 VAL HG1# . 7125 1 1576 . 3 2 23 23 VAL HG13 H 1 0.432 0.014 . 2 . . . . 23 VAL HG1# . 7125 1 1577 . 3 2 23 23 VAL HG21 H 1 0.409 0.029 . 2 . . . . 23 VAL HG2# . 7125 1 1578 . 3 2 23 23 VAL HG22 H 1 0.409 0.029 . 2 . . . . 23 VAL HG2# . 7125 1 1579 . 3 2 23 23 VAL HG23 H 1 0.409 0.029 . 2 . . . . 23 VAL HG2# . 7125 1 1580 . 3 2 23 23 VAL CA C 13 66.972 0.040 . 1 . . . . 23 VAL CA . 7125 1 1581 . 3 2 23 23 VAL CB C 13 31.180 0.069 . 1 . . . . 23 VAL CB . 7125 1 1582 . 3 2 23 23 VAL CG1 C 13 24.144 0.045 . 2 . . . . 23 VAL CG1 . 7125 1 1583 . 3 2 23 23 VAL CG2 C 13 20.588 0.053 . 2 . . . . 23 VAL CG2 . 7125 1 1584 . 3 2 23 23 VAL N N 15 118.284 0.055 . 1 . . . . 23 VAL N . 7125 1 1585 . 3 2 24 24 GLY H H 1 8.590 0.006 . 1 . . . . 24 GLY HN . 7125 1 1586 . 3 2 24 24 GLY HA2 H 1 3.538 0.000 . 2 . . . . 24 GLY HA2 . 7125 1 1587 . 3 2 24 24 GLY HA3 H 1 3.127 0.000 . 2 . . . . 24 GLY HA3 . 7125 1 1588 . 3 2 24 24 GLY CA C 13 47.570 0.025 . 1 . . . . 24 GLY CA . 7125 1 1589 . 3 2 24 24 GLY N N 15 108.589 0.110 . 1 . . . . 24 GLY N . 7125 1 1590 . 3 2 25 25 GLY H H 1 7.515 0.007 . 1 . . . . 25 GLY HN . 7125 1 1591 . 3 2 25 25 GLY HA2 H 1 3.760 0.020 . 2 . . . . 25 GLY HA2 . 7125 1 1592 . 3 2 25 25 GLY HA3 H 1 3.335 0.000 . 2 . . . . 25 GLY HA3 . 7125 1 1593 . 3 2 25 25 GLY CA C 13 47.589 0.034 . 1 . . . . 25 GLY CA . 7125 1 1594 . 3 2 25 25 GLY N N 15 108.766 0.036 . 1 . . . . 25 GLY N . 7125 1 1595 . 3 2 26 26 GLU H H 1 7.610 0.012 . 1 . . . . 26 GLU HN . 7125 1 1596 . 3 2 26 26 GLU HA H 1 3.772 0.034 . 1 . . . . 26 GLU HA . 7125 1 1597 . 3 2 26 26 GLU HB2 H 1 2.030 0.000 . 2 . . . . 26 GLU HB2 . 7125 1 1598 . 3 2 26 26 GLU HB3 H 1 1.958 0.000 . 2 . . . . 26 GLU HB3 . 7125 1 1599 . 3 2 26 26 GLU HG3 H 1 2.139 0.009 . 2 . . . . 26 GLU HG3 . 7125 1 1600 . 3 2 26 26 GLU CA C 13 59.109 0.044 . 1 . . . . 26 GLU CA . 7125 1 1601 . 3 2 26 26 GLU CB C 13 29.672 0.048 . 1 . . . . 26 GLU CB . 7125 1 1602 . 3 2 26 26 GLU CG C 13 36.928 0.084 . 1 . . . . 26 GLU CG . 7125 1 1603 . 3 2 26 26 GLU N N 15 121.951 0.059 . 1 . . . . 26 GLU N . 7125 1 1604 . 3 2 27 27 ALA H H 1 8.053 0.007 . 1 . . . . 27 ALA HN . 7125 1 1605 . 3 2 27 27 ALA HA H 1 3.739 0.000 . 1 . . . . 27 ALA HA . 7125 1 1606 . 3 2 27 27 ALA HB1 H 1 1.071 0.013 . 1 . . . . 27 ALA HB# . 7125 1 1607 . 3 2 27 27 ALA HB2 H 1 1.071 0.013 . 1 . . . . 27 ALA HB# . 7125 1 1608 . 3 2 27 27 ALA HB3 H 1 1.071 0.013 . 1 . . . . 27 ALA HB# . 7125 1 1609 . 3 2 27 27 ALA CA C 13 54.743 0.000 . 1 . . . . 27 ALA CA . 7125 1 1610 . 3 2 27 27 ALA CB C 13 16.998 0.042 . 1 . . . . 27 ALA CB . 7125 1 1611 . 3 2 27 27 ALA N N 15 119.996 0.057 . 1 . . . . 27 ALA N . 7125 1 1612 . 3 2 28 28 LEU H H 1 7.861 0.014 . 1 . . . . 28 LEU HN . 7125 1 1613 . 3 2 28 28 LEU HA H 1 3.340 0.008 . 1 . . . . 28 LEU HA . 7125 1 1614 . 3 2 28 28 LEU HB2 H 1 1.139 0.009 . 2 . . . . 28 LEU HB2 . 7125 1 1615 . 3 2 28 28 LEU HB3 H 1 0.342 0.000 . 2 . . . . 28 LEU HB3 . 7125 1 1616 . 3 2 28 28 LEU HD11 H 1 -0.722 0.015 . 1 . . . . 28 LEU HD1 . 7125 1 1617 . 3 2 28 28 LEU HD12 H 1 -0.722 0.015 . 1 . . . . 28 LEU HD1 . 7125 1 1618 . 3 2 28 28 LEU HD13 H 1 -0.722 0.015 . 1 . . . . 28 LEU HD1 . 7125 1 1619 . 3 2 28 28 LEU HD21 H 1 -0.213 0.003 . 1 . . . . 28 LEU HD2 . 7125 1 1620 . 3 2 28 28 LEU HD22 H 1 -0.213 0.003 . 1 . . . . 28 LEU HD2 . 7125 1 1621 . 3 2 28 28 LEU HD23 H 1 -0.213 0.003 . 1 . . . . 28 LEU HD2 . 7125 1 1622 . 3 2 28 28 LEU CA C 13 56.886 0.081 . 1 . . . . 28 LEU CA . 7125 1 1623 . 3 2 28 28 LEU CB C 13 41.608 0.019 . 1 . . . . 28 LEU CB . 7125 1 1624 . 3 2 28 28 LEU CD1 C 13 21.343 0.093 . 2 . . . . 28 LEU CD1 . 7125 1 1625 . 3 2 28 28 LEU CD2 C 13 26.075 0.012 . 2 . . . . 28 LEU CD2 . 7125 1 1626 . 3 2 28 28 LEU N N 15 116.456 0.048 . 1 . . . . 28 LEU N . 7125 1 1627 . 3 2 29 29 GLY H H 1 8.064 0.011 . 1 . . . . 29 GLY HN . 7125 1 1628 . 3 2 29 29 GLY HA2 H 1 3.527 0.000 . 2 . . . . 29 GLY HA2 . 7125 1 1629 . 3 2 29 29 GLY HA3 H 1 3.125 0.000 . 2 . . . . 29 GLY HA3 . 7125 1 1630 . 3 2 29 29 GLY CA C 13 47.587 0.090 . 1 . . . . 29 GLY CA . 7125 1 1631 . 3 2 29 29 GLY N N 15 104.306 0.086 . 1 . . . . 29 GLY N . 7125 1 1632 . 3 2 30 30 ARG H H 1 7.921 0.011 . 1 . . . . 30 ARG HN . 7125 1 1633 . 3 2 30 30 ARG HA H 1 3.530 0.011 . 1 . . . . 30 ARG HA . 7125 1 1634 . 3 2 30 30 ARG HB2 H 1 1.772 0.000 . 2 . . . . 30 ARG HB2 . 7125 1 1635 . 3 2 30 30 ARG CA C 13 60.645 0.019 . 1 . . . . 30 ARG CA . 7125 1 1636 . 3 2 30 30 ARG CB C 13 31.862 0.000 . 1 . . . . 30 ARG CB . 7125 1 1637 . 3 2 30 30 ARG N N 15 116.977 0.094 . 1 . . . . 30 ARG N . 7125 1 1638 . 3 2 31 31 LEU H H 1 7.757 0.008 . 1 . . . . 31 LEU HN . 7125 1 1639 . 3 2 31 31 LEU HA H 1 3.805 0.000 . 1 . . . . 31 LEU HA . 7125 1 1640 . 3 2 31 31 LEU HB3 H 1 1.560 0.000 . 2 . . . . 31 LEU HB3 . 7125 1 1641 . 3 2 31 31 LEU HD11 H 1 0.745 0.000 . 2 . . . . 31 LEU HD1 . 7125 1 1642 . 3 2 31 31 LEU HD12 H 1 0.745 0.000 . 2 . . . . 31 LEU HD1 . 7125 1 1643 . 3 2 31 31 LEU HD13 H 1 0.745 0.000 . 2 . . . . 31 LEU HD1 . 7125 1 1644 . 3 2 31 31 LEU HD21 H 1 1.059 0.017 . 2 . . . . 31 LEU HD2 . 7125 1 1645 . 3 2 31 31 LEU HD22 H 1 1.059 0.017 . 2 . . . . 31 LEU HD2 . 7125 1 1646 . 3 2 31 31 LEU HD23 H 1 1.059 0.017 . 2 . . . . 31 LEU HD2 . 7125 1 1647 . 3 2 31 31 LEU CA C 13 59.438 0.000 . 1 . . . . 31 LEU CA . 7125 1 1648 . 3 2 31 31 LEU CB C 13 41.647 0.000 . 1 . . . . 31 LEU CB . 7125 1 1649 . 3 2 31 31 LEU CD1 C 13 26.557 0.000 . 2 . . . . 31 LEU CD1 . 7125 1 1650 . 3 2 31 31 LEU CD2 C 13 24.822 0.032 . 2 . . . . 31 LEU CD2 . 7125 1 1651 . 3 2 31 31 LEU N N 15 121.166 0.076 . 1 . . . . 31 LEU N . 7125 1 1652 . 3 2 32 32 LEU H H 1 7.051 0.004 . 1 . . . . 32 LEU HN . 7125 1 1653 . 3 2 32 32 LEU HG H 1 1.464 0.000 . 1 . . . . 32 LEU HG . 7125 1 1654 . 3 2 32 32 LEU HD11 H 1 0.214 0.020 . 2 . . . . 32 LEU HD1 . 7125 1 1655 . 3 2 32 32 LEU HD12 H 1 0.214 0.020 . 2 . . . . 32 LEU HD1 . 7125 1 1656 . 3 2 32 32 LEU HD13 H 1 0.214 0.020 . 2 . . . . 32 LEU HD1 . 7125 1 1657 . 3 2 32 32 LEU HD21 H 1 0.427 0.015 . 2 . . . . 32 LEU HD2 . 7125 1 1658 . 3 2 32 32 LEU HD22 H 1 0.427 0.015 . 2 . . . . 32 LEU HD2 . 7125 1 1659 . 3 2 32 32 LEU HD23 H 1 0.427 0.015 . 2 . . . . 32 LEU HD2 . 7125 1 1660 . 3 2 32 32 LEU CG C 13 27.663 0.000 . 1 . . . . 32 LEU CG . 7125 1 1661 . 3 2 32 32 LEU CD1 C 13 25.221 0.074 . 2 . . . . 32 LEU CD1 . 7125 1 1662 . 3 2 32 32 LEU CD2 C 13 23.711 0.000 . 2 . . . . 32 LEU CD2 . 7125 1 1663 . 3 2 32 32 LEU N N 15 115.477 0.037 . 1 . . . . 32 LEU N . 7125 1 1664 . 3 2 33 33 VAL H H 1 7.494 0.012 . 1 . . . . 33 VAL HN . 7125 1 1665 . 3 2 33 33 VAL HA H 1 3.431 0.006 . 1 . . . . 33 VAL HA . 7125 1 1666 . 3 2 33 33 VAL HB H 1 1.598 0.020 . 1 . . . . 33 VAL HB . 7125 1 1667 . 3 2 33 33 VAL HG11 H 1 0.501 0.008 . 2 . . . . 33 VAL HG1# . 7125 1 1668 . 3 2 33 33 VAL HG12 H 1 0.501 0.008 . 2 . . . . 33 VAL HG1# . 7125 1 1669 . 3 2 33 33 VAL HG13 H 1 0.501 0.008 . 2 . . . . 33 VAL HG1# . 7125 1 1670 . 3 2 33 33 VAL HG21 H 1 0.746 0.003 . 2 . . . . 33 VAL HG2# . 7125 1 1671 . 3 2 33 33 VAL HG22 H 1 0.746 0.003 . 2 . . . . 33 VAL HG2# . 7125 1 1672 . 3 2 33 33 VAL HG23 H 1 0.746 0.003 . 2 . . . . 33 VAL HG2# . 7125 1 1673 . 3 2 33 33 VAL CA C 13 64.811 0.010 . 1 . . . . 33 VAL CA . 7125 1 1674 . 3 2 33 33 VAL CB C 13 33.093 0.032 . 1 . . . . 33 VAL CB . 7125 1 1675 . 3 2 33 33 VAL CG1 C 13 21.233 0.017 . 2 . . . . 33 VAL CG1 . 7125 1 1676 . 3 2 33 33 VAL CG2 C 13 22.933 0.057 . 2 . . . . 33 VAL CG2 . 7125 1 1677 . 3 2 33 33 VAL N N 15 116.348 0.072 . 1 . . . . 33 VAL N . 7125 1 1678 . 3 2 34 34 VAL H H 1 8.582 0.009 . 1 . . . . 34 VAL HN . 7125 1 1679 . 3 2 34 34 VAL HA H 1 2.989 0.008 . 1 . . . . 34 VAL HA . 7125 1 1680 . 3 2 34 34 VAL HB H 1 1.070 0.003 . 1 . . . . 34 VAL HB . 7125 1 1681 . 3 2 34 34 VAL HG21 H 1 -0.251 0.012 . 2 . . . . 34 VAL HG2# . 7125 1 1682 . 3 2 34 34 VAL HG22 H 1 -0.251 0.012 . 2 . . . . 34 VAL HG2# . 7125 1 1683 . 3 2 34 34 VAL HG23 H 1 -0.251 0.012 . 2 . . . . 34 VAL HG2# . 7125 1 1684 . 3 2 34 34 VAL CA C 13 65.254 0.066 . 1 . . . . 34 VAL CA . 7125 1 1685 . 3 2 34 34 VAL CB C 13 32.081 0.039 . 1 . . . . 34 VAL CB . 7125 1 1686 . 3 2 34 34 VAL CG2 C 13 20.939 0.076 . 1 . . . . 34 VAL CG2 . 7125 1 1687 . 3 2 34 34 VAL N N 15 119.158 0.085 . 1 . . . . 34 VAL N . 7125 1 1688 . 3 2 35 35 TYR H H 1 7.475 0.006 . 1 . . . . 35 TYR HN . 7125 1 1689 . 3 2 35 35 TYR HA H 1 4.330 0.000 . 1 . . . . 35 TYR HA . 7125 1 1690 . 3 2 35 35 TYR HB2 H 1 2.560 0.000 . 2 . . . . 35 TYR HB2 . 7125 1 1691 . 3 2 35 35 TYR HB3 H 1 1.477 0.000 . 2 . . . . 35 TYR HB3 . 7125 1 1692 . 3 2 35 35 TYR CA C 13 53.307 0.000 . 1 . . . . 35 TYR CA . 7125 1 1693 . 3 2 35 35 TYR CB C 13 35.571 0.000 . 1 . . . . 35 TYR CB . 7125 1 1694 . 3 2 35 35 TYR N N 15 117.735 0.034 . 1 . . . . 35 TYR N . 7125 1 1695 . 3 2 36 36 PRO HA H 1 4.493 0.000 . 1 . . . . 36 PRO HA . 7125 1 1696 . 3 2 36 36 PRO HD2 H 1 3.508 0.000 . 2 . . . . 36 PRO HD2 . 7125 1 1697 . 3 2 36 36 PRO CA C 13 65.780 0.000 . 1 . . . . 36 PRO CA . 7125 1 1698 . 3 2 36 36 PRO CD C 13 50.862 0.000 . 1 . . . . 36 PRO CD . 7125 1 1699 . 3 2 37 37 TRP H H 1 7.112 0.007 . 1 . . . . 37 TRP HN . 7125 1 1700 . 3 2 37 37 TRP HA H 1 4.619 0.000 . 1 . . . . 37 TRP HA . 7125 1 1701 . 3 2 37 37 TRP HB2 H 1 1.944 0.000 . 2 . . . . 37 TRP HB2 . 7125 1 1702 . 3 2 37 37 TRP HD1 H 1 7.401 0.015 . 1 . . . . 37 TRP HD1 . 7125 1 1703 . 3 2 37 37 TRP HE1 H 1 10.652 0.008 . 1 . . . . 37 TRP HE1 . 7125 1 1704 . 3 2 37 37 TRP HZ2 H 1 7.529 0.007 . 1 . . . . 37 TRP HZ2 . 7125 1 1705 . 3 2 37 37 TRP CA C 13 61.139 0.000 . 1 . . . . 37 TRP CA . 7125 1 1706 . 3 2 37 37 TRP CB C 13 27.174 0.000 . 1 . . . . 37 TRP CB . 7125 1 1707 . 3 2 37 37 TRP CD1 C 13 127.137 0.044 . 1 . . . . 37 TRP CD1 . 7125 1 1708 . 3 2 37 37 TRP CZ2 C 13 116.372 0.047 . 1 . . . . 37 TRP CZ2 . 7125 1 1709 . 3 2 37 37 TRP N N 15 117.401 0.090 . 1 . . . . 37 TRP N . 7125 1 1710 . 3 2 37 37 TRP NE1 N 15 133.634 0.067 . 1 . . . . 37 TRP NE1 . 7125 1 1711 . 3 2 38 38 THR H H 1 8.213 0.012 . 1 . . . . 38 THR HN . 7125 1 1712 . 3 2 38 38 THR HA H 1 4.447 0.013 . 1 . . . . 38 THR HA . 7125 1 1713 . 3 2 38 38 THR HG21 H 1 1.205 0.009 . 1 . . . . 38 THR HG2# . 7125 1 1714 . 3 2 38 38 THR HG22 H 1 1.205 0.009 . 1 . . . . 38 THR HG2# . 7125 1 1715 . 3 2 38 38 THR HG23 H 1 1.205 0.009 . 1 . . . . 38 THR HG2# . 7125 1 1716 . 3 2 38 38 THR CA C 13 65.743 0.086 . 1 . . . . 38 THR CA . 7125 1 1717 . 3 2 38 38 THR CG2 C 13 21.953 0.031 . 1 . . . . 38 THR CG2 . 7125 1 1718 . 3 2 38 38 THR N N 15 117.248 0.027 . 1 . . . . 38 THR N . 7125 1 1719 . 3 2 39 39 GLN H H 1 7.751 0.012 . 1 . . . . 39 GLN HN . 7125 1 1720 . 3 2 39 39 GLN N N 15 118.091 0.018 . 1 . . . . 39 GLN N . 7125 1 1721 . 3 2 40 40 ARG H H 1 7.779 0.009 . 1 . . . . 40 ARG HN . 7125 1 1722 . 3 2 40 40 ARG HA H 1 4.065 0.030 . 1 . . . . 40 ARG HA . 7125 1 1723 . 3 2 40 40 ARG HB2 H 1 2.208 0.000 . 2 . . . . 40 ARG HB2 . 7125 1 1724 . 3 2 40 40 ARG HG2 H 1 1.498 0.000 . 2 . . . . 40 ARG HG2 . 7125 1 1725 . 3 2 40 40 ARG HD3 H 1 2.920 0.000 . 2 . . . . 40 ARG HD3 . 7125 1 1726 . 3 2 40 40 ARG CA C 13 59.321 0.190 . 1 . . . . 40 ARG CA . 7125 1 1727 . 3 2 40 40 ARG CB C 13 31.338 0.000 . 1 . . . . 40 ARG CB . 7125 1 1728 . 3 2 40 40 ARG CG C 13 27.705 0.000 . 1 . . . . 40 ARG CG . 7125 1 1729 . 3 2 40 40 ARG CD C 13 42.113 0.000 . 1 . . . . 40 ARG CD . 7125 1 1730 . 3 2 40 40 ARG N N 15 118.215 0.064 . 1 . . . . 40 ARG N . 7125 1 1731 . 3 2 41 41 PHE H H 1 7.498 0.010 . 1 . . . . 41 PHE HN . 7125 1 1732 . 3 2 41 41 PHE HA H 1 4.441 0.007 . 1 . . . . 41 PHE HA . 7125 1 1733 . 3 2 41 41 PHE HD1 H 1 7.979 0.019 . 3 . . . . 41 PHE HD1 . 7125 1 1734 . 3 2 41 41 PHE CA C 13 60.406 0.003 . 1 . . . . 41 PHE CA . 7125 1 1735 . 3 2 41 41 PHE CD1 C 13 132.161 0.054 . 1 . . . . 41 PHE CD1 . 7125 1 1736 . 3 2 41 41 PHE N N 15 112.422 0.051 . 1 . . . . 41 PHE N . 7125 1 1737 . 3 2 42 42 PHE H H 1 7.594 0.009 . 1 . . . . 42 PHE HN . 7125 1 1738 . 3 2 42 42 PHE HA H 1 4.404 0.004 . 1 . . . . 42 PHE HA . 7125 1 1739 . 3 2 42 42 PHE HB2 H 1 2.543 0.009 . 2 . . . . 42 PHE HB2 . 7125 1 1740 . 3 2 42 42 PHE HB3 H 1 2.022 0.000 . 2 . . . . 42 PHE HB3 . 7125 1 1741 . 3 2 42 42 PHE HD1 H 1 6.287 0.025 . 3 . . . . 42 PHE HD1 . 7125 1 1742 . 3 2 42 42 PHE HE1 H 1 6.342 0.002 . 3 . . . . 42 PHE HE1 . 7125 1 1743 . 3 2 42 42 PHE CA C 13 57.199 0.026 . 1 . . . . 42 PHE CA . 7125 1 1744 . 3 2 42 42 PHE CB C 13 39.867 0.009 . 1 . . . . 42 PHE CB . 7125 1 1745 . 3 2 42 42 PHE CD1 C 13 132.816 0.024 . 3 . . . . 42 PHE CD1 . 7125 1 1746 . 3 2 42 42 PHE CE1 C 13 128.828 0.071 . 3 . . . . 42 PHE CE1 . 7125 1 1747 . 3 2 42 42 PHE N N 15 116.396 0.075 . 1 . . . . 42 PHE N . 7125 1 1748 . 3 2 43 43 GLU H H 1 7.388 0.010 . 1 . . . . 43 GLU HN . 7125 1 1749 . 3 2 43 43 GLU HA H 1 4.173 0.022 . 1 . . . . 43 GLU HA . 7125 1 1750 . 3 2 43 43 GLU HB2 H 1 2.150 0.008 . 2 . . . . 43 GLU HB2 . 7125 1 1751 . 3 2 43 43 GLU HG2 H 1 2.441 0.020 . 2 . . . . 43 GLU HG2 . 7125 1 1752 . 3 2 43 43 GLU HG3 H 1 2.372 0.000 . 2 . . . . 43 GLU HG3 . 7125 1 1753 . 3 2 43 43 GLU CA C 13 59.683 0.049 . 1 . . . . 43 GLU CA . 7125 1 1754 . 3 2 43 43 GLU CB C 13 30.000 0.049 . 1 . . . . 43 GLU CB . 7125 1 1755 . 3 2 43 43 GLU CG C 13 36.325 0.046 . 1 . . . . 43 GLU CG . 7125 1 1756 . 3 2 43 43 GLU N N 15 121.043 0.059 . 1 . . . . 43 GLU N . 7125 1 1757 . 3 2 44 44 SER H H 1 8.727 0.014 . 1 . . . . 44 SER HN . 7125 1 1758 . 3 2 44 44 SER HA H 1 4.425 0.020 . 1 . . . . 44 SER HA . 7125 1 1759 . 3 2 44 44 SER HB3 H 1 4.106 0.008 . 2 . . . . 44 SER HB3 . 7125 1 1760 . 3 2 44 44 SER CA C 13 60.139 0.071 . 1 . . . . 44 SER CA . 7125 1 1761 . 3 2 44 44 SER CB C 13 63.275 0.005 . 1 . . . . 44 SER CB . 7125 1 1762 . 3 2 44 44 SER N N 15 113.220 0.065 . 1 . . . . 44 SER N . 7125 1 1763 . 3 2 45 45 PHE H H 1 8.578 0.009 . 1 . . . . 45 PHE HN . 7125 1 1764 . 3 2 45 45 PHE HA H 1 4.522 0.022 . 1 . . . . 45 PHE HA . 7125 1 1765 . 3 2 45 45 PHE HB2 H 1 3.576 0.016 . 1 . . . . 45 PHE HB2 . 7125 1 1766 . 3 2 45 45 PHE HB3 H 1 3.103 0.016 . 1 . . . . 45 PHE HB3 . 7125 1 1767 . 3 2 45 45 PHE HD1 H 1 6.869 0.001 . 3 . . . . 45 PHE HD1 . 7125 1 1768 . 3 2 45 45 PHE HE1 H 1 6.787 0.004 . 3 . . . . 45 PHE HE1 . 7125 1 1769 . 3 2 45 45 PHE CA C 13 56.893 0.013 . 1 . . . . 45 PHE CA . 7125 1 1770 . 3 2 45 45 PHE CB C 13 36.631 0.188 . 1 . . . . 45 PHE CB . 7125 1 1771 . 3 2 45 45 PHE CD1 C 13 129.673 0.044 . 3 . . . . 45 PHE CD1 . 7125 1 1772 . 3 2 45 45 PHE CE1 C 13 131.536 0.045 . 3 . . . . 45 PHE CE1 . 7125 1 1773 . 3 2 45 45 PHE N N 15 122.163 0.086 . 1 . . . . 45 PHE N . 7125 1 1774 . 3 2 46 46 GLY CA C 13 44.881 0.063 . 1 . . . . 46 GLY CA . 7125 1 1775 . 3 2 46 46 GLY HA2 H 1 3.636 0.018 . 2 . . . . 46 GLY HA2 . 7125 1 1776 . 3 2 46 46 GLY HA3 H 1 4.289 0.001 . 2 . . . . 46 GLY HA3 . 7125 1 1777 . 3 2 46 46 GLY H H 1 7.763 0.007 . 1 . . . . 46 GLY HN . 7125 1 1778 . 3 2 46 46 GLY N N 15 108.128 0.024 . 1 . . . . 46 GLY N . 7125 1 1779 . 3 2 47 47 ASP H H 1 8.439 0.004 . 1 . . . . 47 ASP HN . 7125 1 1780 . 3 2 47 47 ASP HA H 1 4.298 0.010 . 1 . . . . 47 ASP HA . 7125 1 1781 . 3 2 47 47 ASP HB2 H 1 2.874 0.000 . 2 . . . . 47 ASP HB2 . 7125 1 1782 . 3 2 47 47 ASP HB3 H 1 2.549 0.000 . 2 . . . . 47 ASP HB3 . 7125 1 1783 . 3 2 47 47 ASP CA C 13 55.689 0.088 . 1 . . . . 47 ASP CA . 7125 1 1784 . 3 2 47 47 ASP CB C 13 40.516 0.112 . 1 . . . . 47 ASP CB . 7125 1 1785 . 3 2 47 47 ASP N N 15 122.418 0.068 . 1 . . . . 47 ASP N . 7125 1 1786 . 3 2 48 48 LEU H H 1 8.401 0.007 . 1 . . . . 48 LEU HN . 7125 1 1787 . 3 2 48 48 LEU HA H 1 4.484 0.010 . 1 . . . . 48 LEU HA . 7125 1 1788 . 3 2 48 48 LEU HG H 1 1.657 0.000 . 1 . . . . 48 LEU HG . 7125 1 1789 . 3 2 48 48 LEU HD11 H 1 0.783 0.008 . 2 . . . . 48 LEU HD1 . 7125 1 1790 . 3 2 48 48 LEU HD12 H 1 0.783 0.008 . 2 . . . . 48 LEU HD1 . 7125 1 1791 . 3 2 48 48 LEU HD13 H 1 0.783 0.008 . 2 . . . . 48 LEU HD1 . 7125 1 1792 . 3 2 48 48 LEU HD21 H 1 0.671 0.014 . 2 . . . . 48 LEU HD2 . 7125 1 1793 . 3 2 48 48 LEU HD22 H 1 0.671 0.014 . 2 . . . . 48 LEU HD2 . 7125 1 1794 . 3 2 48 48 LEU HD23 H 1 0.671 0.014 . 2 . . . . 48 LEU HD2 . 7125 1 1795 . 3 2 48 48 LEU CA C 13 52.762 0.029 . 1 . . . . 48 LEU CA . 7125 1 1796 . 3 2 48 48 LEU CG C 13 25.910 0.000 . 1 . . . . 48 LEU CG . 7125 1 1797 . 3 2 48 48 LEU CD1 C 13 26.815 0.039 . 2 . . . . 48 LEU CD1 . 7125 1 1798 . 3 2 48 48 LEU CD2 C 13 23.539 0.064 . 2 . . . . 48 LEU CD2 . 7125 1 1799 . 3 2 48 48 LEU N N 15 128.504 0.086 . 1 . . . . 48 LEU N . 7125 1 1800 . 3 2 49 49 SER H H 1 8.190 0.006 . 1 . . . . 49 SER HN . 7125 1 1801 . 3 2 49 49 SER HA H 1 3.989 0.004 . 1 . . . . 49 SER HA . 7125 1 1802 . 3 2 49 49 SER HB2 H 1 3.921 0.011 . 2 . . . . 49 SER HB2 . 7125 1 1803 . 3 2 49 49 SER CA C 13 62.221 0.004 . 1 . . . . 49 SER CA . 7125 1 1804 . 3 2 49 49 SER CB C 13 64.198 0.017 . 1 . . . . 49 SER CB . 7125 1 1805 . 3 2 49 49 SER N N 15 112.811 0.051 . 1 . . . . 49 SER N . 7125 1 1806 . 3 2 50 50 THR H H 1 7.130 0.006 . 1 . . . . 50 THR HN . 7125 1 1807 . 3 2 50 50 THR HA H 1 4.865 0.000 . 1 . . . . 50 THR HA . 7125 1 1808 . 3 2 50 50 THR HB H 1 4.444 0.008 . 1 . . . . 50 THR HB . 7125 1 1809 . 3 2 50 50 THR HG21 H 1 1.183 0.027 . 1 . . . . 50 THR HG2# . 7125 1 1810 . 3 2 50 50 THR HG22 H 1 1.183 0.027 . 1 . . . . 50 THR HG2# . 7125 1 1811 . 3 2 50 50 THR HG23 H 1 1.183 0.027 . 1 . . . . 50 THR HG2# . 7125 1 1812 . 3 2 50 50 THR CA C 13 58.324 0.000 . 1 . . . . 50 THR CA . 7125 1 1813 . 3 2 50 50 THR CB C 13 70.543 0.033 . 1 . . . . 50 THR CB . 7125 1 1814 . 3 2 50 50 THR CG2 C 13 21.922 0.097 . 1 . . . . 50 THR CG2 . 7125 1 1815 . 3 2 50 50 THR N N 15 111.489 0.053 . 1 . . . . 50 THR N . 7125 1 1816 . 3 2 51 51 PRO HA H 1 3.887 0.016 . 1 . . . . 51 PRO HA . 7125 1 1817 . 3 2 51 51 PRO HB2 H 1 1.891 0.045 . 2 . . . . 51 PRO HB2 . 7125 1 1818 . 3 2 51 51 PRO HB3 H 1 2.040 0.000 . 2 . . . . 51 PRO HB3 . 7125 1 1819 . 3 2 51 51 PRO HG2 H 1 2.033 0.000 . 2 . . . . 51 PRO HG2 . 7125 1 1820 . 3 2 51 51 PRO HG3 H 1 1.384 0.000 . 2 . . . . 51 PRO HG3 . 7125 1 1821 . 3 2 51 51 PRO HD2 H 1 3.829 0.010 . 2 . . . . 51 PRO HD2 . 7125 1 1822 . 3 2 51 51 PRO CA C 13 65.815 0.027 . 1 . . . . 51 PRO CA . 7125 1 1823 . 3 2 51 51 PRO CB C 13 31.619 0.000 . 1 . . . . 51 PRO CB . 7125 1 1824 . 3 2 51 51 PRO CG C 13 28.077 0.039 . 1 . . . . 51 PRO CG . 7125 1 1825 . 3 2 51 51 PRO CD C 13 50.299 0.000 . 1 . . . . 51 PRO CD . 7125 1 1826 . 3 2 52 52 ASP H H 1 7.958 0.006 . 1 . . . . 52 ASP HN . 7125 1 1827 . 3 2 52 52 ASP HA H 1 4.127 0.016 . 1 . . . . 52 ASP HA . 7125 1 1828 . 3 2 52 52 ASP HB3 H 1 2.422 0.003 . 2 . . . . 52 ASP HB3 . 7125 1 1829 . 3 2 52 52 ASP CA C 13 57.126 0.029 . 1 . . . . 52 ASP CA . 7125 1 1830 . 3 2 52 52 ASP CB C 13 40.319 0.001 . 1 . . . . 52 ASP CB . 7125 1 1831 . 3 2 52 52 ASP N N 15 114.667 0.053 . 1 . . . . 52 ASP N . 7125 1 1832 . 3 2 53 53 ALA H H 1 7.815 0.006 . 1 . . . . 53 ALA HN . 7125 1 1833 . 3 2 53 53 ALA HA H 1 3.969 0.013 . 1 . . . . 53 ALA HA . 7125 1 1834 . 3 2 53 53 ALA HB1 H 1 1.286 0.018 . 1 . . . . 53 ALA HB# . 7125 1 1835 . 3 2 53 53 ALA HB2 H 1 1.286 0.018 . 1 . . . . 53 ALA HB# . 7125 1 1836 . 3 2 53 53 ALA HB3 H 1 1.286 0.018 . 1 . . . . 53 ALA HB# . 7125 1 1837 . 3 2 53 53 ALA CA C 13 54.762 0.001 . 1 . . . . 53 ALA CA . 7125 1 1838 . 3 2 53 53 ALA CB C 13 18.452 0.070 . 1 . . . . 53 ALA CB . 7125 1 1839 . 3 2 53 53 ALA N N 15 123.758 0.076 . 1 . . . . 53 ALA N . 7125 1 1840 . 3 2 54 54 VAL H H 1 7.835 0.015 . 1 . . . . 54 VAL HN . 7125 1 1841 . 3 2 54 54 VAL HA H 1 3.303 0.012 . 1 . . . . 54 VAL HA . 7125 1 1842 . 3 2 54 54 VAL HB H 1 1.836 0.004 . 1 . . . . 54 VAL HB . 7125 1 1843 . 3 2 54 54 VAL HG11 H 1 0.796 0.019 . 2 . . . . 54 VAL HG1# . 7125 1 1844 . 3 2 54 54 VAL HG12 H 1 0.796 0.019 . 2 . . . . 54 VAL HG1# . 7125 1 1845 . 3 2 54 54 VAL HG13 H 1 0.796 0.019 . 2 . . . . 54 VAL HG1# . 7125 1 1846 . 3 2 54 54 VAL HG21 H 1 0.745 0.013 . 2 . . . . 54 VAL HG2# . 7125 1 1847 . 3 2 54 54 VAL HG22 H 1 0.745 0.013 . 2 . . . . 54 VAL HG2# . 7125 1 1848 . 3 2 54 54 VAL HG23 H 1 0.745 0.013 . 2 . . . . 54 VAL HG2# . 7125 1 1849 . 3 2 54 54 VAL CA C 13 67.028 0.026 . 1 . . . . 54 VAL CA . 7125 1 1850 . 3 2 54 54 VAL CB C 13 32.023 0.034 . 1 . . . . 54 VAL CB . 7125 1 1851 . 3 2 54 54 VAL CG1 C 13 24.011 0.121 . 2 . . . . 54 VAL CG1 . 7125 1 1852 . 3 2 54 54 VAL CG2 C 13 22.961 0.092 . 2 . . . . 54 VAL CG2 . 7125 1 1853 . 3 2 54 54 VAL N N 15 116.672 0.060 . 1 . . . . 54 VAL N . 7125 1 1854 . 3 2 55 55 MET H H 1 7.923 0.012 . 1 . . . . 55 MET HN . 7125 1 1855 . 3 2 55 55 MET HA H 1 4.092 0.008 . 1 . . . . 55 MET HA . 7125 1 1856 . 3 2 55 55 MET HB2 H 1 1.923 0.000 . 2 . . . . 55 MET HB2 . 7125 1 1857 . 3 2 55 55 MET HG2 H 1 2.643 0.000 . 2 . . . . 55 MET HG2 . 7125 1 1858 . 3 2 55 55 MET HE1 H 1 1.942 0.013 . 1 . . . . 55 MET HE# . 7125 1 1859 . 3 2 55 55 MET HE2 H 1 1.942 0.013 . 1 . . . . 55 MET HE# . 7125 1 1860 . 3 2 55 55 MET HE3 H 1 1.942 0.013 . 1 . . . . 55 MET HE# . 7125 1 1861 . 3 2 55 55 MET CA C 13 55.321 0.000 . 1 . . . . 55 MET CA . 7125 1 1862 . 3 2 55 55 MET CB C 13 29.003 0.000 . 1 . . . . 55 MET CB . 7125 1 1863 . 3 2 55 55 MET CG C 13 30.815 0.000 . 1 . . . . 55 MET CG . 7125 1 1864 . 3 2 55 55 MET CE C 13 15.763 0.055 . 1 . . . . 55 MET CE . 7125 1 1865 . 3 2 55 55 MET N N 15 111.923 0.042 . 1 . . . . 55 MET N . 7125 1 1866 . 3 2 56 56 GLY H H 1 7.405 0.004 . 1 . . . . 56 GLY HN . 7125 1 1867 . 3 2 56 56 GLY HA2 H 1 3.527 0.003 . 2 . . . . 56 GLY HA2 . 7125 1 1868 . 3 2 56 56 GLY HA3 H 1 4.191 0.018 . 2 . . . . 56 GLY HA3 . 7125 1 1869 . 3 2 56 56 GLY CA C 13 44.314 0.077 . 1 . . . . 56 GLY CA . 7125 1 1870 . 3 2 56 56 GLY N N 15 103.328 0.035 . 1 . . . . 56 GLY N . 7125 1 1871 . 3 2 57 57 ASN H H 1 7.179 0.006 . 1 . . . . 57 ASN HN . 7125 1 1872 . 3 2 57 57 ASN HA H 1 4.765 0.000 . 1 . . . . 57 ASN HA . 7125 1 1873 . 3 2 57 57 ASN HB2 H 1 3.338 0.000 . 2 . . . . 57 ASN HB2 . 7125 1 1874 . 3 2 57 57 ASN HB3 H 1 2.826 0.000 . 2 . . . . 57 ASN HB3 . 7125 1 1875 . 3 2 57 57 ASN CA C 13 51.887 0.000 . 1 . . . . 57 ASN CA . 7125 1 1876 . 3 2 57 57 ASN CB C 13 38.951 0.037 . 1 . . . . 57 ASN CB . 7125 1 1877 . 3 2 57 57 ASN N N 15 123.465 0.040 . 1 . . . . 57 ASN N . 7125 1 1878 . 3 2 58 58 PRO HA H 1 4.167 0.015 . 1 . . . . 58 PRO HA . 7125 1 1879 . 3 2 58 58 PRO HB2 H 1 2.382 0.000 . 2 . . . . 58 PRO HB2 . 7125 1 1880 . 3 2 58 58 PRO HB3 H 1 1.869 0.000 . 2 . . . . 58 PRO HB3 . 7125 1 1881 . 3 2 58 58 PRO HG2 H 1 2.044 0.000 . 2 . . . . 58 PRO HG2 . 7125 1 1882 . 3 2 58 58 PRO HD2 H 1 3.785 0.000 . 2 . . . . 58 PRO HD1 . 7125 1 1883 . 3 2 58 58 PRO CA C 13 65.046 0.060 . 1 . . . . 58 PRO CA . 7125 1 1884 . 3 2 58 58 PRO CB C 13 32.184 0.123 . 1 . . . . 58 PRO CB . 7125 1 1885 . 3 2 58 58 PRO CG C 13 27.501 0.000 . 1 . . . . 58 PRO CG . 7125 1 1886 . 3 2 58 58 PRO CD C 13 51.348 0.000 . 1 . . . . 58 PRO CD . 7125 1 1887 . 3 2 59 59 LYS H H 1 8.120 0.008 . 1 . . . . 59 LYS HN . 7125 1 1888 . 3 2 59 59 LYS HA H 1 3.836 0.006 . 1 . . . . 59 LYS HA . 7125 1 1889 . 3 2 59 59 LYS HB2 H 1 0.648 0.011 . 2 . . . . 59 LYS HB2 . 7125 1 1890 . 3 2 59 59 LYS HB3 H 1 1.496 0.000 . 2 . . . . 59 LYS HB3 . 7125 1 1891 . 3 2 59 59 LYS HG2 H 1 1.376 0.005 . 2 . . . . 59 LYS HG2 . 7125 1 1892 . 3 2 59 59 LYS HG3 H 1 1.089 0.000 . 2 . . . . 59 LYS HG3 . 7125 1 1893 . 3 2 59 59 LYS HD2 H 1 1.468 0.006 . 2 . . . . 59 LYS HD2 . 7125 1 1894 . 3 2 59 59 LYS HD3 H 1 1.485 0.000 . 2 . . . . 59 LYS HD3 . 7125 1 1895 . 3 2 59 59 LYS HE2 H 1 2.807 0.000 . 2 . . . . 59 LYS HE2 . 7125 1 1896 . 3 2 59 59 LYS CA C 13 59.226 0.089 . 1 . . . . 59 LYS CA . 7125 1 1897 . 3 2 59 59 LYS CB C 13 30.999 0.071 . 1 . . . . 59 LYS CB . 7125 1 1898 . 3 2 59 59 LYS CG C 13 26.393 0.090 . 1 . . . . 59 LYS CG . 7125 1 1899 . 3 2 59 59 LYS CD C 13 29.510 0.073 . 1 . . . . 59 LYS CD . 7125 1 1900 . 3 2 59 59 LYS CE C 13 42.257 0.000 . 1 . . . . 59 LYS CE . 7125 1 1901 . 3 2 59 59 LYS N N 15 119.345 0.064 . 1 . . . . 59 LYS N . 7125 1 1902 . 3 2 60 60 VAL H H 1 7.482 0.008 . 1 . . . . 60 VAL HN . 7125 1 1903 . 3 2 60 60 VAL HA H 1 3.075 0.024 . 1 . . . . 60 VAL HA . 7125 1 1904 . 3 2 60 60 VAL HB H 1 2.277 0.003 . 1 . . . . 60 VAL HB . 7125 1 1905 . 3 2 60 60 VAL HG11 H 1 0.677 0.011 . 2 . . . . 60 VAL HG1# . 7125 1 1906 . 3 2 60 60 VAL HG12 H 1 0.677 0.011 . 2 . . . . 60 VAL HG1# . 7125 1 1907 . 3 2 60 60 VAL HG13 H 1 0.677 0.011 . 2 . . . . 60 VAL HG1# . 7125 1 1908 . 3 2 60 60 VAL HG21 H 1 0.414 0.013 . 2 . . . . 60 VAL HG2# . 7125 1 1909 . 3 2 60 60 VAL HG22 H 1 0.414 0.013 . 2 . . . . 60 VAL HG2# . 7125 1 1910 . 3 2 60 60 VAL HG23 H 1 0.414 0.013 . 2 . . . . 60 VAL HG2# . 7125 1 1911 . 3 2 60 60 VAL CA C 13 66.514 0.019 . 1 . . . . 60 VAL CA . 7125 1 1912 . 3 2 60 60 VAL CB C 13 31.561 0.031 . 1 . . . . 60 VAL CB . 7125 1 1913 . 3 2 60 60 VAL CG1 C 13 23.475 0.031 . 2 . . . . 60 VAL CG1 . 7125 1 1914 . 3 2 60 60 VAL CG2 C 13 20.603 0.070 . 2 . . . . 60 VAL CG2 . 7125 1 1915 . 3 2 60 60 VAL N N 15 122.434 0.082 . 1 . . . . 60 VAL N . 7125 1 1916 . 3 2 61 61 LYS H H 1 7.346 0.013 . 1 . . . . 61 LYS HN . 7125 1 1917 . 3 2 61 61 LYS HA H 1 3.557 0.015 . 1 . . . . 61 LYS HA . 7125 1 1918 . 3 2 61 61 LYS HB2 H 1 1.734 0.003 . 2 . . . . 61 LYS HB2 . 7125 1 1919 . 3 2 61 61 LYS HG2 H 1 1.389 0.012 . 2 . . . . 61 LYS HG2 . 7125 1 1920 . 3 2 61 61 LYS HD2 H 1 1.550 0.000 . 2 . . . . 61 LYS HD2 . 7125 1 1921 . 3 2 61 61 LYS HE2 H 1 2.871 0.010 . 2 . . . . 61 LYS HE2 . 7125 1 1922 . 3 2 61 61 LYS CA C 13 60.458 0.104 . 1 . . . . 61 LYS CA . 7125 1 1923 . 3 2 61 61 LYS CB C 13 32.257 0.030 . 1 . . . . 61 LYS CB . 7125 1 1924 . 3 2 61 61 LYS CG C 13 25.275 0.070 . 1 . . . . 61 LYS CG . 7125 1 1925 . 3 2 61 61 LYS CD C 13 29.398 0.002 . 1 . . . . 61 LYS CD . 7125 1 1926 . 3 2 61 61 LYS CE C 13 41.971 0.013 . 1 . . . . 61 LYS CE . 7125 1 1927 . 3 2 61 61 LYS N N 15 118.639 0.037 . 1 . . . . 61 LYS N . 7125 1 1928 . 3 2 62 62 ALA H H 1 7.854 0.011 . 1 . . . . 62 ALA HN . 7125 1 1929 . 3 2 62 62 ALA HA H 1 3.992 0.011 . 1 . . . . 62 ALA HA . 7125 1 1930 . 3 2 62 62 ALA HB1 H 1 1.385 0.002 . 1 . . . . 62 ALA HB# . 7125 1 1931 . 3 2 62 62 ALA HB2 H 1 1.385 0.002 . 1 . . . . 62 ALA HB# . 7125 1 1932 . 3 2 62 62 ALA HB3 H 1 1.385 0.002 . 1 . . . . 62 ALA HB# . 7125 1 1933 . 3 2 62 62 ALA CA C 13 54.988 0.081 . 1 . . . . 62 ALA CA . 7125 1 1934 . 3 2 62 62 ALA CB C 13 18.407 0.003 . 1 . . . . 62 ALA CB . 7125 1 1935 . 3 2 62 62 ALA N N 15 120.836 0.064 . 1 . . . . 62 ALA N . 7125 1 1936 . 3 2 63 63 HIS H H 1 8.339 0.002 . 1 . . . . 63 HIS HN . 7125 1 1937 . 3 2 63 63 HIS HA H 1 3.869 0.020 . 1 . . . . 63 HIS HA . 7125 1 1938 . 3 2 63 63 HIS HB2 H 1 2.901 0.000 . 2 . . . . 63 HIS HB2 . 7125 1 1939 . 3 2 63 63 HIS HB3 H 1 2.219 0.014 . 2 . . . . 63 HIS HB3 . 7125 1 1940 . 3 2 63 63 HIS HD2 H 1 4.568 0.000 . 1 . . . . 63 HIS HD2 . 7125 1 1941 . 3 2 63 63 HIS HE1 H 1 8.379 0.005 . 1 . . . . 63 HIS HE1 . 7125 1 1942 . 3 2 63 63 HIS CA C 13 59.950 0.091 . 1 . . . . 63 HIS CA . 7125 1 1943 . 3 2 63 63 HIS CB C 13 31.359 0.088 . 1 . . . . 63 HIS CB . 7125 1 1944 . 3 2 63 63 HIS CD2 C 13 114.964 0.000 . 1 . . . . 63 HIS CD2 . 7125 1 1945 . 3 2 63 63 HIS CE1 C 13 138.660 0.008 . 1 . . . . 63 HIS CE1 . 7125 1 1946 . 3 2 63 63 HIS N N 15 120.455 0.038 . 1 . . . . 63 HIS N . 7125 1 1947 . 3 2 64 64 GLY H H 1 8.214 0.012 . 1 . . . . 64 GLY HN . 7125 1 1948 . 3 2 64 64 GLY HA2 H 1 2.998 0.001 . 2 . . . . 64 GLY HA2 . 7125 1 1949 . 3 2 64 64 GLY HA3 H 1 2.562 0.000 . 2 . . . . 64 GLY HA3 . 7125 1 1950 . 3 2 64 64 GLY CA C 13 46.131 0.154 . 1 . . . . 64 GLY CA . 7125 1 1951 . 3 2 64 64 GLY N N 15 105.417 0.086 . 1 . . . . 64 GLY N . 7125 1 1952 . 3 2 65 65 LYS H H 1 7.098 0.012 . 1 . . . . 65 LYS HN . 7125 1 1953 . 3 2 65 65 LYS HA H 1 4.071 0.038 . 1 . . . . 65 LYS HA . 7125 1 1954 . 3 2 65 65 LYS HB2 H 1 1.865 0.033 . 2 . . . . 65 LYS HB2 . 7125 1 1955 . 3 2 65 65 LYS HB3 H 1 1.751 0.000 . 2 . . . . 65 LYS HB3 . 7125 1 1956 . 3 2 65 65 LYS HG2 H 1 1.537 0.000 . 2 . . . . 65 LYS HG2 . 7125 1 1957 . 3 2 65 65 LYS HD2 H 1 1.659 0.000 . 2 . . . . 65 LYS HD2 . 7125 1 1958 . 3 2 65 65 LYS HE2 H 1 2.917 0.000 . 2 . . . . 65 LYS HE2 . 7125 1 1959 . 3 2 65 65 LYS CA C 13 60.149 0.059 . 1 . . . . 65 LYS CA . 7125 1 1960 . 3 2 65 65 LYS CB C 13 32.247 0.075 . 1 . . . . 65 LYS CB . 7125 1 1961 . 3 2 65 65 LYS CG C 13 25.612 0.000 . 1 . . . . 65 LYS CG . 7125 1 1962 . 3 2 65 65 LYS CD C 13 29.655 0.000 . 1 . . . . 65 LYS CD . 7125 1 1963 . 3 2 65 65 LYS CE C 13 42.303 0.000 . 1 . . . . 65 LYS CE . 7125 1 1964 . 3 2 65 65 LYS N N 15 120.844 0.060 . 1 . . . . 65 LYS N . 7125 1 1965 . 3 2 66 66 LYS H H 1 6.966 0.011 . 1 . . . . 66 LYS HN . 7125 1 1966 . 3 2 66 66 LYS HA H 1 4.169 0.004 . 1 . . . . 66 LYS HA . 7125 1 1967 . 3 2 66 66 LYS HB2 H 1 1.927 0.000 . 2 . . . . 66 LYS HB2 . 7125 1 1968 . 3 2 66 66 LYS HB3 H 1 1.540 0.000 . 2 . . . . 66 LYS HB3 . 7125 1 1969 . 3 2 66 66 LYS HG2 H 1 1.561 0.010 . 2 . . . . 66 LYS HG2 . 7125 1 1970 . 3 2 66 66 LYS HD2 H 1 1.908 0.000 . 2 . . . . 66 LYS HD2 . 7125 1 1971 . 3 2 66 66 LYS HD3 H 1 1.758 0.000 . 2 . . . . 66 LYS HD3 . 7125 1 1972 . 3 2 66 66 LYS HE2 H 1 3.114 0.000 . 2 . . . . 66 LYS HE2 . 7125 1 1973 . 3 2 66 66 LYS CA C 13 59.581 0.033 . 1 . . . . 66 LYS CA . 7125 1 1974 . 3 2 66 66 LYS CB C 13 31.892 0.175 . 1 . . . . 66 LYS CB . 7125 1 1975 . 3 2 66 66 LYS CG C 13 25.689 0.043 . 1 . . . . 66 LYS CG . 7125 1 1976 . 3 2 66 66 LYS CD C 13 30.127 0.132 . 1 . . . . 66 LYS CD . 7125 1 1977 . 3 2 66 66 LYS CE C 13 42.395 0.000 . 1 . . . . 66 LYS CE . 7125 1 1978 . 3 2 66 66 LYS N N 15 120.201 0.048 . 1 . . . . 66 LYS N . 7125 1 1979 . 3 2 67 67 VAL H H 1 7.312 0.008 . 1 . . . . 67 VAL HN . 7125 1 1980 . 3 2 67 67 VAL HA H 1 3.523 0.006 . 1 . . . . 67 VAL HA . 7125 1 1981 . 3 2 67 67 VAL HB H 1 1.431 0.004 . 1 . . . . 67 VAL HB . 7125 1 1982 . 3 2 67 67 VAL HG11 H 1 -1.827 0.013 . 2 . . . . 67 VAL HG1# . 7125 1 1983 . 3 2 67 67 VAL HG12 H 1 -1.827 0.013 . 2 . . . . 67 VAL HG1# . 7125 1 1984 . 3 2 67 67 VAL HG13 H 1 -1.827 0.013 . 2 . . . . 67 VAL HG1# . 7125 1 1985 . 3 2 67 67 VAL HG21 H 1 0.179 0.006 . 2 . . . . 67 VAL HG2# . 7125 1 1986 . 3 2 67 67 VAL HG22 H 1 0.179 0.006 . 2 . . . . 67 VAL HG2# . 7125 1 1987 . 3 2 67 67 VAL HG23 H 1 0.179 0.006 . 2 . . . . 67 VAL HG2# . 7125 1 1988 . 3 2 67 67 VAL CA C 13 66.721 0.092 . 1 . . . . 67 VAL CA . 7125 1 1989 . 3 2 67 67 VAL CB C 13 30.801 0.141 . 1 . . . . 67 VAL CB . 7125 1 1990 . 3 2 67 67 VAL CG1 C 13 21.606 0.017 . 2 . . . . 67 VAL CG1 . 7125 1 1991 . 3 2 67 67 VAL CG2 C 13 19.856 0.045 . 2 . . . . 67 VAL CG2 . 7125 1 1992 . 3 2 67 67 VAL N N 15 121.046 0.037 . 1 . . . . 67 VAL N . 7125 1 1993 . 3 2 68 68 LEU H H 1 8.198 0.009 . 1 . . . . 68 LEU HN . 7125 1 1994 . 3 2 68 68 LEU HA H 1 4.386 0.004 . 1 . . . . 68 LEU HA . 7125 1 1995 . 3 2 68 68 LEU HB2 H 1 1.533 0.012 . 2 . . . . 68 LEU HB2 . 7125 1 1996 . 3 2 68 68 LEU HB3 H 1 1.992 0.008 . 2 . . . . 68 LEU HB3 . 7125 1 1997 . 3 2 68 68 LEU HG H 1 1.986 0.001 . 1 . . . . 68 LEU HG . 7125 1 1998 . 3 2 68 68 LEU HD11 H 1 0.743 0.009 . 2 . . . . 68 LEU HD1 . 7125 1 1999 . 3 2 68 68 LEU HD12 H 1 0.743 0.009 . 2 . . . . 68 LEU HD1 . 7125 1 2000 . 3 2 68 68 LEU HD13 H 1 0.743 0.009 . 2 . . . . 68 LEU HD1 . 7125 1 2001 . 3 2 68 68 LEU HD21 H 1 0.755 0.008 . 2 . . . . 68 LEU HD2 . 7125 1 2002 . 3 2 68 68 LEU HD22 H 1 0.755 0.008 . 2 . . . . 68 LEU HD2 . 7125 1 2003 . 3 2 68 68 LEU HD23 H 1 0.755 0.008 . 2 . . . . 68 LEU HD2 . 7125 1 2004 . 3 2 68 68 LEU CA C 13 58.332 0.048 . 1 . . . . 68 LEU CA . 7125 1 2005 . 3 2 68 68 LEU CB C 13 41.390 0.042 . 1 . . . . 68 LEU CB . 7125 1 2006 . 3 2 68 68 LEU CG C 13 27.442 0.058 . 1 . . . . 68 LEU CG . 7125 1 2007 . 3 2 68 68 LEU CD1 C 13 25.257 0.053 . 2 . . . . 68 LEU CD1 . 7125 1 2008 . 3 2 68 68 LEU CD2 C 13 25.402 0.105 . 2 . . . . 68 LEU CD2 . 7125 1 2009 . 3 2 68 68 LEU N N 15 119.594 0.079 . 1 . . . . 68 LEU N . 7125 1 2010 . 3 2 69 69 GLY CA C 13 47.475 0.027 . 1 . . . . 69 G69 CA . 7125 1 2011 . 3 2 69 69 GLY HA2 H 1 4.152 0.011 . 2 . . . . 69 G69 HA2 . 7125 1 2012 . 3 2 69 69 GLY H H 1 8.373 0.012 . 1 . . . . 69 G69 HN . 7125 1 2013 . 3 2 69 69 GLY N N 15 107.883 0.045 . 1 . . . . 69 G69 N . 7125 1 2014 . 3 2 70 70 ALA H H 1 8.135 0.006 . 1 . . . . 70 ALA HN . 7125 1 2015 . 3 2 70 70 ALA HA H 1 4.843 0.023 . 1 . . . . 70 ALA HA . 7125 1 2016 . 3 2 70 70 ALA HB1 H 1 2.415 0.005 . 1 . . . . 70 ALA HB# . 7125 1 2017 . 3 2 70 70 ALA HB2 H 1 2.415 0.005 . 1 . . . . 70 ALA HB# . 7125 1 2018 . 3 2 70 70 ALA HB3 H 1 2.415 0.005 . 1 . . . . 70 ALA HB# . 7125 1 2019 . 3 2 70 70 ALA CA C 13 55.321 0.000 . 1 . . . . 70 ALA CA . 7125 1 2020 . 3 2 70 70 ALA CB C 13 19.446 0.041 . 1 . . . . 70 ALA CB . 7125 1 2021 . 3 2 70 70 ALA N N 15 125.146 0.084 . 1 . . . . 70 ALA N . 7125 1 2022 . 3 2 71 71 PHE H H 1 8.532 0.005 . 1 . . . . 71 PHE HN . 7125 1 2023 . 3 2 71 71 PHE HA H 1 4.209 0.005 . 1 . . . . 71 PHE HA . 7125 1 2024 . 3 2 71 71 PHE HB2 H 1 3.091 0.018 . 2 . . . . 71 PHE HB2 . 7125 1 2025 . 3 2 71 71 PHE HB3 H 1 3.620 0.001 . 2 . . . . 71 PHE HB3 . 7125 1 2026 . 3 2 71 71 PHE HD1 H 1 7.303 0.001 . 3 . . . . 71 PHE HD1 . 7125 1 2027 . 3 2 71 71 PHE CA C 13 64.731 0.056 . 1 . . . . 71 PHE CA . 7125 1 2028 . 3 2 71 71 PHE CB C 13 40.003 0.026 . 1 . . . . 71 PHE CB . 7125 1 2029 . 3 2 71 71 PHE CD1 C 13 131.800 0.011 . 3 . . . . 71 PHE CD1 . 7125 1 2030 . 3 2 71 71 PHE N N 15 118.247 0.048 . 1 . . . . 71 PHE N . 7125 1 2031 . 3 2 72 72 SER H H 1 9.179 0.006 . 1 . . . . 72 SER HN . 7125 1 2032 . 3 2 72 72 SER HA H 1 4.131 0.018 . 1 . . . . 72 SER HA . 7125 1 2033 . 3 2 72 72 SER HB2 H 1 4.541 0.046 . 2 . . . . 72 SER HB2 . 7125 1 2034 . 3 2 72 72 SER HB3 H 1 4.252 0.054 . 2 . . . . 72 SER HB3 . 7125 1 2035 . 3 2 72 72 SER CA C 13 62.636 0.071 . 1 . . . . 72 SER CA . 7125 1 2036 . 3 2 72 72 SER CB C 13 62.996 0.100 . 1 . . . . 72 SER CB . 7125 1 2037 . 3 2 72 72 SER N N 15 116.183 0.069 . 1 . . . . 72 SER N . 7125 1 2038 . 3 2 73 73 ASP H H 1 8.313 0.015 . 1 . . . . 73 ASP HN . 7125 1 2039 . 3 2 73 73 ASP HA H 1 4.600 0.004 . 1 . . . . 73 ASP HA . 7125 1 2040 . 3 2 73 73 ASP HB2 H 1 3.011 0.009 . 2 . . . . 73 ASP HB2 . 7125 1 2041 . 3 2 73 73 ASP HB3 H 1 2.649 0.003 . 2 . . . . 73 ASP HB3 . 7125 1 2042 . 3 2 73 73 ASP CA C 13 57.561 0.021 . 1 . . . . 73 ASP CA . 7125 1 2043 . 3 2 73 73 ASP CB C 13 40.450 0.060 . 1 . . . . 73 ASP CB . 7125 1 2044 . 3 2 73 73 ASP N N 15 123.788 0.052 . 1 . . . . 73 ASP N . 7125 1 2045 . 3 2 74 74 GLY H H 1 8.591 0.006 . 1 . . . . 74 GLY HN . 7125 1 2046 . 3 2 74 74 GLY HA2 H 1 3.588 0.006 . 2 . . . . 74 GLY HA2 . 7125 1 2047 . 3 2 74 74 GLY CA C 13 47.903 0.077 . 1 . . . . 74 GLY CA . 7125 1 2048 . 3 2 74 74 GLY N N 15 108.305 0.067 . 1 . . . . 74 GLY N . 7125 1 2049 . 3 2 75 75 LEU H H 1 8.079 0.008 . 1 . . . . 75 LEU HN . 7125 1 2050 . 3 2 75 75 LEU HA H 1 3.714 0.027 . 1 . . . . 75 LEU HA . 7125 1 2051 . 3 2 75 75 LEU HB2 H 1 1.556 0.009 . 2 . . . . 75 LEU HB2 . 7125 1 2052 . 3 2 75 75 LEU HB3 H 1 1.171 0.015 . 2 . . . . 75 LEU HB3 . 7125 1 2053 . 3 2 75 75 LEU HG H 1 1.270 0.007 . 1 . . . . 75 LEU HG . 7125 1 2054 . 3 2 75 75 LEU HD11 H 1 0.348 0.004 . 2 . . . . 75 LEU HD1 . 7125 1 2055 . 3 2 75 75 LEU HD12 H 1 0.348 0.004 . 2 . . . . 75 LEU HD1 . 7125 1 2056 . 3 2 75 75 LEU HD13 H 1 0.348 0.004 . 2 . . . . 75 LEU HD1 . 7125 1 2057 . 3 2 75 75 LEU HD21 H 1 -0.110 0.011 . 2 . . . . 75 LEU HD2 . 7125 1 2058 . 3 2 75 75 LEU HD22 H 1 -0.110 0.011 . 2 . . . . 75 LEU HD2 . 7125 1 2059 . 3 2 75 75 LEU HD23 H 1 -0.110 0.011 . 2 . . . . 75 LEU HD2 . 7125 1 2060 . 3 2 75 75 LEU CA C 13 57.733 0.034 . 1 . . . . 75 LEU CA . 7125 1 2061 . 3 2 75 75 LEU CB C 13 41.797 0.151 . 1 . . . . 75 LEU CB . 7125 1 2062 . 3 2 75 75 LEU CG C 13 27.270 0.028 . 1 . . . . 75 LEU CG . 7125 1 2063 . 3 2 75 75 LEU CD1 C 13 24.481 0.020 . 2 . . . . 75 LEU CD1 . 7125 1 2064 . 3 2 75 75 LEU CD2 C 13 23.672 0.045 . 2 . . . . 75 LEU CD2 . 7125 1 2065 . 3 2 75 75 LEU N N 15 119.879 0.095 . 1 . . . . 75 LEU N . 7125 1 2066 . 3 2 76 76 ALA H H 1 7.364 0.009 . 1 . . . . 76 ALA HN . 7125 1 2067 . 3 2 76 76 ALA HA H 1 4.130 0.014 . 1 . . . . 76 ALA HA . 7125 1 2068 . 3 2 76 76 ALA HB1 H 1 1.284 0.004 . 1 . . . . 76 ALA HB# . 7125 1 2069 . 3 2 76 76 ALA HB2 H 1 1.284 0.004 . 1 . . . . 76 ALA HB# . 7125 1 2070 . 3 2 76 76 ALA HB3 H 1 1.284 0.004 . 1 . . . . 76 ALA HB# . 7125 1 2071 . 3 2 76 76 ALA CA C 13 52.610 0.112 . 1 . . . . 76 ALA CA . 7125 1 2072 . 3 2 76 76 ALA CB C 13 19.031 0.015 . 1 . . . . 76 ALA CB . 7125 1 2073 . 3 2 76 76 ALA N N 15 118.691 0.049 . 1 . . . . 76 ALA N . 7125 1 2074 . 3 2 77 77 HIS H H 1 7.659 0.008 . 1 . . . . 77 HIS HN . 7125 1 2075 . 3 2 77 77 HIS HA H 1 4.901 0.024 . 1 . . . . 77 HIS HA . 7125 1 2076 . 3 2 77 77 HIS HB2 H 1 3.229 0.007 . 2 . . . . 77 HIS HB2 . 7125 1 2077 . 3 2 77 77 HIS HB3 H 1 2.727 0.019 . 2 . . . . 77 HIS HB3 . 7125 1 2078 . 3 2 77 77 HIS HD2 H 1 7.362 0.004 . 1 . . . . 77 HIS HD2 . 7125 1 2079 . 3 2 77 77 HIS HE1 H 1 8.422 0.001 . 1 . . . . 77 HIS HE1 . 7125 1 2080 . 3 2 77 77 HIS CA C 13 54.503 0.085 . 1 . . . . 77 HIS CA . 7125 1 2081 . 3 2 77 77 HIS CB C 13 29.682 0.036 . 1 . . . . 77 HIS CB . 7125 1 2082 . 3 2 77 77 HIS CD2 C 13 121.407 0.030 . 1 . . . . 77 HIS CD2 . 7125 1 2083 . 3 2 77 77 HIS CE1 C 13 136.371 0.009 . 1 . . . . 77 HIS CE1 . 7125 1 2084 . 3 2 77 77 HIS N N 15 118.360 0.036 . 1 . . . . 77 HIS N . 7125 1 2085 . 3 2 78 78 LEU H H 1 7.802 0.007 . 1 . . . . 78 LEU HN . 7125 1 2086 . 3 2 78 78 LEU HA H 1 3.875 0.013 . 1 . . . . 78 LEU HA . 7125 1 2087 . 3 2 78 78 LEU HB2 H 1 1.623 0.033 . 2 . . . . 78 LEU HB2 . 7125 1 2088 . 3 2 78 78 LEU HG H 1 2.053 0.014 . 1 . . . . 78 LEU HG . 7125 1 2089 . 3 2 78 78 LEU HD11 H 1 0.804 0.023 . 2 . . . . 78 LEU HD1 . 7125 1 2090 . 3 2 78 78 LEU HD12 H 1 0.804 0.023 . 2 . . . . 78 LEU HD1 . 7125 1 2091 . 3 2 78 78 LEU HD13 H 1 0.804 0.023 . 2 . . . . 78 LEU HD1 . 7125 1 2092 . 3 2 78 78 LEU HD21 H 1 0.826 0.004 . 2 . . . . 78 LEU HD2 . 7125 1 2093 . 3 2 78 78 LEU HD22 H 1 0.826 0.004 . 2 . . . . 78 LEU HD2 . 7125 1 2094 . 3 2 78 78 LEU HD23 H 1 0.826 0.004 . 2 . . . . 78 LEU HD2 . 7125 1 2095 . 3 2 78 78 LEU CA C 13 58.240 0.094 . 1 . . . . 78 LEU CA . 7125 1 2096 . 3 2 78 78 LEU CB C 13 42.070 0.006 . 1 . . . . 78 LEU CB . 7125 1 2097 . 3 2 78 78 LEU CG C 13 26.515 0.055 . 1 . . . . 78 LEU CG . 7125 1 2098 . 3 2 78 78 LEU CD1 C 13 26.032 0.020 . 2 . . . . 78 LEU CD1 . 7125 1 2099 . 3 2 78 78 LEU CD2 C 13 24.501 0.097 . 2 . . . . 78 LEU CD2 . 7125 1 2100 . 3 2 78 78 LEU N N 15 120.943 0.052 . 1 . . . . 78 LEU N . 7125 1 2101 . 3 2 79 79 ASP H H 1 8.596 0.006 . 1 . . . . 79 ASP HN . 7125 1 2102 . 3 2 79 79 ASP HA H 1 4.497 0.004 . 1 . . . . 79 ASP HA . 7125 1 2103 . 3 2 79 79 ASP HB2 H 1 2.706 0.007 . 2 . . . . 79 ASP HB2 . 7125 1 2104 . 3 2 79 79 ASP CA C 13 54.183 0.009 . 1 . . . . 79 ASP CA . 7125 1 2105 . 3 2 79 79 ASP CB C 13 40.462 0.082 . 1 . . . . 79 ASP CB . 7125 1 2106 . 3 2 79 79 ASP N N 15 114.595 0.056 . 1 . . . . 79 ASP N . 7125 1 2107 . 3 2 80 80 ASN H H 1 8.105 0.010 . 1 . . . . 80 ASN HN . 7125 1 2108 . 3 2 80 80 ASN HA H 1 5.109 0.017 . 1 . . . . 80 ASN HA . 7125 1 2109 . 3 2 80 80 ASN HB3 H 1 2.606 0.004 . 2 . . . . 80 ASN HB3 . 7125 1 2110 . 3 2 80 80 ASN CA C 13 52.014 0.021 . 1 . . . . 80 ASN CA . 7125 1 2111 . 3 2 80 80 ASN CB C 13 38.174 0.003 . 1 . . . . 80 ASN CB . 7125 1 2112 . 3 2 80 80 ASN N N 15 119.150 0.047 . 1 . . . . 80 ASN N . 7125 1 2113 . 3 2 81 81 LEU H H 1 8.537 0.007 . 1 . . . . 81 LEU HN . 7125 1 2114 . 3 2 81 81 LEU HA H 1 3.958 0.026 . 1 . . . . 81 LEU HA . 7125 1 2115 . 3 2 81 81 LEU HD11 H 1 0.840 0.006 . 2 . . . . 81 LEU HD1 . 7125 1 2116 . 3 2 81 81 LEU HD12 H 1 0.840 0.006 . 2 . . . . 81 LEU HD1 . 7125 1 2117 . 3 2 81 81 LEU HD13 H 1 0.840 0.006 . 2 . . . . 81 LEU HD1 . 7125 1 2118 . 3 2 81 81 LEU HD21 H 1 0.808 0.031 . 2 . . . . 81 LEU HD2 . 7125 1 2119 . 3 2 81 81 LEU HD22 H 1 0.808 0.031 . 2 . . . . 81 LEU HD2 . 7125 1 2120 . 3 2 81 81 LEU HD23 H 1 0.808 0.031 . 2 . . . . 81 LEU HD2 . 7125 1 2121 . 3 2 81 81 LEU CA C 13 58.593 0.041 . 1 . . . . 81 LEU CA . 7125 1 2122 . 3 2 81 81 LEU CD1 C 13 24.623 0.000 . 2 . . . . 81 LEU CD1 . 7125 1 2123 . 3 2 81 81 LEU CD2 C 13 26.134 0.059 . 2 . . . . 81 LEU CD2 . 7125 1 2124 . 3 2 82 82 LYS H H 1 8.658 0.005 . 1 . . . . 82 LYS HN . 7125 1 2125 . 3 2 82 82 LYS HA H 1 3.626 0.002 . 1 . . . . 82 LYS HA . 7125 1 2126 . 3 2 82 82 LYS HB2 H 1 1.360 0.011 . 2 . . . . 82 LYS HB2 . 7125 1 2127 . 3 2 82 82 LYS HB3 H 1 1.651 0.005 . 2 . . . . 82 LYS HB3 . 7125 1 2128 . 3 2 82 82 LYS HG2 H 1 1.147 0.010 . 2 . . . . 82 LYS HG2 . 7125 1 2129 . 3 2 82 82 LYS HG3 H 1 0.829 0.007 . 2 . . . . 82 LYS HG3 . 7125 1 2130 . 3 2 82 82 LYS HD2 H 1 1.244 0.002 . 2 . . . . 82 LYS HD2 . 7125 1 2131 . 3 2 82 82 LYS CA C 13 60.995 0.012 . 1 . . . . 82 LYS CA . 7125 1 2132 . 3 2 82 82 LYS CB C 13 31.619 0.033 . 1 . . . . 82 LYS CB . 7125 1 2133 . 3 2 82 82 LYS CG C 13 25.751 0.065 . 1 . . . . 82 LYS CG . 7125 1 2134 . 3 2 82 82 LYS CD C 13 29.321 0.055 . 1 . . . . 82 LYS CD . 7125 1 2135 . 3 2 82 82 LYS N N 15 118.370 0.068 . 1 . . . . 82 LYS N . 7125 1 2136 . 3 2 83 83 GLY H H 1 7.510 0.006 . 1 . . . . 83 GLY HN . 7125 1 2137 . 3 2 83 83 GLY HA2 H 1 3.789 0.000 . 2 . . . . 83 GLY HA2 . 7125 1 2138 . 3 2 83 83 GLY CA C 13 47.046 0.000 . 1 . . . . 83 GLY CA . 7125 1 2139 . 3 2 83 83 GLY N N 15 104.045 0.072 . 1 . . . . 83 GLY N . 7125 1 2140 . 3 2 84 84 THR H H 1 7.577 0.018 . 1 . . . . 84 THR HN . 7125 1 2141 . 3 2 84 84 THR HA H 1 3.704 0.005 . 1 . . . . 84 THR HA . 7125 1 2142 . 3 2 84 84 THR HB H 1 3.771 0.012 . 1 . . . . 84 THR HB . 7125 1 2143 . 3 2 84 84 THR HG21 H 1 0.494 0.007 . 1 . . . . 84 THR HG2# . 7125 1 2144 . 3 2 84 84 THR HG22 H 1 0.494 0.007 . 1 . . . . 84 THR HG2# . 7125 1 2145 . 3 2 84 84 THR HG23 H 1 0.494 0.007 . 1 . . . . 84 THR HG2# . 7125 1 2146 . 3 2 84 84 THR CA C 13 66.407 0.035 . 1 . . . . 84 THR CA . 7125 1 2147 . 3 2 84 84 THR CB C 13 68.924 0.047 . 1 . . . . 84 THR CB . 7125 1 2148 . 3 2 84 84 THR CG2 C 13 20.478 0.038 . 1 . . . . 84 THR CG2 . 7125 1 2149 . 3 2 84 84 THR N N 15 118.273 0.028 . 1 . . . . 84 THR N . 7125 1 2150 . 3 2 85 85 PHE H H 1 7.704 0.013 . 1 . . . . 85 PHE HN . 7125 1 2151 . 3 2 85 85 PHE HA H 1 4.671 0.009 . 1 . . . . 85 PHE HA . 7125 1 2152 . 3 2 85 85 PHE HB2 H 1 3.111 0.000 . 2 . . . . 85 PHE HB2 . 7125 1 2153 . 3 2 85 85 PHE HB3 H 1 2.606 0.000 . 2 . . . . 85 PHE HB3 . 7125 1 2154 . 3 2 85 85 PHE HD1 H 1 7.197 0.005 . 3 . . . . 85 PHE HD1 . 7125 1 2155 . 3 2 85 85 PHE HE1 H 1 7.193 0.002 . 3 . . . . 85 PHE HE1 . 7125 1 2156 . 3 2 85 85 PHE CA C 13 58.195 0.067 . 1 . . . . 85 PHE CA . 7125 1 2157 . 3 2 85 85 PHE CB C 13 38.347 0.005 . 1 . . . . 85 PHE CB . 7125 1 2158 . 3 2 85 85 PHE CD1 C 13 130.775 0.083 . 3 . . . . 85 PHE CD1 . 7125 1 2159 . 3 2 85 85 PHE CE1 C 13 131.212 0.068 . 3 . . . . 85 PHE CE1 . 7125 1 2160 . 3 2 85 85 PHE N N 15 115.814 0.071 . 1 . . . . 85 PHE N . 7125 1 2161 . 3 2 86 86 ALA H H 1 7.114 0.005 . 1 . . . . 86 ALA HN . 7125 1 2162 . 3 2 86 86 ALA HA H 1 4.122 0.028 . 1 . . . . 86 ALA HA . 7125 1 2163 . 3 2 86 86 ALA HB1 H 1 1.528 0.009 . 1 . . . . 86 ALA HB# . 7125 1 2164 . 3 2 86 86 ALA HB2 H 1 1.528 0.009 . 1 . . . . 86 ALA HB# . 7125 1 2165 . 3 2 86 86 ALA HB3 H 1 1.528 0.009 . 1 . . . . 86 ALA HB# . 7125 1 2166 . 3 2 86 86 ALA CA C 13 57.366 0.106 . 1 . . . . 86 ALA CA . 7125 1 2167 . 3 2 86 86 ALA CB C 13 18.399 0.060 . 1 . . . . 86 ALA CB . 7125 1 2168 . 3 2 86 86 ALA N N 15 124.988 0.052 . 1 . . . . 86 ALA N . 7125 1 2169 . 3 2 87 87 THR H H 1 8.400 0.003 . 1 . . . . 87 THR HN . 7125 1 2170 . 3 2 87 87 THR HA H 1 3.937 0.014 . 1 . . . . 87 THR HA . 7125 1 2171 . 3 2 87 87 THR HB H 1 4.105 0.016 . 1 . . . . 87 THR HB . 7125 1 2172 . 3 2 87 87 THR HG21 H 1 1.159 0.000 . 1 . . . . 87 THR HG2# . 7125 1 2173 . 3 2 87 87 THR HG22 H 1 1.159 0.000 . 1 . . . . 87 THR HG2# . 7125 1 2174 . 3 2 87 87 THR HG23 H 1 1.159 0.000 . 1 . . . . 87 THR HG2# . 7125 1 2175 . 3 2 87 87 THR CA C 13 66.184 0.053 . 1 . . . . 87 THR CA . 7125 1 2176 . 3 2 87 87 THR CB C 13 68.135 0.038 . 1 . . . . 87 THR CB . 7125 1 2177 . 3 2 87 87 THR CG2 C 13 22.304 0.000 . 1 . . . . 87 THR CG2 . 7125 1 2178 . 3 2 87 87 THR N N 15 114.294 0.077 . 1 . . . . 87 THR N . 7125 1 2179 . 3 2 88 88 LEU H H 1 7.848 0.007 . 1 . . . . 88 LEU HN . 7125 1 2180 . 3 2 88 88 LEU HA H 1 3.570 0.030 . 1 . . . . 88 LEU HA . 7125 1 2181 . 3 2 88 88 LEU HB2 H 1 0.324 0.029 . 2 . . . . 88 LEU HB2 . 7125 1 2182 . 3 2 88 88 LEU HB3 H 1 1.486 0.003 . 2 . . . . 88 LEU HB3 . 7125 1 2183 . 3 2 88 88 LEU HG H 1 1.400 0.000 . 1 . . . . 88 LEU HG . 7125 1 2184 . 3 2 88 88 LEU HD11 H 1 0.975 0.003 . 2 . . . . 88 LEU HD1 . 7125 1 2185 . 3 2 88 88 LEU HD12 H 1 0.975 0.003 . 2 . . . . 88 LEU HD1 . 7125 1 2186 . 3 2 88 88 LEU HD13 H 1 0.975 0.003 . 2 . . . . 88 LEU HD1 . 7125 1 2187 . 3 2 88 88 LEU HD21 H 1 0.585 0.014 . 2 . . . . 88 LEU HD2 . 7125 1 2188 . 3 2 88 88 LEU HD22 H 1 0.585 0.014 . 2 . . . . 88 LEU HD2 . 7125 1 2189 . 3 2 88 88 LEU HD23 H 1 0.585 0.014 . 2 . . . . 88 LEU HD2 . 7125 1 2190 . 3 2 88 88 LEU CA C 13 56.942 0.107 . 1 . . . . 88 LEU CA . 7125 1 2191 . 3 2 88 88 LEU CB C 13 42.154 0.131 . 1 . . . . 88 LEU CB . 7125 1 2192 . 3 2 88 88 LEU CG C 13 26.611 0.000 . 1 . . . . 88 LEU CG . 7125 1 2193 . 3 2 88 88 LEU CD1 C 13 25.934 0.042 . 2 . . . . 88 LEU CD1 . 7125 1 2194 . 3 2 88 88 LEU CD2 C 13 23.718 0.047 . 2 . . . . 88 LEU CD2 . 7125 1 2195 . 3 2 88 88 LEU N N 15 123.344 0.041 . 1 . . . . 88 LEU N . 7125 1 2196 . 3 2 89 89 SER H H 1 8.990 0.007 . 1 . . . . 89 SER HN . 7125 1 2197 . 3 2 89 89 SER HA H 1 3.784 0.001 . 1 . . . . 89 SER HA . 7125 1 2198 . 3 2 89 89 SER HB3 H 1 3.816 0.003 . 2 . . . . 89 SER HB3 . 7125 1 2199 . 3 2 89 89 SER CA C 13 60.880 0.065 . 1 . . . . 89 SER CA . 7125 1 2200 . 3 2 89 89 SER CB C 13 64.094 0.147 . 1 . . . . 89 SER CB . 7125 1 2201 . 3 2 89 89 SER N N 15 119.729 0.059 . 1 . . . . 89 SER N . 7125 1 2202 . 3 2 90 90 GLU CA C 13 60.206 0.124 . 1 . . . . 90 E90 CA . 7125 1 2203 . 3 2 90 90 GLU CB C 13 29.301 0.041 . 1 . . . . 90 E90 CB . 7125 1 2204 . 3 2 90 90 GLU CG C 13 36.367 0.070 . 1 . . . . 90 E90 CG . 7125 1 2205 . 3 2 90 90 GLU HA H 1 3.538 0.016 . 1 . . . . 90 E90 HA . 7125 1 2206 . 3 2 90 90 GLU HB2 H 1 1.965 0.010 . 2 . . . . 90 E90 HB2 . 7125 1 2207 . 3 2 90 90 GLU HG2 H 1 2.271 0.011 . 2 . . . . 90 E90 HG2 . 7125 1 2208 . 3 2 90 90 GLU HG3 H 1 1.968 0.016 . 2 . . . . 90 E90 HG3 . 7125 1 2209 . 3 2 90 90 GLU H H 1 7.548 0.012 . 1 . . . . 90 E90 HN . 7125 1 2210 . 3 2 90 90 GLU N N 15 120.234 0.072 . 1 . . . . 90 E90 N . 7125 1 2211 . 3 2 91 91 LEU H H 1 7.253 0.010 . 1 . . . . 91 LEU HN . 7125 1 2212 . 3 2 91 91 LEU HA H 1 3.617 0.011 . 1 . . . . 91 LEU HA . 7125 1 2213 . 3 2 91 91 LEU HB2 H 1 1.342 0.000 . 2 . . . . 91 LEU HB2 . 7125 1 2214 . 3 2 91 91 LEU HB3 H 1 0.824 0.023 . 2 . . . . 91 LEU HB3 . 7125 1 2215 . 3 2 91 91 LEU HD11 H 1 0.530 0.019 . 2 . . . . 91 LEU HD1 . 7125 1 2216 . 3 2 91 91 LEU HD12 H 1 0.530 0.019 . 2 . . . . 91 LEU HD1 . 7125 1 2217 . 3 2 91 91 LEU HD13 H 1 0.530 0.019 . 2 . . . . 91 LEU HD1 . 7125 1 2218 . 3 2 91 91 LEU HD21 H 1 -0.096 0.007 . 2 . . . . 91 LEU HD2 . 7125 1 2219 . 3 2 91 91 LEU HD22 H 1 -0.096 0.007 . 2 . . . . 91 LEU HD2 . 7125 1 2220 . 3 2 91 91 LEU HD23 H 1 -0.096 0.007 . 2 . . . . 91 LEU HD2 . 7125 1 2221 . 3 2 91 91 LEU CA C 13 57.789 0.097 . 1 . . . . 91 LEU CA . 7125 1 2222 . 3 2 91 91 LEU CB C 13 41.719 0.069 . 1 . . . . 91 LEU CB . 7125 1 2223 . 3 2 91 91 LEU CD1 C 13 22.768 0.047 . 2 . . . . 91 LEU CD1 . 7125 1 2224 . 3 2 91 91 LEU CD2 C 13 26.137 0.056 . 2 . . . . 91 LEU CD2 . 7125 1 2225 . 3 2 91 91 LEU N N 15 117.386 0.034 . 1 . . . . 91 LEU N . 7125 1 2226 . 3 2 92 92 HIS H H 1 7.091 0.008 . 1 . . . . 92 HIS HN . 7125 1 2227 . 3 2 92 92 HIS HA H 1 2.627 0.001 . 1 . . . . 92 HIS HA . 7125 1 2228 . 3 2 92 92 HIS HD1 H 1 9.353 0.010 . 1 . . . . 92 HIS HD1 . 7125 1 2229 . 3 2 92 92 HIS HD2 H 1 0.889 0.000 . 1 . . . . 92 HIS HD2 . 7125 1 2230 . 3 2 92 92 HIS HE1 H 1 1.405 0.002 . 1 . . . . 92 HIS HE1 . 7125 1 2231 . 3 2 92 92 HIS CA C 13 60.597 0.006 . 1 . . . . 92 HIS CA . 7125 1 2232 . 3 2 92 92 HIS CD2 C 13 122.753 0.000 . 1 . . . . 92 HIS CD2 . 7125 1 2233 . 3 2 92 92 HIS CE1 C 13 132.239 0.016 . 1 . . . . 92 HIS CE1 . 7125 1 2234 . 3 2 92 92 HIS N N 15 112.027 0.044 . 1 . . . . 92 HIS N . 7125 1 2235 . 3 2 92 92 HIS ND1 N 15 163.539 0.042 . 1 . . . . 92 HIS ND1 . 7125 1 2236 . 3 2 93 93 CYS H H 1 7.910 0.014 . 1 . . . . 93 CYS HN . 7125 1 2237 . 3 2 93 93 CYS HA H 1 4.188 0.009 . 1 . . . . 93 CYS HA . 7125 1 2238 . 3 2 93 93 CYS HB3 H 1 1.982 0.000 . 2 . . . . 93 CYS HB3 . 7125 1 2239 . 3 2 93 93 CYS CA C 13 60.334 0.079 . 1 . . . . 93 CYS CA . 7125 1 2240 . 3 2 93 93 CYS CB C 13 28.144 0.000 . 1 . . . . 93 CYS CB . 7125 1 2241 . 3 2 93 93 CYS N N 15 114.878 0.043 . 1 . . . . 93 CYS N . 7125 1 2242 . 3 2 94 94 ASP H H 1 7.292 0.009 . 1 . . . . 94 ASP HN . 7125 1 2243 . 3 2 94 94 ASP HA H 1 4.267 0.010 . 1 . . . . 94 ASP HA . 7125 1 2244 . 3 2 94 94 ASP HB3 H 1 2.575 0.065 . 2 . . . . 94 ASP HB3 . 7125 1 2245 . 3 2 94 94 ASP CA C 13 56.785 0.088 . 1 . . . . 94 ASP CA . 7125 1 2246 . 3 2 94 94 ASP CB C 13 41.159 0.125 . 1 . . . . 94 ASP CB . 7125 1 2247 . 3 2 94 94 ASP N N 15 117.010 0.106 . 1 . . . . 94 ASP N . 7125 1 2248 . 3 2 95 95 LYS H H 1 6.826 0.010 . 1 . . . . 95 LYS HN . 7125 1 2249 . 3 2 95 95 LYS HA H 1 4.272 0.013 . 1 . . . . 95 LYS HA . 7125 1 2250 . 3 2 95 95 LYS HB2 H 1 1.893 0.017 . 2 . . . . 95 LYS HB2 . 7125 1 2251 . 3 2 95 95 LYS HG2 H 1 1.211 0.009 . 2 . . . . 95 LYS HG2 . 7125 1 2252 . 3 2 95 95 LYS HD2 H 1 1.487 0.000 . 2 . . . . 95 LYS HD2 . 7125 1 2253 . 3 2 95 95 LYS HE2 H 1 2.862 0.000 . 2 . . . . 95 LYS HE2 . 7125 1 2254 . 3 2 95 95 LYS CA C 13 57.590 0.002 . 1 . . . . 95 LYS CA . 7125 1 2255 . 3 2 95 95 LYS CB C 13 32.070 0.007 . 1 . . . . 95 LYS CB . 7125 1 2256 . 3 2 95 95 LYS CG C 13 25.297 0.043 . 1 . . . . 95 LYS CG . 7125 1 2257 . 3 2 95 95 LYS CD C 13 28.956 0.000 . 1 . . . . 95 LYS CD . 7125 1 2258 . 3 2 95 95 LYS CE C 13 42.230 0.000 . 1 . . . . 95 LYS CE . 7125 1 2259 . 3 2 95 95 LYS N N 15 115.242 0.046 . 1 . . . . 95 LYS N . 7125 1 2260 . 3 2 96 96 LEU H H 1 7.253 0.009 . 1 . . . . 96 LEU HN . 7125 1 2261 . 3 2 96 96 LEU HA H 1 4.199 0.003 . 1 . . . . 96 LEU HA . 7125 1 2262 . 3 2 96 96 LEU HG H 1 0.986 0.000 . 1 . . . . 96 LEU HG . 7125 1 2263 . 3 2 96 96 LEU HD11 H 1 0.928 0.020 . 2 . . . . 96 LEU HD1 . 7125 1 2264 . 3 2 96 96 LEU HD12 H 1 0.928 0.020 . 2 . . . . 96 LEU HD1 . 7125 1 2265 . 3 2 96 96 LEU HD13 H 1 0.928 0.020 . 2 . . . . 96 LEU HD1 . 7125 1 2266 . 3 2 96 96 LEU HD21 H 1 -0.690 0.016 . 2 . . . . 96 LEU HD2 . 7125 1 2267 . 3 2 96 96 LEU HD22 H 1 -0.690 0.016 . 2 . . . . 96 LEU HD2 . 7125 1 2268 . 3 2 96 96 LEU HD23 H 1 -0.690 0.016 . 2 . . . . 96 LEU HD2 . 7125 1 2269 . 3 2 96 96 LEU CA C 13 55.321 0.000 . 1 . . . . 96 LEU CA . 7125 1 2270 . 3 2 96 96 LEU CG C 13 25.861 0.000 . 1 . . . . 96 LEU CG . 7125 1 2271 . 3 2 96 96 LEU CD1 C 13 22.147 0.065 . 2 . . . . 96 LEU CD1 . 7125 1 2272 . 3 2 96 96 LEU CD2 C 13 24.575 0.067 . 2 . . . . 96 LEU CD2 . 7125 1 2273 . 3 2 96 96 LEU N N 15 114.337 0.063 . 1 . . . . 96 LEU N . 7125 1 2274 . 3 2 97 97 HIS H H 1 6.387 0.012 . 1 . . . . 97 HIS HN . 7125 1 2275 . 3 2 97 97 HIS HA H 1 4.505 0.010 . 1 . . . . 97 HIS HA . 7125 1 2276 . 3 2 97 97 HIS HB2 H 1 3.281 0.036 . 2 . . . . 97 HIS HB2 . 7125 1 2277 . 3 2 97 97 HIS HB3 H 1 3.695 0.013 . 2 . . . . 97 HIS HB3 . 7125 1 2278 . 3 2 97 97 HIS HD2 H 1 7.102 0.004 . 1 . . . . 97 HIS HD2 . 7125 1 2279 . 3 2 97 97 HIS HE1 H 1 8.323 0.005 . 1 . . . . 97 HIS HE1 . 7125 1 2280 . 3 2 97 97 HIS CA C 13 56.319 0.008 . 1 . . . . 97 HIS CA . 7125 1 2281 . 3 2 97 97 HIS CB C 13 26.443 0.103 . 1 . . . . 97 HIS CB . 7125 1 2282 . 3 2 97 97 HIS CD2 C 13 120.692 0.020 . 1 . . . . 97 HIS CD2 . 7125 1 2283 . 3 2 97 97 HIS CE1 C 13 137.103 0.011 . 1 . . . . 97 HIS CE1 . 7125 1 2284 . 3 2 97 97 HIS N N 15 110.856 0.055 . 1 . . . . 97 HIS N . 7125 1 2285 . 3 2 98 98 VAL H H 1 8.057 0.012 . 1 . . . . 98 VAL HN . 7125 1 2286 . 3 2 98 98 VAL HA H 1 3.813 0.007 . 1 . . . . 98 VAL HA . 7125 1 2287 . 3 2 98 98 VAL HB H 1 1.325 0.000 . 1 . . . . 98 VAL HB . 7125 1 2288 . 3 2 98 98 VAL HG11 H 1 0.633 0.008 . 2 . . . . 98 VAL HG1# . 7125 1 2289 . 3 2 98 98 VAL HG12 H 1 0.633 0.008 . 2 . . . . 98 VAL HG1# . 7125 1 2290 . 3 2 98 98 VAL HG13 H 1 0.633 0.008 . 2 . . . . 98 VAL HG1# . 7125 1 2291 . 3 2 98 98 VAL HG21 H 1 0.130 0.019 . 2 . . . . 98 VAL HG2# . 7125 1 2292 . 3 2 98 98 VAL HG22 H 1 0.130 0.019 . 2 . . . . 98 VAL HG2# . 7125 1 2293 . 3 2 98 98 VAL HG23 H 1 0.130 0.019 . 2 . . . . 98 VAL HG2# . 7125 1 2294 . 3 2 98 98 VAL CA C 13 62.774 0.001 . 1 . . . . 98 VAL CA . 7125 1 2295 . 3 2 98 98 VAL CB C 13 32.753 0.000 . 1 . . . . 98 VAL CB . 7125 1 2296 . 3 2 98 98 VAL CG1 C 13 21.765 0.070 . 2 . . . . 98 VAL CG1 . 7125 1 2297 . 3 2 98 98 VAL CG2 C 13 21.348 0.078 . 2 . . . . 98 VAL CG2 . 7125 1 2298 . 3 2 98 98 VAL N N 15 119.491 0.049 . 1 . . . . 98 VAL N . 7125 1 2299 . 3 2 99 99 ASP H H 1 9.297 0.012 . 1 . . . . 99 ASP HN . 7125 1 2300 . 3 2 99 99 ASP HA H 1 4.589 0.000 . 1 . . . . 99 ASP HA . 7125 1 2301 . 3 2 99 99 ASP HB2 H 1 2.721 0.000 . 2 . . . . 99 ASP HB2 . 7125 1 2302 . 3 2 99 99 ASP CA C 13 54.254 0.000 . 1 . . . . 99 ASP CA . 7125 1 2303 . 3 2 99 99 ASP CB C 13 43.365 0.000 . 1 . . . . 99 ASP CB . 7125 1 2304 . 3 2 99 99 ASP N N 15 130.974 0.056 . 1 . . . . 99 ASP N . 7125 1 2305 . 3 2 100 100 PRO HA H 1 3.503 0.004 . 1 . . . . 100 PRO HA . 7125 1 2306 . 3 2 100 100 PRO HB2 H 1 2.036 0.000 . 2 . . . . 100 PRO HB2 . 7125 1 2307 . 3 2 100 100 PRO HB3 H 1 2.162 0.000 . 2 . . . . 100 PRO HB3 . 7125 1 2308 . 3 2 100 100 PRO HD2 H 1 3.612 0.081 . 2 . . . . 100 PRO HD2 . 7125 1 2309 . 3 2 100 100 PRO HD3 H 1 3.311 0.002 . 2 . . . . 100 PRO HD3 . 7125 1 2310 . 3 2 100 100 PRO CA C 13 64.327 0.052 . 1 . . . . 100 PRO CA . 7125 1 2311 . 3 2 100 100 PRO CB C 13 32.340 0.000 . 1 . . . . 100 PRO CB . 7125 1 2312 . 3 2 100 100 PRO CD C 13 51.282 0.000 . 1 . . . . 100 PRO CD . 7125 1 2313 . 3 2 101 101 GLU H H 1 9.088 0.015 . 1 . . . . 101 GLU HN . 7125 1 2314 . 3 2 101 101 GLU HA H 1 4.261 0.020 . 1 . . . . 101 GLU HA . 7125 1 2315 . 3 2 101 101 GLU HB2 H 1 1.935 0.020 . 2 . . . . 101 GLU HB2 . 7125 1 2316 . 3 2 101 101 GLU HB3 H 1 2.182 0.000 . 2 . . . . 101 GLU HB3 . 7125 1 2317 . 3 2 101 101 GLU HG2 H 1 2.292 0.007 . 2 . . . . 101 GLU HG2 . 7125 1 2318 . 3 2 101 101 GLU HG3 H 1 2.726 0.003 . 2 . . . . 101 GLU HG3 . 7125 1 2319 . 3 2 101 101 GLU CA C 13 59.397 0.057 . 1 . . . . 101 GLU CA . 7125 1 2320 . 3 2 101 101 GLU CB C 13 29.005 0.034 . 1 . . . . 101 GLU CB . 7125 1 2321 . 3 2 101 101 GLU CG C 13 35.700 0.050 . 1 . . . . 101 GLU CG . 7125 1 2322 . 3 2 101 101 GLU N N 15 123.745 0.111 . 1 . . . . 101 GLU N . 7125 1 2323 . 3 2 102 102 ASN H H 1 8.200 0.009 . 1 . . . . 102 ASN HN . 7125 1 2324 . 3 2 102 102 ASN HA H 1 4.693 0.000 . 1 . . . . 102 ASN HA . 7125 1 2325 . 3 2 102 102 ASN CA C 13 56.774 0.000 . 1 . . . . 102 ASN CA . 7125 1 2326 . 3 2 102 102 ASN N N 15 112.413 0.072 . 1 . . . . 102 ASN N . 7125 1 2327 . 3 2 103 103 PHE H H 1 7.610 0.014 . 1 . . . . 103 PHE HN . 7125 1 2328 . 3 2 103 103 PHE HA H 1 5.471 0.000 . 1 . . . . 103 PHE HA . 7125 1 2329 . 3 2 103 103 PHE HB2 H 1 3.539 0.000 . 2 . . . . 103 PHE HB1 . 7125 1 2330 . 3 2 103 103 PHE CA C 13 59.056 0.000 . 1 . . . . 103 PHE CA . 7125 1 2331 . 3 2 103 103 PHE CB C 13 38.320 0.000 . 1 . . . . 103 PHE CB . 7125 1 2332 . 3 2 103 103 PHE N N 15 117.932 0.063 . 1 . . . . 103 PHE N . 7125 1 2333 . 3 2 104 104 ARG H H 1 7.349 0.007 . 1 . . . . 104 ARG HN . 7125 1 2334 . 3 2 104 104 ARG HA H 1 4.184 0.033 . 1 . . . . 104 ARG HA . 7125 1 2335 . 3 2 104 104 ARG HB2 H 1 2.097 0.047 . 2 . . . . 104 ARG HB2 . 7125 1 2336 . 3 2 104 104 ARG HG2 H 1 1.754 0.000 . 2 . . . . 104 ARG HG2 . 7125 1 2337 . 3 2 104 104 ARG HD2 H 1 3.277 0.000 . 2 . . . . 104 ARG HD2 . 7125 1 2338 . 3 2 104 104 ARG CA C 13 59.305 0.050 . 1 . . . . 104 ARG CA . 7125 1 2339 . 3 2 104 104 ARG CB C 13 30.029 0.033 . 1 . . . . 104 ARG CB . 7125 1 2340 . 3 2 104 104 ARG CG C 13 27.789 0.000 . 1 . . . . 104 ARG CG . 7125 1 2341 . 3 2 104 104 ARG CD C 13 43.495 0.000 . 1 . . . . 104 ARG CD . 7125 1 2342 . 3 2 104 104 ARG N N 15 119.480 0.044 . 1 . . . . 104 ARG N . 7125 1 2343 . 3 2 105 105 LEU H H 1 8.007 0.017 . 1 . . . . 105 LEU HN . 7125 1 2344 . 3 2 105 105 LEU HA H 1 4.119 0.017 . 1 . . . . 105 LEU HA . 7125 1 2345 . 3 2 105 105 LEU HB2 H 1 1.952 0.000 . 2 . . . . 105 LEU HB2 . 7125 1 2346 . 3 2 105 105 LEU HB3 H 1 1.024 0.000 . 2 . . . . 105 LEU HB3 . 7125 1 2347 . 3 2 105 105 LEU HG H 1 1.907 0.000 . 1 . . . . 105 LEU HG . 7125 1 2348 . 3 2 105 105 LEU HD11 H 1 0.647 0.011 . 2 . . . . 105 LEU HD1 . 7125 1 2349 . 3 2 105 105 LEU HD12 H 1 0.647 0.011 . 2 . . . . 105 LEU HD1 . 7125 1 2350 . 3 2 105 105 LEU HD13 H 1 0.647 0.011 . 2 . . . . 105 LEU HD1 . 7125 1 2351 . 3 2 105 105 LEU HD21 H 1 0.583 0.016 . 2 . . . . 105 LEU HD2 . 7125 1 2352 . 3 2 105 105 LEU HD22 H 1 0.583 0.016 . 2 . . . . 105 LEU HD2 . 7125 1 2353 . 3 2 105 105 LEU HD23 H 1 0.583 0.016 . 2 . . . . 105 LEU HD2 . 7125 1 2354 . 3 2 105 105 LEU CA C 13 58.490 0.059 . 1 . . . . 105 LEU CA . 7125 1 2355 . 3 2 105 105 LEU CB C 13 40.578 0.005 . 1 . . . . 105 LEU CB . 7125 1 2356 . 3 2 105 105 LEU CG C 13 25.843 0.000 . 1 . . . . 105 LEU CG . 7125 1 2357 . 3 2 105 105 LEU CD1 C 13 24.762 0.023 . 2 . . . . 105 LEU CD1 . 7125 1 2358 . 3 2 105 105 LEU CD2 C 13 21.554 0.060 . 2 . . . . 105 LEU CD2 . 7125 1 2359 . 3 2 105 105 LEU N N 15 118.552 0.047 . 1 . . . . 105 LEU N . 7125 1 2360 . 3 2 106 106 LEU H H 1 8.243 0.010 . 1 . . . . 106 LEU HN . 7125 1 2361 . 3 2 106 106 LEU HA H 1 4.213 0.008 . 1 . . . . 106 LEU HA . 7125 1 2362 . 3 2 106 106 LEU HB2 H 1 2.018 0.000 . 2 . . . . 106 LEU HB2 . 7125 1 2363 . 3 2 106 106 LEU HB3 H 1 2.621 0.000 . 2 . . . . 106 LEU HB3 . 7125 1 2364 . 3 2 106 106 LEU HG H 1 1.575 0.010 . 1 . . . . 106 LEU HG . 7125 1 2365 . 3 2 106 106 LEU HD11 H 1 0.567 0.011 . 2 . . . . 106 LEU HD1 . 7125 1 2366 . 3 2 106 106 LEU HD12 H 1 0.567 0.011 . 2 . . . . 106 LEU HD1 . 7125 1 2367 . 3 2 106 106 LEU HD13 H 1 0.567 0.011 . 2 . . . . 106 LEU HD1 . 7125 1 2368 . 3 2 106 106 LEU HD21 H 1 0.501 0.007 . 2 . . . . 106 LEU HD2 . 7125 1 2369 . 3 2 106 106 LEU HD22 H 1 0.501 0.007 . 2 . . . . 106 LEU HD2 . 7125 1 2370 . 3 2 106 106 LEU HD23 H 1 0.501 0.007 . 2 . . . . 106 LEU HD2 . 7125 1 2371 . 3 2 106 106 LEU CA C 13 58.907 0.001 . 1 . . . . 106 LEU CA . 7125 1 2372 . 3 2 106 106 LEU CB C 13 40.710 0.043 . 1 . . . . 106 LEU CB . 7125 1 2373 . 3 2 106 106 LEU CG C 13 28.641 0.059 . 1 . . . . 106 LEU CG . 7125 1 2374 . 3 2 106 106 LEU CD1 C 13 23.647 0.049 . 2 . . . . 106 LEU CD1 . 7125 1 2375 . 3 2 106 106 LEU CD2 C 13 25.401 0.065 . 2 . . . . 106 LEU CD2 . 7125 1 2376 . 3 2 106 106 LEU N N 15 118.358 0.115 . 1 . . . . 106 LEU N . 7125 1 2377 . 3 2 107 107 GLY H H 1 8.178 0.014 . 1 . . . . 107 GLY HN . 7125 1 2378 . 3 2 107 107 GLY HA2 H 1 4.325 0.000 . 2 . . . . 107 GLY HA2 . 7125 1 2379 . 3 2 107 107 GLY HA3 H 1 3.843 0.000 . 2 . . . . 107 GLY HA3 . 7125 1 2380 . 3 2 107 107 GLY CA C 13 48.382 0.048 . 1 . . . . 107 GLY CA . 7125 1 2381 . 3 2 107 107 GLY N N 15 105.468 0.017 . 1 . . . . 107 GLY N . 7125 1 2382 . 3 2 108 108 ASN H H 1 8.169 0.006 . 1 . . . . 108 ASN HN . 7125 1 2383 . 3 2 108 108 ASN HA H 1 4.704 0.036 . 1 . . . . 108 ASN HA . 7125 1 2384 . 3 2 108 108 ASN HB2 H 1 3.012 0.000 . 2 . . . . 108 ASN HB2 . 7125 1 2385 . 3 2 108 108 ASN CA C 13 55.321 0.000 . 1 . . . . 108 ASN CA . 7125 1 2386 . 3 2 108 108 ASN CB C 13 36.952 0.000 . 1 . . . . 108 ASN CB . 7125 1 2387 . 3 2 108 108 ASN N N 15 120.515 0.083 . 1 . . . . 108 ASN N . 7125 1 2388 . 3 2 109 109 VAL H H 1 8.966 0.013 . 1 . . . . 109 VAL HN . 7125 1 2389 . 3 2 109 109 VAL HA H 1 3.801 0.003 . 1 . . . . 109 VAL HA . 7125 1 2390 . 3 2 109 109 VAL HB H 1 2.385 0.012 . 1 . . . . 109 VAL HB . 7125 1 2391 . 3 2 109 109 VAL HG11 H 1 1.075 0.029 . 2 . . . . 109 VAL HG1# . 7125 1 2392 . 3 2 109 109 VAL HG12 H 1 1.075 0.029 . 2 . . . . 109 VAL HG1# . 7125 1 2393 . 3 2 109 109 VAL HG13 H 1 1.075 0.029 . 2 . . . . 109 VAL HG1# . 7125 1 2394 . 3 2 109 109 VAL HG21 H 1 1.301 0.014 . 2 . . . . 109 VAL HG2# . 7125 1 2395 . 3 2 109 109 VAL HG22 H 1 1.301 0.014 . 2 . . . . 109 VAL HG2# . 7125 1 2396 . 3 2 109 109 VAL HG23 H 1 1.301 0.014 . 2 . . . . 109 VAL HG2# . 7125 1 2397 . 3 2 109 109 VAL CA C 13 68.271 0.073 . 1 . . . . 109 VAL CA . 7125 1 2398 . 3 2 109 109 VAL CB C 13 31.608 0.011 . 1 . . . . 109 VAL CB . 7125 1 2399 . 3 2 109 109 VAL CG1 C 13 25.276 0.042 . 2 . . . . 109 VAL CG1 . 7125 1 2400 . 3 2 109 109 VAL CG2 C 13 24.956 0.129 . 2 . . . . 109 VAL CG2 . 7125 1 2401 . 3 2 109 109 VAL N N 15 123.527 0.044 . 1 . . . . 109 VAL N . 7125 1 2402 . 3 2 110 110 LEU H H 1 8.749 0.007 . 1 . . . . 110 LEU HN . 7125 1 2403 . 3 2 110 110 LEU HA H 1 3.776 0.028 . 1 . . . . 110 LEU HA . 7125 1 2404 . 3 2 110 110 LEU HB2 H 1 2.254 0.000 . 2 . . . . 110 LEU HB2 . 7125 1 2405 . 3 2 110 110 LEU HB3 H 1 1.047 0.015 . 2 . . . . 110 LEU HB3 . 7125 1 2406 . 3 2 110 110 LEU HG H 1 1.259 0.000 . 1 . . . . 110 LEU HG . 7125 1 2407 . 3 2 110 110 LEU HD11 H 1 0.128 0.022 . 2 . . . . 110 LEU HD1 . 7125 1 2408 . 3 2 110 110 LEU HD12 H 1 0.128 0.022 . 2 . . . . 110 LEU HD1 . 7125 1 2409 . 3 2 110 110 LEU HD13 H 1 0.128 0.022 . 2 . . . . 110 LEU HD1 . 7125 1 2410 . 3 2 110 110 LEU HD21 H 1 0.481 0.004 . 2 . . . . 110 LEU HD2 . 7125 1 2411 . 3 2 110 110 LEU HD22 H 1 0.481 0.004 . 2 . . . . 110 LEU HD2 . 7125 1 2412 . 3 2 110 110 LEU HD23 H 1 0.481 0.004 . 2 . . . . 110 LEU HD2 . 7125 1 2413 . 3 2 110 110 LEU CA C 13 58.906 0.077 . 1 . . . . 110 LEU CA . 7125 1 2414 . 3 2 110 110 LEU CB C 13 40.806 0.099 . 1 . . . . 110 LEU CB . 7125 1 2415 . 3 2 110 110 LEU CG C 13 27.250 0.000 . 1 . . . . 110 LEU CG . 7125 1 2416 . 3 2 110 110 LEU CD1 C 13 24.480 0.001 . 2 . . . . 110 LEU CD1 . 7125 1 2417 . 3 2 110 110 LEU CD2 C 13 22.928 0.015 . 1 . . . . 110 LEU CD2 . 7125 1 2418 . 3 2 110 110 LEU N N 15 121.078 0.054 . 1 . . . . 110 LEU N . 7125 1 2419 . 3 2 111 111 VAL H H 1 7.986 0.012 . 1 . . . . 111 VAL HN . 7125 1 2420 . 3 2 111 111 VAL HA H 1 3.308 0.020 . 1 . . . . 111 VAL HA . 7125 1 2421 . 3 2 111 111 VAL HB H 1 2.661 0.007 . 1 . . . . 111 VAL HB . 7125 1 2422 . 3 2 111 111 VAL HG11 H 1 1.305 0.022 . 2 . . . . 111 VAL HG1# . 7125 1 2423 . 3 2 111 111 VAL HG12 H 1 1.305 0.022 . 2 . . . . 111 VAL HG1# . 7125 1 2424 . 3 2 111 111 VAL HG13 H 1 1.305 0.022 . 2 . . . . 111 VAL HG1# . 7125 1 2425 . 3 2 111 111 VAL HG21 H 1 1.373 0.011 . 2 . . . . 111 VAL HG2# . 7125 1 2426 . 3 2 111 111 VAL HG22 H 1 1.373 0.011 . 2 . . . . 111 VAL HG2# . 7125 1 2427 . 3 2 111 111 VAL HG23 H 1 1.373 0.011 . 2 . . . . 111 VAL HG2# . 7125 1 2428 . 3 2 111 111 VAL CA C 13 68.310 0.093 . 1 . . . . 111 VAL CA . 7125 1 2429 . 3 2 111 111 VAL CB C 13 31.434 0.066 . 1 . . . . 111 VAL CB . 7125 1 2430 . 3 2 111 111 VAL CG1 C 13 24.000 0.038 . 2 . . . . 111 VAL CG1 . 7125 1 2431 . 3 2 111 111 VAL CG2 C 13 21.810 0.018 . 2 . . . . 111 VAL CG2 . 7125 1 2432 . 3 2 111 111 VAL N N 15 118.598 0.075 . 1 . . . . 111 VAL N . 7125 1 2433 . 3 2 112 112 CYS H H 1 8.104 0.012 . 1 . . . . 112 CYS HN . 7125 1 2434 . 3 2 112 112 CYS HA H 1 3.750 0.018 . 1 . . . . 112 CYS HA . 7125 1 2435 . 3 2 112 112 CYS HB2 H 1 3.450 0.007 . 2 . . . . 112 CYS HB2 . 7125 1 2436 . 3 2 112 112 CYS HB3 H 1 2.425 0.008 . 2 . . . . 112 CYS HB3 . 7125 1 2437 . 3 2 112 112 CYS CA C 13 65.257 0.104 . 1 . . . . 112 CYS CA . 7125 1 2438 . 3 2 112 112 CYS CB C 13 26.800 0.018 . 1 . . . . 112 CYS CB . 7125 1 2439 . 3 2 112 112 CYS N N 15 117.395 0.059 . 1 . . . . 112 CYS N . 7125 1 2440 . 3 2 113 113 VAL H H 1 8.422 0.012 . 1 . . . . 113 VAL HN . 7125 1 2441 . 3 2 113 113 VAL HA H 1 3.510 0.015 . 1 . . . . 113 VAL HA . 7125 1 2442 . 3 2 113 113 VAL HB H 1 2.208 0.000 . 1 . . . . 113 VAL HB . 7125 1 2443 . 3 2 113 113 VAL HG11 H 1 0.862 0.003 . 2 . . . . 113 VAL HG1# . 7125 1 2444 . 3 2 113 113 VAL HG12 H 1 0.862 0.003 . 2 . . . . 113 VAL HG1# . 7125 1 2445 . 3 2 113 113 VAL HG13 H 1 0.862 0.003 . 2 . . . . 113 VAL HG1# . 7125 1 2446 . 3 2 113 113 VAL HG21 H 1 0.893 0.007 . 2 . . . . 113 VAL HG2# . 7125 1 2447 . 3 2 113 113 VAL HG22 H 1 0.893 0.007 . 2 . . . . 113 VAL HG2# . 7125 1 2448 . 3 2 113 113 VAL HG23 H 1 0.893 0.007 . 2 . . . . 113 VAL HG2# . 7125 1 2449 . 3 2 113 113 VAL CA C 13 66.831 0.052 . 1 . . . . 113 VAL CA . 7125 1 2450 . 3 2 113 113 VAL CB C 13 31.572 0.000 . 1 . . . . 113 VAL CB . 7125 1 2451 . 3 2 113 113 VAL CG1 C 13 22.945 0.002 . 2 . . . . 113 VAL CG1 . 7125 1 2452 . 3 2 113 113 VAL CG2 C 13 23.812 0.027 . 2 . . . . 113 VAL CG2 . 7125 1 2453 . 3 2 113 113 VAL N N 15 120.365 0.045 . 1 . . . . 113 VAL N . 7125 1 2454 . 3 2 114 114 LEU H H 1 8.385 0.007 . 1 . . . . 114 LEU HN . 7125 1 2455 . 3 2 114 114 LEU HA H 1 3.678 0.023 . 1 . . . . 114 LEU HA . 7125 1 2456 . 3 2 114 114 LEU HG H 1 1.646 0.000 . 1 . . . . 114 LEU HG . 7125 1 2457 . 3 2 114 114 LEU HD11 H 1 0.320 0.007 . 2 . . . . 114 LEU HD1 . 7125 1 2458 . 3 2 114 114 LEU HD12 H 1 0.320 0.007 . 2 . . . . 114 LEU HD1 . 7125 1 2459 . 3 2 114 114 LEU HD13 H 1 0.320 0.007 . 2 . . . . 114 LEU HD1 . 7125 1 2460 . 3 2 114 114 LEU HD21 H 1 0.565 0.012 . 2 . . . . 114 LEU HD2 . 7125 1 2461 . 3 2 114 114 LEU HD22 H 1 0.565 0.012 . 2 . . . . 114 LEU HD2 . 7125 1 2462 . 3 2 114 114 LEU HD23 H 1 0.565 0.012 . 2 . . . . 114 LEU HD2 . 7125 1 2463 . 3 2 114 114 LEU CA C 13 58.114 0.120 . 1 . . . . 114 LEU CA . 7125 1 2464 . 3 2 114 114 LEU CG C 13 26.233 0.000 . 1 . . . . 114 LEU CG . 7125 1 2465 . 3 2 114 114 LEU CD1 C 13 25.510 0.017 . 2 . . . . 114 LEU CD1 . 7125 1 2466 . 3 2 114 114 LEU CD2 C 13 22.551 0.195 . 2 . . . . 114 LEU CD2 . 7125 1 2467 . 3 2 114 114 LEU N N 15 121.042 0.061 . 1 . . . . 114 LEU N . 7125 1 2468 . 3 2 115 115 ALA H H 1 7.428 0.008 . 1 . . . . 115 ALA HN . 7125 1 2469 . 3 2 115 115 ALA HA H 1 3.324 0.015 . 1 . . . . 115 ALA HA . 7125 1 2470 . 3 2 115 115 ALA HB1 H 1 1.242 0.012 . 1 . . . . 115 ALA HB# . 7125 1 2471 . 3 2 115 115 ALA HB2 H 1 1.242 0.012 . 1 . . . . 115 ALA HB# . 7125 1 2472 . 3 2 115 115 ALA HB3 H 1 1.242 0.012 . 1 . . . . 115 ALA HB# . 7125 1 2473 . 3 2 115 115 ALA CA C 13 55.217 0.104 . 1 . . . . 115 ALA CA . 7125 1 2474 . 3 2 115 115 ALA CB C 13 19.770 0.027 . 1 . . . . 115 ALA CB . 7125 1 2475 . 3 2 115 115 ALA N N 15 121.656 0.096 . 1 . . . . 115 ALA N . 7125 1 2476 . 3 2 116 116 HIS H H 1 7.967 0.012 . 1 . . . . 116 HIS HN . 7125 1 2477 . 3 2 116 116 HIS HA H 1 4.022 0.021 . 1 . . . . 116 HIS HA . 7125 1 2478 . 3 2 116 116 HIS HB2 H 1 2.993 0.007 . 2 . . . . 116 HIS HB2 . 7125 1 2479 . 3 2 116 116 HIS HB3 H 1 3.463 0.030 . 2 . . . . 116 HIS HB3 . 7125 1 2480 . 3 2 116 116 HIS HD2 H 1 7.209 0.006 . 1 . . . . 116 HIS HD2 . 7125 1 2481 . 3 2 116 116 HIS CA C 13 58.035 0.019 . 1 . . . . 116 HIS CA . 7125 1 2482 . 3 2 116 116 HIS CB C 13 31.418 0.072 . 1 . . . . 116 HIS CB . 7125 1 2483 . 3 2 116 116 HIS CD2 C 13 117.438 0.035 . 1 . . . . 116 HIS CD2 . 7125 1 2484 . 3 2 116 116 HIS CE1 C 13 138.341 0.000 . 1 . . . . 116 HIS CE1 . 7125 1 2485 . 3 2 116 116 HIS N N 15 116.999 0.086 . 1 . . . . 116 HIS N . 7125 1 2486 . 3 2 117 117 HIS H H 1 8.169 0.024 . 1 . . . . 117 HIS HN . 7125 1 2487 . 3 2 117 117 HIS HA H 1 3.800 0.010 . 1 . . . . 117 HIS HA . 7125 1 2488 . 3 2 117 117 HIS HB2 H 1 2.617 0.001 . 2 . . . . 117 HIS HB2 . 7125 1 2489 . 3 2 117 117 HIS HB3 H 1 2.147 0.005 . 2 . . . . 117 HIS HB3 . 7125 1 2490 . 3 2 117 117 HIS HD2 H 1 6.386 0.006 . 1 . . . . 117 HIS HD2 . 7125 1 2491 . 3 2 117 117 HIS CA C 13 59.110 0.059 . 1 . . . . 117 HIS CA . 7125 1 2492 . 3 2 117 117 HIS CB C 13 30.595 0.073 . 1 . . . . 117 HIS CB . 7125 1 2493 . 3 2 117 117 HIS CD2 C 13 119.883 0.110 . 1 . . . . 117 HIS CD2 . 7125 1 2494 . 3 2 117 117 HIS CE1 C 13 137.775 0.000 . 1 . . . . 117 HIS CE1 . 7125 1 2495 . 3 2 117 117 HIS N N 15 115.765 0.083 . 1 . . . . 117 HIS N . 7125 1 2496 . 3 2 118 118 PHE H H 1 8.368 0.011 . 1 . . . . 118 PHE HN . 7125 1 2497 . 3 2 118 118 PHE HA H 1 4.584 0.008 . 1 . . . . 118 PHE HA . 7125 1 2498 . 3 2 118 118 PHE HB2 H 1 3.211 0.000 . 2 . . . . 118 PHE HB2 . 7125 1 2499 . 3 2 118 118 PHE HB3 H 1 2.734 0.000 . 2 . . . . 118 PHE HB3 . 7125 1 2500 . 3 2 118 118 PHE HD1 H 1 7.358 0.006 . 3 . . . . 118 PHE HD1 . 7125 1 2501 . 3 2 118 118 PHE CA C 13 59.383 0.041 . 1 . . . . 118 PHE CA . 7125 1 2502 . 3 2 118 118 PHE CB C 13 39.762 0.017 . 1 . . . . 118 PHE CB . 7125 1 2503 . 3 2 118 118 PHE CD1 C 13 131.718 0.085 . 3 . . . . 118 PHE CD1 . 7125 1 2504 . 3 2 118 118 PHE N N 15 114.887 0.079 . 1 . . . . 118 PHE N . 7125 1 2505 . 3 2 119 119 GLY H H 1 8.483 0.014 . 1 . . . . 119 GLY HN . 7125 1 2506 . 3 2 119 119 GLY HA2 H 1 3.902 0.018 . 2 . . . . 119 GLY HA2 . 7125 1 2507 . 3 2 119 119 GLY CA C 13 48.089 0.012 . 1 . . . . 119 GLY CA . 7125 1 2508 . 3 2 119 119 GLY N N 15 113.592 0.066 . 1 . . . . 119 GLY N . 7125 1 2509 . 3 2 120 120 LYS H H 1 8.702 0.005 . 1 . . . . 120 LYS HN . 7125 1 2510 . 3 2 120 120 LYS HA H 1 3.794 0.010 . 1 . . . . 120 LYS HA . 7125 1 2511 . 3 2 120 120 LYS HB3 H 1 1.765 0.010 . 2 . . . . 120 LYS HB3 . 7125 1 2512 . 3 2 120 120 LYS HG3 H 1 1.361 0.007 . 2 . . . . 120 LYS HG3 . 7125 1 2513 . 3 2 120 120 LYS HD2 H 1 1.596 0.022 . 2 . . . . 120 LYS HD2 . 7125 1 2514 . 3 2 120 120 LYS CA C 13 58.206 0.034 . 1 . . . . 120 LYS CA . 7125 1 2515 . 3 2 120 120 LYS CB C 13 32.037 0.043 . 1 . . . . 120 LYS CB . 7125 1 2516 . 3 2 120 120 LYS CG C 13 24.394 0.026 . 1 . . . . 120 LYS CG . 7125 1 2517 . 3 2 120 120 LYS CD C 13 29.352 0.003 . 1 . . . . 120 LYS CD . 7125 1 2518 . 3 2 120 120 LYS N N 15 125.030 0.097 . 1 . . . . 120 LYS N . 7125 1 2519 . 3 2 121 121 GLU H H 1 7.805 0.007 . 1 . . . . 121 GLU HN . 7125 1 2520 . 3 2 121 121 GLU HA H 1 4.210 0.005 . 1 . . . . 121 GLU HA . 7125 1 2521 . 3 2 121 121 GLU HB2 H 1 2.122 0.011 . 2 . . . . 121 GLU HB2 . 7125 1 2522 . 3 2 121 121 GLU HG2 H 1 2.344 0.009 . 2 . . . . 121 GLU HG2 . 7125 1 2523 . 3 2 121 121 GLU CA C 13 57.582 0.001 . 1 . . . . 121 GLU CA . 7125 1 2524 . 3 2 121 121 GLU CB C 13 30.370 0.032 . 1 . . . . 121 GLU CB . 7125 1 2525 . 3 2 121 121 GLU CG C 13 37.327 0.047 . 1 . . . . 121 GLU CG . 7125 1 2526 . 3 2 121 121 GLU N N 15 116.831 0.047 . 1 . . . . 121 GLU N . 7125 1 2527 . 3 2 122 122 PHE H H 1 8.537 0.007 . 1 . . . . 122 PHE HN . 7125 1 2528 . 3 2 122 122 PHE HA H 1 4.452 0.014 . 1 . . . . 122 PHE HA . 7125 1 2529 . 3 2 122 122 PHE HB2 H 1 3.506 0.000 . 2 . . . . 122 PHE HB2 . 7125 1 2530 . 3 2 122 122 PHE HB3 H 1 2.400 0.009 . 2 . . . . 122 PHE HB3 . 7125 1 2531 . 3 2 122 122 PHE HD1 H 1 6.836 0.033 . 3 . . . . 122 PHE HD1 . 7125 1 2532 . 3 2 122 122 PHE CA C 13 56.954 0.006 . 1 . . . . 122 PHE CA . 7125 1 2533 . 3 2 122 122 PHE CB C 13 37.886 0.002 . 1 . . . . 122 PHE CB . 7125 1 2534 . 3 2 122 122 PHE CD1 C 13 131.932 0.042 . 3 . . . . 122 PHE CD1 . 7125 1 2535 . 3 2 122 122 PHE N N 15 126.301 0.086 . 1 . . . . 122 PHE N . 7125 1 2536 . 3 2 123 123 THR H H 1 7.165 0.013 . 1 . . . . 123 THR HN . 7125 1 2537 . 3 2 123 123 THR HA H 1 4.468 0.000 . 1 . . . . 123 THR HA . 7125 1 2538 . 3 2 123 123 THR HB H 1 4.374 0.000 . 1 . . . . 123 THR HB . 7125 1 2539 . 3 2 123 123 THR HG21 H 1 1.263 0.007 . 1 . . . . 123 THR HG2# . 7125 1 2540 . 3 2 123 123 THR HG22 H 1 1.263 0.007 . 1 . . . . 123 THR HG2# . 7125 1 2541 . 3 2 123 123 THR HG23 H 1 1.263 0.007 . 1 . . . . 123 THR HG2# . 7125 1 2542 . 3 2 123 123 THR CA C 13 60.822 0.000 . 1 . . . . 123 THR CA . 7125 1 2543 . 3 2 123 123 THR CB C 13 67.449 0.000 . 1 . . . . 123 THR CB . 7125 1 2544 . 3 2 123 123 THR CG2 C 13 22.662 0.068 . 1 . . . . 123 THR CG2 . 7125 1 2545 . 3 2 123 123 THR N N 15 113.320 0.053 . 1 . . . . 123 THR N . 7125 1 2546 . 3 2 125 125 PRO HA H 1 4.204 0.008 . 1 . . . . 125 PRO HA . 7125 1 2547 . 3 2 125 125 PRO HG3 H 1 1.857 0.000 . 2 . . . . 125 PRO HG3 . 7125 1 2548 . 3 2 125 125 PRO HD2 H 1 3.565 0.022 . 2 . . . . 125 PRO HD2 . 7125 1 2549 . 3 2 125 125 PRO CA C 13 66.124 0.075 . 1 . . . . 125 PRO CA . 7125 1 2550 . 3 2 125 125 PRO CG C 13 28.486 0.000 . 1 . . . . 125 PRO CG . 7125 1 2551 . 3 2 125 125 PRO CD C 13 50.144 0.000 . 1 . . . . 125 PRO CD . 7125 1 2552 . 3 2 126 126 VAL H H 1 6.916 0.013 . 1 . . . . 126 VAL HN . 7125 1 2553 . 3 2 126 126 VAL HA H 1 3.439 0.005 . 1 . . . . 126 VAL HA . 7125 1 2554 . 3 2 126 126 VAL HB H 1 1.901 0.014 . 1 . . . . 126 VAL HB . 7125 1 2555 . 3 2 126 126 VAL HG11 H 1 0.786 0.019 . 2 . . . . 126 VAL HG1# . 7125 1 2556 . 3 2 126 126 VAL HG12 H 1 0.786 0.019 . 2 . . . . 126 VAL HG1# . 7125 1 2557 . 3 2 126 126 VAL HG13 H 1 0.786 0.019 . 2 . . . . 126 VAL HG1# . 7125 1 2558 . 3 2 126 126 VAL HG21 H 1 0.949 0.008 . 2 . . . . 126 VAL HG2# . 7125 1 2559 . 3 2 126 126 VAL HG22 H 1 0.949 0.008 . 2 . . . . 126 VAL HG2# . 7125 1 2560 . 3 2 126 126 VAL HG23 H 1 0.949 0.008 . 2 . . . . 126 VAL HG2# . 7125 1 2561 . 3 2 126 126 VAL CA C 13 66.819 0.059 . 1 . . . . 126 VAL CA . 7125 1 2562 . 3 2 126 126 VAL CB C 13 31.294 0.012 . 1 . . . . 126 VAL CB . 7125 1 2563 . 3 2 126 126 VAL CG1 C 13 22.316 0.070 . 2 . . . . 126 VAL CG1 . 7125 1 2564 . 3 2 126 126 VAL CG2 C 13 24.108 0.058 . 2 . . . . 126 VAL CG2 . 7125 1 2565 . 3 2 126 126 VAL N N 15 120.999 0.072 . 1 . . . . 126 VAL N . 7125 1 2566 . 3 2 127 127 GLN H H 1 8.295 0.008 . 1 . . . . 127 GLN HN . 7125 1 2567 . 3 2 127 127 GLN HA H 1 3.487 0.000 . 1 . . . . 127 GLN HA . 7125 1 2568 . 3 2 127 127 GLN HB2 H 1 1.970 0.000 . 2 . . . . 127 GLN HB2 . 7125 1 2569 . 3 2 127 127 GLN CA C 13 59.368 0.000 . 1 . . . . 127 GLN CA . 7125 1 2570 . 3 2 127 127 GLN CB C 13 26.133 0.000 . 1 . . . . 127 GLN CB . 7125 1 2571 . 3 2 127 127 GLN N N 15 119.741 0.066 . 1 . . . . 127 GLN N . 7125 1 2572 . 3 2 128 128 ALA H H 1 8.156 0.009 . 1 . . . . 128 ALA HN . 7125 1 2573 . 3 2 128 128 ALA HA H 1 3.934 0.012 . 1 . . . . 128 ALA HA . 7125 1 2574 . 3 2 128 128 ALA HB1 H 1 1.255 0.009 . 1 . . . . 128 ALA HB# . 7125 1 2575 . 3 2 128 128 ALA HB2 H 1 1.255 0.009 . 1 . . . . 128 ALA HB# . 7125 1 2576 . 3 2 128 128 ALA HB3 H 1 1.255 0.009 . 1 . . . . 128 ALA HB# . 7125 1 2577 . 3 2 128 128 ALA CA C 13 55.648 0.077 . 1 . . . . 128 ALA CA . 7125 1 2578 . 3 2 128 128 ALA CB C 13 17.810 0.040 . 1 . . . . 128 ALA CB . 7125 1 2579 . 3 2 128 128 ALA N N 15 121.720 0.051 . 1 . . . . 128 ALA N . 7125 1 2580 . 3 2 129 129 ALA H H 1 7.274 0.012 . 1 . . . . 129 ALA HN . 7125 1 2581 . 3 2 129 129 ALA HA H 1 3.899 0.002 . 1 . . . . 129 ALA HA . 7125 1 2582 . 3 2 129 129 ALA HB1 H 1 1.359 0.010 . 1 . . . . 129 ALA HB# . 7125 1 2583 . 3 2 129 129 ALA HB2 H 1 1.359 0.010 . 1 . . . . 129 ALA HB# . 7125 1 2584 . 3 2 129 129 ALA HB3 H 1 1.359 0.010 . 1 . . . . 129 ALA HB# . 7125 1 2585 . 3 2 129 129 ALA CA C 13 55.321 0.000 . 1 . . . . 129 ALA CA . 7125 1 2586 . 3 2 129 129 ALA CB C 13 18.416 0.090 . 1 . . . . 129 ALA CB . 7125 1 2587 . 3 2 129 129 ALA N N 15 120.077 0.116 . 1 . . . . 129 ALA N . 7125 1 2588 . 3 2 130 130 TYR H H 1 8.264 0.013 . 1 . . . . 130 TYR HN . 7125 1 2589 . 3 2 130 130 TYR HA H 1 3.912 0.015 . 1 . . . . 130 TYR HA . 7125 1 2590 . 3 2 130 130 TYR HD1 H 1 7.182 0.012 . 3 . . . . 130 TYR HD1 . 7125 1 2591 . 3 2 130 130 TYR HE1 H 1 6.897 0.005 . 3 . . . . 130 TYR HE1 . 7125 1 2592 . 3 2 130 130 TYR CA C 13 65.055 0.091 . 1 . . . . 130 TYR CA . 7125 1 2593 . 3 2 130 130 TYR CD1 C 13 132.254 0.067 . 3 . . . . 130 TYR CD1 . 7125 1 2594 . 3 2 130 130 TYR CE1 C 13 121.892 0.043 . 3 . . . . 130 TYR CE1 . 7125 1 2595 . 3 2 130 130 TYR N N 15 116.203 0.040 . 1 . . . . 130 TYR N . 7125 1 2596 . 3 2 131 131 GLN H H 1 9.523 0.007 . 1 . . . . 131 GLN HN . 7125 1 2597 . 3 2 131 131 GLN HA H 1 4.407 0.006 . 1 . . . . 131 GLN HA . 7125 1 2598 . 3 2 131 131 GLN CA C 13 58.558 0.058 . 1 . . . . 131 GLN CA . 7125 1 2599 . 3 2 131 131 GLN N N 15 119.142 0.095 . 1 . . . . 131 GLN N . 7125 1 2600 . 3 2 132 132 LYS H H 1 7.618 0.008 . 1 . . . . 132 LYS HN . 7125 1 2601 . 3 2 132 132 LYS HA H 1 4.217 0.023 . 1 . . . . 132 LYS HA . 7125 1 2602 . 3 2 132 132 LYS HB2 H 1 1.646 0.000 . 2 . . . . 132 LYS HB2 . 7125 1 2603 . 3 2 132 132 LYS HB3 H 1 2.169 0.000 . 2 . . . . 132 LYS HB3 . 7125 1 2604 . 3 2 132 132 LYS HG2 H 1 1.432 0.000 . 2 . . . . 132 LYS HG2 . 7125 1 2605 . 3 2 132 132 LYS HG3 H 1 1.851 0.000 . 2 . . . . 132 LYS HG3 . 7125 1 2606 . 3 2 132 132 LYS HD2 H 1 1.657 0.000 . 2 . . . . 132 LYS HD2 . 7125 1 2607 . 3 2 132 132 LYS HE2 H 1 2.935 0.003 . 2 . . . . 132 LYS HE2 . 7125 1 2608 . 3 2 132 132 LYS CA C 13 60.521 0.098 . 1 . . . . 132 LYS CA . 7125 1 2609 . 3 2 132 132 LYS CB C 13 32.546 0.056 . 1 . . . . 132 LYS CB . 7125 1 2610 . 3 2 132 132 LYS CG C 13 26.289 0.197 . 1 . . . . 132 LYS CG . 7125 1 2611 . 3 2 132 132 LYS CD C 13 30.412 0.000 . 1 . . . . 132 LYS CD . 7125 1 2612 . 3 2 132 132 LYS CE C 13 42.248 0.115 . 1 . . . . 132 LYS CE . 7125 1 2613 . 3 2 132 132 LYS N N 15 121.039 0.119 . 1 . . . . 132 LYS N . 7125 1 2614 . 3 2 133 133 VAL H H 1 7.571 0.008 . 1 . . . . 133 VAL HN . 7125 1 2615 . 3 2 133 133 VAL HA H 1 3.546 0.001 . 1 . . . . 133 VAL HA . 7125 1 2616 . 3 2 133 133 VAL HB H 1 2.347 0.005 . 1 . . . . 133 VAL HB . 7125 1 2617 . 3 2 133 133 VAL HG11 H 1 0.812 0.011 . 2 . . . . 133 VAL HG1# . 7125 1 2618 . 3 2 133 133 VAL HG12 H 1 0.812 0.011 . 2 . . . . 133 VAL HG1# . 7125 1 2619 . 3 2 133 133 VAL HG13 H 1 0.812 0.011 . 2 . . . . 133 VAL HG1# . 7125 1 2620 . 3 2 133 133 VAL HG21 H 1 0.906 0.018 . 2 . . . . 133 VAL HG2# . 7125 1 2621 . 3 2 133 133 VAL HG22 H 1 0.906 0.018 . 2 . . . . 133 VAL HG2# . 7125 1 2622 . 3 2 133 133 VAL HG23 H 1 0.906 0.018 . 2 . . . . 133 VAL HG2# . 7125 1 2623 . 3 2 133 133 VAL CA C 13 67.739 0.021 . 1 . . . . 133 VAL CA . 7125 1 2624 . 3 2 133 133 VAL CB C 13 31.976 0.022 . 1 . . . . 133 VAL CB . 7125 1 2625 . 3 2 133 133 VAL CG1 C 13 20.715 0.052 . 2 . . . . 133 VAL CG1 . 7125 1 2626 . 3 2 133 133 VAL CG2 C 13 22.891 0.050 . 2 . . . . 133 VAL CG2 . 7125 1 2627 . 3 2 133 133 VAL N N 15 119.223 0.056 . 1 . . . . 133 VAL N . 7125 1 2628 . 3 2 134 134 VAL H H 1 9.102 0.010 . 1 . . . . 134 VAL HN . 7125 1 2629 . 3 2 134 134 VAL HA H 1 4.192 0.019 . 1 . . . . 134 VAL HA . 7125 1 2630 . 3 2 134 134 VAL HB H 1 2.607 0.010 . 1 . . . . 134 VAL HB . 7125 1 2631 . 3 2 134 134 VAL HG11 H 1 1.342 0.011 . 2 . . . . 134 VAL HG1 . 7125 1 2632 . 3 2 134 134 VAL HG12 H 1 1.342 0.011 . 2 . . . . 134 VAL HG1 . 7125 1 2633 . 3 2 134 134 VAL HG13 H 1 1.342 0.011 . 2 . . . . 134 VAL HG1 . 7125 1 2634 . 3 2 134 134 VAL HG21 H 1 1.321 0.024 . 2 . . . . 134 VAL HG2 . 7125 1 2635 . 3 2 134 134 VAL HG22 H 1 1.321 0.024 . 2 . . . . 134 VAL HG2 . 7125 1 2636 . 3 2 134 134 VAL HG23 H 1 1.321 0.024 . 2 . . . . 134 VAL HG2 . 7125 1 2637 . 3 2 134 134 VAL CA C 13 67.081 0.050 . 1 . . . . 134 VAL CA . 7125 1 2638 . 3 2 134 134 VAL CB C 13 31.391 0.024 . 1 . . . . 134 VAL CB . 7125 1 2639 . 3 2 134 134 VAL CG1 C 13 21.443 0.081 . 2 . . . . 134 VAL CG1 . 7125 1 2640 . 3 2 134 134 VAL CG2 C 13 19.959 0.065 . 2 . . . . 134 VAL CG2 . 7125 1 2641 . 3 2 134 134 VAL N N 15 113.878 0.049 . 1 . . . . 134 VAL N . 7125 1 2642 . 3 2 135 135 ALA H H 1 8.118 0.008 . 1 . . . . 135 ALA HN . 7125 1 2643 . 3 2 135 135 ALA HA H 1 4.408 0.010 . 1 . . . . 135 ALA HA . 7125 1 2644 . 3 2 135 135 ALA HB1 H 1 1.666 0.001 . 1 . . . . 135 ALA HB# . 7125 1 2645 . 3 2 135 135 ALA HB2 H 1 1.666 0.001 . 1 . . . . 135 ALA HB# . 7125 1 2646 . 3 2 135 135 ALA HB3 H 1 1.666 0.001 . 1 . . . . 135 ALA HB# . 7125 1 2647 . 3 2 135 135 ALA CA C 13 55.321 0.000 . 1 . . . . 135 ALA CA . 7125 1 2648 . 3 2 135 135 ALA CB C 13 18.363 0.004 . 1 . . . . 135 ALA CB . 7125 1 2649 . 3 2 135 135 ALA N N 15 124.553 0.095 . 1 . . . . 135 ALA N . 7125 1 2650 . 3 2 136 136 GLY H H 1 8.023 0.007 . 1 . . . . 136 GLY HN . 7125 1 2651 . 3 2 136 136 GLY HA2 H 1 4.008 0.006 . 2 . . . . 136 GLY HA2 . 7125 1 2652 . 3 2 136 136 GLY HA3 H 1 3.533 0.004 . 2 . . . . 136 GLY HA3 . 7125 1 2653 . 3 2 136 136 GLY CA C 13 47.273 0.195 . 1 . . . . 136 GLY CA . 7125 1 2654 . 3 2 136 136 GLY N N 15 106.850 0.059 . 1 . . . . 136 GLY N . 7125 1 2655 . 3 2 137 137 VAL H H 1 8.668 0.008 . 1 . . . . 137 VAL HN . 7125 1 2656 . 3 2 137 137 VAL HA H 1 3.214 0.010 . 1 . . . . 137 VAL HA . 7125 1 2657 . 3 2 137 137 VAL HB H 1 2.158 0.015 . 1 . . . . 137 VAL HB . 7125 1 2658 . 3 2 137 137 VAL HG11 H 1 0.961 0.005 . 2 . . . . 137 VAL HG1# . 7125 1 2659 . 3 2 137 137 VAL HG12 H 1 0.961 0.005 . 2 . . . . 137 VAL HG1# . 7125 1 2660 . 3 2 137 137 VAL HG13 H 1 0.961 0.005 . 2 . . . . 137 VAL HG1# . 7125 1 2661 . 3 2 137 137 VAL HG21 H 1 0.380 0.019 . 2 . . . . 137 VAL HG2# . 7125 1 2662 . 3 2 137 137 VAL HG22 H 1 0.380 0.019 . 2 . . . . 137 VAL HG2# . 7125 1 2663 . 3 2 137 137 VAL HG23 H 1 0.380 0.019 . 2 . . . . 137 VAL HG2# . 7125 1 2664 . 3 2 137 137 VAL CA C 13 67.473 0.070 . 1 . . . . 137 VAL CA . 7125 1 2665 . 3 2 137 137 VAL CB C 13 31.861 0.009 . 1 . . . . 137 VAL CB . 7125 1 2666 . 3 2 137 137 VAL CG1 C 13 22.347 0.072 . 2 . . . . 137 VAL CG1 . 7125 1 2667 . 3 2 137 137 VAL CG2 C 13 20.605 0.032 . 2 . . . . 137 VAL CG2 . 7125 1 2668 . 3 2 137 137 VAL N N 15 124.249 0.064 . 1 . . . . 137 VAL N . 7125 1 2669 . 3 2 138 138 ALA H H 1 8.358 0.009 . 1 . . . . 138 ALA HN . 7125 1 2670 . 3 2 138 138 ALA HA H 1 3.804 0.001 . 1 . . . . 138 ALA HA . 7125 1 2671 . 3 2 138 138 ALA HB1 H 1 1.609 0.008 . 1 . . . . 138 ALA HB# . 7125 1 2672 . 3 2 138 138 ALA HB2 H 1 1.609 0.008 . 1 . . . . 138 ALA HB# . 7125 1 2673 . 3 2 138 138 ALA HB3 H 1 1.609 0.008 . 1 . . . . 138 ALA HB# . 7125 1 2674 . 3 2 138 138 ALA CA C 13 56.065 0.037 . 1 . . . . 138 ALA CA . 7125 1 2675 . 3 2 138 138 ALA CB C 13 17.927 0.129 . 1 . . . . 138 ALA CB . 7125 1 2676 . 3 2 138 138 ALA N N 15 121.232 0.057 . 1 . . . . 138 ALA N . 7125 1 2677 . 3 2 139 139 ASN H H 1 8.270 0.007 . 1 . . . . 139 ASN HN . 7125 1 2678 . 3 2 139 139 ASN HA H 1 4.406 0.011 . 1 . . . . 139 ASN HA . 7125 1 2679 . 3 2 139 139 ASN HB2 H 1 2.790 0.009 . 2 . . . . 139 ASN HB2 . 7125 1 2680 . 3 2 139 139 ASN CA C 13 56.137 0.069 . 1 . . . . 139 ASN CA . 7125 1 2681 . 3 2 139 139 ASN CB C 13 38.653 0.035 . 1 . . . . 139 ASN CB . 7125 1 2682 . 3 2 139 139 ASN N N 15 114.855 0.062 . 1 . . . . 139 ASN N . 7125 1 2683 . 3 2 140 140 ALA H H 1 7.900 0.010 . 1 . . . . 140 ALA HN . 7125 1 2684 . 3 2 140 140 ALA HA H 1 3.996 0.002 . 1 . . . . 140 ALA HA . 7125 1 2685 . 3 2 140 140 ALA HB1 H 1 1.324 0.022 . 1 . . . . 140 ALA HB# . 7125 1 2686 . 3 2 140 140 ALA HB2 H 1 1.324 0.022 . 1 . . . . 140 ALA HB# . 7125 1 2687 . 3 2 140 140 ALA HB3 H 1 1.324 0.022 . 1 . . . . 140 ALA HB# . 7125 1 2688 . 3 2 140 140 ALA CA C 13 54.858 0.048 . 1 . . . . 140 ALA CA . 7125 1 2689 . 3 2 140 140 ALA CB C 13 18.715 0.071 . 1 . . . . 140 ALA CB . 7125 1 2690 . 3 2 140 140 ALA N N 15 122.549 0.064 . 1 . . . . 140 ALA N . 7125 1 2691 . 3 2 141 141 LEU H H 1 8.117 0.006 . 1 . . . . 141 LEU HN . 7125 1 2692 . 3 2 141 141 LEU HA H 1 3.230 0.006 . 1 . . . . 141 LEU HA . 7125 1 2693 . 3 2 141 141 LEU HB2 H 1 0.643 0.026 . 2 . . . . 141 LEU HB2 . 7125 1 2694 . 3 2 141 141 LEU HB3 H 1 -0.360 0.010 . 2 . . . . 141 LEU HB3 . 7125 1 2695 . 3 2 141 141 LEU HG H 1 0.305 0.022 . 1 . . . . 141 LEU HG . 7125 1 2696 . 3 2 141 141 LEU HD11 H 1 -0.827 0.026 . 2 . . . . 141 LEU HD1 . 7125 1 2697 . 3 2 141 141 LEU HD12 H 1 -0.827 0.026 . 2 . . . . 141 LEU HD1 . 7125 1 2698 . 3 2 141 141 LEU HD13 H 1 -0.827 0.026 . 2 . . . . 141 LEU HD1 . 7125 1 2699 . 3 2 141 141 LEU HD21 H 1 -1.048 0.013 . 2 . . . . 141 LEU HD2 . 7125 1 2700 . 3 2 141 141 LEU HD22 H 1 -1.048 0.013 . 2 . . . . 141 LEU HD2 . 7125 1 2701 . 3 2 141 141 LEU HD23 H 1 -1.048 0.013 . 2 . . . . 141 LEU HD2 . 7125 1 2702 . 3 2 141 141 LEU CA C 13 56.620 0.089 . 1 . . . . 141 LEU CA . 7125 1 2703 . 3 2 141 141 LEU CB C 13 39.916 0.065 . 1 . . . . 141 LEU CB . 7125 1 2704 . 3 2 141 141 LEU CG C 13 26.881 0.096 . 1 . . . . 141 LEU CG . 7125 1 2705 . 3 2 141 141 LEU CD1 C 13 24.549 0.032 . 2 . . . . 141 LEU CD1 . 7125 1 2706 . 3 2 141 141 LEU CD2 C 13 22.885 0.015 . 2 . . . . 141 LEU CD2 . 7125 1 2707 . 3 2 141 141 LEU N N 15 120.557 0.067 . 1 . . . . 141 LEU N . 7125 1 2708 . 3 2 142 142 ALA H H 1 7.369 0.008 . 1 . . . . 142 ALA HN . 7125 1 2709 . 3 2 142 142 ALA HA H 1 4.300 0.000 . 1 . . . . 142 ALA HA . 7125 1 2710 . 3 2 142 142 ALA HB1 H 1 1.588 0.007 . 1 . . . . 142 ALA HB# . 7125 1 2711 . 3 2 142 142 ALA HB2 H 1 1.588 0.007 . 1 . . . . 142 ALA HB# . 7125 1 2712 . 3 2 142 142 ALA HB3 H 1 1.588 0.007 . 1 . . . . 142 ALA HB# . 7125 1 2713 . 3 2 142 142 ALA CA C 13 52.312 0.000 . 1 . . . . 142 ALA CA . 7125 1 2714 . 3 2 142 142 ALA CB C 13 19.823 0.051 . 1 . . . . 142 ALA CB . 7125 1 2715 . 3 2 142 142 ALA N N 15 118.780 0.071 . 1 . . . . 142 ALA N . 7125 1 2716 . 3 2 143 143 HIS H H 1 7.129 0.005 . 1 . . . . 143 HIS HN . 7125 1 2717 . 3 2 143 143 HIS HA H 1 4.072 0.014 . 1 . . . . 143 HIS HA . 7125 1 2718 . 3 2 143 143 HIS HB2 H 1 2.972 0.023 . 2 . . . . 143 HIS HB2 . 7125 1 2719 . 3 2 143 143 HIS HB3 H 1 3.328 0.017 . 2 . . . . 143 HIS HB3 . 7125 1 2720 . 3 2 143 143 HIS HD2 H 1 6.906 0.000 . 1 . . . . 143 HIS HD2 . 7125 1 2721 . 3 2 143 143 HIS CA C 13 60.362 0.062 . 1 . . . . 143 HIS CA . 7125 1 2722 . 3 2 143 143 HIS CB C 13 30.115 0.068 . 1 . . . . 143 HIS CB . 7125 1 2723 . 3 2 143 143 HIS CD2 C 13 122.798 0.000 . 1 . . . . 143 HIS CD2 . 7125 1 2724 . 3 2 143 143 HIS CE1 C 13 136.988 0.023 . 1 . . . . 143 HIS CE1 . 7125 1 2725 . 3 2 143 143 HIS N N 15 118.257 0.058 . 1 . . . . 143 HIS N . 7125 1 2726 . 3 2 144 144 LYS H H 1 7.053 0.013 . 1 . . . . 144 LYS HN . 7125 1 2727 . 3 2 144 144 LYS HA H 1 3.870 0.008 . 1 . . . . 144 LYS HA . 7125 1 2728 . 3 2 144 144 LYS HB2 H 1 1.572 0.000 . 2 . . . . 144 LYS HB1 . 7125 1 2729 . 3 2 144 144 LYS HB3 H 1 1.323 0.010 . 2 . . . . 144 LYS HB2 . 7125 1 2730 . 3 2 144 144 LYS HG2 H 1 1.017 0.000 . 2 . . . . 144 LYS HG1 . 7125 1 2731 . 3 2 144 144 LYS HG3 H 1 0.984 0.005 . 2 . . . . 144 LYS HG2 . 7125 1 2732 . 3 2 144 144 LYS HD2 H 1 1.505 0.000 . 2 . . . . 144 LYS HD1 . 7125 1 2733 . 3 2 144 144 LYS HD3 H 1 1.473 0.000 . 2 . . . . 144 LYS HD2 . 7125 1 2734 . 3 2 144 144 LYS HE3 H 1 2.836 0.020 . 2 . . . . 144 LYS HE3 . 7125 1 2735 . 3 2 144 144 LYS CA C 13 56.265 0.063 . 1 . . . . 144 LYS CA . 7125 1 2736 . 3 2 144 144 LYS CB C 13 30.234 0.081 . 1 . . . . 144 LYS CB . 7125 1 2737 . 3 2 144 144 LYS CG C 13 24.525 0.155 . 1 . . . . 144 LYS CG . 7125 1 2738 . 3 2 144 144 LYS CD C 13 27.276 0.028 . 1 . . . . 144 LYS CD . 7125 1 2739 . 3 2 144 144 LYS CE C 13 41.715 0.111 . 1 . . . . 144 LYS CE . 7125 1 2740 . 3 2 144 144 LYS N N 15 115.563 0.130 . 1 . . . . 144 LYS N . 7125 1 2741 . 3 2 145 145 TYR H H 1 7.770 0.008 . 1 . . . . 145 TYR HN . 7125 1 2742 . 3 2 145 145 TYR HA H 1 4.527 0.008 . 1 . . . . 145 TYR HA . 7125 1 2743 . 3 2 145 145 TYR HB2 H 1 3.149 0.021 . 2 . . . . 145 TYR HB2 . 7125 1 2744 . 3 2 145 145 TYR HB3 H 1 2.748 0.015 . 2 . . . . 145 TYR HB3 . 7125 1 2745 . 3 2 145 145 TYR HD1 H 1 7.061 0.004 . 3 . . . . 145 TYR HD1 . 7125 1 2746 . 3 2 145 145 TYR HE1 H 1 6.811 0.018 . 3 . . . . 145 TYR HE1 . 7125 1 2747 . 3 2 145 145 TYR CA C 13 58.623 0.001 . 1 . . . . 145 TYR CA . 7125 1 2748 . 3 2 145 145 TYR CB C 13 38.496 0.078 . 1 . . . . 145 TYR CB . 7125 1 2749 . 3 2 145 145 TYR CD1 C 13 132.375 0.045 . 3 . . . . 145 TYR CD1 . 7125 1 2750 . 3 2 145 145 TYR CE1 C 13 119.023 0.063 . 3 . . . . 145 TYR CE1 . 7125 1 2751 . 3 2 145 145 TYR N N 15 118.084 0.059 . 1 . . . . 145 TYR N . 7125 1 2752 . 3 2 146 146 HIS H H 1 7.474 0.005 . 1 . . . . 146 HIS HN . 7125 1 2753 . 3 2 146 146 HIS HA H 1 4.510 0.000 . 1 . . . . 146 HIS HA . 7125 1 2754 . 3 2 146 146 HIS HB2 H 1 3.063 0.000 . 2 . . . . 146 HIS HB2 . 7125 1 2755 . 3 2 146 146 HIS HD2 H 1 6.898 0.043 . 1 . . . . 146 HIS HD2 . 7125 1 2756 . 3 2 146 146 HIS HE1 H 1 7.876 0.044 . 1 . . . . 146 HIS HE1 . 7125 1 2757 . 3 2 146 146 HIS CA C 13 56.638 0.000 . 1 . . . . 146 HIS CA . 7125 1 2758 . 3 2 146 146 HIS CB C 13 31.314 0.000 . 1 . . . . 146 HIS CB . 7125 1 2759 . 3 2 146 146 HIS CD2 C 13 119.662 0.146 . 1 . . . . 146 HIS CD2 . 7125 1 2760 . 3 2 146 146 HIS CE1 C 13 137.466 0.827 . 1 . . . . 146 HIS CE1 . 7125 1 2761 . 3 2 146 146 HIS N N 15 124.445 0.050 . 1 . . . . 146 HIS N . 7125 1 stop_ save_