################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34990 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H NOESY' . . . 34990 1 2 '3D 1H-15N NOESY' . . . 34990 1 3 '3D 1H-15N TOCSY' . . . 34990 1 4 '3D HNCA' . . . 34990 1 5 '3D HNCACB' . . . 34990 1 6 '3D HCCH-TOCSY' . . . 34990 1 7 '3D H(CCO)NH' . . . 34990 1 8 '2D HBCBCGCDHD' . . . 34990 1 9 '3D HCAN' . . . 34990 1 10 '2D 1H-15N HSQC' . . . 34990 1 11 '2D 1H-13C HSQC' . . . 34990 1 12 '3D HCACO' . . . 34990 1 13 '3D HNCO' . . . 34990 1 14 '3D HN(COCA)CB' . . . 34990 1 15 '3D HN(CO)CA' . . . 34990 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY HA2 H 1 3.77 0.02 . 2 . . 102 . A 1 GLY HA2 . 34990 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.77 0.02 . 2 . . 102 . A 1 GLY HA3 . 34990 1 3 . 1 . 1 1 1 GLY CA C 13 44.07 0.10 . 1 . . 101 . A 1 GLY CA . 34990 1 4 . 1 . 1 2 2 SER HA H 1 4.48 0.02 . 1 . . 105 . A 2 SER HA . 34990 1 5 . 1 . 1 2 2 SER HB2 H 1 3.80 0.02 . 2 . . 107 . A 2 SER HB2 . 34990 1 6 . 1 . 1 2 2 SER HB3 H 1 3.80 0.02 . 2 . . 107 . A 2 SER HB3 . 34990 1 7 . 1 . 1 2 2 SER CA C 13 58.28 0.10 . 1 . . 103 . A 2 SER CA . 34990 1 8 . 1 . 1 2 2 SER CB C 13 63.99 0.10 . 1 . . 104 . A 2 SER CB . 34990 1 9 . 1 . 1 2 2 SER N N 15 115.66 0.10 . 1 . . 106 . A 2 SER N . 34990 1 10 . 1 . 1 3 3 HIS HA H 1 4.56 0.02 . 1 . . 110 . A 3 HIS HA . 34990 1 11 . 1 . 1 3 3 HIS HB2 H 1 2.97 0.02 . 2 . . 111 . A 3 HIS HB2 . 34990 1 12 . 1 . 1 3 3 HIS HB3 H 1 2.94 0.02 . 2 . . 112 . A 3 HIS HB3 . 34990 1 13 . 1 . 1 3 3 HIS HD2 H 1 6.89 0.02 . 1 . . 113 . A 3 HIS HD2 . 34990 1 14 . 1 . 1 3 3 HIS CA C 13 56.59 0.10 . 1 . . 108 . A 3 HIS CA . 34990 1 15 . 1 . 1 3 3 HIS CB C 13 30.61 0.10 . 1 . . 109 . A 3 HIS CB . 34990 1 16 . 1 . 1 3 3 HIS N N 15 121.50 0.10 . 1 . . 114 . A 3 HIS N . 34990 1 17 . 1 . 1 4 4 MET HA H 1 4.38 0.02 . 1 . . 119 . A 4 MET HA . 34990 1 18 . 1 . 1 4 4 MET HB2 H 1 2.04 0.02 . 2 . . 123 . A 4 MET HB2 . 34990 1 19 . 1 . 1 4 4 MET HB3 H 1 2.04 0.02 . 2 . . 123 . A 4 MET HB3 . 34990 1 20 . 1 . 1 4 4 MET HG2 H 1 2.42 0.02 . 2 . . 120 . A 4 MET HG2 . 34990 1 21 . 1 . 1 4 4 MET HG3 H 1 2.34 0.02 . 2 . . 121 . A 4 MET HG3 . 34990 1 22 . 1 . 1 4 4 MET C C 13 176.59 0.10 . 1 . . 115 . A 4 MET C . 34990 1 23 . 1 . 1 4 4 MET CA C 13 55.77 0.10 . 1 . . 116 . A 4 MET CA . 34990 1 24 . 1 . 1 4 4 MET CB C 13 32.46 0.10 . 1 . . 117 . A 4 MET CB . 34990 1 25 . 1 . 1 4 4 MET CG C 13 31.93 0.10 . 1 . . 118 . A 4 MET CG . 34990 1 26 . 1 . 1 4 4 MET N N 15 121.72 0.10 . 1 . . 122 . A 4 MET N . 34990 1 27 . 1 . 1 5 5 GLY H H 1 8.40 0.02 . 1 . . 126 . A 5 GLY H . 34990 1 28 . 1 . 1 5 5 GLY HA2 H 1 3.98 0.02 . 2 . . 128 . A 5 GLY HA2 . 34990 1 29 . 1 . 1 5 5 GLY HA3 H 1 3.98 0.02 . 2 . . 128 . A 5 GLY HA3 . 34990 1 30 . 1 . 1 5 5 GLY C C 13 174.07 0.10 . 1 . . 124 . A 5 GLY C . 34990 1 31 . 1 . 1 5 5 GLY CA C 13 45.38 0.10 . 1 . . 125 . A 5 GLY CA . 34990 1 32 . 1 . 1 5 5 GLY N N 15 109.66 0.10 . 1 . . 127 . A 5 GLY N . 34990 1 33 . 1 . 1 6 6 GLU H H 1 8.19 0.02 . 1 . . 133 . A 6 GLU H . 34990 1 34 . 1 . 1 6 6 GLU HA H 1 4.48 0.02 . 1 . . 134 . A 6 GLU HA . 34990 1 35 . 1 . 1 6 6 GLU HB2 H 1 2.17 0.02 . 2 . . 135 . A 6 GLU HB2 . 34990 1 36 . 1 . 1 6 6 GLU HB3 H 1 1.97 0.02 . 2 . . 136 . A 6 GLU HB3 . 34990 1 37 . 1 . 1 6 6 GLU HG2 H 1 2.29 0.02 . 2 . . 138 . A 6 GLU HG2 . 34990 1 38 . 1 . 1 6 6 GLU HG3 H 1 2.29 0.02 . 2 . . 138 . A 6 GLU HG3 . 34990 1 39 . 1 . 1 6 6 GLU C C 13 176.19 0.10 . 1 . . 129 . A 6 GLU C . 34990 1 40 . 1 . 1 6 6 GLU CA C 13 56.30 0.10 . 1 . . 130 . A 6 GLU CA . 34990 1 41 . 1 . 1 6 6 GLU CB C 13 30.71 0.10 . 1 . . 131 . A 6 GLU CB . 34990 1 42 . 1 . 1 6 6 GLU CG C 13 36.46 0.10 . 1 . . 132 . A 6 GLU CG . 34990 1 43 . 1 . 1 6 6 GLU N N 15 120.16 0.10 . 1 . . 137 . A 6 GLU N . 34990 1 44 . 1 . 1 7 7 GLN H H 1 8.56 0.02 . 1 . . 143 . A 7 GLN H . 34990 1 45 . 1 . 1 7 7 GLN HA H 1 4.79 0.02 . 1 . . 144 . A 7 GLN HA . 34990 1 46 . 1 . 1 7 7 GLN HB2 H 1 1.97 0.02 . 2 . . 145 . A 7 GLN HB2 . 34990 1 47 . 1 . 1 7 7 GLN HB3 H 1 2.16 0.02 . 2 . . 146 . A 7 GLN HB3 . 34990 1 48 . 1 . 1 7 7 GLN HG2 H 1 2.44 0.02 . 2 . . 151 . A 7 GLN HG2 . 34990 1 49 . 1 . 1 7 7 GLN HG3 H 1 2.44 0.02 . 2 . . 151 . A 7 GLN HG3 . 34990 1 50 . 1 . 1 7 7 GLN HE21 H 1 6.88 0.02 . 2 . . 147 . A 7 GLN HE21 . 34990 1 51 . 1 . 1 7 7 GLN HE22 H 1 7.51 0.02 . 2 . . 148 . A 7 GLN HE22 . 34990 1 52 . 1 . 1 7 7 GLN C C 13 173.63 0.10 . 1 . . 139 . A 7 GLN C . 34990 1 53 . 1 . 1 7 7 GLN CA C 13 53.05 0.10 . 1 . . 140 . A 7 GLN CA . 34990 1 54 . 1 . 1 7 7 GLN CB C 13 29.52 0.10 . 1 . . 141 . A 7 GLN CB . 34990 1 55 . 1 . 1 7 7 GLN CG C 13 33.44 0.10 . 1 . . 142 . A 7 GLN CG . 34990 1 56 . 1 . 1 7 7 GLN N N 15 120.91 0.10 . 1 . . 149 . A 7 GLN N . 34990 1 57 . 1 . 1 7 7 GLN NE2 N 15 112.83 0.10 . 1 . . 150 . A 7 GLN NE2 . 34990 1 58 . 1 . 1 8 8 PRO HA H 1 3.78 0.02 . 1 . . 157 . A 8 PRO HA . 34990 1 59 . 1 . 1 8 8 PRO HB2 H 1 1.49 0.02 . 1 . . 158 . A 8 PRO HB2 . 34990 1 60 . 1 . 1 8 8 PRO HB3 H 1 1.34 0.02 . 1 . . 159 . A 8 PRO HB3 . 34990 1 61 . 1 . 1 8 8 PRO HG2 H 1 1.89 0.02 . 2 . . 162 . A 8 PRO HG2 . 34990 1 62 . 1 . 1 8 8 PRO HG3 H 1 1.84 0.02 . 2 . . 163 . A 8 PRO HG3 . 34990 1 63 . 1 . 1 8 8 PRO HD2 H 1 3.80 0.02 . 1 . . 160 . A 8 PRO HD2 . 34990 1 64 . 1 . 1 8 8 PRO HD3 H 1 3.74 0.02 . 1 . . 161 . A 8 PRO HD3 . 34990 1 65 . 1 . 1 8 8 PRO C C 13 177.13 0.10 . 1 . . 152 . A 8 PRO C . 34990 1 66 . 1 . 1 8 8 PRO CA C 13 62.52 0.10 . 1 . . 153 . A 8 PRO CA . 34990 1 67 . 1 . 1 8 8 PRO CB C 13 32.21 0.10 . 1 . . 154 . A 8 PRO CB . 34990 1 68 . 1 . 1 8 8 PRO CG C 13 26.82 0.10 . 1 . . 156 . A 8 PRO CG . 34990 1 69 . 1 . 1 8 8 PRO CD C 13 50.41 0.10 . 1 . . 155 . A 8 PRO CD . 34990 1 70 . 1 . 1 9 9 ILE H H 1 8.58 0.02 . 1 . . 170 . A 9 ILE H . 34990 1 71 . 1 . 1 9 9 ILE HA H 1 4.21 0.02 . 1 . . 171 . A 9 ILE HA . 34990 1 72 . 1 . 1 9 9 ILE HB H 1 1.79 0.02 . 1 . . 172 . A 9 ILE HB . 34990 1 73 . 1 . 1 9 9 ILE HG12 H 1 1.47 0.02 . 1 . . 174 . A 9 ILE HG12 . 34990 1 74 . 1 . 1 9 9 ILE HG13 H 1 1.18 0.02 . 1 . . 175 . A 9 ILE HG13 . 34990 1 75 . 1 . 1 9 9 ILE HG21 H 1 1.03 0.02 . 1 . . 176 . A 9 ILE HG21 . 34990 1 76 . 1 . 1 9 9 ILE HG22 H 1 1.03 0.02 . 1 . . 176 . A 9 ILE HG22 . 34990 1 77 . 1 . 1 9 9 ILE HG23 H 1 1.03 0.02 . 1 . . 176 . A 9 ILE HG23 . 34990 1 78 . 1 . 1 9 9 ILE HD11 H 1 0.76 0.02 . 1 . . 173 . A 9 ILE HD11 . 34990 1 79 . 1 . 1 9 9 ILE HD12 H 1 0.76 0.02 . 1 . . 173 . A 9 ILE HD12 . 34990 1 80 . 1 . 1 9 9 ILE HD13 H 1 0.76 0.02 . 1 . . 173 . A 9 ILE HD13 . 34990 1 81 . 1 . 1 9 9 ILE C C 13 176.40 0.10 . 1 . . 164 . A 9 ILE C . 34990 1 82 . 1 . 1 9 9 ILE CA C 13 62.00 0.10 . 1 . . 165 . A 9 ILE CA . 34990 1 83 . 1 . 1 9 9 ILE CB C 13 39.02 0.10 . 1 . . 166 . A 9 ILE CB . 34990 1 84 . 1 . 1 9 9 ILE CG1 C 13 27.52 0.10 . 1 . . 168 . A 9 ILE CG1 . 34990 1 85 . 1 . 1 9 9 ILE CG2 C 13 18.29 0.10 . 1 . . 169 . A 9 ILE CG2 . 34990 1 86 . 1 . 1 9 9 ILE CD1 C 13 13.75 0.10 . 1 . . 167 . A 9 ILE CD1 . 34990 1 87 . 1 . 1 9 9 ILE N N 15 119.00 0.10 . 1 . . 177 . A 9 ILE N . 34990 1 88 . 1 . 1 10 10 PHE H H 1 7.23 0.02 . 1 . . 183 . A 10 PHE H . 34990 1 89 . 1 . 1 10 10 PHE HA H 1 4.73 0.02 . 1 . . 184 . A 10 PHE HA . 34990 1 90 . 1 . 1 10 10 PHE HB2 H 1 3.48 0.02 . 2 . . 185 . A 10 PHE HB2 . 34990 1 91 . 1 . 1 10 10 PHE HB3 H 1 2.71 0.02 . 2 . . 186 . A 10 PHE HB3 . 34990 1 92 . 1 . 1 10 10 PHE HD1 H 1 7.34 0.02 . 3 . . 188 . A 10 PHE HD1 . 34990 1 93 . 1 . 1 10 10 PHE HD2 H 1 7.34 0.02 . 3 . . 188 . A 10 PHE HD2 . 34990 1 94 . 1 . 1 10 10 PHE HE1 H 1 7.38 0.02 . 3 . . 189 . A 10 PHE HE1 . 34990 1 95 . 1 . 1 10 10 PHE HE2 H 1 7.38 0.02 . 3 . . 189 . A 10 PHE HE2 . 34990 1 96 . 1 . 1 10 10 PHE C C 13 173.53 0.10 . 1 . . 178 . A 10 PHE C . 34990 1 97 . 1 . 1 10 10 PHE CA C 13 58.42 0.10 . 1 . . 179 . A 10 PHE CA . 34990 1 98 . 1 . 1 10 10 PHE CB C 13 41.92 0.10 . 1 . . 180 . A 10 PHE CB . 34990 1 99 . 1 . 1 10 10 PHE CD1 C 13 132.22 0.10 . 1 . . 181 . A 10 PHE CD1 . 34990 1 100 . 1 . 1 10 10 PHE CD2 C 13 132.22 0.10 . 1 . . 181 . A 10 PHE CD2 . 34990 1 101 . 1 . 1 10 10 PHE CE1 C 13 132.26 0.10 . 1 . . 182 . A 10 PHE CE1 . 34990 1 102 . 1 . 1 10 10 PHE CE2 C 13 132.26 0.10 . 1 . . 182 . A 10 PHE CE2 . 34990 1 103 . 1 . 1 10 10 PHE N N 15 118.73 0.10 . 1 . . 187 . A 10 PHE N . 34990 1 104 . 1 . 1 11 11 SER H H 1 7.92 0.02 . 1 . . 193 . A 11 SER H . 34990 1 105 . 1 . 1 11 11 SER HA H 1 5.43 0.02 . 1 . . 194 . A 11 SER HA . 34990 1 106 . 1 . 1 11 11 SER HB2 H 1 3.40 0.02 . 2 . . 195 . A 11 SER HB2 . 34990 1 107 . 1 . 1 11 11 SER HB3 H 1 3.66 0.02 . 2 . . 196 . A 11 SER HB3 . 34990 1 108 . 1 . 1 11 11 SER C C 13 170.62 0.10 . 1 . . 190 . A 11 SER C . 34990 1 109 . 1 . 1 11 11 SER CA C 13 57.55 0.10 . 1 . . 191 . A 11 SER CA . 34990 1 110 . 1 . 1 11 11 SER CB C 13 66.58 0.10 . 1 . . 192 . A 11 SER CB . 34990 1 111 . 1 . 1 11 11 SER N N 15 123.30 0.10 . 1 . . 197 . A 11 SER N . 34990 1 112 . 1 . 1 12 12 THR H H 1 8.91 0.02 . 1 . . 202 . A 12 THR H . 34990 1 113 . 1 . 1 12 12 THR HA H 1 4.62 0.02 . 1 . . 203 . A 12 THR HA . 34990 1 114 . 1 . 1 12 12 THR HB H 1 4.21 0.02 . 1 . . 204 . A 12 THR HB . 34990 1 115 . 1 . 1 12 12 THR HG21 H 1 1.39 0.02 . 1 . . 205 . A 12 THR HG21 . 34990 1 116 . 1 . 1 12 12 THR HG22 H 1 1.39 0.02 . 1 . . 205 . A 12 THR HG22 . 34990 1 117 . 1 . 1 12 12 THR HG23 H 1 1.39 0.02 . 1 . . 205 . A 12 THR HG23 . 34990 1 118 . 1 . 1 12 12 THR C C 13 171.72 0.10 . 1 . . 198 . A 12 THR C . 34990 1 119 . 1 . 1 12 12 THR CA C 13 59.45 0.10 . 1 . . 199 . A 12 THR CA . 34990 1 120 . 1 . 1 12 12 THR CB C 13 70.02 0.10 . 1 . . 200 . A 12 THR CB . 34990 1 121 . 1 . 1 12 12 THR CG2 C 13 20.46 0.10 . 1 . . 201 . A 12 THR CG2 . 34990 1 122 . 1 . 1 12 12 THR N N 15 118.36 0.10 . 1 . . 206 . A 12 THR N . 34990 1 123 . 1 . 1 13 13 ARG H H 1 8.17 0.02 . 1 . . 212 . A 13 ARG H . 34990 1 124 . 1 . 1 13 13 ARG HA H 1 5.36 0.02 . 1 . . 213 . A 13 ARG HA . 34990 1 125 . 1 . 1 13 13 ARG HB2 H 1 1.64 0.02 . 1 . . 214 . A 13 ARG HB2 . 34990 1 126 . 1 . 1 13 13 ARG HB3 H 1 1.47 0.02 . 1 . . 215 . A 13 ARG HB3 . 34990 1 127 . 1 . 1 13 13 ARG HG2 H 1 1.49 0.02 . 2 . . 216 . A 13 ARG HG2 . 34990 1 128 . 1 . 1 13 13 ARG HG3 H 1 1.41 0.02 . 2 . . 217 . A 13 ARG HG3 . 34990 1 129 . 1 . 1 13 13 ARG HD2 H 1 3.01 0.02 . 2 . . 219 . A 13 ARG HD2 . 34990 1 130 . 1 . 1 13 13 ARG HD3 H 1 3.01 0.02 . 2 . . 219 . A 13 ARG HD3 . 34990 1 131 . 1 . 1 13 13 ARG C C 13 175.04 0.10 . 1 . . 207 . A 13 ARG C . 34990 1 132 . 1 . 1 13 13 ARG CA C 13 54.30 0.10 . 1 . . 208 . A 13 ARG CA . 34990 1 133 . 1 . 1 13 13 ARG CB C 13 32.69 0.10 . 1 . . 209 . A 13 ARG CB . 34990 1 134 . 1 . 1 13 13 ARG CG C 13 27.04 0.10 . 1 . . 211 . A 13 ARG CG . 34990 1 135 . 1 . 1 13 13 ARG CD C 13 43.17 0.10 . 1 . . 210 . A 13 ARG CD . 34990 1 136 . 1 . 1 13 13 ARG N N 15 123.17 0.10 . 1 . . 218 . A 13 ARG N . 34990 1 137 . 1 . 1 14 14 ALA H H 1 9.06 0.02 . 1 . . 223 . A 14 ALA H . 34990 1 138 . 1 . 1 14 14 ALA HA H 1 4.52 0.02 . 1 . . 224 . A 14 ALA HA . 34990 1 139 . 1 . 1 14 14 ALA HB1 H 1 0.56 0.02 . 1 . . 225 . A 14 ALA HB1 . 34990 1 140 . 1 . 1 14 14 ALA HB2 H 1 0.56 0.02 . 1 . . 225 . A 14 ALA HB2 . 34990 1 141 . 1 . 1 14 14 ALA HB3 H 1 0.56 0.02 . 1 . . 225 . A 14 ALA HB3 . 34990 1 142 . 1 . 1 14 14 ALA C C 13 176.00 0.10 . 1 . . 220 . A 14 ALA C . 34990 1 143 . 1 . 1 14 14 ALA CA C 13 51.55 0.10 . 1 . . 221 . A 14 ALA CA . 34990 1 144 . 1 . 1 14 14 ALA CB C 13 22.43 0.10 . 1 . . 222 . A 14 ALA CB . 34990 1 145 . 1 . 1 14 14 ALA N N 15 123.52 0.10 . 1 . . 226 . A 14 ALA N . 34990 1 146 . 1 . 1 15 15 HIS H H 1 8.67 0.02 . 1 . . 231 . A 15 HIS H . 34990 1 147 . 1 . 1 15 15 HIS HA H 1 4.17 0.02 . 1 . . 232 . A 15 HIS HA . 34990 1 148 . 1 . 1 15 15 HIS HB2 H 1 3.10 0.02 . 2 . . 233 . A 15 HIS HB2 . 34990 1 149 . 1 . 1 15 15 HIS HB3 H 1 2.83 0.02 . 2 . . 234 . A 15 HIS HB3 . 34990 1 150 . 1 . 1 15 15 HIS HD2 H 1 6.64 0.02 . 1 . . 235 . A 15 HIS HD2 . 34990 1 151 . 1 . 1 15 15 HIS HE1 H 1 7.72 0.02 . 1 . . 236 . A 15 HIS HE1 . 34990 1 152 . 1 . 1 15 15 HIS C C 13 174.69 0.10 . 1 . . 227 . A 15 HIS C . 34990 1 153 . 1 . 1 15 15 HIS CA C 13 58.12 0.10 . 1 . . 228 . A 15 HIS CA . 34990 1 154 . 1 . 1 15 15 HIS CB C 13 31.63 0.10 . 1 . . 229 . A 15 HIS CB . 34990 1 155 . 1 . 1 15 15 HIS CE1 C 13 139.47 0.10 . 1 . . 230 . A 15 HIS CE1 . 34990 1 156 . 1 . 1 15 15 HIS N N 15 120.05 0.10 . 1 . . 237 . A 15 HIS N . 34990 1 157 . 1 . 1 16 16 VAL H H 1 7.86 0.02 . 1 . . 243 . A 16 VAL H . 34990 1 158 . 1 . 1 16 16 VAL HA H 1 4.59 0.02 . 1 . . 244 . A 16 VAL HA . 34990 1 159 . 1 . 1 16 16 VAL HB H 1 1.58 0.02 . 1 . . 245 . A 16 VAL HB . 34990 1 160 . 1 . 1 16 16 VAL HG11 H 1 0.97 0.02 . 2 . . 246 . A 16 VAL HG11 . 34990 1 161 . 1 . 1 16 16 VAL HG12 H 1 0.97 0.02 . 2 . . 246 . A 16 VAL HG12 . 34990 1 162 . 1 . 1 16 16 VAL HG13 H 1 0.97 0.02 . 2 . . 246 . A 16 VAL HG13 . 34990 1 163 . 1 . 1 16 16 VAL HG21 H 1 0.66 0.02 . 2 . . 247 . A 16 VAL HG21 . 34990 1 164 . 1 . 1 16 16 VAL HG22 H 1 0.66 0.02 . 2 . . 247 . A 16 VAL HG22 . 34990 1 165 . 1 . 1 16 16 VAL HG23 H 1 0.66 0.02 . 2 . . 247 . A 16 VAL HG23 . 34990 1 166 . 1 . 1 16 16 VAL C C 13 175.12 0.10 . 1 . . 238 . A 16 VAL C . 34990 1 167 . 1 . 1 16 16 VAL CA C 13 62.35 0.10 . 1 . . 239 . A 16 VAL CA . 34990 1 168 . 1 . 1 16 16 VAL CB C 13 33.38 0.10 . 1 . . 240 . A 16 VAL CB . 34990 1 169 . 1 . 1 16 16 VAL CG1 C 13 21.90 0.10 . 2 . . 241 . A 16 VAL CG1 . 34990 1 170 . 1 . 1 16 16 VAL CG2 C 13 21.25 0.10 . 2 . . 242 . A 16 VAL CG2 . 34990 1 171 . 1 . 1 16 16 VAL N N 15 122.55 0.10 . 1 . . 248 . A 16 VAL N . 34990 1 172 . 1 . 1 17 17 PHE H H 1 9.59 0.02 . 1 . . 254 . A 17 PHE H . 34990 1 173 . 1 . 1 17 17 PHE HA H 1 5.54 0.02 . 1 . . 255 . A 17 PHE HA . 34990 1 174 . 1 . 1 17 17 PHE HB2 H 1 3.25 0.02 . 1 . . 256 . A 17 PHE HB2 . 34990 1 175 . 1 . 1 17 17 PHE HB3 H 1 2.60 0.02 . 1 . . 257 . A 17 PHE HB3 . 34990 1 176 . 1 . 1 17 17 PHE HD1 H 1 6.93 0.02 . 3 . . 259 . A 17 PHE HD1 . 34990 1 177 . 1 . 1 17 17 PHE HD2 H 1 6.93 0.02 . 3 . . 259 . A 17 PHE HD2 . 34990 1 178 . 1 . 1 17 17 PHE HE1 H 1 7.17 0.02 . 3 . . 260 . A 17 PHE HE1 . 34990 1 179 . 1 . 1 17 17 PHE HE2 H 1 7.17 0.02 . 3 . . 260 . A 17 PHE HE2 . 34990 1 180 . 1 . 1 17 17 PHE C C 13 175.00 0.10 . 1 . . 249 . A 17 PHE C . 34990 1 181 . 1 . 1 17 17 PHE CA C 13 56.20 0.10 . 1 . . 250 . A 17 PHE CA . 34990 1 182 . 1 . 1 17 17 PHE CB C 13 45.38 0.10 . 1 . . 251 . A 17 PHE CB . 34990 1 183 . 1 . 1 17 17 PHE CD1 C 13 132.66 0.10 . 1 . . 252 . A 17 PHE CD1 . 34990 1 184 . 1 . 1 17 17 PHE CD2 C 13 132.66 0.10 . 1 . . 252 . A 17 PHE CD2 . 34990 1 185 . 1 . 1 17 17 PHE CE1 C 13 133.97 0.10 . 1 . . 253 . A 17 PHE CE1 . 34990 1 186 . 1 . 1 17 17 PHE CE2 C 13 133.97 0.10 . 1 . . 253 . A 17 PHE CE2 . 34990 1 187 . 1 . 1 17 17 PHE N N 15 127.38 0.10 . 1 . . 258 . A 17 PHE N . 34990 1 188 . 1 . 1 18 18 GLN H H 1 9.17 0.02 . 1 . . 265 . A 18 GLN H . 34990 1 189 . 1 . 1 18 18 GLN HA H 1 5.69 0.02 . 1 . . 266 . A 18 GLN HA . 34990 1 190 . 1 . 1 18 18 GLN HB2 H 1 2.08 0.02 . 1 . . 267 . A 18 GLN HB2 . 34990 1 191 . 1 . 1 18 18 GLN HB3 H 1 1.95 0.02 . 1 . . 268 . A 18 GLN HB3 . 34990 1 192 . 1 . 1 18 18 GLN HG2 H 1 2.35 0.02 . 2 . . 273 . A 18 GLN HG2 . 34990 1 193 . 1 . 1 18 18 GLN HG3 H 1 2.35 0.02 . 2 . . 273 . A 18 GLN HG3 . 34990 1 194 . 1 . 1 18 18 GLN HE21 H 1 7.33 0.02 . 2 . . 269 . A 18 GLN HE21 . 34990 1 195 . 1 . 1 18 18 GLN HE22 H 1 7.03 0.02 . 2 . . 270 . A 18 GLN HE22 . 34990 1 196 . 1 . 1 18 18 GLN C C 13 175.72 0.10 . 1 . . 261 . A 18 GLN C . 34990 1 197 . 1 . 1 18 18 GLN CA C 13 54.70 0.10 . 1 . . 262 . A 18 GLN CA . 34990 1 198 . 1 . 1 18 18 GLN CB C 13 34.62 0.10 . 1 . . 263 . A 18 GLN CB . 34990 1 199 . 1 . 1 18 18 GLN CG C 13 35.55 0.10 . 1 . . 264 . A 18 GLN CG . 34990 1 200 . 1 . 1 18 18 GLN N N 15 117.30 0.10 . 1 . . 271 . A 18 GLN N . 34990 1 201 . 1 . 1 18 18 GLN NE2 N 15 111.98 0.10 . 1 . . 272 . A 18 GLN NE2 . 34990 1 202 . 1 . 1 19 19 ILE H H 1 7.83 0.02 . 1 . . 280 . A 19 ILE H . 34990 1 203 . 1 . 1 19 19 ILE HA H 1 3.85 0.02 . 1 . . 281 . A 19 ILE HA . 34990 1 204 . 1 . 1 19 19 ILE HB H 1 0.99 0.02 . 1 . . 282 . A 19 ILE HB . 34990 1 205 . 1 . 1 19 19 ILE HG12 H 1 0.51 0.02 . 2 . . 284 . A 19 ILE HG12 . 34990 1 206 . 1 . 1 19 19 ILE HG13 H 1 0.30 0.02 . 2 . . 285 . A 19 ILE HG13 . 34990 1 207 . 1 . 1 19 19 ILE HG21 H 1 0.40 0.02 . 1 . . 286 . A 19 ILE HG21 . 34990 1 208 . 1 . 1 19 19 ILE HG22 H 1 0.40 0.02 . 1 . . 286 . A 19 ILE HG22 . 34990 1 209 . 1 . 1 19 19 ILE HG23 H 1 0.40 0.02 . 1 . . 286 . A 19 ILE HG23 . 34990 1 210 . 1 . 1 19 19 ILE HD11 H 1 -0.45 0.02 . 1 . . 283 . A 19 ILE HD11 . 34990 1 211 . 1 . 1 19 19 ILE HD12 H 1 -0.45 0.02 . 1 . . 283 . A 19 ILE HD12 . 34990 1 212 . 1 . 1 19 19 ILE HD13 H 1 -0.45 0.02 . 1 . . 283 . A 19 ILE HD13 . 34990 1 213 . 1 . 1 19 19 ILE C C 13 175.04 0.10 . 1 . . 274 . A 19 ILE C . 34990 1 214 . 1 . 1 19 19 ILE CA C 13 59.66 0.10 . 1 . . 275 . A 19 ILE CA . 34990 1 215 . 1 . 1 19 19 ILE CB C 13 39.06 0.10 . 1 . . 276 . A 19 ILE CB . 34990 1 216 . 1 . 1 19 19 ILE CG1 C 13 28.38 0.10 . 1 . . 278 . A 19 ILE CG1 . 34990 1 217 . 1 . 1 19 19 ILE CG2 C 13 17.88 0.10 . 1 . . 279 . A 19 ILE CG2 . 34990 1 218 . 1 . 1 19 19 ILE CD1 C 13 11.67 0.10 . 1 . . 277 . A 19 ILE CD1 . 34990 1 219 . 1 . 1 19 19 ILE N N 15 124.25 0.10 . 1 . . 287 . A 19 ILE N . 34990 1 220 . 1 . 1 20 20 ASP H H 1 8.32 0.02 . 1 . . 291 . A 20 ASP H . 34990 1 221 . 1 . 1 20 20 ASP HA H 1 4.60 0.02 . 1 . . 292 . A 20 ASP HA . 34990 1 222 . 1 . 1 20 20 ASP HB2 H 1 2.84 0.02 . 2 . . 293 . A 20 ASP HB2 . 34990 1 223 . 1 . 1 20 20 ASP HB3 H 1 2.55 0.02 . 2 . . 294 . A 20 ASP HB3 . 34990 1 224 . 1 . 1 20 20 ASP C C 13 175.47 0.10 . 1 . . 288 . A 20 ASP C . 34990 1 225 . 1 . 1 20 20 ASP CA C 13 51.81 0.10 . 1 . . 289 . A 20 ASP CA . 34990 1 226 . 1 . 1 20 20 ASP CB C 13 42.52 0.10 . 1 . . 290 . A 20 ASP CB . 34990 1 227 . 1 . 1 20 20 ASP N N 15 127.75 0.10 . 1 . . 295 . A 20 ASP N . 34990 1 228 . 1 . 1 21 21 PRO HA H 1 4.26 0.02 . 1 . . 301 . A 21 PRO HA . 34990 1 229 . 1 . 1 21 21 PRO HB2 H 1 2.28 0.02 . 2 . . 302 . A 21 PRO HB2 . 34990 1 230 . 1 . 1 21 21 PRO HB3 H 1 1.93 0.02 . 2 . . 303 . A 21 PRO HB3 . 34990 1 231 . 1 . 1 21 21 PRO HG2 H 1 2.04 0.02 . 2 . . 306 . A 21 PRO HG2 . 34990 1 232 . 1 . 1 21 21 PRO HG3 H 1 1.93 0.02 . 2 . . 307 . A 21 PRO HG3 . 34990 1 233 . 1 . 1 21 21 PRO HD2 H 1 3.89 0.02 . 1 . . 304 . A 21 PRO HD2 . 34990 1 234 . 1 . 1 21 21 PRO HD3 H 1 3.96 0.02 . 1 . . 305 . A 21 PRO HD3 . 34990 1 235 . 1 . 1 21 21 PRO C C 13 177.34 0.10 . 1 . . 296 . A 21 PRO C . 34990 1 236 . 1 . 1 21 21 PRO CA C 13 64.06 0.10 . 1 . . 297 . A 21 PRO CA . 34990 1 237 . 1 . 1 21 21 PRO CB C 13 32.16 0.10 . 1 . . 298 . A 21 PRO CB . 34990 1 238 . 1 . 1 21 21 PRO CG C 13 26.96 0.10 . 1 . . 300 . A 21 PRO CG . 34990 1 239 . 1 . 1 21 21 PRO CD C 13 50.85 0.10 . 1 . . 299 . A 21 PRO CD . 34990 1 240 . 1 . 1 22 22 ASN H H 1 8.45 0.02 . 1 . . 311 . A 22 ASN H . 34990 1 241 . 1 . 1 22 22 ASN HA H 1 4.67 0.02 . 1 . . 312 . A 22 ASN HA . 34990 1 242 . 1 . 1 22 22 ASN HB2 H 1 2.95 0.02 . 2 . . 313 . A 22 ASN HB2 . 34990 1 243 . 1 . 1 22 22 ASN HB3 H 1 2.85 0.02 . 2 . . 314 . A 22 ASN HB3 . 34990 1 244 . 1 . 1 22 22 ASN HD21 H 1 7.92 0.02 . 2 . . 315 . A 22 ASN HD21 . 34990 1 245 . 1 . 1 22 22 ASN HD22 H 1 7.06 0.02 . 2 . . 316 . A 22 ASN HD22 . 34990 1 246 . 1 . 1 22 22 ASN C C 13 176.03 0.10 . 1 . . 308 . A 22 ASN C . 34990 1 247 . 1 . 1 22 22 ASN CA C 13 55.03 0.10 . 1 . . 309 . A 22 ASN CA . 34990 1 248 . 1 . 1 22 22 ASN CB C 13 39.12 0.10 . 1 . . 310 . A 22 ASN CB . 34990 1 249 . 1 . 1 22 22 ASN N N 15 115.92 0.10 . 1 . . 317 . A 22 ASN N . 34990 1 250 . 1 . 1 22 22 ASN ND2 N 15 114.94 0.10 . 1 . . 318 . A 22 ASN ND2 . 34990 1 251 . 1 . 1 23 23 THR H H 1 7.94 0.02 . 1 . . 323 . A 23 THR H . 34990 1 252 . 1 . 1 23 23 THR HA H 1 4.35 0.02 . 1 . . 324 . A 23 THR HA . 34990 1 253 . 1 . 1 23 23 THR HB H 1 4.21 0.02 . 1 . . 325 . A 23 THR HB . 34990 1 254 . 1 . 1 23 23 THR HG21 H 1 1.17 0.02 . 1 . . 326 . A 23 THR HG21 . 34990 1 255 . 1 . 1 23 23 THR HG22 H 1 1.17 0.02 . 1 . . 326 . A 23 THR HG22 . 34990 1 256 . 1 . 1 23 23 THR HG23 H 1 1.17 0.02 . 1 . . 326 . A 23 THR HG23 . 34990 1 257 . 1 . 1 23 23 THR C C 13 174.82 0.10 . 1 . . 319 . A 23 THR C . 34990 1 258 . 1 . 1 23 23 THR CA C 13 61.73 0.10 . 1 . . 320 . A 23 THR CA . 34990 1 259 . 1 . 1 23 23 THR CB C 13 70.67 0.10 . 1 . . 321 . A 23 THR CB . 34990 1 260 . 1 . 1 23 23 THR CG2 C 13 21.34 0.10 . 1 . . 322 . A 23 THR CG2 . 34990 1 261 . 1 . 1 23 23 THR N N 15 109.58 0.10 . 1 . . 327 . A 23 THR N . 34990 1 262 . 1 . 1 24 24 LYS H H 1 8.21 0.02 . 1 . . 333 . A 24 LYS H . 34990 1 263 . 1 . 1 24 24 LYS HA H 1 3.89 0.02 . 1 . . 334 . A 24 LYS HA . 34990 1 264 . 1 . 1 24 24 LYS HB2 H 1 1.89 0.02 . 2 . . 335 . A 24 LYS HB2 . 34990 1 265 . 1 . 1 24 24 LYS HB3 H 1 1.81 0.02 . 2 . . 336 . A 24 LYS HB3 . 34990 1 266 . 1 . 1 24 24 LYS HG2 H 1 1.24 0.02 . 2 . . 339 . A 24 LYS HG2 . 34990 1 267 . 1 . 1 24 24 LYS HG3 H 1 1.27 0.02 . 2 . . 340 . A 24 LYS HG3 . 34990 1 268 . 1 . 1 24 24 LYS HD2 H 1 1.61 0.02 . 2 . . 337 . A 24 LYS HD2 . 34990 1 269 . 1 . 1 24 24 LYS HD3 H 1 1.52 0.02 . 2 . . 338 . A 24 LYS HD3 . 34990 1 270 . 1 . 1 24 24 LYS C C 13 176.04 0.10 . 1 . . 328 . A 24 LYS C . 34990 1 271 . 1 . 1 24 24 LYS CA C 13 57.66 0.10 . 1 . . 329 . A 24 LYS CA . 34990 1 272 . 1 . 1 24 24 LYS CB C 13 30.20 0.10 . 1 . . 330 . A 24 LYS CB . 34990 1 273 . 1 . 1 24 24 LYS CG C 13 25.05 0.10 . 1 . . 332 . A 24 LYS CG . 34990 1 274 . 1 . 1 24 24 LYS CD C 13 28.98 0.10 . 1 . . 331 . A 24 LYS CD . 34990 1 275 . 1 . 1 24 24 LYS N N 15 117.66 0.10 . 1 . . 341 . A 24 LYS N . 34990 1 276 . 1 . 1 25 25 LYS H H 1 7.84 0.02 . 1 . . 348 . A 25 LYS H . 34990 1 277 . 1 . 1 25 25 LYS HA H 1 4.22 0.02 . 1 . . 349 . A 25 LYS HA . 34990 1 278 . 1 . 1 25 25 LYS HB2 H 1 1.72 0.02 . 1 . . 350 . A 25 LYS HB2 . 34990 1 279 . 1 . 1 25 25 LYS HB3 H 1 1.55 0.02 . 1 . . 351 . A 25 LYS HB3 . 34990 1 280 . 1 . 1 25 25 LYS HG2 H 1 1.33 0.02 . 2 . . 352 . A 25 LYS HG2 . 34990 1 281 . 1 . 1 25 25 LYS HG3 H 1 1.26 0.02 . 2 . . 353 . A 25 LYS HG3 . 34990 1 282 . 1 . 1 25 25 LYS HD2 H 1 1.59 0.02 . 2 . . 355 . A 25 LYS HD2 . 34990 1 283 . 1 . 1 25 25 LYS HD3 H 1 1.59 0.02 . 2 . . 355 . A 25 LYS HD3 . 34990 1 284 . 1 . 1 25 25 LYS HE2 H 1 2.95 0.02 . 2 . . 356 . A 25 LYS HE2 . 34990 1 285 . 1 . 1 25 25 LYS HE3 H 1 2.95 0.02 . 2 . . 356 . A 25 LYS HE3 . 34990 1 286 . 1 . 1 25 25 LYS C C 13 175.00 0.10 . 1 . . 342 . A 25 LYS C . 34990 1 287 . 1 . 1 25 25 LYS CA C 13 56.52 0.10 . 1 . . 343 . A 25 LYS CA . 34990 1 288 . 1 . 1 25 25 LYS CB C 13 34.45 0.10 . 1 . . 344 . A 25 LYS CB . 34990 1 289 . 1 . 1 25 25 LYS CG C 13 24.56 0.10 . 1 . . 347 . A 25 LYS CG . 34990 1 290 . 1 . 1 25 25 LYS CD C 13 29.04 0.10 . 1 . . 345 . A 25 LYS CD . 34990 1 291 . 1 . 1 25 25 LYS CE C 13 42.12 0.10 . 1 . . 346 . A 25 LYS CE . 34990 1 292 . 1 . 1 25 25 LYS N N 15 115.78 0.10 . 1 . . 354 . A 25 LYS N . 34990 1 293 . 1 . 1 26 26 ASN H H 1 7.42 0.02 . 1 . . 360 . A 26 ASN H . 34990 1 294 . 1 . 1 26 26 ASN HA H 1 4.71 0.02 . 1 . . 361 . A 26 ASN HA . 34990 1 295 . 1 . 1 26 26 ASN HB2 H 1 2.75 0.02 . 2 . . 362 . A 26 ASN HB2 . 34990 1 296 . 1 . 1 26 26 ASN HB3 H 1 2.62 0.02 . 2 . . 363 . A 26 ASN HB3 . 34990 1 297 . 1 . 1 26 26 ASN C C 13 173.25 0.10 . 1 . . 357 . A 26 ASN C . 34990 1 298 . 1 . 1 26 26 ASN CA C 13 52.46 0.10 . 1 . . 358 . A 26 ASN CA . 34990 1 299 . 1 . 1 26 26 ASN CB C 13 40.52 0.10 . 1 . . 359 . A 26 ASN CB . 34990 1 300 . 1 . 1 26 26 ASN N N 15 115.69 0.10 . 1 . . 364 . A 26 ASN N . 34990 1 301 . 1 . 1 27 27 TRP H H 1 8.52 0.02 . 1 . . 372 . A 27 TRP H . 34990 1 302 . 1 . 1 27 27 TRP HA H 1 4.68 0.02 . 1 . . 373 . A 27 TRP HA . 34990 1 303 . 1 . 1 27 27 TRP HB2 H 1 2.94 0.02 . 2 . . 382 . A 27 TRP HB2 . 34990 1 304 . 1 . 1 27 27 TRP HB3 H 1 2.94 0.02 . 2 . . 382 . A 27 TRP HB3 . 34990 1 305 . 1 . 1 27 27 TRP HD1 H 1 6.88 0.02 . 1 . . 374 . A 27 TRP HD1 . 34990 1 306 . 1 . 1 27 27 TRP HE1 H 1 9.71 0.02 . 1 . . 375 . A 27 TRP HE1 . 34990 1 307 . 1 . 1 27 27 TRP HE3 H 1 7.10 0.02 . 1 . . 376 . A 27 TRP HE3 . 34990 1 308 . 1 . 1 27 27 TRP HZ2 H 1 7.38 0.02 . 1 . . 378 . A 27 TRP HZ2 . 34990 1 309 . 1 . 1 27 27 TRP HZ3 H 1 6.83 0.02 . 1 . . 379 . A 27 TRP HZ3 . 34990 1 310 . 1 . 1 27 27 TRP HH2 H 1 6.76 0.02 . 1 . . 377 . A 27 TRP HH2 . 34990 1 311 . 1 . 1 27 27 TRP C C 13 176.50 0.10 . 1 . . 365 . A 27 TRP C . 34990 1 312 . 1 . 1 27 27 TRP CA C 13 56.94 0.10 . 1 . . 366 . A 27 TRP CA . 34990 1 313 . 1 . 1 27 27 TRP CB C 13 31.13 0.10 . 1 . . 367 . A 27 TRP CB . 34990 1 314 . 1 . 1 27 27 TRP CE3 C 13 119.78 0.10 . 1 . . 368 . A 27 TRP CE3 . 34990 1 315 . 1 . 1 27 27 TRP CZ2 C 13 115.38 0.10 . 1 . . 370 . A 27 TRP CZ2 . 34990 1 316 . 1 . 1 27 27 TRP CZ3 C 13 121.53 0.10 . 1 . . 371 . A 27 TRP CZ3 . 34990 1 317 . 1 . 1 27 27 TRP CH2 C 13 124.66 0.10 . 1 . . 369 . A 27 TRP CH2 . 34990 1 318 . 1 . 1 27 27 TRP N N 15 121.55 0.10 . 1 . . 380 . A 27 TRP N . 34990 1 319 . 1 . 1 27 27 TRP NE1 N 15 128.25 0.10 . 1 . . 381 . A 27 TRP NE1 . 34990 1 320 . 1 . 1 28 28 VAL H H 1 9.60 0.02 . 1 . . 387 . A 28 VAL H . 34990 1 321 . 1 . 1 28 28 VAL HA H 1 4.84 0.02 . 1 . . 388 . A 28 VAL HA . 34990 1 322 . 1 . 1 28 28 VAL HB H 1 2.32 0.02 . 1 . . 389 . A 28 VAL HB . 34990 1 323 . 1 . 1 28 28 VAL HG11 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG11 . 34990 1 324 . 1 . 1 28 28 VAL HG12 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG12 . 34990 1 325 . 1 . 1 28 28 VAL HG13 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG13 . 34990 1 326 . 1 . 1 28 28 VAL HG21 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG21 . 34990 1 327 . 1 . 1 28 28 VAL HG22 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG22 . 34990 1 328 . 1 . 1 28 28 VAL HG23 H 1 1.03 0.02 . 1 . . 390 . A 28 VAL HG23 . 34990 1 329 . 1 . 1 28 28 VAL C C 13 174.53 0.10 . 1 . . 383 . A 28 VAL C . 34990 1 330 . 1 . 1 28 28 VAL CA C 13 59.17 0.10 . 1 . . 384 . A 28 VAL CA . 34990 1 331 . 1 . 1 28 28 VAL CB C 13 33.98 0.10 . 1 . . 385 . A 28 VAL CB . 34990 1 332 . 1 . 1 28 28 VAL CG1 C 13 20.58 0.10 . 1 . . 386 . A 28 VAL CG1 . 34990 1 333 . 1 . 1 28 28 VAL CG2 C 13 20.58 0.10 . 1 . . 386 . A 28 VAL CG2 . 34990 1 334 . 1 . 1 28 28 VAL N N 15 125.20 0.10 . 1 . . 391 . A 28 VAL N . 34990 1 335 . 1 . 1 29 29 PRO HA H 1 4.42 0.02 . 1 . . 397 . A 29 PRO HA . 34990 1 336 . 1 . 1 29 29 PRO HB2 H 1 1.93 0.02 . 1 . . 398 . A 29 PRO HB2 . 34990 1 337 . 1 . 1 29 29 PRO HB3 H 1 2.19 0.02 . 1 . . 399 . A 29 PRO HB3 . 34990 1 338 . 1 . 1 29 29 PRO HG2 H 1 2.18 0.02 . 2 . . 402 . A 29 PRO HG2 . 34990 1 339 . 1 . 1 29 29 PRO HG3 H 1 2.28 0.02 . 2 . . 403 . A 29 PRO HG3 . 34990 1 340 . 1 . 1 29 29 PRO HD2 H 1 3.99 0.02 . 2 . . 400 . A 29 PRO HD2 . 34990 1 341 . 1 . 1 29 29 PRO HD3 H 1 4.13 0.02 . 2 . . 401 . A 29 PRO HD3 . 34990 1 342 . 1 . 1 29 29 PRO C C 13 177.60 0.10 . 1 . . 392 . A 29 PRO C . 34990 1 343 . 1 . 1 29 29 PRO CA C 13 63.25 0.10 . 1 . . 393 . A 29 PRO CA . 34990 1 344 . 1 . 1 29 29 PRO CB C 13 32.12 0.10 . 1 . . 394 . A 29 PRO CB . 34990 1 345 . 1 . 1 29 29 PRO CG C 13 27.64 0.10 . 1 . . 396 . A 29 PRO CG . 34990 1 346 . 1 . 1 29 29 PRO CD C 13 51.27 0.10 . 1 . . 395 . A 29 PRO CD . 34990 1 347 . 1 . 1 30 30 THR H H 1 9.00 0.02 . 1 . . 408 . A 30 THR H . 34990 1 348 . 1 . 1 30 30 THR HA H 1 4.38 0.02 . 1 . . 409 . A 30 THR HA . 34990 1 349 . 1 . 1 30 30 THR HB H 1 4.04 0.02 . 1 . . 410 . A 30 THR HB . 34990 1 350 . 1 . 1 30 30 THR HG21 H 1 1.24 0.02 . 1 . . 411 . A 30 THR HG21 . 34990 1 351 . 1 . 1 30 30 THR HG22 H 1 1.24 0.02 . 1 . . 411 . A 30 THR HG22 . 34990 1 352 . 1 . 1 30 30 THR HG23 H 1 1.24 0.02 . 1 . . 411 . A 30 THR HG23 . 34990 1 353 . 1 . 1 30 30 THR C C 13 174.82 0.10 . 1 . . 404 . A 30 THR C . 34990 1 354 . 1 . 1 30 30 THR CA C 13 62.64 0.10 . 1 . . 405 . A 30 THR CA . 34990 1 355 . 1 . 1 30 30 THR CB C 13 68.83 0.10 . 1 . . 406 . A 30 THR CB . 34990 1 356 . 1 . 1 30 30 THR CG2 C 13 23.29 0.10 . 1 . . 407 . A 30 THR CG2 . 34990 1 357 . 1 . 1 30 30 THR N N 15 118.73 0.10 . 1 . . 412 . A 30 THR N . 34990 1 358 . 1 . 1 31 31 SER H H 1 7.42 0.02 . 1 . . 416 . A 31 SER H . 34990 1 359 . 1 . 1 31 31 SER HA H 1 4.66 0.02 . 1 . . 417 . A 31 SER HA . 34990 1 360 . 1 . 1 31 31 SER HB2 H 1 4.11 0.02 . 2 . . 418 . A 31 SER HB2 . 34990 1 361 . 1 . 1 31 31 SER HB3 H 1 3.50 0.02 . 2 . . 419 . A 31 SER HB3 . 34990 1 362 . 1 . 1 31 31 SER C C 13 173.90 0.10 . 1 . . 413 . A 31 SER C . 34990 1 363 . 1 . 1 31 31 SER CA C 13 56.84 0.10 . 1 . . 414 . A 31 SER CA . 34990 1 364 . 1 . 1 31 31 SER CB C 13 66.05 0.10 . 1 . . 415 . A 31 SER CB . 34990 1 365 . 1 . 1 31 31 SER N N 15 114.19 0.10 . 1 . . 420 . A 31 SER N . 34990 1 366 . 1 . 1 32 32 LYS HA H 1 4.12 0.02 . 1 . . 427 . A 32 LYS HA . 34990 1 367 . 1 . 1 32 32 LYS HB2 H 1 1.66 0.02 . 2 . . 430 . A 32 LYS HB2 . 34990 1 368 . 1 . 1 32 32 LYS HB3 H 1 1.66 0.02 . 2 . . 430 . A 32 LYS HB3 . 34990 1 369 . 1 . 1 32 32 LYS HG2 H 1 1.29 0.02 . 2 . . 428 . A 32 LYS HG2 . 34990 1 370 . 1 . 1 32 32 LYS HG3 H 1 1.22 0.02 . 2 . . 429 . A 32 LYS HG3 . 34990 1 371 . 1 . 1 32 32 LYS HD2 H 1 1.62 0.02 . 2 . . 431 . A 32 LYS HD2 . 34990 1 372 . 1 . 1 32 32 LYS HD3 H 1 1.62 0.02 . 2 . . 431 . A 32 LYS HD3 . 34990 1 373 . 1 . 1 32 32 LYS HE2 H 1 2.97 0.02 . 2 . . 432 . A 32 LYS HE2 . 34990 1 374 . 1 . 1 32 32 LYS HE3 H 1 2.97 0.02 . 2 . . 432 . A 32 LYS HE3 . 34990 1 375 . 1 . 1 32 32 LYS C C 13 175.94 0.10 . 1 . . 421 . A 32 LYS C . 34990 1 376 . 1 . 1 32 32 LYS CA C 13 57.73 0.10 . 1 . . 422 . A 32 LYS CA . 34990 1 377 . 1 . 1 32 32 LYS CB C 13 32.57 0.10 . 1 . . 423 . A 32 LYS CB . 34990 1 378 . 1 . 1 32 32 LYS CG C 13 24.99 0.10 . 1 . . 426 . A 32 LYS CG . 34990 1 379 . 1 . 1 32 32 LYS CD C 13 28.97 0.10 . 1 . . 424 . A 32 LYS CD . 34990 1 380 . 1 . 1 32 32 LYS CE C 13 42.10 0.10 . 1 . . 425 . A 32 LYS CE . 34990 1 381 . 1 . 1 33 33 HIS H H 1 7.54 0.02 . 1 . . 437 . A 33 HIS H . 34990 1 382 . 1 . 1 33 33 HIS HA H 1 4.72 0.02 . 1 . . 438 . A 33 HIS HA . 34990 1 383 . 1 . 1 33 33 HIS HB2 H 1 3.27 0.02 . 2 . . 439 . A 33 HIS HB2 . 34990 1 384 . 1 . 1 33 33 HIS HB3 H 1 2.96 0.02 . 2 . . 440 . A 33 HIS HB3 . 34990 1 385 . 1 . 1 33 33 HIS HD2 H 1 6.92 0.02 . 1 . . 441 . A 33 HIS HD2 . 34990 1 386 . 1 . 1 33 33 HIS C C 13 174.00 0.10 . 1 . . 433 . A 33 HIS C . 34990 1 387 . 1 . 1 33 33 HIS CA C 13 53.30 0.10 . 1 . . 434 . A 33 HIS CA . 34990 1 388 . 1 . 1 33 33 HIS CB C 13 32.23 0.10 . 1 . . 435 . A 33 HIS CB . 34990 1 389 . 1 . 1 33 33 HIS CD2 C 13 120.28 0.10 . 1 . . 436 . A 33 HIS CD2 . 34990 1 390 . 1 . 1 33 33 HIS N N 15 115.20 0.10 . 1 . . 442 . A 33 HIS N . 34990 1 391 . 1 . 1 34 34 ALA H H 1 8.33 0.02 . 1 . . 446 . A 34 ALA H . 34990 1 392 . 1 . 1 34 34 ALA HA H 1 3.51 0.02 . 1 . . 447 . A 34 ALA HA . 34990 1 393 . 1 . 1 34 34 ALA HB1 H 1 0.91 0.02 . 1 . . 448 . A 34 ALA HB1 . 34990 1 394 . 1 . 1 34 34 ALA HB2 H 1 0.91 0.02 . 1 . . 448 . A 34 ALA HB2 . 34990 1 395 . 1 . 1 34 34 ALA HB3 H 1 0.91 0.02 . 1 . . 448 . A 34 ALA HB3 . 34990 1 396 . 1 . 1 34 34 ALA C C 13 176.98 0.10 . 1 . . 443 . A 34 ALA C . 34990 1 397 . 1 . 1 34 34 ALA CA C 13 52.77 0.10 . 1 . . 444 . A 34 ALA CA . 34990 1 398 . 1 . 1 34 34 ALA CB C 13 17.79 0.10 . 1 . . 445 . A 34 ALA CB . 34990 1 399 . 1 . 1 34 34 ALA N N 15 123.50 0.10 . 1 . . 449 . A 34 ALA N . 34990 1 400 . 1 . 1 35 35 VAL H H 1 8.38 0.02 . 1 . . 455 . A 35 VAL H . 34990 1 401 . 1 . 1 35 35 VAL HA H 1 4.62 0.02 . 1 . . 456 . A 35 VAL HA . 34990 1 402 . 1 . 1 35 35 VAL HB H 1 2.27 0.02 . 1 . . 457 . A 35 VAL HB . 34990 1 403 . 1 . 1 35 35 VAL HG11 H 1 0.89 0.02 . 2 . . 458 . A 35 VAL HG11 . 34990 1 404 . 1 . 1 35 35 VAL HG12 H 1 0.89 0.02 . 2 . . 458 . A 35 VAL HG12 . 34990 1 405 . 1 . 1 35 35 VAL HG13 H 1 0.89 0.02 . 2 . . 458 . A 35 VAL HG13 . 34990 1 406 . 1 . 1 35 35 VAL HG21 H 1 0.74 0.02 . 2 . . 459 . A 35 VAL HG21 . 34990 1 407 . 1 . 1 35 35 VAL HG22 H 1 0.74 0.02 . 2 . . 459 . A 35 VAL HG22 . 34990 1 408 . 1 . 1 35 35 VAL HG23 H 1 0.74 0.02 . 2 . . 459 . A 35 VAL HG23 . 34990 1 409 . 1 . 1 35 35 VAL C C 13 175.25 0.10 . 1 . . 450 . A 35 VAL C . 34990 1 410 . 1 . 1 35 35 VAL CA C 13 59.12 0.10 . 1 . . 451 . A 35 VAL CA . 34990 1 411 . 1 . 1 35 35 VAL CB C 13 35.67 0.10 . 1 . . 452 . A 35 VAL CB . 34990 1 412 . 1 . 1 35 35 VAL CG1 C 13 22.49 0.10 . 2 . . 453 . A 35 VAL CG1 . 34990 1 413 . 1 . 1 35 35 VAL CG2 C 13 19.11 0.10 . 2 . . 454 . A 35 VAL CG2 . 34990 1 414 . 1 . 1 35 35 VAL N N 15 116.59 0.10 . 1 . . 460 . A 35 VAL N . 34990 1 415 . 1 . 1 36 36 THR H H 1 8.75 0.02 . 1 . . 465 . A 36 THR H . 34990 1 416 . 1 . 1 36 36 THR HA H 1 4.72 0.02 . 1 . . 466 . A 36 THR HA . 34990 1 417 . 1 . 1 36 36 THR HB H 1 4.13 0.02 . 1 . . 467 . A 36 THR HB . 34990 1 418 . 1 . 1 36 36 THR HG21 H 1 1.26 0.02 . 1 . . 468 . A 36 THR HG21 . 34990 1 419 . 1 . 1 36 36 THR HG22 H 1 1.26 0.02 . 1 . . 468 . A 36 THR HG22 . 34990 1 420 . 1 . 1 36 36 THR HG23 H 1 1.26 0.02 . 1 . . 468 . A 36 THR HG23 . 34990 1 421 . 1 . 1 36 36 THR C C 13 175.44 0.10 . 1 . . 461 . A 36 THR C . 34990 1 422 . 1 . 1 36 36 THR CA C 13 63.82 0.10 . 1 . . 462 . A 36 THR CA . 34990 1 423 . 1 . 1 36 36 THR CB C 13 68.98 0.10 . 1 . . 463 . A 36 THR CB . 34990 1 424 . 1 . 1 36 36 THR CG2 C 13 22.43 0.10 . 1 . . 464 . A 36 THR CG2 . 34990 1 425 . 1 . 1 36 36 THR N N 15 117.30 0.10 . 1 . . 469 . A 36 THR N . 34990 1 426 . 1 . 1 37 37 VAL H H 1 9.23 0.02 . 1 . . 475 . A 37 VAL H . 34990 1 427 . 1 . 1 37 37 VAL HA H 1 4.34 0.02 . 1 . . 476 . A 37 VAL HA . 34990 1 428 . 1 . 1 37 37 VAL HB H 1 1.76 0.02 . 1 . . 477 . A 37 VAL HB . 34990 1 429 . 1 . 1 37 37 VAL HG11 H 1 0.76 0.02 . 2 . . 478 . A 37 VAL HG11 . 34990 1 430 . 1 . 1 37 37 VAL HG12 H 1 0.76 0.02 . 2 . . 478 . A 37 VAL HG12 . 34990 1 431 . 1 . 1 37 37 VAL HG13 H 1 0.76 0.02 . 2 . . 478 . A 37 VAL HG13 . 34990 1 432 . 1 . 1 37 37 VAL HG21 H 1 0.78 0.02 . 2 . . 479 . A 37 VAL HG21 . 34990 1 433 . 1 . 1 37 37 VAL HG22 H 1 0.78 0.02 . 2 . . 479 . A 37 VAL HG22 . 34990 1 434 . 1 . 1 37 37 VAL HG23 H 1 0.78 0.02 . 2 . . 479 . A 37 VAL HG23 . 34990 1 435 . 1 . 1 37 37 VAL C C 13 174.62 0.10 . 1 . . 470 . A 37 VAL C . 34990 1 436 . 1 . 1 37 37 VAL CA C 13 62.30 0.10 . 1 . . 471 . A 37 VAL CA . 34990 1 437 . 1 . 1 37 37 VAL CB C 13 33.71 0.10 . 1 . . 472 . A 37 VAL CB . 34990 1 438 . 1 . 1 37 37 VAL CG1 C 13 20.29 0.10 . 2 . . 473 . A 37 VAL CG1 . 34990 1 439 . 1 . 1 37 37 VAL CG2 C 13 21.95 0.10 . 2 . . 474 . A 37 VAL CG2 . 34990 1 440 . 1 . 1 37 37 VAL N N 15 132.54 0.10 . 1 . . 480 . A 37 VAL N . 34990 1 441 . 1 . 1 38 38 SER H H 1 8.61 0.02 . 1 . . 484 . A 38 SER H . 34990 1 442 . 1 . 1 38 38 SER HA H 1 5.75 0.02 . 1 . . 485 . A 38 SER HA . 34990 1 443 . 1 . 1 38 38 SER HB2 H 1 3.68 0.02 . 2 . . 486 . A 38 SER HB2 . 34990 1 444 . 1 . 1 38 38 SER HB3 H 1 3.58 0.02 . 2 . . 487 . A 38 SER HB3 . 34990 1 445 . 1 . 1 38 38 SER C C 13 172.34 0.10 . 1 . . 481 . A 38 SER C . 34990 1 446 . 1 . 1 38 38 SER CA C 13 57.25 0.10 . 1 . . 482 . A 38 SER CA . 34990 1 447 . 1 . 1 38 38 SER CB C 13 67.53 0.10 . 1 . . 483 . A 38 SER CB . 34990 1 448 . 1 . 1 38 38 SER N N 15 120.72 0.10 . 1 . . 488 . A 38 SER N . 34990 1 449 . 1 . 1 39 39 TYR H H 1 8.70 0.02 . 1 . . 494 . A 39 TYR H . 34990 1 450 . 1 . 1 39 39 TYR HA H 1 5.62 0.02 . 1 . . 495 . A 39 TYR HA . 34990 1 451 . 1 . 1 39 39 TYR HB2 H 1 2.74 0.02 . 2 . . 496 . A 39 TYR HB2 . 34990 1 452 . 1 . 1 39 39 TYR HB3 H 1 2.50 0.02 . 2 . . 497 . A 39 TYR HB3 . 34990 1 453 . 1 . 1 39 39 TYR HD1 H 1 6.88 0.02 . 3 . . 499 . A 39 TYR HD1 . 34990 1 454 . 1 . 1 39 39 TYR HD2 H 1 6.88 0.02 . 3 . . 499 . A 39 TYR HD2 . 34990 1 455 . 1 . 1 39 39 TYR HE1 H 1 5.92 0.02 . 3 . . 500 . A 39 TYR HE1 . 34990 1 456 . 1 . 1 39 39 TYR HE2 H 1 5.92 0.02 . 3 . . 500 . A 39 TYR HE2 . 34990 1 457 . 1 . 1 39 39 TYR C C 13 175.54 0.10 . 1 . . 489 . A 39 TYR C . 34990 1 458 . 1 . 1 39 39 TYR CA C 13 56.87 0.10 . 1 . . 490 . A 39 TYR CA . 34990 1 459 . 1 . 1 39 39 TYR CB C 13 41.57 0.10 . 1 . . 491 . A 39 TYR CB . 34990 1 460 . 1 . 1 39 39 TYR CD1 C 13 133.38 0.10 . 1 . . 492 . A 39 TYR CD1 . 34990 1 461 . 1 . 1 39 39 TYR CD2 C 13 133.38 0.10 . 1 . . 492 . A 39 TYR CD2 . 34990 1 462 . 1 . 1 39 39 TYR CE1 C 13 118.12 0.10 . 1 . . 493 . A 39 TYR CE1 . 34990 1 463 . 1 . 1 39 39 TYR CE2 C 13 118.12 0.10 . 1 . . 493 . A 39 TYR CE2 . 34990 1 464 . 1 . 1 39 39 TYR N N 15 118.83 0.10 . 1 . . 498 . A 39 TYR N . 34990 1 465 . 1 . 1 40 40 PHE H H 1 9.59 0.02 . 1 . . 506 . A 40 PHE H . 34990 1 466 . 1 . 1 40 40 PHE HA H 1 4.85 0.02 . 1 . . 507 . A 40 PHE HA . 34990 1 467 . 1 . 1 40 40 PHE HB2 H 1 2.55 0.02 . 1 . . 508 . A 40 PHE HB2 . 34990 1 468 . 1 . 1 40 40 PHE HB3 H 1 3.00 0.02 . 1 . . 509 . A 40 PHE HB3 . 34990 1 469 . 1 . 1 40 40 PHE HD1 H 1 7.04 0.02 . 3 . . 511 . A 40 PHE HD1 . 34990 1 470 . 1 . 1 40 40 PHE HD2 H 1 7.04 0.02 . 3 . . 511 . A 40 PHE HD2 . 34990 1 471 . 1 . 1 40 40 PHE HE1 H 1 7.17 0.02 . 3 . . 512 . A 40 PHE HE1 . 34990 1 472 . 1 . 1 40 40 PHE HE2 H 1 7.17 0.02 . 3 . . 512 . A 40 PHE HE2 . 34990 1 473 . 1 . 1 40 40 PHE C C 13 174.13 0.10 . 1 . . 501 . A 40 PHE C . 34990 1 474 . 1 . 1 40 40 PHE CA C 13 57.02 0.10 . 1 . . 502 . A 40 PHE CA . 34990 1 475 . 1 . 1 40 40 PHE CB C 13 43.70 0.10 . 1 . . 503 . A 40 PHE CB . 34990 1 476 . 1 . 1 40 40 PHE CD1 C 13 132.44 0.10 . 1 . . 504 . A 40 PHE CD1 . 34990 1 477 . 1 . 1 40 40 PHE CD2 C 13 132.44 0.10 . 1 . . 504 . A 40 PHE CD2 . 34990 1 478 . 1 . 1 40 40 PHE CE1 C 13 131.90 0.10 . 1 . . 505 . A 40 PHE CE1 . 34990 1 479 . 1 . 1 40 40 PHE CE2 C 13 131.90 0.10 . 1 . . 505 . A 40 PHE CE2 . 34990 1 480 . 1 . 1 40 40 PHE N N 15 120.33 0.10 . 1 . . 510 . A 40 PHE N . 34990 1 481 . 1 . 1 41 41 TYR H H 1 9.04 0.02 . 1 . . 518 . A 41 TYR H . 34990 1 482 . 1 . 1 41 41 TYR HA H 1 4.67 0.02 . 1 . . 519 . A 41 TYR HA . 34990 1 483 . 1 . 1 41 41 TYR HB2 H 1 2.60 0.02 . 1 . . 520 . A 41 TYR HB2 . 34990 1 484 . 1 . 1 41 41 TYR HB3 H 1 2.67 0.02 . 1 . . 521 . A 41 TYR HB3 . 34990 1 485 . 1 . 1 41 41 TYR HD1 H 1 5.94 0.02 . 3 . . 523 . A 41 TYR HD1 . 34990 1 486 . 1 . 1 41 41 TYR HD2 H 1 5.94 0.02 . 3 . . 523 . A 41 TYR HD2 . 34990 1 487 . 1 . 1 41 41 TYR HE1 H 1 6.26 0.02 . 3 . . 524 . A 41 TYR HE1 . 34990 1 488 . 1 . 1 41 41 TYR HE2 H 1 6.26 0.02 . 3 . . 524 . A 41 TYR HE2 . 34990 1 489 . 1 . 1 41 41 TYR C C 13 173.75 0.10 . 1 . . 513 . A 41 TYR C . 34990 1 490 . 1 . 1 41 41 TYR CA C 13 56.03 0.10 . 1 . . 514 . A 41 TYR CA . 34990 1 491 . 1 . 1 41 41 TYR CB C 13 40.28 0.10 . 1 . . 515 . A 41 TYR CB . 34990 1 492 . 1 . 1 41 41 TYR CD1 C 13 133.47 0.10 . 1 . . 516 . A 41 TYR CD1 . 34990 1 493 . 1 . 1 41 41 TYR CD2 C 13 133.47 0.10 . 1 . . 516 . A 41 TYR CD2 . 34990 1 494 . 1 . 1 41 41 TYR CE1 C 13 117.41 0.10 . 1 . . 517 . A 41 TYR CE1 . 34990 1 495 . 1 . 1 41 41 TYR CE2 C 13 117.41 0.10 . 1 . . 517 . A 41 TYR CE2 . 34990 1 496 . 1 . 1 41 41 TYR N N 15 121.28 0.10 . 1 . . 522 . A 41 TYR N . 34990 1 497 . 1 . 1 42 42 ASP H H 1 8.34 0.02 . 1 . . 528 . A 42 ASP H . 34990 1 498 . 1 . 1 42 42 ASP HA H 1 4.59 0.02 . 1 . . 529 . A 42 ASP HA . 34990 1 499 . 1 . 1 42 42 ASP HB2 H 1 2.21 0.02 . 2 . . 530 . A 42 ASP HB2 . 34990 1 500 . 1 . 1 42 42 ASP HB3 H 1 2.73 0.02 . 2 . . 531 . A 42 ASP HB3 . 34990 1 501 . 1 . 1 42 42 ASP C C 13 175.87 0.10 . 1 . . 525 . A 42 ASP C . 34990 1 502 . 1 . 1 42 42 ASP CA C 13 51.66 0.10 . 1 . . 526 . A 42 ASP CA . 34990 1 503 . 1 . 1 42 42 ASP CB C 13 41.66 0.10 . 1 . . 527 . A 42 ASP CB . 34990 1 504 . 1 . 1 42 42 ASP N N 15 128.53 0.10 . 1 . . 532 . A 42 ASP N . 34990 1 505 . 1 . 1 43 43 SER H H 1 8.49 0.02 . 1 . . 536 . A 43 SER H . 34990 1 506 . 1 . 1 43 43 SER HA H 1 3.72 0.02 . 1 . . 537 . A 43 SER HA . 34990 1 507 . 1 . 1 43 43 SER HB2 H 1 3.84 0.02 . 2 . . 538 . A 43 SER HB2 . 34990 1 508 . 1 . 1 43 43 SER HB3 H 1 4.05 0.02 . 2 . . 539 . A 43 SER HB3 . 34990 1 509 . 1 . 1 43 43 SER C C 13 175.66 0.10 . 1 . . 533 . A 43 SER C . 34990 1 510 . 1 . 1 43 43 SER CA C 13 60.00 0.10 . 1 . . 534 . A 43 SER CA . 34990 1 511 . 1 . 1 43 43 SER CB C 13 63.14 0.10 . 1 . . 535 . A 43 SER CB . 34990 1 512 . 1 . 1 43 43 SER N N 15 120.34 0.10 . 1 . . 540 . A 43 SER N . 34990 1 513 . 1 . 1 44 44 THR H H 1 8.24 0.02 . 1 . . 545 . A 44 THR H . 34990 1 514 . 1 . 1 44 44 THR HA H 1 4.12 0.02 . 1 . . 546 . A 44 THR HA . 34990 1 515 . 1 . 1 44 44 THR HB H 1 4.21 0.02 . 1 . . 547 . A 44 THR HB . 34990 1 516 . 1 . 1 44 44 THR HG21 H 1 1.18 0.02 . 1 . . 548 . A 44 THR HG21 . 34990 1 517 . 1 . 1 44 44 THR HG22 H 1 1.18 0.02 . 1 . . 548 . A 44 THR HG22 . 34990 1 518 . 1 . 1 44 44 THR HG23 H 1 1.18 0.02 . 1 . . 548 . A 44 THR HG23 . 34990 1 519 . 1 . 1 44 44 THR C C 13 175.88 0.10 . 1 . . 541 . A 44 THR C . 34990 1 520 . 1 . 1 44 44 THR CA C 13 65.19 0.10 . 1 . . 542 . A 44 THR CA . 34990 1 521 . 1 . 1 44 44 THR CB C 13 68.45 0.10 . 1 . . 543 . A 44 THR CB . 34990 1 522 . 1 . 1 44 44 THR CG2 C 13 21.75 0.10 . 1 . . 544 . A 44 THR CG2 . 34990 1 523 . 1 . 1 44 44 THR N N 15 118.06 0.10 . 1 . . 549 . A 44 THR N . 34990 1 524 . 1 . 1 45 45 ARG H H 1 7.23 0.02 . 1 . . 555 . A 45 ARG H . 34990 1 525 . 1 . 1 45 45 ARG HA H 1 4.25 0.02 . 1 . . 556 . A 45 ARG HA . 34990 1 526 . 1 . 1 45 45 ARG HB2 H 1 1.88 0.02 . 1 . . 557 . A 45 ARG HB2 . 34990 1 527 . 1 . 1 45 45 ARG HB3 H 1 1.21 0.02 . 1 . . 558 . A 45 ARG HB3 . 34990 1 528 . 1 . 1 45 45 ARG HD2 H 1 3.06 0.02 . 2 . . 560 . A 45 ARG HD2 . 34990 1 529 . 1 . 1 45 45 ARG HD3 H 1 3.06 0.02 . 2 . . 560 . A 45 ARG HD3 . 34990 1 530 . 1 . 1 45 45 ARG C C 13 175.34 0.10 . 1 . . 550 . A 45 ARG C . 34990 1 531 . 1 . 1 45 45 ARG CA C 13 55.56 0.10 . 1 . . 551 . A 45 ARG CA . 34990 1 532 . 1 . 1 45 45 ARG CB C 13 31.96 0.10 . 1 . . 552 . A 45 ARG CB . 34990 1 533 . 1 . 1 45 45 ARG CG C 13 27.80 0.10 . 1 . . 554 . A 45 ARG CG . 34990 1 534 . 1 . 1 45 45 ARG CD C 13 42.96 0.10 . 1 . . 553 . A 45 ARG CD . 34990 1 535 . 1 . 1 45 45 ARG N N 15 118.88 0.10 . 1 . . 559 . A 45 ARG N . 34990 1 536 . 1 . 1 46 46 ASN H H 1 7.97 0.02 . 1 . . 564 . A 46 ASN H . 34990 1 537 . 1 . 1 46 46 ASN HA H 1 4.09 0.02 . 1 . . 565 . A 46 ASN HA . 34990 1 538 . 1 . 1 46 46 ASN HB2 H 1 2.62 0.02 . 2 . . 566 . A 46 ASN HB2 . 34990 1 539 . 1 . 1 46 46 ASN HB3 H 1 3.31 0.02 . 2 . . 567 . A 46 ASN HB3 . 34990 1 540 . 1 . 1 46 46 ASN HD21 H 1 7.72 0.02 . 2 . . 568 . A 46 ASN HD21 . 34990 1 541 . 1 . 1 46 46 ASN HD22 H 1 7.00 0.02 . 2 . . 569 . A 46 ASN HD22 . 34990 1 542 . 1 . 1 46 46 ASN C C 13 173.76 0.10 . 1 . . 561 . A 46 ASN C . 34990 1 543 . 1 . 1 46 46 ASN CA C 13 53.88 0.10 . 1 . . 562 . A 46 ASN CA . 34990 1 544 . 1 . 1 46 46 ASN CB C 13 36.59 0.10 . 1 . . 563 . A 46 ASN CB . 34990 1 545 . 1 . 1 46 46 ASN N N 15 118.08 0.10 . 1 . . 570 . A 46 ASN N . 34990 1 546 . 1 . 1 46 46 ASN ND2 N 15 112.86 0.10 . 1 . . 571 . A 46 ASN ND2 . 34990 1 547 . 1 . 1 47 47 VAL H H 1 6.96 0.02 . 1 . . 577 . A 47 VAL H . 34990 1 548 . 1 . 1 47 47 VAL HA H 1 4.71 0.02 . 1 . . 578 . A 47 VAL HA . 34990 1 549 . 1 . 1 47 47 VAL HB H 1 2.10 0.02 . 1 . . 579 . A 47 VAL HB . 34990 1 550 . 1 . 1 47 47 VAL HG11 H 1 0.85 0.02 . 1 . . 580 . A 47 VAL HG11 . 34990 1 551 . 1 . 1 47 47 VAL HG12 H 1 0.85 0.02 . 1 . . 580 . A 47 VAL HG12 . 34990 1 552 . 1 . 1 47 47 VAL HG13 H 1 0.85 0.02 . 1 . . 580 . A 47 VAL HG13 . 34990 1 553 . 1 . 1 47 47 VAL HG21 H 1 0.67 0.02 . 1 . . 581 . A 47 VAL HG21 . 34990 1 554 . 1 . 1 47 47 VAL HG22 H 1 0.67 0.02 . 1 . . 581 . A 47 VAL HG22 . 34990 1 555 . 1 . 1 47 47 VAL HG23 H 1 0.67 0.02 . 1 . . 581 . A 47 VAL HG23 . 34990 1 556 . 1 . 1 47 47 VAL C C 13 173.18 0.10 . 1 . . 572 . A 47 VAL C . 34990 1 557 . 1 . 1 47 47 VAL CA C 13 59.02 0.10 . 1 . . 573 . A 47 VAL CA . 34990 1 558 . 1 . 1 47 47 VAL CB C 13 36.23 0.10 . 1 . . 574 . A 47 VAL CB . 34990 1 559 . 1 . 1 47 47 VAL CG1 C 13 21.67 0.10 . 1 . . 575 . A 47 VAL CG1 . 34990 1 560 . 1 . 1 47 47 VAL CG2 C 13 19.45 0.10 . 1 . . 576 . A 47 VAL CG2 . 34990 1 561 . 1 . 1 47 47 VAL N N 15 109.58 0.10 . 1 . . 582 . A 47 VAL N . 34990 1 562 . 1 . 1 48 48 TYR H H 1 9.59 0.02 . 1 . . 588 . A 48 TYR H . 34990 1 563 . 1 . 1 48 48 TYR HA H 1 5.21 0.02 . 1 . . 589 . A 48 TYR HA . 34990 1 564 . 1 . 1 48 48 TYR HB2 H 1 2.74 0.02 . 1 . . 590 . A 48 TYR HB2 . 34990 1 565 . 1 . 1 48 48 TYR HB3 H 1 2.44 0.02 . 1 . . 591 . A 48 TYR HB3 . 34990 1 566 . 1 . 1 48 48 TYR HD1 H 1 6.60 0.02 . 3 . . 593 . A 48 TYR HD1 . 34990 1 567 . 1 . 1 48 48 TYR HD2 H 1 6.60 0.02 . 3 . . 593 . A 48 TYR HD2 . 34990 1 568 . 1 . 1 48 48 TYR HE1 H 1 6.21 0.02 . 3 . . 594 . A 48 TYR HE1 . 34990 1 569 . 1 . 1 48 48 TYR HE2 H 1 6.21 0.02 . 3 . . 594 . A 48 TYR HE2 . 34990 1 570 . 1 . 1 48 48 TYR C C 13 175.12 0.10 . 1 . . 583 . A 48 TYR C . 34990 1 571 . 1 . 1 48 48 TYR CA C 13 57.59 0.10 . 1 . . 584 . A 48 TYR CA . 34990 1 572 . 1 . 1 48 48 TYR CB C 13 41.05 0.10 . 1 . . 585 . A 48 TYR CB . 34990 1 573 . 1 . 1 48 48 TYR CD1 C 13 132.78 0.10 . 1 . . 586 . A 48 TYR CD1 . 34990 1 574 . 1 . 1 48 48 TYR CD2 C 13 132.78 0.10 . 1 . . 586 . A 48 TYR CD2 . 34990 1 575 . 1 . 1 48 48 TYR CE1 C 13 118.69 0.10 . 1 . . 587 . A 48 TYR CE1 . 34990 1 576 . 1 . 1 48 48 TYR CE2 C 13 118.69 0.10 . 1 . . 587 . A 48 TYR CE2 . 34990 1 577 . 1 . 1 48 48 TYR N N 15 122.28 0.10 . 1 . . 592 . A 48 TYR N . 34990 1 578 . 1 . 1 49 49 ARG H H 1 9.16 0.02 . 1 . . 600 . A 49 ARG H . 34990 1 579 . 1 . 1 49 49 ARG HA H 1 5.43 0.02 . 1 . . 601 . A 49 ARG HA . 34990 1 580 . 1 . 1 49 49 ARG HB2 H 1 1.70 0.02 . 2 . . 602 . A 49 ARG HB2 . 34990 1 581 . 1 . 1 49 49 ARG HB3 H 1 1.42 0.02 . 2 . . 603 . A 49 ARG HB3 . 34990 1 582 . 1 . 1 49 49 ARG HG2 H 1 1.60 0.02 . 2 . . 604 . A 49 ARG HG2 . 34990 1 583 . 1 . 1 49 49 ARG HG3 H 1 1.41 0.02 . 2 . . 605 . A 49 ARG HG3 . 34990 1 584 . 1 . 1 49 49 ARG HD2 H 1 3.05 0.02 . 2 . . 607 . A 49 ARG HD2 . 34990 1 585 . 1 . 1 49 49 ARG HD3 H 1 3.05 0.02 . 2 . . 607 . A 49 ARG HD3 . 34990 1 586 . 1 . 1 49 49 ARG C C 13 174.90 0.10 . 1 . . 595 . A 49 ARG C . 34990 1 587 . 1 . 1 49 49 ARG CA C 13 54.05 0.10 . 1 . . 596 . A 49 ARG CA . 34990 1 588 . 1 . 1 49 49 ARG CB C 13 35.13 0.10 . 1 . . 597 . A 49 ARG CB . 34990 1 589 . 1 . 1 49 49 ARG CG C 13 27.62 0.10 . 1 . . 599 . A 49 ARG CG . 34990 1 590 . 1 . 1 49 49 ARG CD C 13 43.85 0.10 . 1 . . 598 . A 49 ARG CD . 34990 1 591 . 1 . 1 49 49 ARG N N 15 118.69 0.10 . 1 . . 606 . A 49 ARG N . 34990 1 592 . 1 . 1 50 50 ILE H H 1 9.18 0.02 . 1 . . 614 . A 50 ILE H . 34990 1 593 . 1 . 1 50 50 ILE HA H 1 4.72 0.02 . 1 . . 615 . A 50 ILE HA . 34990 1 594 . 1 . 1 50 50 ILE HB H 1 1.56 0.02 . 1 . . 616 . A 50 ILE HB . 34990 1 595 . 1 . 1 50 50 ILE HG12 H 1 0.10 0.02 . 1 . . 618 . A 50 ILE HG12 . 34990 1 596 . 1 . 1 50 50 ILE HG13 H 1 1.31 0.02 . 1 . . 619 . A 50 ILE HG13 . 34990 1 597 . 1 . 1 50 50 ILE HG21 H 1 0.64 0.02 . 1 . . 620 . A 50 ILE HG21 . 34990 1 598 . 1 . 1 50 50 ILE HG22 H 1 0.64 0.02 . 1 . . 620 . A 50 ILE HG22 . 34990 1 599 . 1 . 1 50 50 ILE HG23 H 1 0.64 0.02 . 1 . . 620 . A 50 ILE HG23 . 34990 1 600 . 1 . 1 50 50 ILE HD11 H 1 0.23 0.02 . 1 . . 617 . A 50 ILE HD11 . 34990 1 601 . 1 . 1 50 50 ILE HD12 H 1 0.23 0.02 . 1 . . 617 . A 50 ILE HD12 . 34990 1 602 . 1 . 1 50 50 ILE HD13 H 1 0.23 0.02 . 1 . . 617 . A 50 ILE HD13 . 34990 1 603 . 1 . 1 50 50 ILE C C 13 175.06 0.10 . 1 . . 608 . A 50 ILE C . 34990 1 604 . 1 . 1 50 50 ILE CA C 13 60.53 0.10 . 1 . . 609 . A 50 ILE CA . 34990 1 605 . 1 . 1 50 50 ILE CB C 13 39.48 0.10 . 1 . . 610 . A 50 ILE CB . 34990 1 606 . 1 . 1 50 50 ILE CG1 C 13 27.90 0.10 . 1 . . 612 . A 50 ILE CG1 . 34990 1 607 . 1 . 1 50 50 ILE CG2 C 13 18.39 0.10 . 1 . . 613 . A 50 ILE CG2 . 34990 1 608 . 1 . 1 50 50 ILE CD1 C 13 14.04 0.10 . 1 . . 611 . A 50 ILE CD1 . 34990 1 609 . 1 . 1 50 50 ILE N N 15 122.55 0.10 . 1 . . 621 . A 50 ILE N . 34990 1 610 . 1 . 1 51 51 ILE H H 1 9.10 0.02 . 1 . . 628 . A 51 ILE H . 34990 1 611 . 1 . 1 51 51 ILE HA H 1 4.96 0.02 . 1 . . 629 . A 51 ILE HA . 34990 1 612 . 1 . 1 51 51 ILE HB H 1 1.72 0.02 . 1 . . 630 . A 51 ILE HB . 34990 1 613 . 1 . 1 51 51 ILE HG12 H 1 1.32 0.02 . 2 . . 632 . A 51 ILE HG12 . 34990 1 614 . 1 . 1 51 51 ILE HG13 H 1 1.05 0.02 . 2 . . 633 . A 51 ILE HG13 . 34990 1 615 . 1 . 1 51 51 ILE HG21 H 1 0.79 0.02 . 1 . . 634 . A 51 ILE HG21 . 34990 1 616 . 1 . 1 51 51 ILE HG22 H 1 0.79 0.02 . 1 . . 634 . A 51 ILE HG22 . 34990 1 617 . 1 . 1 51 51 ILE HG23 H 1 0.79 0.02 . 1 . . 634 . A 51 ILE HG23 . 34990 1 618 . 1 . 1 51 51 ILE HD11 H 1 0.45 0.02 . 1 . . 631 . A 51 ILE HD11 . 34990 1 619 . 1 . 1 51 51 ILE HD12 H 1 0.45 0.02 . 1 . . 631 . A 51 ILE HD12 . 34990 1 620 . 1 . 1 51 51 ILE HD13 H 1 0.45 0.02 . 1 . . 631 . A 51 ILE HD13 . 34990 1 621 . 1 . 1 51 51 ILE C C 13 175.94 0.10 . 1 . . 622 . A 51 ILE C . 34990 1 622 . 1 . 1 51 51 ILE CA C 13 58.50 0.10 . 1 . . 623 . A 51 ILE CA . 34990 1 623 . 1 . 1 51 51 ILE CB C 13 41.91 0.10 . 1 . . 624 . A 51 ILE CB . 34990 1 624 . 1 . 1 51 51 ILE CG1 C 13 27.23 0.10 . 1 . . 626 . A 51 ILE CG1 . 34990 1 625 . 1 . 1 51 51 ILE CG2 C 13 16.88 0.10 . 1 . . 627 . A 51 ILE CG2 . 34990 1 626 . 1 . 1 51 51 ILE CD1 C 13 12.19 0.10 . 1 . . 625 . A 51 ILE CD1 . 34990 1 627 . 1 . 1 51 51 ILE N N 15 125.50 0.10 . 1 . . 635 . A 51 ILE N . 34990 1 628 . 1 . 1 52 52 SER H H 1 8.46 0.02 . 1 . . 639 . A 52 SER H . 34990 1 629 . 1 . 1 52 52 SER HA H 1 4.85 0.02 . 1 . . 640 . A 52 SER HA . 34990 1 630 . 1 . 1 52 52 SER HB2 H 1 3.68 0.02 . 2 . . 641 . A 52 SER HB2 . 34990 1 631 . 1 . 1 52 52 SER HB3 H 1 3.39 0.02 . 2 . . 642 . A 52 SER HB3 . 34990 1 632 . 1 . 1 52 52 SER C C 13 173.38 0.10 . 1 . . 636 . A 52 SER C . 34990 1 633 . 1 . 1 52 52 SER CA C 13 57.77 0.10 . 1 . . 637 . A 52 SER CA . 34990 1 634 . 1 . 1 52 52 SER CB C 13 66.25 0.10 . 1 . . 638 . A 52 SER CB . 34990 1 635 . 1 . 1 52 52 SER N N 15 121.61 0.10 . 1 . . 643 . A 52 SER N . 34990 1 636 . 1 . 1 53 53 LEU H H 1 9.12 0.02 . 1 . . 650 . A 53 LEU H . 34990 1 637 . 1 . 1 53 53 LEU HA H 1 5.15 0.02 . 1 . . 651 . A 53 LEU HA . 34990 1 638 . 1 . 1 53 53 LEU HB2 H 1 1.68 0.02 . 1 . . 652 . A 53 LEU HB2 . 34990 1 639 . 1 . 1 53 53 LEU HB3 H 1 1.50 0.02 . 1 . . 653 . A 53 LEU HB3 . 34990 1 640 . 1 . 1 53 53 LEU HG H 1 1.50 0.02 . 1 . . 656 . A 53 LEU HG . 34990 1 641 . 1 . 1 53 53 LEU HD11 H 1 0.71 0.02 . 2 . . 654 . A 53 LEU HD11 . 34990 1 642 . 1 . 1 53 53 LEU HD12 H 1 0.71 0.02 . 2 . . 654 . A 53 LEU HD12 . 34990 1 643 . 1 . 1 53 53 LEU HD13 H 1 0.71 0.02 . 2 . . 654 . A 53 LEU HD13 . 34990 1 644 . 1 . 1 53 53 LEU HD21 H 1 0.85 0.02 . 2 . . 655 . A 53 LEU HD21 . 34990 1 645 . 1 . 1 53 53 LEU HD22 H 1 0.85 0.02 . 2 . . 655 . A 53 LEU HD22 . 34990 1 646 . 1 . 1 53 53 LEU HD23 H 1 0.85 0.02 . 2 . . 655 . A 53 LEU HD23 . 34990 1 647 . 1 . 1 53 53 LEU C C 13 175.59 0.10 . 1 . . 644 . A 53 LEU C . 34990 1 648 . 1 . 1 53 53 LEU CA C 13 54.25 0.10 . 1 . . 645 . A 53 LEU CA . 34990 1 649 . 1 . 1 53 53 LEU CB C 13 44.55 0.10 . 1 . . 646 . A 53 LEU CB . 34990 1 650 . 1 . 1 53 53 LEU CG C 13 27.82 0.10 . 1 . . 649 . A 53 LEU CG . 34990 1 651 . 1 . 1 53 53 LEU CD1 C 13 23.71 0.10 . 2 . . 647 . A 53 LEU CD1 . 34990 1 652 . 1 . 1 53 53 LEU CD2 C 13 25.36 0.10 . 2 . . 648 . A 53 LEU CD2 . 34990 1 653 . 1 . 1 53 53 LEU N N 15 130.51 0.10 . 1 . . 657 . A 53 LEU N . 34990 1 654 . 1 . 1 54 54 ASP H H 1 8.82 0.02 . 1 . . 661 . A 54 ASP H . 34990 1 655 . 1 . 1 54 54 ASP HA H 1 4.88 0.02 . 1 . . 662 . A 54 ASP HA . 34990 1 656 . 1 . 1 54 54 ASP HB2 H 1 2.42 0.02 . 2 . . 663 . A 54 ASP HB2 . 34990 1 657 . 1 . 1 54 54 ASP HB3 H 1 2.85 0.02 . 2 . . 664 . A 54 ASP HB3 . 34990 1 658 . 1 . 1 54 54 ASP C C 13 177.07 0.10 . 1 . . 658 . A 54 ASP C . 34990 1 659 . 1 . 1 54 54 ASP CA C 13 52.63 0.10 . 1 . . 659 . A 54 ASP CA . 34990 1 660 . 1 . 1 54 54 ASP CB C 13 42.23 0.10 . 1 . . 660 . A 54 ASP CB . 34990 1 661 . 1 . 1 54 54 ASP N N 15 120.88 0.10 . 1 . . 665 . A 54 ASP N . 34990 1 662 . 1 . 1 55 55 GLY H H 1 8.70 0.02 . 1 . . 668 . A 55 GLY H . 34990 1 663 . 1 . 1 55 55 GLY HA2 H 1 4.12 0.02 . 2 . . 669 . A 55 GLY HA2 . 34990 1 664 . 1 . 1 55 55 GLY HA3 H 1 3.68 0.02 . 2 . . 670 . A 55 GLY HA3 . 34990 1 665 . 1 . 1 55 55 GLY C C 13 174.81 0.10 . 1 . . 666 . A 55 GLY C . 34990 1 666 . 1 . 1 55 55 GLY CA C 13 47.05 0.10 . 1 . . 667 . A 55 GLY CA . 34990 1 667 . 1 . 1 55 55 GLY N N 15 115.39 0.10 . 1 . . 671 . A 55 GLY N . 34990 1 668 . 1 . 1 56 56 SER HA H 1 4.46 0.02 . 1 . . 675 . A 56 SER HA . 34990 1 669 . 1 . 1 56 56 SER HB2 H 1 4.03 0.02 . 2 . . 676 . A 56 SER HB2 . 34990 1 670 . 1 . 1 56 56 SER HB3 H 1 3.90 0.02 . 2 . . 677 . A 56 SER HB3 . 34990 1 671 . 1 . 1 56 56 SER C C 13 173.69 0.10 . 1 . . 672 . A 56 SER C . 34990 1 672 . 1 . 1 56 56 SER CA C 13 58.52 0.10 . 1 . . 673 . A 56 SER CA . 34990 1 673 . 1 . 1 56 56 SER CB C 13 63.78 0.10 . 1 . . 674 . A 56 SER CB . 34990 1 674 . 1 . 1 56 56 SER N N 15 120.73 0.10 . 1 . . 678 . A 56 SER N . 34990 1 675 . 1 . 1 57 57 LYS H H 1 7.80 0.02 . 1 . . 685 . A 57 LYS H . 34990 1 676 . 1 . 1 57 57 LYS HA H 1 4.42 0.02 . 1 . . 686 . A 57 LYS HA . 34990 1 677 . 1 . 1 57 57 LYS HB2 H 1 1.95 0.02 . 2 . . 687 . A 57 LYS HB2 . 34990 1 678 . 1 . 1 57 57 LYS HB3 H 1 1.84 0.02 . 2 . . 688 . A 57 LYS HB3 . 34990 1 679 . 1 . 1 57 57 LYS HG2 H 1 1.43 0.02 . 2 . . 689 . A 57 LYS HG2 . 34990 1 680 . 1 . 1 57 57 LYS HG3 H 1 1.31 0.02 . 2 . . 690 . A 57 LYS HG3 . 34990 1 681 . 1 . 1 57 57 LYS HD2 H 1 1.72 0.02 . 2 . . 692 . A 57 LYS HD2 . 34990 1 682 . 1 . 1 57 57 LYS HD3 H 1 1.72 0.02 . 2 . . 692 . A 57 LYS HD3 . 34990 1 683 . 1 . 1 57 57 LYS HE2 H 1 3.01 0.02 . 2 . . 693 . A 57 LYS HE2 . 34990 1 684 . 1 . 1 57 57 LYS HE3 H 1 3.01 0.02 . 2 . . 693 . A 57 LYS HE3 . 34990 1 685 . 1 . 1 57 57 LYS C C 13 174.97 0.10 . 1 . . 679 . A 57 LYS C . 34990 1 686 . 1 . 1 57 57 LYS CA C 13 55.28 0.10 . 1 . . 680 . A 57 LYS CA . 34990 1 687 . 1 . 1 57 57 LYS CB C 13 34.24 0.10 . 1 . . 681 . A 57 LYS CB . 34990 1 688 . 1 . 1 57 57 LYS CG C 13 24.61 0.10 . 1 . . 684 . A 57 LYS CG . 34990 1 689 . 1 . 1 57 57 LYS CD C 13 29.27 0.10 . 1 . . 682 . A 57 LYS CD . 34990 1 690 . 1 . 1 57 57 LYS CE C 13 42.16 0.10 . 1 . . 683 . A 57 LYS CE . 34990 1 691 . 1 . 1 57 57 LYS N N 15 123.05 0.10 . 1 . . 691 . A 57 LYS N . 34990 1 692 . 1 . 1 58 58 ALA H H 1 8.81 0.02 . 1 . . 697 . A 58 ALA H . 34990 1 693 . 1 . 1 58 58 ALA HB1 H 1 1.29 0.02 . 1 . . 698 . A 58 ALA HB1 . 34990 1 694 . 1 . 1 58 58 ALA HB2 H 1 1.29 0.02 . 1 . . 698 . A 58 ALA HB2 . 34990 1 695 . 1 . 1 58 58 ALA HB3 H 1 1.29 0.02 . 1 . . 698 . A 58 ALA HB3 . 34990 1 696 . 1 . 1 58 58 ALA C C 13 177.40 0.10 . 1 . . 694 . A 58 ALA C . 34990 1 697 . 1 . 1 58 58 ALA CA C 13 52.19 0.10 . 1 . . 695 . A 58 ALA CA . 34990 1 698 . 1 . 1 58 58 ALA CB C 13 17.25 0.10 . 1 . . 696 . A 58 ALA CB . 34990 1 699 . 1 . 1 58 58 ALA N N 15 128.31 0.10 . 1 . . 699 . A 58 ALA N . 34990 1 700 . 1 . 1 59 59 ILE H H 1 8.68 0.02 . 1 . . 706 . A 59 ILE H . 34990 1 701 . 1 . 1 59 59 ILE HA H 1 4.38 0.02 . 1 . . 707 . A 59 ILE HA . 34990 1 702 . 1 . 1 59 59 ILE HB H 1 1.95 0.02 . 1 . . 708 . A 59 ILE HB . 34990 1 703 . 1 . 1 59 59 ILE HG12 H 1 1.05 0.02 . 2 . . 712 . A 59 ILE HG12 . 34990 1 704 . 1 . 1 59 59 ILE HG13 H 1 1.05 0.02 . 2 . . 712 . A 59 ILE HG13 . 34990 1 705 . 1 . 1 59 59 ILE HG21 H 1 0.99 0.02 . 1 . . 710 . A 59 ILE HG21 . 34990 1 706 . 1 . 1 59 59 ILE HG22 H 1 0.99 0.02 . 1 . . 710 . A 59 ILE HG22 . 34990 1 707 . 1 . 1 59 59 ILE HG23 H 1 0.99 0.02 . 1 . . 710 . A 59 ILE HG23 . 34990 1 708 . 1 . 1 59 59 ILE HD11 H 1 0.82 0.02 . 1 . . 709 . A 59 ILE HD11 . 34990 1 709 . 1 . 1 59 59 ILE HD12 H 1 0.82 0.02 . 1 . . 709 . A 59 ILE HD12 . 34990 1 710 . 1 . 1 59 59 ILE HD13 H 1 0.82 0.02 . 1 . . 709 . A 59 ILE HD13 . 34990 1 711 . 1 . 1 59 59 ILE C C 13 176.50 0.10 . 1 . . 700 . A 59 ILE C . 34990 1 712 . 1 . 1 59 59 ILE CA C 13 62.62 0.10 . 1 . . 701 . A 59 ILE CA . 34990 1 713 . 1 . 1 59 59 ILE CB C 13 38.71 0.10 . 1 . . 702 . A 59 ILE CB . 34990 1 714 . 1 . 1 59 59 ILE CG1 C 13 26.73 0.10 . 1 . . 704 . A 59 ILE CG1 . 34990 1 715 . 1 . 1 59 59 ILE CG2 C 13 18.61 0.10 . 1 . . 705 . A 59 ILE CG2 . 34990 1 716 . 1 . 1 59 59 ILE CD1 C 13 14.12 0.10 . 1 . . 703 . A 59 ILE CD1 . 34990 1 717 . 1 . 1 59 59 ILE N N 15 121.83 0.10 . 1 . . 711 . A 59 ILE N . 34990 1 718 . 1 . 1 60 60 ILE H H 1 7.69 0.02 . 1 . . 719 . A 60 ILE H . 34990 1 719 . 1 . 1 60 60 ILE HA H 1 3.92 0.02 . 1 . . 720 . A 60 ILE HA . 34990 1 720 . 1 . 1 60 60 ILE HB H 1 1.31 0.02 . 1 . . 721 . A 60 ILE HB . 34990 1 721 . 1 . 1 60 60 ILE HG21 H 1 0.51 0.02 . 1 . . 723 . A 60 ILE HG21 . 34990 1 722 . 1 . 1 60 60 ILE HG22 H 1 0.51 0.02 . 1 . . 723 . A 60 ILE HG22 . 34990 1 723 . 1 . 1 60 60 ILE HG23 H 1 0.51 0.02 . 1 . . 723 . A 60 ILE HG23 . 34990 1 724 . 1 . 1 60 60 ILE HD11 H 1 0.76 0.02 . 1 . . 722 . A 60 ILE HD11 . 34990 1 725 . 1 . 1 60 60 ILE HD12 H 1 0.76 0.02 . 1 . . 722 . A 60 ILE HD12 . 34990 1 726 . 1 . 1 60 60 ILE HD13 H 1 0.76 0.02 . 1 . . 722 . A 60 ILE HD13 . 34990 1 727 . 1 . 1 60 60 ILE C C 13 175.00 0.10 . 1 . . 713 . A 60 ILE C . 34990 1 728 . 1 . 1 60 60 ILE CA C 13 62.71 0.10 . 1 . . 714 . A 60 ILE CA . 34990 1 729 . 1 . 1 60 60 ILE CB C 13 42.52 0.10 . 1 . . 715 . A 60 ILE CB . 34990 1 730 . 1 . 1 60 60 ILE CG1 C 13 26.67 0.10 . 1 . . 717 . A 60 ILE CG1 . 34990 1 731 . 1 . 1 60 60 ILE CG2 C 13 16.90 0.10 . 1 . . 718 . A 60 ILE CG2 . 34990 1 732 . 1 . 1 60 60 ILE CD1 C 13 14.74 0.10 . 1 . . 716 . A 60 ILE CD1 . 34990 1 733 . 1 . 1 60 60 ILE N N 15 117.72 0.10 . 1 . . 724 . A 60 ILE N . 34990 1 734 . 1 . 1 61 61 ASN H H 1 7.73 0.02 . 1 . . 728 . A 61 ASN H . 34990 1 735 . 1 . 1 61 61 ASN HA H 1 5.14 0.02 . 1 . . 729 . A 61 ASN HA . 34990 1 736 . 1 . 1 61 61 ASN HB2 H 1 2.95 0.02 . 2 . . 730 . A 61 ASN HB2 . 34990 1 737 . 1 . 1 61 61 ASN HB3 H 1 2.53 0.02 . 2 . . 731 . A 61 ASN HB3 . 34990 1 738 . 1 . 1 61 61 ASN HD21 H 1 7.39 0.02 . 2 . . 732 . A 61 ASN HD21 . 34990 1 739 . 1 . 1 61 61 ASN HD22 H 1 6.58 0.02 . 2 . . 733 . A 61 ASN HD22 . 34990 1 740 . 1 . 1 61 61 ASN C C 13 174.51 0.10 . 1 . . 725 . A 61 ASN C . 34990 1 741 . 1 . 1 61 61 ASN CA C 13 53.30 0.10 . 1 . . 726 . A 61 ASN CA . 34990 1 742 . 1 . 1 61 61 ASN CB C 13 37.88 0.10 . 1 . . 727 . A 61 ASN CB . 34990 1 743 . 1 . 1 61 61 ASN N N 15 124.17 0.10 . 1 . . 734 . A 61 ASN N . 34990 1 744 . 1 . 1 61 61 ASN ND2 N 15 109.17 0.10 . 1 . . 735 . A 61 ASN ND2 . 34990 1 745 . 1 . 1 62 62 SER H H 1 9.09 0.02 . 1 . . 739 . A 62 SER H . 34990 1 746 . 1 . 1 62 62 SER HA H 1 5.18 0.02 . 1 . . 740 . A 62 SER HA . 34990 1 747 . 1 . 1 62 62 SER HB2 H 1 4.00 0.02 . 2 . . 741 . A 62 SER HB2 . 34990 1 748 . 1 . 1 62 62 SER HB3 H 1 3.91 0.02 . 2 . . 742 . A 62 SER HB3 . 34990 1 749 . 1 . 1 62 62 SER C C 13 174.69 0.10 . 1 . . 736 . A 62 SER C . 34990 1 750 . 1 . 1 62 62 SER CA C 13 56.94 0.10 . 1 . . 737 . A 62 SER CA . 34990 1 751 . 1 . 1 62 62 SER CB C 13 66.25 0.10 . 1 . . 738 . A 62 SER CB . 34990 1 752 . 1 . 1 62 62 SER N N 15 119.11 0.10 . 1 . . 743 . A 62 SER N . 34990 1 753 . 1 . 1 63 63 THR H H 1 9.12 0.02 . 1 . . 748 . A 63 THR H . 34990 1 754 . 1 . 1 63 63 THR HA H 1 4.61 0.02 . 1 . . 749 . A 63 THR HA . 34990 1 755 . 1 . 1 63 63 THR HB H 1 4.14 0.02 . 1 . . 750 . A 63 THR HB . 34990 1 756 . 1 . 1 63 63 THR HG21 H 1 1.20 0.02 . 1 . . 751 . A 63 THR HG21 . 34990 1 757 . 1 . 1 63 63 THR HG22 H 1 1.20 0.02 . 1 . . 751 . A 63 THR HG22 . 34990 1 758 . 1 . 1 63 63 THR HG23 H 1 1.20 0.02 . 1 . . 751 . A 63 THR HG23 . 34990 1 759 . 1 . 1 63 63 THR C C 13 173.84 0.10 . 1 . . 744 . A 63 THR C . 34990 1 760 . 1 . 1 63 63 THR CA C 13 63.23 0.10 . 1 . . 745 . A 63 THR CA . 34990 1 761 . 1 . 1 63 63 THR CB C 13 69.50 0.10 . 1 . . 746 . A 63 THR CB . 34990 1 762 . 1 . 1 63 63 THR CG2 C 13 21.59 0.10 . 1 . . 747 . A 63 THR CG2 . 34990 1 763 . 1 . 1 63 63 THR N N 15 126.53 0.10 . 1 . . 752 . A 63 THR N . 34990 1 764 . 1 . 1 64 64 ILE H H 1 8.71 0.02 . 1 . . 759 . A 64 ILE H . 34990 1 765 . 1 . 1 64 64 ILE HA H 1 4.38 0.02 . 1 . . 760 . A 64 ILE HA . 34990 1 766 . 1 . 1 64 64 ILE HB H 1 1.74 0.02 . 1 . . 761 . A 64 ILE HB . 34990 1 767 . 1 . 1 64 64 ILE HG12 H 1 1.42 0.02 . 1 . . 763 . A 64 ILE HG12 . 34990 1 768 . 1 . 1 64 64 ILE HG13 H 1 0.66 0.02 . 1 . . 764 . A 64 ILE HG13 . 34990 1 769 . 1 . 1 64 64 ILE HG21 H 1 0.49 0.02 . 1 . . 765 . A 64 ILE HG21 . 34990 1 770 . 1 . 1 64 64 ILE HG22 H 1 0.49 0.02 . 1 . . 765 . A 64 ILE HG22 . 34990 1 771 . 1 . 1 64 64 ILE HG23 H 1 0.49 0.02 . 1 . . 765 . A 64 ILE HG23 . 34990 1 772 . 1 . 1 64 64 ILE HD11 H 1 0.45 0.02 . 1 . . 762 . A 64 ILE HD11 . 34990 1 773 . 1 . 1 64 64 ILE HD12 H 1 0.45 0.02 . 1 . . 762 . A 64 ILE HD12 . 34990 1 774 . 1 . 1 64 64 ILE HD13 H 1 0.45 0.02 . 1 . . 762 . A 64 ILE HD13 . 34990 1 775 . 1 . 1 64 64 ILE C C 13 176.06 0.10 . 1 . . 753 . A 64 ILE C . 34990 1 776 . 1 . 1 64 64 ILE CA C 13 62.62 0.10 . 1 . . 754 . A 64 ILE CA . 34990 1 777 . 1 . 1 64 64 ILE CB C 13 37.34 0.10 . 1 . . 755 . A 64 ILE CB . 34990 1 778 . 1 . 1 64 64 ILE CG1 C 13 27.83 0.10 . 1 . . 757 . A 64 ILE CG1 . 34990 1 779 . 1 . 1 64 64 ILE CG2 C 13 16.45 0.10 . 1 . . 758 . A 64 ILE CG2 . 34990 1 780 . 1 . 1 64 64 ILE CD1 C 13 12.79 0.10 . 1 . . 756 . A 64 ILE CD1 . 34990 1 781 . 1 . 1 64 64 ILE N N 15 127.19 0.10 . 1 . . 766 . A 64 ILE N . 34990 1 782 . 1 . 1 65 65 THR H H 1 8.02 0.02 . 1 . . 771 . A 65 THR H . 34990 1 783 . 1 . 1 65 65 THR HA H 1 5.09 0.02 . 1 . . 772 . A 65 THR HA . 34990 1 784 . 1 . 1 65 65 THR HB H 1 4.75 0.02 . 1 . . 773 . A 65 THR HB . 34990 1 785 . 1 . 1 65 65 THR HG21 H 1 1.38 0.02 . 1 . . 774 . A 65 THR HG21 . 34990 1 786 . 1 . 1 65 65 THR HG22 H 1 1.38 0.02 . 1 . . 774 . A 65 THR HG22 . 34990 1 787 . 1 . 1 65 65 THR HG23 H 1 1.38 0.02 . 1 . . 774 . A 65 THR HG23 . 34990 1 788 . 1 . 1 65 65 THR C C 13 173.59 0.10 . 1 . . 767 . A 65 THR C . 34990 1 789 . 1 . 1 65 65 THR CA C 13 58.55 0.10 . 1 . . 768 . A 65 THR CA . 34990 1 790 . 1 . 1 65 65 THR CB C 13 68.89 0.10 . 1 . . 769 . A 65 THR CB . 34990 1 791 . 1 . 1 65 65 THR CG2 C 13 21.70 0.10 . 1 . . 770 . A 65 THR CG2 . 34990 1 792 . 1 . 1 65 65 THR N N 15 120.41 0.10 . 1 . . 775 . A 65 THR N . 34990 1 793 . 1 . 1 66 66 PRO HA H 1 4.42 0.02 . 1 . . 780 . A 66 PRO HA . 34990 1 794 . 1 . 1 66 66 PRO HB2 H 1 2.35 0.02 . 1 . . 781 . A 66 PRO HB2 . 34990 1 795 . 1 . 1 66 66 PRO HB3 H 1 2.04 0.02 . 1 . . 782 . A 66 PRO HB3 . 34990 1 796 . 1 . 1 66 66 PRO HG2 H 1 2.19 0.02 . 1 . . 783 . A 66 PRO HG2 . 34990 1 797 . 1 . 1 66 66 PRO HG3 H 1 1.83 0.02 . 1 . . 784 . A 66 PRO HG3 . 34990 1 798 . 1 . 1 66 66 PRO HD2 H 1 3.91 0.02 . 2 . . 786 . A 66 PRO HD2 . 34990 1 799 . 1 . 1 66 66 PRO HD3 H 1 3.91 0.02 . 2 . . 786 . A 66 PRO HD3 . 34990 1 800 . 1 . 1 66 66 PRO CA C 13 64.78 0.10 . 1 . . 776 . A 66 PRO CA . 34990 1 801 . 1 . 1 66 66 PRO CB C 13 32.21 0.10 . 1 . . 777 . A 66 PRO CB . 34990 1 802 . 1 . 1 66 66 PRO CG C 13 27.72 0.10 . 1 . . 779 . A 66 PRO CG . 34990 1 803 . 1 . 1 66 66 PRO CD C 13 50.89 0.10 . 1 . . 778 . A 66 PRO CD . 34990 1 804 . 1 . 1 66 66 PRO N N 15 129.34 0.10 . 1 . . 785 . A 66 PRO N . 34990 1 805 . 1 . 1 67 67 ASN HA H 1 4.92 0.02 . 1 . . 790 . A 67 ASN HA . 34990 1 806 . 1 . 1 67 67 ASN HB2 H 1 3.01 0.02 . 2 . . 791 . A 67 ASN HB2 . 34990 1 807 . 1 . 1 67 67 ASN HB3 H 1 2.85 0.02 . 2 . . 792 . A 67 ASN HB3 . 34990 1 808 . 1 . 1 67 67 ASN C C 13 175.50 0.10 . 1 . . 787 . A 67 ASN C . 34990 1 809 . 1 . 1 67 67 ASN CA C 13 52.82 0.10 . 1 . . 788 . A 67 ASN CA . 34990 1 810 . 1 . 1 67 67 ASN CB C 13 38.70 0.10 . 1 . . 789 . A 67 ASN CB . 34990 1 811 . 1 . 1 67 67 ASN N N 15 111.39 0.10 . 1 . . 793 . A 67 ASN N . 34990 1 812 . 1 . 1 68 68 MET H H 1 7.60 0.02 . 1 . . 798 . A 68 MET H . 34990 1 813 . 1 . 1 68 68 MET HA H 1 4.79 0.02 . 1 . . 799 . A 68 MET HA . 34990 1 814 . 1 . 1 68 68 MET HB2 H 1 2.60 0.02 . 2 . . 800 . A 68 MET HB2 . 34990 1 815 . 1 . 1 68 68 MET HB3 H 1 2.40 0.02 . 2 . . 801 . A 68 MET HB3 . 34990 1 816 . 1 . 1 68 68 MET HG2 H 1 3.19 0.02 . 2 . . 803 . A 68 MET HG2 . 34990 1 817 . 1 . 1 68 68 MET HG3 H 1 3.19 0.02 . 2 . . 803 . A 68 MET HG3 . 34990 1 818 . 1 . 1 68 68 MET C C 13 175.47 0.10 . 1 . . 794 . A 68 MET C . 34990 1 819 . 1 . 1 68 68 MET CA C 13 57.20 0.10 . 1 . . 795 . A 68 MET CA . 34990 1 820 . 1 . 1 68 68 MET CB C 13 36.48 0.10 . 1 . . 796 . A 68 MET CB . 34990 1 821 . 1 . 1 68 68 MET CG C 13 32.77 0.10 . 1 . . 797 . A 68 MET CG . 34990 1 822 . 1 . 1 68 68 MET N N 15 121.66 0.10 . 1 . . 802 . A 68 MET N . 34990 1 823 . 1 . 1 69 69 THR H H 1 8.82 0.02 . 1 . . 808 . A 69 THR H . 34990 1 824 . 1 . 1 69 69 THR HA H 1 4.63 0.02 . 1 . . 809 . A 69 THR HA . 34990 1 825 . 1 . 1 69 69 THR HB H 1 4.00 0.02 . 1 . . 810 . A 69 THR HB . 34990 1 826 . 1 . 1 69 69 THR HG21 H 1 1.18 0.02 . 1 . . 811 . A 69 THR HG21 . 34990 1 827 . 1 . 1 69 69 THR HG22 H 1 1.18 0.02 . 1 . . 811 . A 69 THR HG22 . 34990 1 828 . 1 . 1 69 69 THR HG23 H 1 1.18 0.02 . 1 . . 811 . A 69 THR HG23 . 34990 1 829 . 1 . 1 69 69 THR C C 13 172.00 0.10 . 1 . . 804 . A 69 THR C . 34990 1 830 . 1 . 1 69 69 THR CA C 13 61.85 0.10 . 1 . . 805 . A 69 THR CA . 34990 1 831 . 1 . 1 69 69 THR CB C 13 72.30 0.10 . 1 . . 806 . A 69 THR CB . 34990 1 832 . 1 . 1 69 69 THR CG2 C 13 21.49 0.10 . 1 . . 807 . A 69 THR CG2 . 34990 1 833 . 1 . 1 69 69 THR N N 15 115.72 0.10 . 1 . . 812 . A 69 THR N . 34990 1 834 . 1 . 1 70 70 PHE H H 1 8.59 0.02 . 1 . . 819 . A 70 PHE H . 34990 1 835 . 1 . 1 70 70 PHE HA H 1 4.98 0.02 . 1 . . 820 . A 70 PHE HA . 34990 1 836 . 1 . 1 70 70 PHE HB2 H 1 2.59 0.02 . 2 . . 823 . A 70 PHE HB2 . 34990 1 837 . 1 . 1 70 70 PHE HB3 H 1 2.59 0.02 . 2 . . 823 . A 70 PHE HB3 . 34990 1 838 . 1 . 1 70 70 PHE HD1 H 1 7.03 0.02 . 3 . . 824 . A 70 PHE HD1 . 34990 1 839 . 1 . 1 70 70 PHE HD2 H 1 7.03 0.02 . 3 . . 824 . A 70 PHE HD2 . 34990 1 840 . 1 . 1 70 70 PHE HE1 H 1 7.25 0.02 . 3 . . 825 . A 70 PHE HE1 . 34990 1 841 . 1 . 1 70 70 PHE HE2 H 1 7.25 0.02 . 3 . . 825 . A 70 PHE HE2 . 34990 1 842 . 1 . 1 70 70 PHE HZ H 1 7.10 0.02 . 1 . . 821 . A 70 PHE HZ . 34990 1 843 . 1 . 1 70 70 PHE C C 13 175.07 0.10 . 1 . . 813 . A 70 PHE C . 34990 1 844 . 1 . 1 70 70 PHE CA C 13 56.67 0.10 . 1 . . 814 . A 70 PHE CA . 34990 1 845 . 1 . 1 70 70 PHE CB C 13 38.88 0.10 . 1 . . 815 . A 70 PHE CB . 34990 1 846 . 1 . 1 70 70 PHE CD1 C 13 132.78 0.10 . 1 . . 816 . A 70 PHE CD1 . 34990 1 847 . 1 . 1 70 70 PHE CD2 C 13 132.78 0.10 . 1 . . 816 . A 70 PHE CD2 . 34990 1 848 . 1 . 1 70 70 PHE CE1 C 13 130.65 0.10 . 1 . . 817 . A 70 PHE CE1 . 34990 1 849 . 1 . 1 70 70 PHE CE2 C 13 130.65 0.10 . 1 . . 817 . A 70 PHE CE2 . 34990 1 850 . 1 . 1 70 70 PHE CZ C 13 128.53 0.10 . 1 . . 818 . A 70 PHE CZ . 34990 1 851 . 1 . 1 70 70 PHE N N 15 129.38 0.10 . 1 . . 822 . A 70 PHE N . 34990 1 852 . 1 . 1 71 71 THR H H 1 8.84 0.02 . 1 . . 830 . A 71 THR H . 34990 1 853 . 1 . 1 71 71 THR HA H 1 4.44 0.02 . 1 . . 831 . A 71 THR HA . 34990 1 854 . 1 . 1 71 71 THR HB H 1 3.76 0.02 . 1 . . 832 . A 71 THR HB . 34990 1 855 . 1 . 1 71 71 THR HG21 H 1 1.09 0.02 . 1 . . 833 . A 71 THR HG21 . 34990 1 856 . 1 . 1 71 71 THR HG22 H 1 1.09 0.02 . 1 . . 833 . A 71 THR HG22 . 34990 1 857 . 1 . 1 71 71 THR HG23 H 1 1.09 0.02 . 1 . . 833 . A 71 THR HG23 . 34990 1 858 . 1 . 1 71 71 THR C C 13 173.10 0.10 . 1 . . 826 . A 71 THR C . 34990 1 859 . 1 . 1 71 71 THR CA C 13 60.89 0.10 . 1 . . 827 . A 71 THR CA . 34990 1 860 . 1 . 1 71 71 THR CB C 13 70.84 0.10 . 1 . . 828 . A 71 THR CB . 34990 1 861 . 1 . 1 71 71 THR CG2 C 13 21.66 0.10 . 1 . . 829 . A 71 THR CG2 . 34990 1 862 . 1 . 1 71 71 THR N N 15 124.64 0.10 . 1 . . 834 . A 71 THR N . 34990 1 863 . 1 . 1 72 72 LYS H H 1 8.83 0.02 . 1 . . 838 . A 72 LYS H . 34990 1 864 . 1 . 1 72 72 LYS HA H 1 4.58 0.02 . 1 . . 839 . A 72 LYS HA . 34990 1 865 . 1 . 1 72 72 LYS C C 13 176.03 0.10 . 1 . . 835 . A 72 LYS C . 34990 1 866 . 1 . 1 72 72 LYS CA C 13 56.35 0.10 . 1 . . 836 . A 72 LYS CA . 34990 1 867 . 1 . 1 72 72 LYS CB C 13 32.14 0.10 . 1 . . 837 . A 72 LYS CB . 34990 1 868 . 1 . 1 72 72 LYS N N 15 126.50 0.10 . 1 . . 840 . A 72 LYS N . 34990 1 869 . 1 . 1 73 73 THR H H 1 8.65 0.02 . 1 . . 845 . A 73 THR H . 34990 1 870 . 1 . 1 73 73 THR HA H 1 4.33 0.02 . 1 . . 846 . A 73 THR HA . 34990 1 871 . 1 . 1 73 73 THR HB H 1 4.22 0.02 . 1 . . 847 . A 73 THR HB . 34990 1 872 . 1 . 1 73 73 THR HG21 H 1 1.20 0.02 . 1 . . 848 . A 73 THR HG21 . 34990 1 873 . 1 . 1 73 73 THR HG22 H 1 1.20 0.02 . 1 . . 848 . A 73 THR HG22 . 34990 1 874 . 1 . 1 73 73 THR HG23 H 1 1.20 0.02 . 1 . . 848 . A 73 THR HG23 . 34990 1 875 . 1 . 1 73 73 THR C C 13 174.31 0.10 . 1 . . 841 . A 73 THR C . 34990 1 876 . 1 . 1 73 73 THR CA C 13 63.39 0.10 . 1 . . 842 . A 73 THR CA . 34990 1 877 . 1 . 1 73 73 THR CB C 13 69.38 0.10 . 1 . . 843 . A 73 THR CB . 34990 1 878 . 1 . 1 73 73 THR CG2 C 13 22.08 0.10 . 1 . . 844 . A 73 THR CG2 . 34990 1 879 . 1 . 1 73 73 THR N N 15 120.66 0.10 . 1 . . 849 . A 73 THR N . 34990 1 880 . 1 . 1 74 74 SER H H 1 8.53 0.02 . 1 . . 853 . A 74 SER H . 34990 1 881 . 1 . 1 74 74 SER HA H 1 4.61 0.02 . 1 . . 854 . A 74 SER HA . 34990 1 882 . 1 . 1 74 74 SER HB2 H 1 3.96 0.02 . 2 . . 855 . A 74 SER HB2 . 34990 1 883 . 1 . 1 74 74 SER HB3 H 1 4.15 0.02 . 2 . . 856 . A 74 SER HB3 . 34990 1 884 . 1 . 1 74 74 SER C C 13 173.78 0.10 . 1 . . 850 . A 74 SER C . 34990 1 885 . 1 . 1 74 74 SER CA C 13 57.30 0.10 . 1 . . 851 . A 74 SER CA . 34990 1 886 . 1 . 1 74 74 SER CB C 13 63.77 0.10 . 1 . . 852 . A 74 SER CB . 34990 1 887 . 1 . 1 74 74 SER N N 15 116.11 0.10 . 1 . . 857 . A 74 SER N . 34990 1 888 . 1 . 1 75 75 GLN HA H 1 4.08 0.02 . 1 . . 861 . A 75 GLN HA . 34990 1 889 . 1 . 1 75 75 GLN HB2 H 1 2.12 0.02 . 2 . . 868 . A 75 GLN HB2 . 34990 1 890 . 1 . 1 75 75 GLN HB3 H 1 2.12 0.02 . 2 . . 868 . A 75 GLN HB3 . 34990 1 891 . 1 . 1 75 75 GLN HG2 H 1 2.53 0.02 . 2 . . 864 . A 75 GLN HG2 . 34990 1 892 . 1 . 1 75 75 GLN HG3 H 1 2.46 0.02 . 2 . . 865 . A 75 GLN HG3 . 34990 1 893 . 1 . 1 75 75 GLN HE21 H 1 7.71 0.02 . 2 . . 862 . A 75 GLN HE21 . 34990 1 894 . 1 . 1 75 75 GLN HE22 H 1 6.96 0.02 . 2 . . 863 . A 75 GLN HE22 . 34990 1 895 . 1 . 1 75 75 GLN CA C 13 59.60 0.10 . 1 . . 858 . A 75 GLN CA . 34990 1 896 . 1 . 1 75 75 GLN CB C 13 29.29 0.10 . 1 . . 859 . A 75 GLN CB . 34990 1 897 . 1 . 1 75 75 GLN CG C 13 34.57 0.10 . 1 . . 860 . A 75 GLN CG . 34990 1 898 . 1 . 1 75 75 GLN N N 15 117.03 0.10 . 1 . . 866 . A 75 GLN N . 34990 1 899 . 1 . 1 75 75 GLN NE2 N 15 112.53 0.10 . 1 . . 867 . A 75 GLN NE2 . 34990 1 900 . 1 . 1 76 76 LYS HA H 1 4.46 0.02 . 1 . . 873 . A 76 LYS HA . 34990 1 901 . 1 . 1 76 76 LYS HB2 H 1 2.45 0.02 . 2 . . 874 . A 76 LYS HB2 . 34990 1 902 . 1 . 1 76 76 LYS HB3 H 1 2.35 0.02 . 2 . . 875 . A 76 LYS HB3 . 34990 1 903 . 1 . 1 76 76 LYS C C 13 174.09 0.10 . 1 . . 869 . A 76 LYS C . 34990 1 904 . 1 . 1 76 76 LYS CA C 13 55.78 0.10 . 1 . . 870 . A 76 LYS CA . 34990 1 905 . 1 . 1 76 76 LYS CB C 13 33.89 0.10 . 1 . . 871 . A 76 LYS CB . 34990 1 906 . 1 . 1 76 76 LYS CG C 13 25.74 0.10 . 1 . . 872 . A 76 LYS CG . 34990 1 907 . 1 . 1 76 76 LYS N N 15 110.84 0.10 . 1 . . 876 . A 76 LYS N . 34990 1 908 . 1 . 1 77 77 PHE H H 1 7.50 0.02 . 1 . . 882 . A 77 PHE H . 34990 1 909 . 1 . 1 77 77 PHE HA H 1 6.05 0.02 . 1 . . 883 . A 77 PHE HA . 34990 1 910 . 1 . 1 77 77 PHE HB2 H 1 2.89 0.02 . 2 . . 884 . A 77 PHE HB2 . 34990 1 911 . 1 . 1 77 77 PHE HB3 H 1 2.62 0.02 . 2 . . 885 . A 77 PHE HB3 . 34990 1 912 . 1 . 1 77 77 PHE HD1 H 1 6.68 0.02 . 3 . . 887 . A 77 PHE HD1 . 34990 1 913 . 1 . 1 77 77 PHE HD2 H 1 6.68 0.02 . 3 . . 887 . A 77 PHE HD2 . 34990 1 914 . 1 . 1 77 77 PHE HE1 H 1 6.02 0.02 . 3 . . 888 . A 77 PHE HE1 . 34990 1 915 . 1 . 1 77 77 PHE HE2 H 1 6.02 0.02 . 3 . . 888 . A 77 PHE HE2 . 34990 1 916 . 1 . 1 77 77 PHE C C 13 174.37 0.10 . 1 . . 877 . A 77 PHE C . 34990 1 917 . 1 . 1 77 77 PHE CA C 13 56.45 0.10 . 1 . . 878 . A 77 PHE CA . 34990 1 918 . 1 . 1 77 77 PHE CB C 13 44.00 0.10 . 1 . . 879 . A 77 PHE CB . 34990 1 919 . 1 . 1 77 77 PHE CD1 C 13 132.28 0.10 . 1 . . 880 . A 77 PHE CD1 . 34990 1 920 . 1 . 1 77 77 PHE CD2 C 13 132.28 0.10 . 1 . . 880 . A 77 PHE CD2 . 34990 1 921 . 1 . 1 77 77 PHE CE1 C 13 130.26 0.10 . 1 . . 881 . A 77 PHE CE1 . 34990 1 922 . 1 . 1 77 77 PHE CE2 C 13 130.26 0.10 . 1 . . 881 . A 77 PHE CE2 . 34990 1 923 . 1 . 1 77 77 PHE N N 15 123.94 0.10 . 1 . . 886 . A 77 PHE N . 34990 1 924 . 1 . 1 78 78 GLY H H 1 8.09 0.02 . 1 . . 891 . A 78 GLY H . 34990 1 925 . 1 . 1 78 78 GLY HA2 H 1 4.88 0.02 . 2 . . 892 . A 78 GLY HA2 . 34990 1 926 . 1 . 1 78 78 GLY HA3 H 1 3.60 0.02 . 2 . . 893 . A 78 GLY HA3 . 34990 1 927 . 1 . 1 78 78 GLY C C 13 169.00 0.10 . 1 . . 889 . A 78 GLY C . 34990 1 928 . 1 . 1 78 78 GLY CA C 13 45.46 0.10 . 1 . . 890 . A 78 GLY CA . 34990 1 929 . 1 . 1 78 78 GLY N N 15 112.61 0.10 . 1 . . 894 . A 78 GLY N . 34990 1 930 . 1 . 1 79 79 GLN H H 1 8.03 0.02 . 1 . . 899 . A 79 GLN H . 34990 1 931 . 1 . 1 79 79 GLN HA H 1 5.88 0.02 . 1 . . 900 . A 79 GLN HA . 34990 1 932 . 1 . 1 79 79 GLN HB2 H 1 2.14 0.02 . 1 . . 901 . A 79 GLN HB2 . 34990 1 933 . 1 . 1 79 79 GLN HB3 H 1 1.95 0.02 . 1 . . 902 . A 79 GLN HB3 . 34990 1 934 . 1 . 1 79 79 GLN HG2 H 1 2.14 0.02 . 2 . . 907 . A 79 GLN HG2 . 34990 1 935 . 1 . 1 79 79 GLN HG3 H 1 2.14 0.02 . 2 . . 907 . A 79 GLN HG3 . 34990 1 936 . 1 . 1 79 79 GLN HE21 H 1 7.54 0.02 . 2 . . 903 . A 79 GLN HE21 . 34990 1 937 . 1 . 1 79 79 GLN HE22 H 1 6.92 0.02 . 2 . . 904 . A 79 GLN HE22 . 34990 1 938 . 1 . 1 79 79 GLN C C 13 173.75 0.10 . 1 . . 895 . A 79 GLN C . 34990 1 939 . 1 . 1 79 79 GLN CA C 13 53.70 0.10 . 1 . . 896 . A 79 GLN CA . 34990 1 940 . 1 . 1 79 79 GLN CB C 13 35.56 0.10 . 1 . . 897 . A 79 GLN CB . 34990 1 941 . 1 . 1 79 79 GLN CG C 13 33.23 0.10 . 1 . . 898 . A 79 GLN CG . 34990 1 942 . 1 . 1 79 79 GLN N N 15 113.42 0.10 . 1 . . 905 . A 79 GLN N . 34990 1 943 . 1 . 1 79 79 GLN NE2 N 15 111.45 0.10 . 1 . . 906 . A 79 GLN NE2 . 34990 1 944 . 1 . 1 80 80 TRP H H 1 9.03 0.02 . 1 . . 915 . A 80 TRP H . 34990 1 945 . 1 . 1 80 80 TRP HA H 1 5.29 0.02 . 1 . . 916 . A 80 TRP HA . 34990 1 946 . 1 . 1 80 80 TRP HB2 H 1 3.41 0.02 . 2 . . 925 . A 80 TRP HB2 . 34990 1 947 . 1 . 1 80 80 TRP HB3 H 1 3.41 0.02 . 2 . . 925 . A 80 TRP HB3 . 34990 1 948 . 1 . 1 80 80 TRP HD1 H 1 7.39 0.02 . 1 . . 917 . A 80 TRP HD1 . 34990 1 949 . 1 . 1 80 80 TRP HE1 H 1 10.23 0.02 . 1 . . 918 . A 80 TRP HE1 . 34990 1 950 . 1 . 1 80 80 TRP HE3 H 1 7.75 0.02 . 1 . . 919 . A 80 TRP HE3 . 34990 1 951 . 1 . 1 80 80 TRP HZ2 H 1 6.97 0.02 . 1 . . 921 . A 80 TRP HZ2 . 34990 1 952 . 1 . 1 80 80 TRP HZ3 H 1 7.00 0.02 . 1 . . 922 . A 80 TRP HZ3 . 34990 1 953 . 1 . 1 80 80 TRP HH2 H 1 6.83 0.02 . 1 . . 920 . A 80 TRP HH2 . 34990 1 954 . 1 . 1 80 80 TRP C C 13 171.93 0.10 . 1 . . 908 . A 80 TRP C . 34990 1 955 . 1 . 1 80 80 TRP CA C 13 58.21 0.10 . 1 . . 909 . A 80 TRP CA . 34990 1 956 . 1 . 1 80 80 TRP CB C 13 34.75 0.10 . 1 . . 910 . A 80 TRP CB . 34990 1 957 . 1 . 1 80 80 TRP CE3 C 13 122.80 0.10 . 1 . . 911 . A 80 TRP CE3 . 34990 1 958 . 1 . 1 80 80 TRP CZ2 C 13 115.61 0.10 . 1 . . 913 . A 80 TRP CZ2 . 34990 1 959 . 1 . 1 80 80 TRP CZ3 C 13 120.98 0.10 . 1 . . 914 . A 80 TRP CZ3 . 34990 1 960 . 1 . 1 80 80 TRP CH2 C 13 122.94 0.10 . 1 . . 912 . A 80 TRP CH2 . 34990 1 961 . 1 . 1 80 80 TRP N N 15 119.31 0.10 . 1 . . 923 . A 80 TRP N . 34990 1 962 . 1 . 1 80 80 TRP NE1 N 15 126.67 0.10 . 1 . . 924 . A 80 TRP NE1 . 34990 1 963 . 1 . 1 81 81 ALA H H 1 8.66 0.02 . 1 . . 929 . A 81 ALA H . 34990 1 964 . 1 . 1 81 81 ALA HA H 1 4.83 0.02 . 1 . . 930 . A 81 ALA HA . 34990 1 965 . 1 . 1 81 81 ALA HB1 H 1 1.55 0.02 . 1 . . 931 . A 81 ALA HB1 . 34990 1 966 . 1 . 1 81 81 ALA HB2 H 1 1.55 0.02 . 1 . . 931 . A 81 ALA HB2 . 34990 1 967 . 1 . 1 81 81 ALA HB3 H 1 1.55 0.02 . 1 . . 931 . A 81 ALA HB3 . 34990 1 968 . 1 . 1 81 81 ALA C C 13 177.31 0.10 . 1 . . 926 . A 81 ALA C . 34990 1 969 . 1 . 1 81 81 ALA CA C 13 51.23 0.10 . 1 . . 927 . A 81 ALA CA . 34990 1 970 . 1 . 1 81 81 ALA CB C 13 20.38 0.10 . 1 . . 928 . A 81 ALA CB . 34990 1 971 . 1 . 1 81 81 ALA N N 15 122.62 0.10 . 1 . . 932 . A 81 ALA N . 34990 1 972 . 1 . 1 82 82 ASP H H 1 8.54 0.02 . 1 . . 936 . A 82 ASP H . 34990 1 973 . 1 . 1 82 82 ASP HA H 1 5.21 0.02 . 1 . . 937 . A 82 ASP HA . 34990 1 974 . 1 . 1 82 82 ASP HB2 H 1 2.62 0.02 . 2 . . 938 . A 82 ASP HB2 . 34990 1 975 . 1 . 1 82 82 ASP HB3 H 1 3.10 0.02 . 2 . . 939 . A 82 ASP HB3 . 34990 1 976 . 1 . 1 82 82 ASP C C 13 176.38 0.10 . 1 . . 933 . A 82 ASP C . 34990 1 977 . 1 . 1 82 82 ASP CA C 13 52.73 0.10 . 1 . . 934 . A 82 ASP CA . 34990 1 978 . 1 . 1 82 82 ASP CB C 13 44.03 0.10 . 1 . . 935 . A 82 ASP CB . 34990 1 979 . 1 . 1 82 82 ASP N N 15 122.17 0.10 . 1 . . 940 . A 82 ASP N . 34990 1 980 . 1 . 1 83 83 SER HA H 1 4.43 0.02 . 1 . . 944 . A 83 SER HA . 34990 1 981 . 1 . 1 83 83 SER HB2 H 1 4.06 0.02 . 2 . . 945 . A 83 SER HB2 . 34990 1 982 . 1 . 1 83 83 SER HB3 H 1 4.04 0.02 . 2 . . 946 . A 83 SER HB3 . 34990 1 983 . 1 . 1 83 83 SER C C 13 176.69 0.10 . 1 . . 941 . A 83 SER C . 34990 1 984 . 1 . 1 83 83 SER CA C 13 61.05 0.10 . 1 . . 942 . A 83 SER CA . 34990 1 985 . 1 . 1 83 83 SER CB C 13 63.09 0.10 . 1 . . 943 . A 83 SER CB . 34990 1 986 . 1 . 1 83 83 SER N N 15 121.33 0.10 . 1 . . 947 . A 83 SER N . 34990 1 987 . 1 . 1 84 84 ARG H H 1 8.49 0.02 . 1 . . 953 . A 84 ARG H . 34990 1 988 . 1 . 1 84 84 ARG HA H 1 4.26 0.02 . 1 . . 954 . A 84 ARG HA . 34990 1 989 . 1 . 1 84 84 ARG HB2 H 1 2.12 0.02 . 2 . . 958 . A 84 ARG HB2 . 34990 1 990 . 1 . 1 84 84 ARG HB3 H 1 2.12 0.02 . 2 . . 958 . A 84 ARG HB3 . 34990 1 991 . 1 . 1 84 84 ARG HG2 H 1 1.84 0.02 . 2 . . 955 . A 84 ARG HG2 . 34990 1 992 . 1 . 1 84 84 ARG HG3 H 1 1.76 0.02 . 2 . . 956 . A 84 ARG HG3 . 34990 1 993 . 1 . 1 84 84 ARG HD2 H 1 3.35 0.02 . 2 . . 959 . A 84 ARG HD2 . 34990 1 994 . 1 . 1 84 84 ARG HD3 H 1 3.35 0.02 . 2 . . 959 . A 84 ARG HD3 . 34990 1 995 . 1 . 1 84 84 ARG C C 13 177.87 0.10 . 1 . . 948 . A 84 ARG C . 34990 1 996 . 1 . 1 84 84 ARG CA C 13 58.70 0.10 . 1 . . 949 . A 84 ARG CA . 34990 1 997 . 1 . 1 84 84 ARG CB C 13 29.61 0.10 . 1 . . 950 . A 84 ARG CB . 34990 1 998 . 1 . 1 84 84 ARG CG C 13 27.38 0.10 . 1 . . 952 . A 84 ARG CG . 34990 1 999 . 1 . 1 84 84 ARG CD C 13 43.13 0.10 . 1 . . 951 . A 84 ARG CD . 34990 1 1000 . 1 . 1 84 84 ARG N N 15 124.20 0.10 . 1 . . 957 . A 84 ARG N . 34990 1 1001 . 1 . 1 85 85 ALA H H 1 7.98 0.02 . 1 . . 963 . A 85 ALA H . 34990 1 1002 . 1 . 1 85 85 ALA HA H 1 4.38 0.02 . 1 . . 964 . A 85 ALA HA . 34990 1 1003 . 1 . 1 85 85 ALA HB1 H 1 1.45 0.02 . 1 . . 965 . A 85 ALA HB1 . 34990 1 1004 . 1 . 1 85 85 ALA HB2 H 1 1.45 0.02 . 1 . . 965 . A 85 ALA HB2 . 34990 1 1005 . 1 . 1 85 85 ALA HB3 H 1 1.45 0.02 . 1 . . 965 . A 85 ALA HB3 . 34990 1 1006 . 1 . 1 85 85 ALA C C 13 176.88 0.10 . 1 . . 960 . A 85 ALA C . 34990 1 1007 . 1 . 1 85 85 ALA CA C 13 51.77 0.10 . 1 . . 961 . A 85 ALA CA . 34990 1 1008 . 1 . 1 85 85 ALA CB C 13 19.66 0.10 . 1 . . 962 . A 85 ALA CB . 34990 1 1009 . 1 . 1 85 85 ALA N N 15 120.55 0.10 . 1 . . 966 . A 85 ALA N . 34990 1 1010 . 1 . 1 86 86 ASN H H 1 8.00 0.02 . 1 . . 970 . A 86 ASN H . 34990 1 1011 . 1 . 1 86 86 ASN HA H 1 4.35 0.02 . 1 . . 971 . A 86 ASN HA . 34990 1 1012 . 1 . 1 86 86 ASN HB2 H 1 3.22 0.02 . 2 . . 972 . A 86 ASN HB2 . 34990 1 1013 . 1 . 1 86 86 ASN HB3 H 1 2.58 0.02 . 2 . . 973 . A 86 ASN HB3 . 34990 1 1014 . 1 . 1 86 86 ASN HD21 H 1 7.58 0.02 . 2 . . 974 . A 86 ASN HD21 . 34990 1 1015 . 1 . 1 86 86 ASN HD22 H 1 6.80 0.02 . 2 . . 975 . A 86 ASN HD22 . 34990 1 1016 . 1 . 1 86 86 ASN C C 13 173.73 0.10 . 1 . . 967 . A 86 ASN C . 34990 1 1017 . 1 . 1 86 86 ASN CA C 13 53.46 0.10 . 1 . . 968 . A 86 ASN CA . 34990 1 1018 . 1 . 1 86 86 ASN CB C 13 37.16 0.10 . 1 . . 969 . A 86 ASN CB . 34990 1 1019 . 1 . 1 86 86 ASN N N 15 116.72 0.10 . 1 . . 976 . A 86 ASN N . 34990 1 1020 . 1 . 1 86 86 ASN ND2 N 15 111.98 0.10 . 1 . . 977 . A 86 ASN ND2 . 34990 1 1021 . 1 . 1 87 87 THR H H 1 7.75 0.02 . 1 . . 982 . A 87 THR H . 34990 1 1022 . 1 . 1 87 87 THR HA H 1 4.50 0.02 . 1 . . 983 . A 87 THR HA . 34990 1 1023 . 1 . 1 87 87 THR HB H 1 3.69 0.02 . 1 . . 984 . A 87 THR HB . 34990 1 1024 . 1 . 1 87 87 THR HG21 H 1 0.33 0.02 . 1 . . 985 . A 87 THR HG21 . 34990 1 1025 . 1 . 1 87 87 THR HG22 H 1 0.33 0.02 . 1 . . 985 . A 87 THR HG22 . 34990 1 1026 . 1 . 1 87 87 THR HG23 H 1 0.33 0.02 . 1 . . 985 . A 87 THR HG23 . 34990 1 1027 . 1 . 1 87 87 THR C C 13 172.16 0.10 . 1 . . 978 . A 87 THR C . 34990 1 1028 . 1 . 1 87 87 THR CA C 13 60.17 0.10 . 1 . . 979 . A 87 THR CA . 34990 1 1029 . 1 . 1 87 87 THR CB C 13 70.08 0.10 . 1 . . 980 . A 87 THR CB . 34990 1 1030 . 1 . 1 87 87 THR CG2 C 13 18.11 0.10 . 1 . . 981 . A 87 THR CG2 . 34990 1 1031 . 1 . 1 87 87 THR N N 15 110.14 0.10 . 1 . . 986 . A 87 THR N . 34990 1 1032 . 1 . 1 88 88 VAL H H 1 7.91 0.02 . 1 . . 992 . A 88 VAL H . 34990 1 1033 . 1 . 1 88 88 VAL HA H 1 4.35 0.02 . 1 . . 993 . A 88 VAL HA . 34990 1 1034 . 1 . 1 88 88 VAL HB H 1 1.64 0.02 . 1 . . 994 . A 88 VAL HB . 34990 1 1035 . 1 . 1 88 88 VAL HG11 H 1 0.78 0.02 . 2 . . 995 . A 88 VAL HG11 . 34990 1 1036 . 1 . 1 88 88 VAL HG12 H 1 0.78 0.02 . 2 . . 995 . A 88 VAL HG12 . 34990 1 1037 . 1 . 1 88 88 VAL HG13 H 1 0.78 0.02 . 2 . . 995 . A 88 VAL HG13 . 34990 1 1038 . 1 . 1 88 88 VAL HG21 H 1 0.88 0.02 . 2 . . 996 . A 88 VAL HG21 . 34990 1 1039 . 1 . 1 88 88 VAL HG22 H 1 0.88 0.02 . 2 . . 996 . A 88 VAL HG22 . 34990 1 1040 . 1 . 1 88 88 VAL HG23 H 1 0.88 0.02 . 2 . . 996 . A 88 VAL HG23 . 34990 1 1041 . 1 . 1 88 88 VAL C C 13 174.59 0.10 . 1 . . 987 . A 88 VAL C . 34990 1 1042 . 1 . 1 88 88 VAL CA C 13 61.69 0.10 . 1 . . 988 . A 88 VAL CA . 34990 1 1043 . 1 . 1 88 88 VAL CB C 13 34.09 0.10 . 1 . . 989 . A 88 VAL CB . 34990 1 1044 . 1 . 1 88 88 VAL CG1 C 13 21.08 0.10 . 2 . . 990 . A 88 VAL CG1 . 34990 1 1045 . 1 . 1 88 88 VAL CG2 C 13 21.59 0.10 . 2 . . 991 . A 88 VAL CG2 . 34990 1 1046 . 1 . 1 88 88 VAL N N 15 124.73 0.10 . 1 . . 997 . A 88 VAL N . 34990 1 1047 . 1 . 1 89 89 TYR H H 1 8.37 0.02 . 1 . . 1003 . A 89 TYR H . 34990 1 1048 . 1 . 1 89 89 TYR HA H 1 4.96 0.02 . 1 . . 1004 . A 89 TYR HA . 34990 1 1049 . 1 . 1 89 89 TYR HB2 H 1 2.08 0.02 . 2 . . 1006 . A 89 TYR HB2 . 34990 1 1050 . 1 . 1 89 89 TYR HB3 H 1 2.08 0.02 . 2 . . 1006 . A 89 TYR HB3 . 34990 1 1051 . 1 . 1 89 89 TYR HD1 H 1 6.55 0.02 . 3 . . 1007 . A 89 TYR HD1 . 34990 1 1052 . 1 . 1 89 89 TYR HD2 H 1 6.55 0.02 . 3 . . 1007 . A 89 TYR HD2 . 34990 1 1053 . 1 . 1 89 89 TYR HE1 H 1 6.84 0.02 . 3 . . 1008 . A 89 TYR HE1 . 34990 1 1054 . 1 . 1 89 89 TYR HE2 H 1 6.84 0.02 . 3 . . 1008 . A 89 TYR HE2 . 34990 1 1055 . 1 . 1 89 89 TYR C C 13 174.25 0.10 . 1 . . 998 . A 89 TYR C . 34990 1 1056 . 1 . 1 89 89 TYR CA C 13 57.66 0.10 . 1 . . 999 . A 89 TYR CA . 34990 1 1057 . 1 . 1 89 89 TYR CB C 13 40.13 0.10 . 1 . . 1000 . A 89 TYR CB . 34990 1 1058 . 1 . 1 89 89 TYR CD1 C 13 133.31 0.10 . 1 . . 1001 . A 89 TYR CD1 . 34990 1 1059 . 1 . 1 89 89 TYR CD2 C 13 133.31 0.10 . 1 . . 1001 . A 89 TYR CD2 . 34990 1 1060 . 1 . 1 89 89 TYR CE1 C 13 118.75 0.10 . 1 . . 1002 . A 89 TYR CE1 . 34990 1 1061 . 1 . 1 89 89 TYR CE2 C 13 118.75 0.10 . 1 . . 1002 . A 89 TYR CE2 . 34990 1 1062 . 1 . 1 89 89 TYR N N 15 125.53 0.10 . 1 . . 1005 . A 89 TYR N . 34990 1 1063 . 1 . 1 90 90 GLY H H 1 8.71 0.02 . 1 . . 1011 . A 90 GLY H . 34990 1 1064 . 1 . 1 90 90 GLY HA2 H 1 4.59 0.02 . 2 . . 1012 . A 90 GLY HA2 . 34990 1 1065 . 1 . 1 90 90 GLY HA3 H 1 3.77 0.02 . 2 . . 1013 . A 90 GLY HA3 . 34990 1 1066 . 1 . 1 90 90 GLY C C 13 171.00 0.10 . 1 . . 1009 . A 90 GLY C . 34990 1 1067 . 1 . 1 90 90 GLY CA C 13 44.16 0.10 . 1 . . 1010 . A 90 GLY CA . 34990 1 1068 . 1 . 1 90 90 GLY N N 15 107.95 0.10 . 1 . . 1014 . A 90 GLY N . 34990 1 1069 . 1 . 1 91 91 LEU H H 1 8.35 0.02 . 1 . . 1020 . A 91 LEU H . 34990 1 1070 . 1 . 1 91 91 LEU HA H 1 5.19 0.02 . 1 . . 1021 . A 91 LEU HA . 34990 1 1071 . 1 . 1 91 91 LEU HB2 H 1 1.30 0.02 . 1 . . 1022 . A 91 LEU HB2 . 34990 1 1072 . 1 . 1 91 91 LEU HB3 H 1 0.24 0.02 . 1 . . 1023 . A 91 LEU HB3 . 34990 1 1073 . 1 . 1 91 91 LEU HG H 1 0.44 0.02 . 1 . . 1025 . A 91 LEU HG . 34990 1 1074 . 1 . 1 91 91 LEU HD11 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD11 . 34990 1 1075 . 1 . 1 91 91 LEU HD12 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD12 . 34990 1 1076 . 1 . 1 91 91 LEU HD13 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD13 . 34990 1 1077 . 1 . 1 91 91 LEU HD21 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD21 . 34990 1 1078 . 1 . 1 91 91 LEU HD22 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD22 . 34990 1 1079 . 1 . 1 91 91 LEU HD23 H 1 0.76 0.02 . 1 . . 1024 . A 91 LEU HD23 . 34990 1 1080 . 1 . 1 91 91 LEU C C 13 173.76 0.10 . 1 . . 1015 . A 91 LEU C . 34990 1 1081 . 1 . 1 91 91 LEU CA C 13 52.25 0.10 . 1 . . 1016 . A 91 LEU CA . 34990 1 1082 . 1 . 1 91 91 LEU CB C 13 46.38 0.10 . 1 . . 1017 . A 91 LEU CB . 34990 1 1083 . 1 . 1 91 91 LEU CG C 13 28.09 0.10 . 1 . . 1019 . A 91 LEU CG . 34990 1 1084 . 1 . 1 91 91 LEU CD1 C 13 25.49 0.10 . 1 . . 1018 . A 91 LEU CD1 . 34990 1 1085 . 1 . 1 91 91 LEU CD2 C 13 25.49 0.10 . 1 . . 1018 . A 91 LEU CD2 . 34990 1 1086 . 1 . 1 91 91 LEU N N 15 121.89 0.10 . 1 . . 1026 . A 91 LEU N . 34990 1 1087 . 1 . 1 92 92 GLY H H 1 9.15 0.02 . 1 . . 1029 . A 92 GLY H . 34990 1 1088 . 1 . 1 92 92 GLY HA2 H 1 5.02 0.02 . 2 . . 1030 . A 92 GLY HA2 . 34990 1 1089 . 1 . 1 92 92 GLY HA3 H 1 3.73 0.02 . 2 . . 1031 . A 92 GLY HA3 . 34990 1 1090 . 1 . 1 92 92 GLY C C 13 174.38 0.10 . 1 . . 1027 . A 92 GLY C . 34990 1 1091 . 1 . 1 92 92 GLY CA C 13 44.85 0.10 . 1 . . 1028 . A 92 GLY CA . 34990 1 1092 . 1 . 1 92 92 GLY N N 15 106.31 0.10 . 1 . . 1032 . A 92 GLY N . 34990 1 1093 . 1 . 1 93 93 PHE H H 1 9.36 0.02 . 1 . . 1039 . A 93 PHE H . 34990 1 1094 . 1 . 1 93 93 PHE HB2 H 1 3.58 0.02 . 1 . . 1040 . A 93 PHE HB2 . 34990 1 1095 . 1 . 1 93 93 PHE HB3 H 1 2.89 0.02 . 1 . . 1041 . A 93 PHE HB3 . 34990 1 1096 . 1 . 1 93 93 PHE HD1 H 1 7.44 0.02 . 3 . . 1044 . A 93 PHE HD1 . 34990 1 1097 . 1 . 1 93 93 PHE HD2 H 1 7.44 0.02 . 3 . . 1044 . A 93 PHE HD2 . 34990 1 1098 . 1 . 1 93 93 PHE HE1 H 1 7.03 0.02 . 3 . . 1045 . A 93 PHE HE1 . 34990 1 1099 . 1 . 1 93 93 PHE HE2 H 1 7.03 0.02 . 3 . . 1045 . A 93 PHE HE2 . 34990 1 1100 . 1 . 1 93 93 PHE HZ H 1 6.25 0.02 . 1 . . 1042 . A 93 PHE HZ . 34990 1 1101 . 1 . 1 93 93 PHE C C 13 176.16 0.10 . 1 . . 1033 . A 93 PHE C . 34990 1 1102 . 1 . 1 93 93 PHE CA C 13 57.98 0.10 . 1 . . 1034 . A 93 PHE CA . 34990 1 1103 . 1 . 1 93 93 PHE CB C 13 42.63 0.10 . 1 . . 1035 . A 93 PHE CB . 34990 1 1104 . 1 . 1 93 93 PHE CD1 C 13 132.98 0.10 . 1 . . 1036 . A 93 PHE CD1 . 34990 1 1105 . 1 . 1 93 93 PHE CD2 C 13 132.98 0.10 . 1 . . 1036 . A 93 PHE CD2 . 34990 1 1106 . 1 . 1 93 93 PHE CE1 C 13 131.81 0.10 . 1 . . 1037 . A 93 PHE CE1 . 34990 1 1107 . 1 . 1 93 93 PHE CE2 C 13 131.81 0.10 . 1 . . 1037 . A 93 PHE CE2 . 34990 1 1108 . 1 . 1 93 93 PHE CZ C 13 129.16 0.10 . 1 . . 1038 . A 93 PHE CZ . 34990 1 1109 . 1 . 1 93 93 PHE N N 15 124.66 0.10 . 1 . . 1043 . A 93 PHE N . 34990 1 1110 . 1 . 1 94 94 SER HA H 1 4.51 0.02 . 1 . . 1049 . A 94 SER HA . 34990 1 1111 . 1 . 1 94 94 SER HB2 H 1 4.13 0.02 . 2 . . 1050 . A 94 SER HB2 . 34990 1 1112 . 1 . 1 94 94 SER HB3 H 1 4.03 0.02 . 2 . . 1051 . A 94 SER HB3 . 34990 1 1113 . 1 . 1 94 94 SER C C 13 175.00 0.10 . 1 . . 1046 . A 94 SER C . 34990 1 1114 . 1 . 1 94 94 SER CA C 13 60.10 0.10 . 1 . . 1047 . A 94 SER CA . 34990 1 1115 . 1 . 1 94 94 SER CB C 13 63.63 0.10 . 1 . . 1048 . A 94 SER CB . 34990 1 1116 . 1 . 1 94 94 SER N N 15 114.61 0.10 . 1 . . 1052 . A 94 SER N . 34990 1 1117 . 1 . 1 95 95 SER H H 1 7.55 0.02 . 1 . . 1056 . A 95 SER H . 34990 1 1118 . 1 . 1 95 95 SER HA H 1 4.75 0.02 . 1 . . 1057 . A 95 SER HA . 34990 1 1119 . 1 . 1 95 95 SER HB2 H 1 4.12 0.02 . 2 . . 1058 . A 95 SER HB2 . 34990 1 1120 . 1 . 1 95 95 SER HB3 H 1 3.84 0.02 . 2 . . 1059 . A 95 SER HB3 . 34990 1 1121 . 1 . 1 95 95 SER C C 13 173.96 0.10 . 1 . . 1053 . A 95 SER C . 34990 1 1122 . 1 . 1 95 95 SER CA C 13 56.77 0.10 . 1 . . 1054 . A 95 SER CA . 34990 1 1123 . 1 . 1 95 95 SER CB C 13 66.34 0.10 . 1 . . 1055 . A 95 SER CB . 34990 1 1124 . 1 . 1 95 95 SER N N 15 112.19 0.10 . 1 . . 1060 . A 95 SER N . 34990 1 1125 . 1 . 1 96 96 GLU HA H 1 4.42 0.02 . 1 . . 1064 . A 96 GLU HA . 34990 1 1126 . 1 . 1 96 96 GLU HB2 H 1 2.10 0.02 . 2 . . 1066 . A 96 GLU HB2 . 34990 1 1127 . 1 . 1 96 96 GLU HB3 H 1 2.10 0.02 . 2 . . 1066 . A 96 GLU HB3 . 34990 1 1128 . 1 . 1 96 96 GLU HG2 H 1 2.46 0.02 . 2 . . 1067 . A 96 GLU HG2 . 34990 1 1129 . 1 . 1 96 96 GLU HG3 H 1 2.46 0.02 . 2 . . 1067 . A 96 GLU HG3 . 34990 1 1130 . 1 . 1 96 96 GLU CA C 13 59.06 0.10 . 1 . . 1061 . A 96 GLU CA . 34990 1 1131 . 1 . 1 96 96 GLU CB C 13 29.68 0.10 . 1 . . 1062 . A 96 GLU CB . 34990 1 1132 . 1 . 1 96 96 GLU CG C 13 36.02 0.10 . 1 . . 1063 . A 96 GLU CG . 34990 1 1133 . 1 . 1 96 96 GLU N N 15 125.39 0.10 . 1 . . 1065 . A 96 GLU N . 34990 1 1134 . 1 . 1 97 97 HIS HA H 1 4.38 0.02 . 1 . . 1073 . A 97 HIS HA . 34990 1 1135 . 1 . 1 97 97 HIS HB2 H 1 3.10 0.02 . 2 . . 1074 . A 97 HIS HB2 . 34990 1 1136 . 1 . 1 97 97 HIS HB3 H 1 2.98 0.02 . 2 . . 1075 . A 97 HIS HB3 . 34990 1 1137 . 1 . 1 97 97 HIS HD2 H 1 6.58 0.02 . 1 . . 1076 . A 97 HIS HD2 . 34990 1 1138 . 1 . 1 97 97 HIS HE1 H 1 7.75 0.02 . 1 . . 1077 . A 97 HIS HE1 . 34990 1 1139 . 1 . 1 97 97 HIS C C 13 177.81 0.10 . 1 . . 1068 . A 97 HIS C . 34990 1 1140 . 1 . 1 97 97 HIS CA C 13 59.35 0.10 . 1 . . 1069 . A 97 HIS CA . 34990 1 1141 . 1 . 1 97 97 HIS CB C 13 30.13 0.10 . 1 . . 1070 . A 97 HIS CB . 34990 1 1142 . 1 . 1 97 97 HIS CD2 C 13 119.20 0.10 . 1 . . 1071 . A 97 HIS CD2 . 34990 1 1143 . 1 . 1 97 97 HIS CE1 C 13 139.00 0.10 . 1 . . 1072 . A 97 HIS CE1 . 34990 1 1144 . 1 . 1 97 97 HIS N N 15 119.50 0.10 . 1 . . 1078 . A 97 HIS N . 34990 1 1145 . 1 . 1 98 98 HIS H H 1 7.58 0.02 . 1 . . 1082 . A 98 HIS H . 34990 1 1146 . 1 . 1 98 98 HIS HA H 1 4.40 0.02 . 1 . . 1083 . A 98 HIS HA . 34990 1 1147 . 1 . 1 98 98 HIS HB2 H 1 3.48 0.02 . 2 . . 1084 . A 98 HIS HB2 . 34990 1 1148 . 1 . 1 98 98 HIS HB3 H 1 3.28 0.02 . 2 . . 1085 . A 98 HIS HB3 . 34990 1 1149 . 1 . 1 98 98 HIS HD2 H 1 7.21 0.02 . 1 . . 1086 . A 98 HIS HD2 . 34990 1 1150 . 1 . 1 98 98 HIS C C 13 178.54 0.10 . 1 . . 1079 . A 98 HIS C . 34990 1 1151 . 1 . 1 98 98 HIS CA C 13 59.41 0.10 . 1 . . 1080 . A 98 HIS CA . 34990 1 1152 . 1 . 1 98 98 HIS CB C 13 31.95 0.10 . 1 . . 1081 . A 98 HIS CB . 34990 1 1153 . 1 . 1 98 98 HIS N N 15 118.08 0.10 . 1 . . 1087 . A 98 HIS N . 34990 1 1154 . 1 . 1 99 99 LEU H H 1 7.09 0.02 . 1 . . 1094 . A 99 LEU H . 34990 1 1155 . 1 . 1 99 99 LEU HA H 1 2.58 0.02 . 1 . . 1095 . A 99 LEU HA . 34990 1 1156 . 1 . 1 99 99 LEU HB2 H 1 2.02 0.02 . 1 . . 1096 . A 99 LEU HB2 . 34990 1 1157 . 1 . 1 99 99 LEU HB3 H 1 1.16 0.02 . 1 . . 1097 . A 99 LEU HB3 . 34990 1 1158 . 1 . 1 99 99 LEU HG H 1 1.44 0.02 . 1 . . 1100 . A 99 LEU HG . 34990 1 1159 . 1 . 1 99 99 LEU HD11 H 1 0.97 0.02 . 1 . . 1098 . A 99 LEU HD11 . 34990 1 1160 . 1 . 1 99 99 LEU HD12 H 1 0.97 0.02 . 1 . . 1098 . A 99 LEU HD12 . 34990 1 1161 . 1 . 1 99 99 LEU HD13 H 1 0.97 0.02 . 1 . . 1098 . A 99 LEU HD13 . 34990 1 1162 . 1 . 1 99 99 LEU HD21 H 1 1.06 0.02 . 1 . . 1099 . A 99 LEU HD21 . 34990 1 1163 . 1 . 1 99 99 LEU HD22 H 1 1.06 0.02 . 1 . . 1099 . A 99 LEU HD22 . 34990 1 1164 . 1 . 1 99 99 LEU HD23 H 1 1.06 0.02 . 1 . . 1099 . A 99 LEU HD23 . 34990 1 1165 . 1 . 1 99 99 LEU C C 13 177.87 0.10 . 1 . . 1088 . A 99 LEU C . 34990 1 1166 . 1 . 1 99 99 LEU CA C 13 58.24 0.10 . 1 . . 1089 . A 99 LEU CA . 34990 1 1167 . 1 . 1 99 99 LEU CB C 13 40.66 0.10 . 1 . . 1090 . A 99 LEU CB . 34990 1 1168 . 1 . 1 99 99 LEU CG C 13 27.97 0.10 . 1 . . 1093 . A 99 LEU CG . 34990 1 1169 . 1 . 1 99 99 LEU CD1 C 13 26.38 0.10 . 1 . . 1091 . A 99 LEU CD1 . 34990 1 1170 . 1 . 1 99 99 LEU CD2 C 13 25.96 0.10 . 1 . . 1092 . A 99 LEU CD2 . 34990 1 1171 . 1 . 1 99 99 LEU N N 15 122.16 0.10 . 1 . . 1101 . A 99 LEU N . 34990 1 1172 . 1 . 1 100 100 SER H H 1 8.46 0.02 . 1 . . 1104 . A 100 SER H . 34990 1 1173 . 1 . 1 100 100 SER HA H 1 3.96 0.02 . 1 . . 1105 . A 100 SER HA . 34990 1 1174 . 1 . 1 100 100 SER C C 13 177.13 0.10 . 1 . . 1102 . A 100 SER C . 34990 1 1175 . 1 . 1 100 100 SER CA C 13 62.09 0.10 . 1 . . 1103 . A 100 SER CA . 34990 1 1176 . 1 . 1 100 100 SER N N 15 114.72 0.10 . 1 . . 1106 . A 100 SER N . 34990 1 1177 . 1 . 1 101 101 LYS H H 1 8.02 0.02 . 1 . . 1113 . A 101 LYS H . 34990 1 1178 . 1 . 1 101 101 LYS HA H 1 3.98 0.02 . 1 . . 1114 . A 101 LYS HA . 34990 1 1179 . 1 . 1 101 101 LYS HB2 H 1 1.91 0.02 . 2 . . 1115 . A 101 LYS HB2 . 34990 1 1180 . 1 . 1 101 101 LYS HB3 H 1 1.85 0.02 . 2 . . 1116 . A 101 LYS HB3 . 34990 1 1181 . 1 . 1 101 101 LYS HG2 H 1 1.43 0.02 . 2 . . 1117 . A 101 LYS HG2 . 34990 1 1182 . 1 . 1 101 101 LYS HG3 H 1 1.34 0.02 . 2 . . 1118 . A 101 LYS HG3 . 34990 1 1183 . 1 . 1 101 101 LYS HD2 H 1 1.60 0.02 . 2 . . 1120 . A 101 LYS HD2 . 34990 1 1184 . 1 . 1 101 101 LYS HD3 H 1 1.60 0.02 . 2 . . 1120 . A 101 LYS HD3 . 34990 1 1185 . 1 . 1 101 101 LYS HE2 H 1 2.84 0.02 . 2 . . 1121 . A 101 LYS HE2 . 34990 1 1186 . 1 . 1 101 101 LYS HE3 H 1 2.84 0.02 . 2 . . 1121 . A 101 LYS HE3 . 34990 1 1187 . 1 . 1 101 101 LYS C C 13 178.26 0.10 . 1 . . 1107 . A 101 LYS C . 34990 1 1188 . 1 . 1 101 101 LYS CA C 13 57.80 0.10 . 1 . . 1108 . A 101 LYS CA . 34990 1 1189 . 1 . 1 101 101 LYS CB C 13 31.40 0.10 . 1 . . 1109 . A 101 LYS CB . 34990 1 1190 . 1 . 1 101 101 LYS CG C 13 24.20 0.10 . 1 . . 1112 . A 101 LYS CG . 34990 1 1191 . 1 . 1 101 101 LYS CD C 13 27.70 0.10 . 1 . . 1110 . A 101 LYS CD . 34990 1 1192 . 1 . 1 101 101 LYS CE C 13 41.91 0.10 . 1 . . 1111 . A 101 LYS CE . 34990 1 1193 . 1 . 1 101 101 LYS N N 15 120.83 0.10 . 1 . . 1119 . A 101 LYS N . 34990 1 1194 . 1 . 1 102 102 PHE H H 1 7.85 0.02 . 1 . . 1125 . A 102 PHE H . 34990 1 1195 . 1 . 1 102 102 PHE HA H 1 3.72 0.02 . 1 . . 1126 . A 102 PHE HA . 34990 1 1196 . 1 . 1 102 102 PHE HB2 H 1 3.18 0.02 . 1 . . 1127 . A 102 PHE HB2 . 34990 1 1197 . 1 . 1 102 102 PHE HB3 H 1 2.92 0.02 . 1 . . 1128 . A 102 PHE HB3 . 34990 1 1198 . 1 . 1 102 102 PHE HD1 H 1 6.73 0.02 . 3 . . 1130 . A 102 PHE HD1 . 34990 1 1199 . 1 . 1 102 102 PHE HD2 H 1 6.73 0.02 . 3 . . 1130 . A 102 PHE HD2 . 34990 1 1200 . 1 . 1 102 102 PHE HE1 H 1 6.71 0.02 . 3 . . 1131 . A 102 PHE HE1 . 34990 1 1201 . 1 . 1 102 102 PHE HE2 H 1 6.71 0.02 . 3 . . 1131 . A 102 PHE HE2 . 34990 1 1202 . 1 . 1 102 102 PHE C C 13 177.91 0.10 . 1 . . 1122 . A 102 PHE C . 34990 1 1203 . 1 . 1 102 102 PHE CA C 13 63.09 0.10 . 1 . . 1123 . A 102 PHE CA . 34990 1 1204 . 1 . 1 102 102 PHE CB C 13 40.28 0.10 . 1 . . 1124 . A 102 PHE CB . 34990 1 1205 . 1 . 1 102 102 PHE N N 15 120.11 0.10 . 1 . . 1129 . A 102 PHE N . 34990 1 1206 . 1 . 1 103 103 ALA H H 1 8.53 0.02 . 1 . . 1135 . A 103 ALA H . 34990 1 1207 . 1 . 1 103 103 ALA HA H 1 3.41 0.02 . 1 . . 1136 . A 103 ALA HA . 34990 1 1208 . 1 . 1 103 103 ALA HB1 H 1 1.55 0.02 . 1 . . 1137 . A 103 ALA HB1 . 34990 1 1209 . 1 . 1 103 103 ALA HB2 H 1 1.55 0.02 . 1 . . 1137 . A 103 ALA HB2 . 34990 1 1210 . 1 . 1 103 103 ALA HB3 H 1 1.55 0.02 . 1 . . 1137 . A 103 ALA HB3 . 34990 1 1211 . 1 . 1 103 103 ALA C C 13 179.56 0.10 . 1 . . 1132 . A 103 ALA C . 34990 1 1212 . 1 . 1 103 103 ALA CA C 13 54.59 0.10 . 1 . . 1133 . A 103 ALA CA . 34990 1 1213 . 1 . 1 103 103 ALA CB C 13 18.99 0.10 . 1 . . 1134 . A 103 ALA CB . 34990 1 1214 . 1 . 1 103 103 ALA N N 15 121.62 0.10 . 1 . . 1138 . A 103 ALA N . 34990 1 1215 . 1 . 1 104 104 GLU H H 1 8.05 0.02 . 1 . . 1143 . A 104 GLU H . 34990 1 1216 . 1 . 1 104 104 GLU HA H 1 3.85 0.02 . 1 . . 1144 . A 104 GLU HA . 34990 1 1217 . 1 . 1 104 104 GLU HB2 H 1 1.90 0.02 . 1 . . 1145 . A 104 GLU HB2 . 34990 1 1218 . 1 . 1 104 104 GLU HB3 H 1 2.03 0.02 . 1 . . 1146 . A 104 GLU HB3 . 34990 1 1219 . 1 . 1 104 104 GLU HG2 H 1 2.32 0.02 . 2 . . 1147 . A 104 GLU HG2 . 34990 1 1220 . 1 . 1 104 104 GLU HG3 H 1 2.04 0.02 . 2 . . 1148 . A 104 GLU HG3 . 34990 1 1221 . 1 . 1 104 104 GLU C C 13 179.56 0.10 . 1 . . 1139 . A 104 GLU C . 34990 1 1222 . 1 . 1 104 104 GLU CA C 13 59.13 0.10 . 1 . . 1140 . A 104 GLU CA . 34990 1 1223 . 1 . 1 104 104 GLU CB C 13 29.73 0.10 . 1 . . 1141 . A 104 GLU CB . 34990 1 1224 . 1 . 1 104 104 GLU CG C 13 36.20 0.10 . 1 . . 1142 . A 104 GLU CG . 34990 1 1225 . 1 . 1 104 104 GLU N N 15 119.91 0.10 . 1 . . 1149 . A 104 GLU N . 34990 1 1226 . 1 . 1 105 105 LYS H H 1 7.11 0.02 . 1 . . 1156 . A 105 LYS H . 34990 1 1227 . 1 . 1 105 105 LYS HA H 1 3.14 0.02 . 1 . . 1157 . A 105 LYS HA . 34990 1 1228 . 1 . 1 105 105 LYS HB2 H 1 1.74 0.02 . 1 . . 1158 . A 105 LYS HB2 . 34990 1 1229 . 1 . 1 105 105 LYS HB3 H 1 0.24 0.02 . 1 . . 1159 . A 105 LYS HB3 . 34990 1 1230 . 1 . 1 105 105 LYS HG2 H 1 0.61 0.02 . 2 . . 1164 . A 105 LYS HG2 . 34990 1 1231 . 1 . 1 105 105 LYS HG3 H 1 -0.19 0.02 . 2 . . 1165 . A 105 LYS HG3 . 34990 1 1232 . 1 . 1 105 105 LYS HD2 H 1 0.78 0.02 . 1 . . 1160 . A 105 LYS HD2 . 34990 1 1233 . 1 . 1 105 105 LYS HD3 H 1 0.90 0.02 . 1 . . 1161 . A 105 LYS HD3 . 34990 1 1234 . 1 . 1 105 105 LYS HE2 H 1 2.38 0.02 . 2 . . 1162 . A 105 LYS HE2 . 34990 1 1235 . 1 . 1 105 105 LYS HE3 H 1 2.25 0.02 . 2 . . 1163 . A 105 LYS HE3 . 34990 1 1236 . 1 . 1 105 105 LYS C C 13 175.51 0.10 . 1 . . 1150 . A 105 LYS C . 34990 1 1237 . 1 . 1 105 105 LYS CA C 13 56.25 0.10 . 1 . . 1151 . A 105 LYS CA . 34990 1 1238 . 1 . 1 105 105 LYS CB C 13 29.80 0.10 . 1 . . 1152 . A 105 LYS CB . 34990 1 1239 . 1 . 1 105 105 LYS CG C 13 22.54 0.10 . 1 . . 1155 . A 105 LYS CG . 34990 1 1240 . 1 . 1 105 105 LYS CD C 13 26.89 0.10 . 1 . . 1153 . A 105 LYS CD . 34990 1 1241 . 1 . 1 105 105 LYS CE C 13 41.73 0.10 . 1 . . 1154 . A 105 LYS CE . 34990 1 1242 . 1 . 1 105 105 LYS N N 15 118.92 0.10 . 1 . . 1166 . A 105 LYS N . 34990 1 1243 . 1 . 1 106 106 PHE H H 1 7.44 0.02 . 1 . . 1172 . A 106 PHE H . 34990 1 1244 . 1 . 1 106 106 PHE HA H 1 3.30 0.02 . 1 . . 1173 . A 106 PHE HA . 34990 1 1245 . 1 . 1 106 106 PHE HB2 H 1 2.93 0.02 . 1 . . 1174 . A 106 PHE HB2 . 34990 1 1246 . 1 . 1 106 106 PHE HB3 H 1 2.47 0.02 . 1 . . 1175 . A 106 PHE HB3 . 34990 1 1247 . 1 . 1 106 106 PHE HD1 H 1 6.80 0.02 . 3 . . 1177 . A 106 PHE HD1 . 34990 1 1248 . 1 . 1 106 106 PHE HD2 H 1 6.80 0.02 . 3 . . 1177 . A 106 PHE HD2 . 34990 1 1249 . 1 . 1 106 106 PHE HE1 H 1 6.38 0.02 . 3 . . 1178 . A 106 PHE HE1 . 34990 1 1250 . 1 . 1 106 106 PHE HE2 H 1 6.38 0.02 . 3 . . 1178 . A 106 PHE HE2 . 34990 1 1251 . 1 . 1 106 106 PHE C C 13 177.78 0.10 . 1 . . 1167 . A 106 PHE C . 34990 1 1252 . 1 . 1 106 106 PHE CA C 13 61.77 0.10 . 1 . . 1168 . A 106 PHE CA . 34990 1 1253 . 1 . 1 106 106 PHE CB C 13 38.66 0.10 . 1 . . 1169 . A 106 PHE CB . 34990 1 1254 . 1 . 1 106 106 PHE CD1 C 13 132.69 0.10 . 1 . . 1170 . A 106 PHE CD1 . 34990 1 1255 . 1 . 1 106 106 PHE CD2 C 13 132.69 0.10 . 1 . . 1170 . A 106 PHE CD2 . 34990 1 1256 . 1 . 1 106 106 PHE CE1 C 13 130.60 0.10 . 1 . . 1171 . A 106 PHE CE1 . 34990 1 1257 . 1 . 1 106 106 PHE N N 15 121.05 0.10 . 1 . . 1176 . A 106 PHE N . 34990 1 1258 . 1 . 1 107 107 GLN H H 1 7.55 0.02 . 1 . . 1183 . A 107 GLN H . 34990 1 1259 . 1 . 1 107 107 GLN HA H 1 4.01 0.02 . 1 . . 1184 . A 107 GLN HA . 34990 1 1260 . 1 . 1 107 107 GLN HB2 H 1 2.27 0.02 . 1 . . 1185 . A 107 GLN HB2 . 34990 1 1261 . 1 . 1 107 107 GLN HB3 H 1 2.06 0.02 . 1 . . 1186 . A 107 GLN HB3 . 34990 1 1262 . 1 . 1 107 107 GLN HG2 H 1 2.54 0.02 . 1 . . 1189 . A 107 GLN HG2 . 34990 1 1263 . 1 . 1 107 107 GLN HG3 H 1 2.47 0.02 . 1 . . 1190 . A 107 GLN HG3 . 34990 1 1264 . 1 . 1 107 107 GLN HE21 H 1 7.64 0.02 . 1 . . 1187 . A 107 GLN HE21 . 34990 1 1265 . 1 . 1 107 107 GLN HE22 H 1 6.96 0.02 . 1 . . 1188 . A 107 GLN HE22 . 34990 1 1266 . 1 . 1 107 107 GLN C C 13 177.91 0.10 . 1 . . 1179 . A 107 GLN C . 34990 1 1267 . 1 . 1 107 107 GLN CA C 13 58.45 0.10 . 1 . . 1180 . A 107 GLN CA . 34990 1 1268 . 1 . 1 107 107 GLN CB C 13 28.14 0.10 . 1 . . 1181 . A 107 GLN CB . 34990 1 1269 . 1 . 1 107 107 GLN CG C 13 33.24 0.10 . 1 . . 1182 . A 107 GLN CG . 34990 1 1270 . 1 . 1 107 107 GLN N N 15 115.03 0.10 . 1 . . 1191 . A 107 GLN N . 34990 1 1271 . 1 . 1 107 107 GLN NE2 N 15 111.67 0.10 . 1 . . 1192 . A 107 GLN NE2 . 34990 1 1272 . 1 . 1 108 108 GLU H H 1 7.51 0.02 . 1 . . 1197 . A 108 GLU H . 34990 1 1273 . 1 . 1 108 108 GLU HA H 1 3.72 0.02 . 1 . . 1198 . A 108 GLU HA . 34990 1 1274 . 1 . 1 108 108 GLU HB2 H 1 1.58 0.02 . 2 . . 1199 . A 108 GLU HB2 . 34990 1 1275 . 1 . 1 108 108 GLU HB3 H 1 1.33 0.02 . 2 . . 1200 . A 108 GLU HB3 . 34990 1 1276 . 1 . 1 108 108 GLU HG2 H 1 2.04 0.02 . 2 . . 1201 . A 108 GLU HG2 . 34990 1 1277 . 1 . 1 108 108 GLU HG3 H 1 1.61 0.02 . 2 . . 1202 . A 108 GLU HG3 . 34990 1 1278 . 1 . 1 108 108 GLU C C 13 179.84 0.10 . 1 . . 1193 . A 108 GLU C . 34990 1 1279 . 1 . 1 108 108 GLU CA C 13 59.03 0.10 . 1 . . 1194 . A 108 GLU CA . 34990 1 1280 . 1 . 1 108 108 GLU CB C 13 29.07 0.10 . 1 . . 1195 . A 108 GLU CB . 34990 1 1281 . 1 . 1 108 108 GLU CG C 13 35.31 0.10 . 1 . . 1196 . A 108 GLU CG . 34990 1 1282 . 1 . 1 108 108 GLU N N 15 120.55 0.10 . 1 . . 1203 . A 108 GLU N . 34990 1 1283 . 1 . 1 109 109 PHE H H 1 7.92 0.02 . 1 . . 1209 . A 109 PHE H . 34990 1 1284 . 1 . 1 109 109 PHE HA H 1 4.12 0.02 . 1 . . 1210 . A 109 PHE HA . 34990 1 1285 . 1 . 1 109 109 PHE HB2 H 1 2.30 0.02 . 2 . . 1211 . A 109 PHE HB2 . 34990 1 1286 . 1 . 1 109 109 PHE HB3 H 1 2.22 0.02 . 2 . . 1212 . A 109 PHE HB3 . 34990 1 1287 . 1 . 1 109 109 PHE HD1 H 1 5.93 0.02 . 3 . . 1214 . A 109 PHE HD1 . 34990 1 1288 . 1 . 1 109 109 PHE HD2 H 1 5.93 0.02 . 3 . . 1214 . A 109 PHE HD2 . 34990 1 1289 . 1 . 1 109 109 PHE HE1 H 1 6.23 0.02 . 3 . . 1215 . A 109 PHE HE1 . 34990 1 1290 . 1 . 1 109 109 PHE HE2 H 1 6.23 0.02 . 3 . . 1215 . A 109 PHE HE2 . 34990 1 1291 . 1 . 1 109 109 PHE C C 13 177.56 0.10 . 1 . . 1204 . A 109 PHE C . 34990 1 1292 . 1 . 1 109 109 PHE CA C 13 57.77 0.10 . 1 . . 1205 . A 109 PHE CA . 34990 1 1293 . 1 . 1 109 109 PHE CB C 13 36.53 0.10 . 1 . . 1206 . A 109 PHE CB . 34990 1 1294 . 1 . 1 109 109 PHE CD1 C 13 130.85 0.10 . 1 . . 1207 . A 109 PHE CD1 . 34990 1 1295 . 1 . 1 109 109 PHE CD2 C 13 130.85 0.10 . 1 . . 1207 . A 109 PHE CD2 . 34990 1 1296 . 1 . 1 109 109 PHE CE1 C 13 130.06 0.10 . 1 . . 1208 . A 109 PHE CE1 . 34990 1 1297 . 1 . 1 109 109 PHE CE2 C 13 130.06 0.10 . 1 . . 1208 . A 109 PHE CE2 . 34990 1 1298 . 1 . 1 109 109 PHE N N 15 120.05 0.10 . 1 . . 1213 . A 109 PHE N . 34990 1 1299 . 1 . 1 110 110 LYS H H 1 8.56 0.02 . 1 . . 1222 . A 110 LYS H . 34990 1 1300 . 1 . 1 110 110 LYS HA H 1 3.72 0.02 . 1 . . 1223 . A 110 LYS HA . 34990 1 1301 . 1 . 1 110 110 LYS HB2 H 1 1.83 0.02 . 2 . . 1227 . A 110 LYS HB2 . 34990 1 1302 . 1 . 1 110 110 LYS HB3 H 1 1.83 0.02 . 2 . . 1227 . A 110 LYS HB3 . 34990 1 1303 . 1 . 1 110 110 LYS HG2 H 1 1.66 0.02 . 2 . . 1224 . A 110 LYS HG2 . 34990 1 1304 . 1 . 1 110 110 LYS HG3 H 1 1.44 0.02 . 2 . . 1225 . A 110 LYS HG3 . 34990 1 1305 . 1 . 1 110 110 LYS HD2 H 1 1.80 0.02 . 2 . . 1228 . A 110 LYS HD2 . 34990 1 1306 . 1 . 1 110 110 LYS HD3 H 1 1.80 0.02 . 2 . . 1228 . A 110 LYS HD3 . 34990 1 1307 . 1 . 1 110 110 LYS HE2 H 1 3.22 0.02 . 2 . . 1229 . A 110 LYS HE2 . 34990 1 1308 . 1 . 1 110 110 LYS HE3 H 1 3.22 0.02 . 2 . . 1229 . A 110 LYS HE3 . 34990 1 1309 . 1 . 1 110 110 LYS C C 13 178.78 0.10 . 1 . . 1216 . A 110 LYS C . 34990 1 1310 . 1 . 1 110 110 LYS CA C 13 60.09 0.10 . 1 . . 1217 . A 110 LYS CA . 34990 1 1311 . 1 . 1 110 110 LYS CB C 13 32.42 0.10 . 1 . . 1218 . A 110 LYS CB . 34990 1 1312 . 1 . 1 110 110 LYS CG C 13 24.70 0.10 . 1 . . 1221 . A 110 LYS CG . 34990 1 1313 . 1 . 1 110 110 LYS CD C 13 30.20 0.10 . 1 . . 1219 . A 110 LYS CD . 34990 1 1314 . 1 . 1 110 110 LYS CE C 13 42.71 0.10 . 1 . . 1220 . A 110 LYS CE . 34990 1 1315 . 1 . 1 110 110 LYS N N 15 123.31 0.10 . 1 . . 1226 . A 110 LYS N . 34990 1 1316 . 1 . 1 111 111 GLU H H 1 7.80 0.02 . 1 . . 1234 . A 111 GLU H . 34990 1 1317 . 1 . 1 111 111 GLU HA H 1 4.33 0.02 . 1 . . 1235 . A 111 GLU HA . 34990 1 1318 . 1 . 1 111 111 GLU HB2 H 1 2.08 0.02 . 1 . . 1236 . A 111 GLU HB2 . 34990 1 1319 . 1 . 1 111 111 GLU HB3 H 1 2.01 0.02 . 1 . . 1237 . A 111 GLU HB3 . 34990 1 1320 . 1 . 1 111 111 GLU HG2 H 1 2.37 0.02 . 2 . . 1239 . A 111 GLU HG2 . 34990 1 1321 . 1 . 1 111 111 GLU HG3 H 1 2.37 0.02 . 2 . . 1239 . A 111 GLU HG3 . 34990 1 1322 . 1 . 1 111 111 GLU C C 13 178.87 0.10 . 1 . . 1230 . A 111 GLU C . 34990 1 1323 . 1 . 1 111 111 GLU CA C 13 58.23 0.10 . 1 . . 1231 . A 111 GLU CA . 34990 1 1324 . 1 . 1 111 111 GLU CB C 13 28.90 0.10 . 1 . . 1232 . A 111 GLU CB . 34990 1 1325 . 1 . 1 111 111 GLU CG C 13 35.66 0.10 . 1 . . 1233 . A 111 GLU CG . 34990 1 1326 . 1 . 1 111 111 GLU N N 15 118.86 0.10 . 1 . . 1238 . A 111 GLU N . 34990 1 1327 . 1 . 1 112 112 ALA H H 1 7.93 0.02 . 1 . . 1243 . A 112 ALA H . 34990 1 1328 . 1 . 1 112 112 ALA HA H 1 4.14 0.02 . 1 . . 1244 . A 112 ALA HA . 34990 1 1329 . 1 . 1 112 112 ALA HB1 H 1 1.53 0.02 . 1 . . 1245 . A 112 ALA HB1 . 34990 1 1330 . 1 . 1 112 112 ALA HB2 H 1 1.53 0.02 . 1 . . 1245 . A 112 ALA HB2 . 34990 1 1331 . 1 . 1 112 112 ALA HB3 H 1 1.53 0.02 . 1 . . 1245 . A 112 ALA HB3 . 34990 1 1332 . 1 . 1 112 112 ALA C C 13 180.88 0.10 . 1 . . 1240 . A 112 ALA C . 34990 1 1333 . 1 . 1 112 112 ALA CA C 13 55.10 0.10 . 1 . . 1241 . A 112 ALA CA . 34990 1 1334 . 1 . 1 112 112 ALA CB C 13 17.77 0.10 . 1 . . 1242 . A 112 ALA CB . 34990 1 1335 . 1 . 1 112 112 ALA N N 15 122.70 0.10 . 1 . . 1246 . A 112 ALA N . 34990 1 1336 . 1 . 1 113 113 ALA H H 1 8.42 0.02 . 1 . . 1250 . A 113 ALA H . 34990 1 1337 . 1 . 1 113 113 ALA HA H 1 4.40 0.02 . 1 . . 1251 . A 113 ALA HA . 34990 1 1338 . 1 . 1 113 113 ALA HB1 H 1 1.57 0.02 . 1 . . 1252 . A 113 ALA HB1 . 34990 1 1339 . 1 . 1 113 113 ALA HB2 H 1 1.57 0.02 . 1 . . 1252 . A 113 ALA HB2 . 34990 1 1340 . 1 . 1 113 113 ALA HB3 H 1 1.57 0.02 . 1 . . 1252 . A 113 ALA HB3 . 34990 1 1341 . 1 . 1 113 113 ALA C C 13 180.15 0.10 . 1 . . 1247 . A 113 ALA C . 34990 1 1342 . 1 . 1 113 113 ALA CA C 13 54.50 0.10 . 1 . . 1248 . A 113 ALA CA . 34990 1 1343 . 1 . 1 113 113 ALA CB C 13 18.07 0.10 . 1 . . 1249 . A 113 ALA CB . 34990 1 1344 . 1 . 1 113 113 ALA N N 15 121.61 0.10 . 1 . . 1253 . A 113 ALA N . 34990 1 1345 . 1 . 1 114 114 ARG H H 1 8.18 0.02 . 1 . . 1259 . A 114 ARG H . 34990 1 1346 . 1 . 1 114 114 ARG HA H 1 3.98 0.02 . 1 . . 1260 . A 114 ARG HA . 34990 1 1347 . 1 . 1 114 114 ARG HB2 H 1 2.23 0.02 . 1 . . 1261 . A 114 ARG HB2 . 34990 1 1348 . 1 . 1 114 114 ARG HB3 H 1 1.97 0.02 . 1 . . 1262 . A 114 ARG HB3 . 34990 1 1349 . 1 . 1 114 114 ARG HD2 H 1 3.20 0.02 . 2 . . 1263 . A 114 ARG HD2 . 34990 1 1350 . 1 . 1 114 114 ARG HD3 H 1 3.39 0.02 . 2 . . 1264 . A 114 ARG HD3 . 34990 1 1351 . 1 . 1 114 114 ARG C C 13 178.38 0.10 . 1 . . 1254 . A 114 ARG C . 34990 1 1352 . 1 . 1 114 114 ARG CA C 13 59.44 0.10 . 1 . . 1255 . A 114 ARG CA . 34990 1 1353 . 1 . 1 114 114 ARG CB C 13 30.33 0.10 . 1 . . 1256 . A 114 ARG CB . 34990 1 1354 . 1 . 1 114 114 ARG CG C 13 27.34 0.10 . 1 . . 1258 . A 114 ARG CG . 34990 1 1355 . 1 . 1 114 114 ARG CD C 13 43.00 0.10 . 1 . . 1257 . A 114 ARG CD . 34990 1 1356 . 1 . 1 114 114 ARG N N 15 120.89 0.10 . 1 . . 1265 . A 114 ARG N . 34990 1 1357 . 1 . 1 115 115 LEU H H 1 8.23 0.02 . 1 . . 1272 . A 115 LEU H . 34990 1 1358 . 1 . 1 115 115 LEU HA H 1 4.13 0.02 . 1 . . 1273 . A 115 LEU HA . 34990 1 1359 . 1 . 1 115 115 LEU HB2 H 1 1.82 0.02 . 1 . . 1274 . A 115 LEU HB2 . 34990 1 1360 . 1 . 1 115 115 LEU HB3 H 1 1.61 0.02 . 1 . . 1275 . A 115 LEU HB3 . 34990 1 1361 . 1 . 1 115 115 LEU HG H 1 1.74 0.02 . 1 . . 1278 . A 115 LEU HG . 34990 1 1362 . 1 . 1 115 115 LEU HD11 H 1 0.93 0.02 . 2 . . 1276 . A 115 LEU HD11 . 34990 1 1363 . 1 . 1 115 115 LEU HD12 H 1 0.93 0.02 . 2 . . 1276 . A 115 LEU HD12 . 34990 1 1364 . 1 . 1 115 115 LEU HD13 H 1 0.93 0.02 . 2 . . 1276 . A 115 LEU HD13 . 34990 1 1365 . 1 . 1 115 115 LEU HD21 H 1 0.90 0.02 . 2 . . 1277 . A 115 LEU HD21 . 34990 1 1366 . 1 . 1 115 115 LEU HD22 H 1 0.90 0.02 . 2 . . 1277 . A 115 LEU HD22 . 34990 1 1367 . 1 . 1 115 115 LEU HD23 H 1 0.90 0.02 . 2 . . 1277 . A 115 LEU HD23 . 34990 1 1368 . 1 . 1 115 115 LEU C C 13 178.78 0.10 . 1 . . 1266 . A 115 LEU C . 34990 1 1369 . 1 . 1 115 115 LEU CA C 13 57.00 0.10 . 1 . . 1267 . A 115 LEU CA . 34990 1 1370 . 1 . 1 115 115 LEU CB C 13 42.00 0.10 . 1 . . 1268 . A 115 LEU CB . 34990 1 1371 . 1 . 1 115 115 LEU CG C 13 27.11 0.10 . 1 . . 1271 . A 115 LEU CG . 34990 1 1372 . 1 . 1 115 115 LEU CD1 C 13 25.04 0.10 . 2 . . 1269 . A 115 LEU CD1 . 34990 1 1373 . 1 . 1 115 115 LEU CD2 C 13 23.34 0.10 . 2 . . 1270 . A 115 LEU CD2 . 34990 1 1374 . 1 . 1 115 115 LEU N N 15 120.06 0.10 . 1 . . 1279 . A 115 LEU N . 34990 1 1375 . 1 . 1 116 116 ALA H H 1 7.97 0.02 . 1 . . 1283 . A 116 ALA H . 34990 1 1376 . 1 . 1 116 116 ALA HA H 1 4.25 0.02 . 1 . . 1284 . A 116 ALA HA . 34990 1 1377 . 1 . 1 116 116 ALA HB1 H 1 1.57 0.02 . 1 . . 1285 . A 116 ALA HB1 . 34990 1 1378 . 1 . 1 116 116 ALA HB2 H 1 1.57 0.02 . 1 . . 1285 . A 116 ALA HB2 . 34990 1 1379 . 1 . 1 116 116 ALA HB3 H 1 1.57 0.02 . 1 . . 1285 . A 116 ALA HB3 . 34990 1 1380 . 1 . 1 116 116 ALA C C 13 179.15 0.10 . 1 . . 1280 . A 116 ALA C . 34990 1 1381 . 1 . 1 116 116 ALA CA C 13 53.98 0.10 . 1 . . 1281 . A 116 ALA CA . 34990 1 1382 . 1 . 1 116 116 ALA CB C 13 18.71 0.10 . 1 . . 1282 . A 116 ALA CB . 34990 1 1383 . 1 . 1 116 116 ALA N N 15 121.50 0.10 . 1 . . 1286 . A 116 ALA N . 34990 1 1384 . 1 . 1 117 117 LYS H H 1 7.83 0.02 . 1 . . 1293 . A 117 LYS H . 34990 1 1385 . 1 . 1 117 117 LYS HA H 1 4.30 0.02 . 1 . . 1294 . A 117 LYS HA . 34990 1 1386 . 1 . 1 117 117 LYS HB2 H 1 2.04 0.02 . 2 . . 1295 . A 117 LYS HB2 . 34990 1 1387 . 1 . 1 117 117 LYS HB3 H 1 1.93 0.02 . 2 . . 1296 . A 117 LYS HB3 . 34990 1 1388 . 1 . 1 117 117 LYS HG2 H 1 1.55 0.02 . 2 . . 1300 . A 117 LYS HG2 . 34990 1 1389 . 1 . 1 117 117 LYS HG3 H 1 1.55 0.02 . 2 . . 1300 . A 117 LYS HG3 . 34990 1 1390 . 1 . 1 117 117 LYS HD2 H 1 1.76 0.02 . 2 . . 1298 . A 117 LYS HD2 . 34990 1 1391 . 1 . 1 117 117 LYS HD3 H 1 1.76 0.02 . 2 . . 1298 . A 117 LYS HD3 . 34990 1 1392 . 1 . 1 117 117 LYS HE2 H 1 3.06 0.02 . 2 . . 1299 . A 117 LYS HE2 . 34990 1 1393 . 1 . 1 117 117 LYS HE3 H 1 3.06 0.02 . 2 . . 1299 . A 117 LYS HE3 . 34990 1 1394 . 1 . 1 117 117 LYS C C 13 177.78 0.10 . 1 . . 1287 . A 117 LYS C . 34990 1 1395 . 1 . 1 117 117 LYS CA C 13 57.21 0.10 . 1 . . 1288 . A 117 LYS CA . 34990 1 1396 . 1 . 1 117 117 LYS CB C 13 32.75 0.10 . 1 . . 1289 . A 117 LYS CB . 34990 1 1397 . 1 . 1 117 117 LYS CG C 13 24.79 0.10 . 1 . . 1292 . A 117 LYS CG . 34990 1 1398 . 1 . 1 117 117 LYS CD C 13 29.09 0.10 . 1 . . 1290 . A 117 LYS CD . 34990 1 1399 . 1 . 1 117 117 LYS CE C 13 42.20 0.10 . 1 . . 1291 . A 117 LYS CE . 34990 1 1400 . 1 . 1 117 117 LYS N N 15 118.58 0.10 . 1 . . 1297 . A 117 LYS N . 34990 1 1401 . 1 . 1 118 118 GLU H H 1 8.16 0.02 . 1 . . 1305 . A 118 GLU H . 34990 1 1402 . 1 . 1 118 118 GLU HA H 1 4.23 0.02 . 1 . . 1306 . A 118 GLU HA . 34990 1 1403 . 1 . 1 118 118 GLU HB2 H 1 2.15 0.02 . 1 . . 1307 . A 118 GLU HB2 . 34990 1 1404 . 1 . 1 118 118 GLU HB3 H 1 2.06 0.02 . 1 . . 1308 . A 118 GLU HB3 . 34990 1 1405 . 1 . 1 118 118 GLU HG2 H 1 2.43 0.02 . 2 . . 1309 . A 118 GLU HG2 . 34990 1 1406 . 1 . 1 118 118 GLU HG3 H 1 2.31 0.02 . 2 . . 1310 . A 118 GLU HG3 . 34990 1 1407 . 1 . 1 118 118 GLU C C 13 177.12 0.10 . 1 . . 1301 . A 118 GLU C . 34990 1 1408 . 1 . 1 118 118 GLU CA C 13 57.52 0.10 . 1 . . 1302 . A 118 GLU CA . 34990 1 1409 . 1 . 1 118 118 GLU CB C 13 30.12 0.10 . 1 . . 1303 . A 118 GLU CB . 34990 1 1410 . 1 . 1 118 118 GLU CG C 13 36.45 0.10 . 1 . . 1304 . A 118 GLU CG . 34990 1 1411 . 1 . 1 118 118 GLU N N 15 120.28 0.10 . 1 . . 1311 . A 118 GLU N . 34990 1 1412 . 1 . 1 119 119 LYS H H 1 8.05 0.02 . 1 . . 1317 . A 119 LYS H . 34990 1 1413 . 1 . 1 119 119 LYS HA H 1 4.38 0.02 . 1 . . 1318 . A 119 LYS HA . 34990 1 1414 . 1 . 1 119 119 LYS HB2 H 1 1.85 0.02 . 2 . . 1319 . A 119 LYS HB2 . 34990 1 1415 . 1 . 1 119 119 LYS HB3 H 1 1.95 0.02 . 2 . . 1320 . A 119 LYS HB3 . 34990 1 1416 . 1 . 1 119 119 LYS HG2 H 1 1.53 0.02 . 2 . . 1324 . A 119 LYS HG2 . 34990 1 1417 . 1 . 1 119 119 LYS HG3 H 1 1.53 0.02 . 2 . . 1324 . A 119 LYS HG3 . 34990 1 1418 . 1 . 1 119 119 LYS HD2 H 1 1.72 0.02 . 2 . . 1322 . A 119 LYS HD2 . 34990 1 1419 . 1 . 1 119 119 LYS HD3 H 1 1.72 0.02 . 2 . . 1322 . A 119 LYS HD3 . 34990 1 1420 . 1 . 1 119 119 LYS HE2 H 1 3.04 0.02 . 2 . . 1323 . A 119 LYS HE2 . 34990 1 1421 . 1 . 1 119 119 LYS HE3 H 1 3.04 0.02 . 2 . . 1323 . A 119 LYS HE3 . 34990 1 1422 . 1 . 1 119 119 LYS C C 13 176.62 0.10 . 1 . . 1312 . A 119 LYS C . 34990 1 1423 . 1 . 1 119 119 LYS CA C 13 56.56 0.10 . 1 . . 1313 . A 119 LYS CA . 34990 1 1424 . 1 . 1 119 119 LYS CB C 13 32.95 0.10 . 1 . . 1314 . A 119 LYS CB . 34990 1 1425 . 1 . 1 119 119 LYS CG C 13 24.80 0.10 . 1 . . 1316 . A 119 LYS CG . 34990 1 1426 . 1 . 1 119 119 LYS CD C 13 29.20 0.10 . 1 . . 1315 . A 119 LYS CD . 34990 1 1427 . 1 . 1 119 119 LYS N N 15 120.19 0.10 . 1 . . 1321 . A 119 LYS N . 34990 1 1428 . 1 . 1 120 120 SER H H 1 8.17 0.02 . 1 . . 1328 . A 120 SER H . 34990 1 1429 . 1 . 1 120 120 SER HA H 1 4.48 0.02 . 1 . . 1329 . A 120 SER HA . 34990 1 1430 . 1 . 1 120 120 SER HB2 H 1 3.95 0.02 . 2 . . 1331 . A 120 SER HB2 . 34990 1 1431 . 1 . 1 120 120 SER HB3 H 1 3.95 0.02 . 2 . . 1331 . A 120 SER HB3 . 34990 1 1432 . 1 . 1 120 120 SER C C 13 173.71 0.10 . 1 . . 1325 . A 120 SER C . 34990 1 1433 . 1 . 1 120 120 SER CA C 13 58.52 0.10 . 1 . . 1326 . A 120 SER CA . 34990 1 1434 . 1 . 1 120 120 SER CB C 13 64.00 0.10 . 1 . . 1327 . A 120 SER CB . 34990 1 1435 . 1 . 1 120 120 SER N N 15 116.92 0.10 . 1 . . 1330 . A 120 SER N . 34990 1 1436 . 1 . 1 121 121 GLN H H 1 7.96 0.02 . 1 . . 1336 . A 121 GLN H . 34990 1 1437 . 1 . 1 121 121 GLN HA H 1 4.21 0.02 . 1 . . 1337 . A 121 GLN HA . 34990 1 1438 . 1 . 1 121 121 GLN HB2 H 1 2.16 0.02 . 2 . . 1338 . A 121 GLN HB2 . 34990 1 1439 . 1 . 1 121 121 GLN HB3 H 1 1.97 0.02 . 2 . . 1339 . A 121 GLN HB3 . 34990 1 1440 . 1 . 1 121 121 GLN HG2 H 1 2.35 0.02 . 2 . . 1341 . A 121 GLN HG2 . 34990 1 1441 . 1 . 1 121 121 GLN HG3 H 1 2.35 0.02 . 2 . . 1341 . A 121 GLN HG3 . 34990 1 1442 . 1 . 1 121 121 GLN C C 13 180.56 0.10 . 1 . . 1332 . A 121 GLN C . 34990 1 1443 . 1 . 1 121 121 GLN CA C 13 57.53 0.10 . 1 . . 1333 . A 121 GLN CA . 34990 1 1444 . 1 . 1 121 121 GLN CB C 13 30.41 0.10 . 1 . . 1334 . A 121 GLN CB . 34990 1 1445 . 1 . 1 121 121 GLN CG C 13 34.34 0.10 . 1 . . 1335 . A 121 GLN CG . 34990 1 1446 . 1 . 1 121 121 GLN N N 15 126.75 0.10 . 1 . . 1340 . A 121 GLN N . 34990 1 stop_ save_