################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27626 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27626 1 2 '3D HNCO' . . . 27626 1 3 '3D HN(CA)CO' . . . 27626 1 4 '3D HN(CO)CA' . . . 27626 1 5 '3D HNCA' . . . 27626 1 6 '3D HN(COCA)CB' . . . 27626 1 7 '3D HNCACB' . . . 27626 1 8 '3D C(CO)NH' . . . 27626 1 9 '3D HBHA(CO)NH' . . . 27626 1 10 '3D H(CCO)NH' . . . 27626 1 11 '3D 1H-15N NOESY' . . . 27626 1 12 '2D 1H-13C HSQC aliphatic' . . . 27626 1 13 '2D 1H-13C HSQC aromatic' . . . 27626 1 14 '3D (H)CCH-TOCSY' . . . 27626 1 15 '3D H(C)CH-TOCSY' . . . 27626 1 17 '3D 1H-13C NOESY aromatic' . . . 27626 1 18 '3D HCACO' . . . 27626 1 19 '3D (HC)CO(CCO)NH' . . . 27626 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER HA H 1 3.792 0.010 . 1 . . . . . 857 S HA . 27626 1 2 . 1 1 1 1 SER HB2 H 1 3.896 0.010 . 2 . . . . . 857 S HB1 . 27626 1 3 . 1 1 1 1 SER HB3 H 1 3.778 0.010 . 2 . . . . . 857 S HB2 . 27626 1 4 . 1 1 1 1 SER C C 13 176.492 0.037 . 1 . . . . . 857 S C . 27626 1 5 . 1 1 1 1 SER CA C 13 57.968 0.056 . 1 . . . . . 857 S CA . 27626 1 6 . 1 1 1 1 SER CB C 13 65.945 0.055 . 1 . . . . . 857 S CB . 27626 1 7 . 1 1 2 2 ARG HA H 1 4.306 0.010 . 1 . . . . . 858 R HA . 27626 1 8 . 1 1 2 2 ARG HB2 H 1 1.863 0.010 . 2 . . . . . 858 R HB# . 27626 1 9 . 1 1 2 2 ARG HB3 H 1 1.863 0.010 . 2 . . . . . 858 R HB# . 27626 1 10 . 1 1 2 2 ARG HG2 H 1 1.639 0.011 . 2 . . . . . 858 R HG# . 27626 1 11 . 1 1 2 2 ARG HG3 H 1 1.639 0.011 . 2 . . . . . 858 R HG# . 27626 1 12 . 1 1 2 2 ARG HD2 H 1 3.214 0.010 . 2 . . . . . 858 R HD# . 27626 1 13 . 1 1 2 2 ARG HD3 H 1 3.214 0.010 . 2 . . . . . 858 R HD# . 27626 1 14 . 1 1 2 2 ARG C C 13 176.874 0.020 . 1 . . . . . 858 R C . 27626 1 15 . 1 1 2 2 ARG CA C 13 57.029 0.041 . 1 . . . . . 858 R CA . 27626 1 16 . 1 1 2 2 ARG CB C 13 30.438 0.040 . 1 . . . . . 858 R CB . 27626 1 17 . 1 1 2 2 ARG CG C 13 27.137 0.048 . 1 . . . . . 858 R CG . 27626 1 18 . 1 1 2 2 ARG CD C 13 43.327 0.040 . 1 . . . . . 858 R CD . 27626 1 19 . 1 1 2 2 ARG N N 15 123.726 0.060 . 1 . . . . . 858 R N . 27626 1 20 . 1 1 3 3 LEU H H 1 8.283 0.010 . 1 . . . . . 859 L HN . 27626 1 21 . 1 1 3 3 LEU HA H 1 4.282 0.010 . 1 . . . . . 859 L HA . 27626 1 22 . 1 1 3 3 LEU HB2 H 1 1.660 0.010 . 2 . . . . . 859 L HB1 . 27626 1 23 . 1 1 3 3 LEU HB3 H 1 1.560 0.010 . 2 . . . . . 859 L HB2 . 27626 1 24 . 1 1 3 3 LEU HG H 1 1.639 0.010 . 1 . . . . . 859 L HG . 27626 1 25 . 1 1 3 3 LEU HD11 H 1 0.874 0.010 . 2 . . . . . 859 L HD1# . 27626 1 26 . 1 1 3 3 LEU HD12 H 1 0.874 0.010 . 2 . . . . . 859 L HD1# . 27626 1 27 . 1 1 3 3 LEU HD13 H 1 0.874 0.010 . 2 . . . . . 859 L HD1# . 27626 1 28 . 1 1 3 3 LEU HD21 H 1 0.932 0.010 . 2 . . . . . 859 L HD2# . 27626 1 29 . 1 1 3 3 LEU HD22 H 1 0.932 0.010 . 2 . . . . . 859 L HD2# . 27626 1 30 . 1 1 3 3 LEU HD23 H 1 0.932 0.010 . 2 . . . . . 859 L HD2# . 27626 1 31 . 1 1 3 3 LEU C C 13 178.040 0.020 . 1 . . . . . 859 L C . 27626 1 32 . 1 1 3 3 LEU CA C 13 55.993 0.043 . 1 . . . . . 859 L CA . 27626 1 33 . 1 1 3 3 LEU CB C 13 42.192 0.056 . 1 . . . . . 859 L CB . 27626 1 34 . 1 1 3 3 LEU CG C 13 27.051 0.040 . 1 . . . . . 859 L CG . 27626 1 35 . 1 1 3 3 LEU CD1 C 13 23.520 0.044 . 2 . . . . . 859 L CD1 . 27626 1 36 . 1 1 3 3 LEU CD2 C 13 24.897 0.040 . 2 . . . . . 859 L CD2 . 27626 1 37 . 1 1 3 3 LEU N N 15 121.905 0.040 . 1 . . . . . 859 L N . 27626 1 38 . 1 1 4 4 ARG H H 1 8.226 0.010 . 1 . . . . . 860 R HN . 27626 1 39 . 1 1 4 4 ARG HA H 1 4.312 0.010 . 1 . . . . . 860 R HA . 27626 1 40 . 1 1 4 4 ARG HB2 H 1 1.932 0.017 . 2 . . . . . 860 R HB# . 27626 1 41 . 1 1 4 4 ARG HB3 H 1 1.932 0.017 . 2 . . . . . 860 R HB# . 27626 1 42 . 1 1 4 4 ARG HG2 H 1 1.685 0.020 . 2 . . . . . 860 R HG# . 27626 1 43 . 1 1 4 4 ARG HG3 H 1 1.685 0.020 . 2 . . . . . 860 R HG# . 27626 1 44 . 1 1 4 4 ARG HD2 H 1 3.214 0.020 . 2 . . . . . 860 R HD# . 27626 1 45 . 1 1 4 4 ARG HD3 H 1 3.214 0.020 . 2 . . . . . 860 R HD# . 27626 1 46 . 1 1 4 4 ARG C C 13 177.471 0.020 . 1 . . . . . 860 R C . 27626 1 47 . 1 1 4 4 ARG CA C 13 57.213 0.040 . 1 . . . . . 860 R CA . 27626 1 48 . 1 1 4 4 ARG CB C 13 30.311 0.031 . 1 . . . . . 860 R CB . 27626 1 49 . 1 1 4 4 ARG CG C 13 27.157 0.080 . 1 . . . . . 860 R CG . 27626 1 50 . 1 1 4 4 ARG CD C 13 43.309 0.080 . 1 . . . . . 860 R CD . 27626 1 51 . 1 1 4 4 ARG N N 15 121.920 0.040 . 1 . . . . . 860 R N . 27626 1 52 . 1 1 5 5 VAL H H 1 8.148 0.010 . 1 . . . . . 861 V HN . 27626 1 53 . 1 1 5 5 VAL HA H 1 3.931 0.010 . 1 . . . . . 861 V HA . 27626 1 54 . 1 1 5 5 VAL HB H 1 2.112 0.010 . 1 . . . . . 861 V HB . 27626 1 55 . 1 1 5 5 VAL HG11 H 1 1.016 0.011 . 2 . . . . . 861 V HG1# . 27626 1 56 . 1 1 5 5 VAL HG12 H 1 1.016 0.011 . 2 . . . . . 861 V HG1# . 27626 1 57 . 1 1 5 5 VAL HG13 H 1 1.016 0.011 . 2 . . . . . 861 V HG1# . 27626 1 58 . 1 1 5 5 VAL HG21 H 1 0.947 0.010 . 2 . . . . . 861 V HG2# . 27626 1 59 . 1 1 5 5 VAL HG22 H 1 0.947 0.010 . 2 . . . . . 861 V HG2# . 27626 1 60 . 1 1 5 5 VAL HG23 H 1 0.947 0.010 . 2 . . . . . 861 V HG2# . 27626 1 61 . 1 1 5 5 VAL C C 13 177.448 0.020 . 1 . . . . . 861 V C . 27626 1 62 . 1 1 5 5 VAL CA C 13 64.580 0.040 . 1 . . . . . 861 V CA . 27626 1 63 . 1 1 5 5 VAL CB C 13 32.247 0.045 . 1 . . . . . 861 V CB . 27626 1 64 . 1 1 5 5 VAL CG1 C 13 21.508 0.045 . 2 . . . . . 861 V CG1 . 27626 1 65 . 1 1 5 5 VAL CG2 C 13 21.062 0.046 . 2 . . . . . 861 V CG2 . 27626 1 66 . 1 1 5 5 VAL N N 15 121.321 0.040 . 1 . . . . . 861 V N . 27626 1 67 . 1 1 6 6 GLU H H 1 8.571 0.010 . 1 . . . . . 862 E HN . 27626 1 68 . 1 1 6 6 GLU HA H 1 4.151 0.010 . 1 . . . . . 862 E HA . 27626 1 69 . 1 1 6 6 GLU HB2 H 1 2.055 0.010 . 2 . . . . . 862 E HB# . 27626 1 70 . 1 1 6 6 GLU HB3 H 1 2.055 0.010 . 2 . . . . . 862 E HB# . 27626 1 71 . 1 1 6 6 GLU HG2 H 1 2.329 0.010 . 2 . . . . . 862 E HG1 . 27626 1 72 . 1 1 6 6 GLU HG3 H 1 2.310 0.010 . 2 . . . . . 862 E HG2 . 27626 1 73 . 1 1 6 6 GLU C C 13 178.051 0.020 . 1 . . . . . 862 E C . 27626 1 74 . 1 1 6 6 GLU CA C 13 58.557 0.040 . 1 . . . . . 862 E CA . 27626 1 75 . 1 1 6 6 GLU CB C 13 29.341 0.040 . 1 . . . . . 862 E CB . 27626 1 76 . 1 1 6 6 GLU CG C 13 36.230 0.040 . 1 . . . . . 862 E CG . 27626 1 77 . 1 1 6 6 GLU CD C 13 183.576 0.040 . 1 . . . . . 862 E CD . 27626 1 78 . 1 1 6 6 GLU N N 15 122.097 0.040 . 1 . . . . . 862 E N . 27626 1 79 . 1 1 7 7 TYR H H 1 8.092 0.010 . 1 . . . . . 863 Y HN . 27626 1 80 . 1 1 7 7 TYR HA H 1 4.353 0.010 . 1 . . . . . 863 Y HA . 27626 1 81 . 1 1 7 7 TYR HB2 H 1 3.175 0.010 . 2 . . . . . 863 Y HB1 . 27626 1 82 . 1 1 7 7 TYR HB3 H 1 3.129 0.010 . 2 . . . . . 863 Y HB2 . 27626 1 83 . 1 1 7 7 TYR HD1 H 1 7.132 0.010 . 3 . . . . . 863 Y HD# . 27626 1 84 . 1 1 7 7 TYR HD2 H 1 7.132 0.010 . 3 . . . . . 863 Y HD# . 27626 1 85 . 1 1 7 7 TYR HE1 H 1 6.832 0.010 . 3 . . . . . 863 Y HE# . 27626 1 86 . 1 1 7 7 TYR HE2 H 1 6.832 0.010 . 3 . . . . . 863 Y HE# . 27626 1 87 . 1 1 7 7 TYR C C 13 177.191 0.020 . 1 . . . . . 863 Y C . 27626 1 88 . 1 1 7 7 TYR CA C 13 60.251 0.053 . 1 . . . . . 863 Y CA . 27626 1 89 . 1 1 7 7 TYR CB C 13 38.324 0.040 . 1 . . . . . 863 Y CB . 27626 1 90 . 1 1 7 7 TYR CD2 C 13 133.031 0.080 . 1 . . . . . 863 Y CD2 . 27626 1 91 . 1 1 7 7 TYR CE2 C 13 118.330 0.080 . 1 . . . . . 863 Y CE2 . 27626 1 92 . 1 1 7 7 TYR N N 15 120.958 0.040 . 1 . . . . . 863 Y N . 27626 1 93 . 1 1 8 8 GLN H H 1 8.244 0.010 . 1 . . . . . 864 Q HN . 27626 1 94 . 1 1 8 8 GLN HA H 1 3.977 0.010 . 1 . . . . . 864 Q HA . 27626 1 95 . 1 1 8 8 GLN HB2 H 1 2.172 0.010 . 2 . . . . . 864 Q HB1 . 27626 1 96 . 1 1 8 8 GLN HB3 H 1 2.170 0.010 . 2 . . . . . 864 Q HB2 . 27626 1 97 . 1 1 8 8 GLN HG2 H 1 2.462 0.010 . 2 . . . . . 864 Q HG# . 27626 1 98 . 1 1 8 8 GLN HG3 H 1 2.462 0.010 . 2 . . . . . 864 Q HG# . 27626 1 99 . 1 1 8 8 GLN HE21 H 1 6.878 0.010 . 1 . . . . . 864 Q HE21 . 27626 1 100 . 1 1 8 8 GLN HE22 H 1 7.634 0.010 . 1 . . . . . 864 Q HE22 . 27626 1 101 . 1 1 8 8 GLN C C 13 178.139 0.020 . 1 . . . . . 864 Q C . 27626 1 102 . 1 1 8 8 GLN CA C 13 58.269 0.048 . 1 . . . . . 864 Q CA . 27626 1 103 . 1 1 8 8 GLN CB C 13 28.329 0.098 . 1 . . . . . 864 Q CB . 27626 1 104 . 1 1 8 8 GLN CG C 13 33.742 0.040 . 1 . . . . . 864 Q CG . 27626 1 105 . 1 1 8 8 GLN CD C 13 179.870 0.020 . 1 . . . . . 864 Q CD . 27626 1 106 . 1 1 8 8 GLN N N 15 119.580 0.042 . 1 . . . . . 864 Q N . 27626 1 107 . 1 1 8 8 GLN NE2 N 15 111.960 0.040 . 1 . . . . . 864 Q NE2 . 27626 1 108 . 1 1 9 9 ARG H H 1 8.238 0.010 . 1 . . . . . 865 R HN . 27626 1 109 . 1 1 9 9 ARG HA H 1 4.126 0.020 . 1 . . . . . 865 R HA . 27626 1 110 . 1 1 9 9 ARG HB2 H 1 1.923 0.020 . 2 . . . . . 865 R HB# . 27626 1 111 . 1 1 9 9 ARG HB3 H 1 1.923 0.020 . 2 . . . . . 865 R HB# . 27626 1 112 . 1 1 9 9 ARG HG2 H 1 1.683 0.020 . 2 . . . . . 865 R HG# . 27626 1 113 . 1 1 9 9 ARG HG3 H 1 1.683 0.020 . 2 . . . . . 865 R HG# . 27626 1 114 . 1 1 9 9 ARG HD2 H 1 3.214 0.020 . 2 . . . . . 865 R HD# . 27626 1 115 . 1 1 9 9 ARG HD3 H 1 3.214 0.020 . 2 . . . . . 865 R HD# . 27626 1 116 . 1 1 9 9 ARG C C 13 178.849 0.037 . 1 . . . . . 865 R C . 27626 1 117 . 1 1 9 9 ARG CA C 13 59.028 0.080 . 1 . . . . . 865 R CA . 27626 1 118 . 1 1 9 9 ARG CB C 13 30.228 0.080 . 1 . . . . . 865 R CB . 27626 1 119 . 1 1 9 9 ARG CG C 13 27.400 0.080 . 1 . . . . . 865 R CG . 27626 1 120 . 1 1 9 9 ARG CD C 13 43.458 0.080 . 1 . . . . . 865 R CD . 27626 1 121 . 1 1 9 9 ARG N N 15 119.902 0.040 . 1 . . . . . 865 R N . 27626 1 122 . 1 1 10 10 ARG H H 1 8.049 0.010 . 1 . . . . . 866 R HN . 27626 1 123 . 1 1 10 10 ARG HA H 1 4.127 0.010 . 1 . . . . . 866 R HA . 27626 1 124 . 1 1 10 10 ARG HB2 H 1 1.919 0.020 . 2 . . . . . 866 R HB# . 27626 1 125 . 1 1 10 10 ARG HB3 H 1 1.919 0.020 . 2 . . . . . 866 R HB# . 27626 1 126 . 1 1 10 10 ARG HG2 H 1 1.683 0.020 . 2 . . . . . 866 R HG# . 27626 1 127 . 1 1 10 10 ARG HG3 H 1 1.683 0.020 . 2 . . . . . 866 R HG# . 27626 1 128 . 1 1 10 10 ARG HD2 H 1 3.214 0.020 . 2 . . . . . 866 R HD# . 27626 1 129 . 1 1 10 10 ARG HD3 H 1 3.214 0.020 . 2 . . . . . 866 R HD# . 27626 1 130 . 1 1 10 10 ARG C C 13 178.535 0.020 . 1 . . . . . 866 R C . 27626 1 131 . 1 1 10 10 ARG CA C 13 59.002 0.063 . 1 . . . . . 866 R CA . 27626 1 132 . 1 1 10 10 ARG CB C 13 29.742 0.066 . 1 . . . . . 866 R CB . 27626 1 133 . 1 1 10 10 ARG CG C 13 27.429 0.040 . 1 . . . . . 866 R CG . 27626 1 134 . 1 1 10 10 ARG CD C 13 43.507 0.040 . 1 . . . . . 866 R CD . 27626 1 135 . 1 1 10 10 ARG N N 15 121.185 0.040 . 1 . . . . . 866 R N . 27626 1 136 . 1 1 11 11 LEU H H 1 8.051 0.010 . 1 . . . . . 867 L HN . 27626 1 137 . 1 1 11 11 LEU HA H 1 4.089 0.010 . 1 . . . . . 867 L HA . 27626 1 138 . 1 1 11 11 LEU HB2 H 1 1.681 0.010 . 2 . . . . . 867 L HB1 . 27626 1 139 . 1 1 11 11 LEU HB3 H 1 1.569 0.010 . 2 . . . . . 867 L HB2 . 27626 1 140 . 1 1 11 11 LEU HG H 1 1.518 0.010 . 1 . . . . . 867 L HG . 27626 1 141 . 1 1 11 11 LEU HD11 H 1 0.826 0.010 . 2 . . . . . 867 L HD# . 27626 1 142 . 1 1 11 11 LEU HD12 H 1 0.826 0.010 . 2 . . . . . 867 L HD# . 27626 1 143 . 1 1 11 11 LEU HD13 H 1 0.826 0.010 . 2 . . . . . 867 L HD# . 27626 1 144 . 1 1 11 11 LEU HD21 H 1 0.827 0.010 . 2 . . . . . 867 L HD# . 27626 1 145 . 1 1 11 11 LEU HD22 H 1 0.827 0.010 . 2 . . . . . 867 L HD# . 27626 1 146 . 1 1 11 11 LEU HD23 H 1 0.827 0.010 . 2 . . . . . 867 L HD# . 27626 1 147 . 1 1 11 11 LEU C C 13 179.749 0.020 . 1 . . . . . 867 L C . 27626 1 148 . 1 1 11 11 LEU CA C 13 57.623 0.040 . 1 . . . . . 867 L CA . 27626 1 149 . 1 1 11 11 LEU CB C 13 41.771 0.040 . 1 . . . . . 867 L CB . 27626 1 150 . 1 1 11 11 LEU CG C 13 26.828 0.040 . 1 . . . . . 867 L CG . 27626 1 151 . 1 1 11 11 LEU CD1 C 13 23.520 0.040 . 2 . . . . . 867 L CD1 . 27626 1 152 . 1 1 11 11 LEU CD2 C 13 24.792 0.043 . 2 . . . . . 867 L CD2 . 27626 1 153 . 1 1 11 11 LEU N N 15 121.488 0.040 . 1 . . . . . 867 L N . 27626 1 154 . 1 1 12 12 GLU H H 1 8.185 0.010 . 1 . . . . . 868 E HN . 27626 1 155 . 1 1 12 12 GLU HA H 1 4.117 0.010 . 1 . . . . . 868 E HA . 27626 1 156 . 1 1 12 12 GLU HB2 H 1 2.176 0.010 . 2 . . . . . 868 E HB1 . 27626 1 157 . 1 1 12 12 GLU HB3 H 1 2.077 0.010 . 2 . . . . . 868 E HB2 . 27626 1 158 . 1 1 12 12 GLU HG2 H 1 2.355 0.010 . 2 . . . . . 868 E HG# . 27626 1 159 . 1 1 12 12 GLU HG3 H 1 2.355 0.010 . 2 . . . . . 868 E HG# . 27626 1 160 . 1 1 12 12 GLU C C 13 178.544 0.020 . 1 . . . . . 868 E C . 27626 1 161 . 1 1 12 12 GLU CA C 13 58.952 0.040 . 1 . . . . . 868 E CA . 27626 1 162 . 1 1 12 12 GLU CB C 13 29.458 0.040 . 1 . . . . . 868 E CB . 27626 1 163 . 1 1 12 12 GLU CG C 13 36.103 0.040 . 1 . . . . . 868 E CG . 27626 1 164 . 1 1 12 12 GLU CD C 13 183.573 0.040 . 1 . . . . . 868 E CD . 27626 1 165 . 1 1 12 12 GLU N N 15 120.144 0.040 . 1 . . . . . 868 E N . 27626 1 166 . 1 1 13 13 ALA H H 1 8.100 0.010 . 1 . . . . . 869 A HN . 27626 1 167 . 1 1 13 13 ALA HA H 1 4.188 0.010 . 1 . . . . . 869 A HA . 27626 1 168 . 1 1 13 13 ALA HB1 H 1 1.551 0.010 . 1 . . . . . 869 A HB# . 27626 1 169 . 1 1 13 13 ALA HB2 H 1 1.551 0.010 . 1 . . . . . 869 A HB# . 27626 1 170 . 1 1 13 13 ALA HB3 H 1 1.551 0.010 . 1 . . . . . 869 A HB# . 27626 1 171 . 1 1 13 13 ALA C C 13 180.753 0.020 . 1 . . . . . 869 A C . 27626 1 172 . 1 1 13 13 ALA CA C 13 55.095 0.040 . 1 . . . . . 869 A CA . 27626 1 173 . 1 1 13 13 ALA CB C 13 17.959 0.040 . 1 . . . . . 869 A CB . 27626 1 174 . 1 1 13 13 ALA N N 15 122.232 0.040 . 1 . . . . . 869 A N . 27626 1 175 . 1 1 14 14 GLU H H 1 8.140 0.010 . 1 . . . . . 870 E HN . 27626 1 176 . 1 1 14 14 GLU HA H 1 4.216 0.010 . 1 . . . . . 870 E HA . 27626 1 177 . 1 1 14 14 GLU HB2 H 1 2.143 0.020 . 2 . . . . . 870 E HB1 . 27626 1 178 . 1 1 14 14 GLU HB3 H 1 2.069 0.020 . 2 . . . . . 870 E HB2 . 27626 1 179 . 1 1 14 14 GLU HG2 H 1 2.340 0.010 . 2 . . . . . 870 E HG# . 27626 1 180 . 1 1 14 14 GLU HG3 H 1 2.340 0.010 . 2 . . . . . 870 E HG# . 27626 1 181 . 1 1 14 14 GLU C C 13 178.339 0.020 . 1 . . . . . 870 E C . 27626 1 182 . 1 1 14 14 GLU CA C 13 58.845 0.055 . 1 . . . . . 870 E CA . 27626 1 183 . 1 1 14 14 GLU CB C 13 29.556 0.040 . 1 . . . . . 870 E CB . 27626 1 184 . 1 1 14 14 GLU CG C 13 35.845 0.080 . 1 . . . . . 870 E CG . 27626 1 185 . 1 1 14 14 GLU CD C 13 183.569 0.020 . 1 . . . . . 870 E CD . 27626 1 186 . 1 1 14 14 GLU N N 15 119.951 0.040 . 1 . . . . . 870 E N . 27626 1 187 . 1 1 15 15 ARG H H 1 8.132 0.010 . 1 . . . . . 871 R HN . 27626 1 188 . 1 1 15 15 ARG HA H 1 4.042 0.010 . 1 . . . . . 871 R HA . 27626 1 189 . 1 1 15 15 ARG HB2 H 1 1.990 0.010 . 2 . . . . . 871 R HB# . 27626 1 190 . 1 1 15 15 ARG HB3 H 1 1.990 0.010 . 2 . . . . . 871 R HB# . 27626 1 191 . 1 1 15 15 ARG HG2 H 1 1.660 0.020 . 2 . . . . . 871 R HG# . 27626 1 192 . 1 1 15 15 ARG HG3 H 1 1.660 0.020 . 2 . . . . . 871 R HG# . 27626 1 193 . 1 1 15 15 ARG HD2 H 1 3.227 0.020 . 2 . . . . . 871 R HD# . 27626 1 194 . 1 1 15 15 ARG HD3 H 1 3.227 0.020 . 2 . . . . . 871 R HD# . 27626 1 195 . 1 1 15 15 ARG C C 13 179.775 0.020 . 1 . . . . . 871 R C . 27626 1 196 . 1 1 15 15 ARG CA C 13 59.627 0.040 . 1 . . . . . 871 R CA . 27626 1 197 . 1 1 15 15 ARG CB C 13 29.891 0.081 . 1 . . . . . 871 R CB . 27626 1 198 . 1 1 15 15 ARG CG C 13 27.310 0.080 . 1 . . . . . 871 R CG . 27626 1 199 . 1 1 15 15 ARG CD C 13 43.404 0.080 . 1 . . . . . 871 R CD . 27626 1 200 . 1 1 15 15 ARG N N 15 120.026 0.040 . 1 . . . . . 871 R N . 27626 1 201 . 1 1 16 16 MET H H 1 8.197 0.010 . 1 . . . . . 872 M HN . 27626 1 202 . 1 1 16 16 MET HA H 1 4.259 0.010 . 1 . . . . . 872 M HA . 27626 1 203 . 1 1 16 16 MET HB2 H 1 2.192 0.010 . 2 . . . . . 872 M HB# . 27626 1 204 . 1 1 16 16 MET HB3 H 1 2.192 0.010 . 2 . . . . . 872 M HB# . 27626 1 205 . 1 1 16 16 MET HG2 H 1 2.603 0.010 . 2 . . . . . 872 M HG1 . 27626 1 206 . 1 1 16 16 MET HG3 H 1 2.763 0.010 . 2 . . . . . 872 M HG2 . 27626 1 207 . 1 1 16 16 MET HE1 H 1 2.112 0.020 . 1 . . . . . 872 M HE# . 27626 1 208 . 1 1 16 16 MET HE2 H 1 2.112 0.020 . 1 . . . . . 872 M HE# . 27626 1 209 . 1 1 16 16 MET HE3 H 1 2.112 0.020 . 1 . . . . . 872 M HE# . 27626 1 210 . 1 1 16 16 MET C C 13 178.263 0.020 . 1 . . . . . 872 M C . 27626 1 211 . 1 1 16 16 MET CA C 13 58.407 0.054 . 1 . . . . . 872 M CA . 27626 1 212 . 1 1 16 16 MET CB C 13 32.489 0.040 . 1 . . . . . 872 M CB . 27626 1 213 . 1 1 16 16 MET CG C 13 32.270 0.058 . 1 . . . . . 872 M CG . 27626 1 214 . 1 1 16 16 MET CE C 13 16.965 0.080 . 1 . . . . . 872 M CE . 27626 1 215 . 1 1 16 16 MET N N 15 119.057 0.040 . 1 . . . . . 872 M N . 27626 1 216 . 1 1 17 17 ARG H H 1 8.066 0.010 . 1 . . . . . 873 R HN . 27626 1 217 . 1 1 17 17 ARG HA H 1 4.202 0.010 . 1 . . . . . 873 R HA . 27626 1 218 . 1 1 17 17 ARG HD2 H 1 3.246 0.020 . 2 . . . . . 873 R HD# . 27626 1 219 . 1 1 17 17 ARG HD3 H 1 3.246 0.020 . 2 . . . . . 873 R HD# . 27626 1 220 . 1 1 17 17 ARG C C 13 179.018 0.020 . 1 . . . . . 873 R C . 27626 1 221 . 1 1 17 17 ARG CA C 13 59.213 0.040 . 1 . . . . . 873 R CA . 27626 1 222 . 1 1 17 17 ARG CB C 13 29.924 0.040 . 1 . . . . . 873 R CB . 27626 1 223 . 1 1 17 17 ARG CG C 13 27.034 0.080 . 1 . . . . . 873 R CG . 27626 1 224 . 1 1 17 17 ARG CD C 13 43.102 0.080 . 1 . . . . . 873 R CD . 27626 1 225 . 1 1 17 17 ARG N N 15 121.929 0.040 . 1 . . . . . 873 R N . 27626 1 226 . 1 1 18 18 LEU H H 1 8.218 0.010 . 1 . . . . . 874 L HN . 27626 1 227 . 1 1 18 18 LEU HA H 1 4.099 0.010 . 1 . . . . . 874 L HA . 27626 1 228 . 1 1 18 18 LEU HB2 H 1 1.594 0.010 . 2 . . . . . 874 L HB1 . 27626 1 229 . 1 1 18 18 LEU HB3 H 1 1.837 0.015 . 2 . . . . . 874 L HB2 . 27626 1 230 . 1 1 18 18 LEU HG H 1 1.778 0.010 . 1 . . . . . 874 L HG . 27626 1 231 . 1 1 18 18 LEU HD11 H 1 0.907 0.010 . 2 . . . . . 874 L HD1# . 27626 1 232 . 1 1 18 18 LEU HD12 H 1 0.907 0.010 . 2 . . . . . 874 L HD1# . 27626 1 233 . 1 1 18 18 LEU HD13 H 1 0.907 0.010 . 2 . . . . . 874 L HD1# . 27626 1 234 . 1 1 18 18 LEU HD21 H 1 0.931 0.010 . 2 . . . . . 874 L HD2# . 27626 1 235 . 1 1 18 18 LEU HD22 H 1 0.931 0.010 . 2 . . . . . 874 L HD2# . 27626 1 236 . 1 1 18 18 LEU HD23 H 1 0.931 0.010 . 2 . . . . . 874 L HD2# . 27626 1 237 . 1 1 18 18 LEU C C 13 179.690 0.020 . 1 . . . . . 874 L C . 27626 1 238 . 1 1 18 18 LEU CA C 13 57.783 0.040 . 1 . . . . . 874 L CA . 27626 1 239 . 1 1 18 18 LEU CB C 13 41.700 0.094 . 1 . . . . . 874 L CB . 27626 1 240 . 1 1 18 18 LEU CG C 13 26.948 0.080 . 1 . . . . . 874 L CG . 27626 1 241 . 1 1 18 18 LEU CD1 C 13 23.392 0.060 . 2 . . . . . 874 L CD1 . 27626 1 242 . 1 1 18 18 LEU CD2 C 13 25.055 0.080 . 2 . . . . . 874 L CD2 . 27626 1 243 . 1 1 18 18 LEU N N 15 120.090 0.040 . 1 . . . . . 874 L N . 27626 1 244 . 1 1 19 19 ALA H H 1 7.985 0.010 . 1 . . . . . 875 A HN . 27626 1 245 . 1 1 19 19 ALA HA H 1 4.232 0.010 . 1 . . . . . 875 A HA . 27626 1 246 . 1 1 19 19 ALA HB1 H 1 1.559 0.010 . 1 . . . . . 875 A HB# . 27626 1 247 . 1 1 19 19 ALA HB2 H 1 1.559 0.010 . 1 . . . . . 875 A HB# . 27626 1 248 . 1 1 19 19 ALA HB3 H 1 1.559 0.010 . 1 . . . . . 875 A HB# . 27626 1 249 . 1 1 19 19 ALA C C 13 180.935 0.020 . 1 . . . . . 875 A C . 27626 1 250 . 1 1 19 19 ALA CA C 13 54.943 0.040 . 1 . . . . . 875 A CA . 27626 1 251 . 1 1 19 19 ALA CB C 13 18.108 0.110 . 1 . . . . . 875 A CB . 27626 1 252 . 1 1 19 19 ALA N N 15 122.106 0.053 . 1 . . . . . 875 A N . 27626 1 253 . 1 1 20 20 GLU H H 1 8.225 0.010 . 1 . . . . . 876 E HN . 27626 1 254 . 1 1 20 20 GLU HA H 1 4.116 0.013 . 1 . . . . . 876 E HA . 27626 1 255 . 1 1 20 20 GLU HB2 H 1 2.195 0.010 . 2 . . . . . 876 E HB# . 27626 1 256 . 1 1 20 20 GLU HB3 H 1 2.195 0.010 . 2 . . . . . 876 E HB# . 27626 1 257 . 1 1 20 20 GLU HG2 H 1 2.393 0.010 . 2 . . . . . 876 E HG1 . 27626 1 258 . 1 1 20 20 GLU HG3 H 1 2.357 0.010 . 2 . . . . . 876 E HG2 . 27626 1 259 . 1 1 20 20 GLU C C 13 178.912 0.020 . 1 . . . . . 876 E C . 27626 1 260 . 1 1 20 20 GLU CA C 13 59.222 0.040 . 1 . . . . . 876 E CA . 27626 1 261 . 1 1 20 20 GLU CB C 13 29.474 0.080 . 1 . . . . . 876 E CB . 27626 1 262 . 1 1 20 20 GLU CG C 13 36.240 0.080 . 1 . . . . . 876 E CG . 27626 1 263 . 1 1 20 20 GLU CD C 13 183.424 0.020 . 1 . . . . . 876 E CD . 27626 1 264 . 1 1 20 20 GLU N N 15 120.431 0.040 . 1 . . . . . 876 E N . 27626 1 265 . 1 1 21 21 GLU H H 1 8.337 0.010 . 1 . . . . . 877 E HN . 27626 1 266 . 1 1 21 21 GLU HA H 1 4.014 0.010 . 1 . . . . . 877 E HA . 27626 1 267 . 1 1 21 21 GLU HB2 H 1 2.171 0.020 . 2 . . . . . 877 E HB# . 27626 1 268 . 1 1 21 21 GLU HB3 H 1 2.171 0.020 . 2 . . . . . 877 E HB# . 27626 1 269 . 1 1 21 21 GLU HG2 H 1 2.446 0.010 . 2 . . . . . 877 E HG1 . 27626 1 270 . 1 1 21 21 GLU HG3 H 1 2.256 0.011 . 2 . . . . . 877 E HG2 . 27626 1 271 . 1 1 21 21 GLU C C 13 179.160 0.020 . 1 . . . . . 877 E C . 27626 1 272 . 1 1 21 21 GLU CA C 13 59.752 0.040 . 1 . . . . . 877 E CA . 27626 1 273 . 1 1 21 21 GLU CB C 13 29.475 0.080 . 1 . . . . . 877 E CB . 27626 1 274 . 1 1 21 21 GLU CG C 13 36.533 0.080 . 1 . . . . . 877 E CG . 27626 1 275 . 1 1 21 21 GLU CD C 13 183.078 0.020 . 1 . . . . . 877 E CD . 27626 1 276 . 1 1 21 21 GLU N N 15 120.413 0.040 . 1 . . . . . 877 E N . 27626 1 277 . 1 1 22 22 GLU H H 1 8.117 0.010 . 1 . . . . . 878 E HN . 27626 1 278 . 1 1 22 22 GLU HA H 1 4.102 0.010 . 1 . . . . . 878 E HA . 27626 1 279 . 1 1 22 22 GLU HB2 H 1 2.129 0.010 . 2 . . . . . 878 E HB# . 27626 1 280 . 1 1 22 22 GLU HB3 H 1 2.129 0.010 . 2 . . . . . 878 E HB# . 27626 1 281 . 1 1 22 22 GLU HG2 H 1 2.337 0.010 . 2 . . . . . 878 E HG# . 27626 1 282 . 1 1 22 22 GLU HG3 H 1 2.337 0.010 . 2 . . . . . 878 E HG# . 27626 1 283 . 1 1 22 22 GLU C C 13 178.408 0.020 . 1 . . . . . 878 E C . 27626 1 284 . 1 1 22 22 GLU CA C 13 59.227 0.040 . 1 . . . . . 878 E CA . 27626 1 285 . 1 1 22 22 GLU CB C 13 29.406 0.040 . 1 . . . . . 878 E CB . 27626 1 286 . 1 1 22 22 GLU CG C 13 36.008 0.080 . 1 . . . . . 878 E CG . 27626 1 287 . 1 1 22 22 GLU CD C 13 183.491 0.020 . 1 . . . . . 878 E CD . 27626 1 288 . 1 1 22 22 GLU N N 15 119.801 0.051 . 1 . . . . . 878 E N . 27626 1 289 . 1 1 23 23 LYS H H 1 7.862 0.010 . 1 . . . . . 879 K HN . 27626 1 290 . 1 1 23 23 LYS HA H 1 4.036 0.010 . 1 . . . . . 879 K HA . 27626 1 291 . 1 1 23 23 LYS HB2 H 1 1.990 0.010 . 2 . . . . . 879 K HB# . 27626 1 292 . 1 1 23 23 LYS HB3 H 1 1.990 0.010 . 2 . . . . . 879 K HB# . 27626 1 293 . 1 1 23 23 LYS HG2 H 1 1.586 0.011 . 2 . . . . . 879 K HG1 . 27626 1 294 . 1 1 23 23 LYS HG3 H 1 1.388 0.010 . 2 . . . . . 879 K HG2 . 27626 1 295 . 1 1 23 23 LYS HD2 H 1 1.723 0.020 . 2 . . . . . 879 K HD# . 27626 1 296 . 1 1 23 23 LYS HD3 H 1 1.723 0.020 . 2 . . . . . 879 K HD# . 27626 1 297 . 1 1 23 23 LYS HE2 H 1 2.982 0.010 . 2 . . . . . 879 K HE# . 27626 1 298 . 1 1 23 23 LYS HE3 H 1 2.982 0.010 . 2 . . . . . 879 K HE# . 27626 1 299 . 1 1 23 23 LYS C C 13 179.319 0.020 . 1 . . . . . 879 K C . 27626 1 300 . 1 1 23 23 LYS CA C 13 59.739 0.040 . 1 . . . . . 879 K CA . 27626 1 301 . 1 1 23 23 LYS CB C 13 32.612 0.077 . 1 . . . . . 879 K CB . 27626 1 302 . 1 1 23 23 LYS CG C 13 24.890 0.040 . 1 . . . . . 879 K CG . 27626 1 303 . 1 1 23 23 LYS CD C 13 29.670 0.080 . 1 . . . . . 879 K CD . 27626 1 304 . 1 1 23 23 LYS CE C 13 42.057 0.040 . 1 . . . . . 879 K CE . 27626 1 305 . 1 1 23 23 LYS N N 15 120.628 0.044 . 1 . . . . . 879 K N . 27626 1 306 . 1 1 24 24 LEU H H 1 8.109 0.010 . 1 . . . . . 880 L HN . 27626 1 307 . 1 1 24 24 LEU HA H 1 4.183 0.010 . 1 . . . . . 880 L HA . 27626 1 308 . 1 1 24 24 LEU HB2 H 1 1.695 0.020 . 2 . . . . . 880 L HB1 . 27626 1 309 . 1 1 24 24 LEU HB3 H 1 1.850 0.010 . 2 . . . . . 880 L HB2 . 27626 1 310 . 1 1 24 24 LEU HG H 1 1.809 0.020 . 1 . . . . . 880 L HG . 27626 1 311 . 1 1 24 24 LEU HD11 H 1 0.967 0.010 . 2 . . . . . 880 L HD1# . 27626 1 312 . 1 1 24 24 LEU HD12 H 1 0.967 0.010 . 2 . . . . . 880 L HD1# . 27626 1 313 . 1 1 24 24 LEU HD13 H 1 0.967 0.010 . 2 . . . . . 880 L HD1# . 27626 1 314 . 1 1 24 24 LEU HD21 H 1 0.933 0.010 . 2 . . . . . 880 L HD2# . 27626 1 315 . 1 1 24 24 LEU HD22 H 1 0.933 0.010 . 2 . . . . . 880 L HD2# . 27626 1 316 . 1 1 24 24 LEU HD23 H 1 0.933 0.010 . 2 . . . . . 880 L HD2# . 27626 1 317 . 1 1 24 24 LEU C C 13 179.505 0.020 . 1 . . . . . 880 L C . 27626 1 318 . 1 1 24 24 LEU CA C 13 57.737 0.040 . 1 . . . . . 880 L CA . 27626 1 319 . 1 1 24 24 LEU CB C 13 41.757 0.040 . 1 . . . . . 880 L CB . 27626 1 320 . 1 1 24 24 LEU CG C 13 26.977 0.080 . 1 . . . . . 880 L CG . 27626 1 321 . 1 1 24 24 LEU CD1 C 13 24.936 0.040 . 2 . . . . . 880 L CD1 . 27626 1 322 . 1 1 24 24 LEU CD2 C 13 23.683 0.040 . 2 . . . . . 880 L CD2 . 27626 1 323 . 1 1 24 24 LEU N N 15 119.965 0.040 . 1 . . . . . 880 L N . 27626 1 324 . 1 1 25 25 ARG H H 1 8.123 0.010 . 1 . . . . . 881 R HN . 27626 1 325 . 1 1 25 25 ARG C C 13 179.297 0.040 . 1 . . . . . 881 R C . 27626 1 326 . 1 1 25 25 ARG CA C 13 59.447 0.080 . 1 . . . . . 881 R CA . 27626 1 327 . 1 1 25 25 ARG N N 15 119.910 0.040 . 1 . . . . . 881 R N . 27626 1 328 . 1 1 26 26 LYS HA H 1 4.123 0.020 . 1 . . . . . 882 K HA . 27626 1 329 . 1 1 26 26 LYS C C 13 179.221 0.020 . 1 . . . . . 882 K C . 27626 1 330 . 1 1 26 26 LYS CA C 13 59.302 0.080 . 1 . . . . . 882 K CA . 27626 1 331 . 1 1 26 26 LYS CB C 13 32.572 0.080 . 1 . . . . . 882 K CB . 27626 1 332 . 1 1 26 26 LYS CG C 13 25.106 0.080 . 1 . . . . . 882 K CG . 27626 1 333 . 1 1 26 26 LYS CD C 13 29.130 0.080 . 1 . . . . . 882 K CD . 27626 1 334 . 1 1 26 26 LYS CE C 13 42.143 0.080 . 1 . . . . . 882 K CE . 27626 1 335 . 1 1 27 27 GLU H H 1 8.207 0.010 . 1 . . . . . 883 E HN . 27626 1 336 . 1 1 27 27 GLU HA H 1 4.224 0.010 . 1 . . . . . 883 E HA . 27626 1 337 . 1 1 27 27 GLU HB2 H 1 2.141 0.020 . 2 . . . . . 883 E HB# . 27626 1 338 . 1 1 27 27 GLU HB3 H 1 2.141 0.020 . 2 . . . . . 883 E HB# . 27626 1 339 . 1 1 27 27 GLU HG2 H 1 2.449 0.010 . 2 . . . . . 883 E HG1 . 27626 1 340 . 1 1 27 27 GLU HG3 H 1 2.269 0.010 . 2 . . . . . 883 E HG2 . 27626 1 341 . 1 1 27 27 GLU C C 13 178.793 0.020 . 1 . . . . . 883 E C . 27626 1 342 . 1 1 27 27 GLU CA C 13 58.678 0.071 . 1 . . . . . 883 E CA . 27626 1 343 . 1 1 27 27 GLU CB C 13 30.054 0.040 . 1 . . . . . 883 E CB . 27626 1 344 . 1 1 27 27 GLU CG C 13 36.356 0.080 . 1 . . . . . 883 E CG . 27626 1 345 . 1 1 27 27 GLU CD C 13 183.164 0.040 . 1 . . . . . 883 E CD . 27626 1 346 . 1 1 27 27 GLU N N 15 120.128 0.040 . 1 . . . . . 883 E N . 27626 1 347 . 1 1 28 28 MET H H 1 8.430 0.010 . 1 . . . . . 884 M HN . 27626 1 348 . 1 1 28 28 MET HA H 1 4.412 0.010 . 1 . . . . . 884 M HA . 27626 1 349 . 1 1 28 28 MET HB2 H 1 2.216 0.013 . 2 . . . . . 884 M HB1 . 27626 1 350 . 1 1 28 28 MET HB3 H 1 2.213 0.013 . 2 . . . . . 884 M HB2 . 27626 1 351 . 1 1 28 28 MET HG2 H 1 2.722 0.013 . 2 . . . . . 884 M HG1 . 27626 1 352 . 1 1 28 28 MET HG3 H 1 2.713 0.014 . 2 . . . . . 884 M HG2 . 27626 1 353 . 1 1 28 28 MET HE1 H 1 2.122 0.010 . 1 . . . . . 884 M HE# . 27626 1 354 . 1 1 28 28 MET HE2 H 1 2.122 0.010 . 1 . . . . . 884 M HE# . 27626 1 355 . 1 1 28 28 MET HE3 H 1 2.122 0.010 . 1 . . . . . 884 M HE# . 27626 1 356 . 1 1 28 28 MET C C 13 178.199 0.026 . 1 . . . . . 884 M C . 27626 1 357 . 1 1 28 28 MET CA C 13 57.572 0.040 . 1 . . . . . 884 M CA . 27626 1 358 . 1 1 28 28 MET CB C 13 32.570 0.040 . 1 . . . . . 884 M CB . 27626 1 359 . 1 1 28 28 MET CG C 13 31.857 0.045 . 1 . . . . . 884 M CG . 27626 1 360 . 1 1 28 28 MET CE C 13 17.000 0.040 . 1 . . . . . 884 M CE . 27626 1 361 . 1 1 28 28 MET N N 15 119.517 0.048 . 1 . . . . . 884 M N . 27626 1 362 . 1 1 29 29 SER H H 1 8.331 0.010 . 1 . . . . . 885 S HN . 27626 1 363 . 1 1 29 29 SER HA H 1 4.301 0.010 . 1 . . . . . 885 S HA . 27626 1 364 . 1 1 29 29 SER HB2 H 1 4.097 0.010 . 2 . . . . . 885 S HB1 . 27626 1 365 . 1 1 29 29 SER HB3 H 1 4.024 0.010 . 2 . . . . . 885 S HB2 . 27626 1 366 . 1 1 29 29 SER C C 13 176.429 0.032 . 1 . . . . . 885 S C . 27626 1 367 . 1 1 29 29 SER CA C 13 60.833 0.048 . 1 . . . . . 885 S CA . 27626 1 368 . 1 1 29 29 SER CB C 13 63.051 0.041 . 1 . . . . . 885 S CB . 27626 1 369 . 1 1 29 29 SER N N 15 116.017 0.055 . 1 . . . . . 885 S N . 27626 1 370 . 1 1 30 30 ALA H H 1 8.224 0.010 . 1 . . . . . 886 A HN . 27626 1 371 . 1 1 30 30 ALA HA H 1 4.217 0.016 . 1 . . . . . 886 A HA . 27626 1 372 . 1 1 30 30 ALA HB1 H 1 1.532 0.010 . 1 . . . . . 886 A HB# . 27626 1 373 . 1 1 30 30 ALA HB2 H 1 1.532 0.010 . 1 . . . . . 886 A HB# . 27626 1 374 . 1 1 30 30 ALA HB3 H 1 1.532 0.010 . 1 . . . . . 886 A HB# . 27626 1 375 . 1 1 30 30 ALA C C 13 180.297 0.020 . 1 . . . . . 886 A C . 27626 1 376 . 1 1 30 30 ALA CA C 13 55.049 0.040 . 1 . . . . . 886 A CA . 27626 1 377 . 1 1 30 30 ALA CB C 13 18.218 0.040 . 1 . . . . . 886 A CB . 27626 1 378 . 1 1 30 30 ALA N N 15 125.210 0.040 . 1 . . . . . 886 A N . 27626 1 379 . 1 1 31 31 LYS H H 1 8.121 0.010 . 1 . . . . . 887 K HN . 27626 1 380 . 1 1 31 31 LYS HB2 H 1 1.952 0.020 . 2 . . . . . 887 K HB# . 27626 1 381 . 1 1 31 31 LYS HB3 H 1 1.952 0.020 . 2 . . . . . 887 K HB# . 27626 1 382 . 1 1 31 31 LYS C C 13 178.737 0.020 . 1 . . . . . 887 K C . 27626 1 383 . 1 1 31 31 LYS CA C 13 59.549 0.080 . 1 . . . . . 887 K CA . 27626 1 384 . 1 1 31 31 LYS CB C 13 32.765 0.050 . 1 . . . . . 887 K CB . 27626 1 385 . 1 1 31 31 LYS CG C 13 25.078 0.080 . 1 . . . . . 887 K CG . 27626 1 386 . 1 1 31 31 LYS CE C 13 42.110 0.080 . 1 . . . . . 887 K CE . 27626 1 387 . 1 1 31 31 LYS N N 15 120.215 0.040 . 1 . . . . . 887 K N . 27626 1 388 . 1 1 32 32 LYS H H 1 7.993 0.010 . 1 . . . . . 888 K HN . 27626 1 389 . 1 1 32 32 LYS HA H 1 4.208 0.011 . 1 . . . . . 888 K HA . 27626 1 390 . 1 1 32 32 LYS HB2 H 1 1.935 0.020 . 2 . . . . . 888 K HB# . 27626 1 391 . 1 1 32 32 LYS HB3 H 1 1.935 0.020 . 2 . . . . . 888 K HB# . 27626 1 392 . 1 1 32 32 LYS HG2 H 1 1.505 0.020 . 2 . . . . . 888 K HG# . 27626 1 393 . 1 1 32 32 LYS HG3 H 1 1.505 0.020 . 2 . . . . . 888 K HG# . 27626 1 394 . 1 1 32 32 LYS HD2 H 1 1.689 0.020 . 2 . . . . . 888 K HD# . 27626 1 395 . 1 1 32 32 LYS HD3 H 1 1.689 0.020 . 2 . . . . . 888 K HD# . 27626 1 396 . 1 1 32 32 LYS HE2 H 1 2.965 0.020 . 2 . . . . . 888 K HE# . 27626 1 397 . 1 1 32 32 LYS HE3 H 1 2.965 0.020 . 2 . . . . . 888 K HE# . 27626 1 398 . 1 1 32 32 LYS C C 13 178.754 0.020 . 1 . . . . . 888 K C . 27626 1 399 . 1 1 32 32 LYS CA C 13 58.822 0.040 . 1 . . . . . 888 K CA . 27626 1 400 . 1 1 32 32 LYS CB C 13 32.263 0.102 . 1 . . . . . 888 K CB . 27626 1 401 . 1 1 32 32 LYS CG C 13 24.973 0.080 . 1 . . . . . 888 K CG . 27626 1 402 . 1 1 32 32 LYS CD C 13 29.044 0.080 . 1 . . . . . 888 K CD . 27626 1 403 . 1 1 32 32 LYS CE C 13 42.387 0.080 . 1 . . . . . 888 K CE . 27626 1 404 . 1 1 32 32 LYS N N 15 120.070 0.042 . 1 . . . . . 888 K N . 27626 1 405 . 1 1 33 33 ALA H H 1 8.188 0.010 . 1 . . . . . 889 A HN . 27626 1 406 . 1 1 33 33 ALA HA H 1 4.233 0.010 . 1 . . . . . 889 A HA . 27626 1 407 . 1 1 33 33 ALA HB1 H 1 1.522 0.010 . 1 . . . . . 889 A HB# . 27626 1 408 . 1 1 33 33 ALA HB2 H 1 1.522 0.010 . 1 . . . . . 889 A HB# . 27626 1 409 . 1 1 33 33 ALA HB3 H 1 1.522 0.010 . 1 . . . . . 889 A HB# . 27626 1 410 . 1 1 33 33 ALA C C 13 180.589 0.020 . 1 . . . . . 889 A C . 27626 1 411 . 1 1 33 33 ALA CA C 13 54.981 0.040 . 1 . . . . . 889 A CA . 27626 1 412 . 1 1 33 33 ALA CB C 13 18.211 0.080 . 1 . . . . . 889 A CB . 27626 1 413 . 1 1 33 33 ALA N N 15 121.730 0.040 . 1 . . . . . 889 A N . 27626 1 414 . 1 1 34 34 LYS H H 1 7.968 0.010 . 1 . . . . . 890 K HN . 27626 1 415 . 1 1 34 34 LYS HE2 H 1 3.025 0.020 . 2 . . . . . 890 K HE# . 27626 1 416 . 1 1 34 34 LYS HE3 H 1 3.025 0.020 . 2 . . . . . 890 K HE# . 27626 1 417 . 1 1 34 34 LYS C C 13 178.863 0.020 . 1 . . . . . 890 K C . 27626 1 418 . 1 1 34 34 LYS CA C 13 59.392 0.080 . 1 . . . . . 890 K CA . 27626 1 419 . 1 1 34 34 LYS CG C 13 24.862 0.080 . 1 . . . . . 890 K CG . 27626 1 420 . 1 1 34 34 LYS CE C 13 42.060 0.080 . 1 . . . . . 890 K CE . 27626 1 421 . 1 1 34 34 LYS N N 15 120.361 0.040 . 1 . . . . . 890 K N . 27626 1 422 . 1 1 35 35 GLU H H 1 8.149 0.010 . 1 . . . . . 891 E HN . 27626 1 423 . 1 1 35 35 GLU HA H 1 4.122 0.010 . 1 . . . . . 891 E HA . 27626 1 424 . 1 1 35 35 GLU HB2 H 1 2.192 0.020 . 2 . . . . . 891 E HB# . 27626 1 425 . 1 1 35 35 GLU HB3 H 1 2.192 0.020 . 2 . . . . . 891 E HB# . 27626 1 426 . 1 1 35 35 GLU HG2 H 1 2.539 0.010 . 2 . . . . . 891 E HG1 . 27626 1 427 . 1 1 35 35 GLU HG3 H 1 2.307 0.010 . 2 . . . . . 891 E HG2 . 27626 1 428 . 1 1 35 35 GLU C C 13 179.709 0.020 . 1 . . . . . 891 E C . 27626 1 429 . 1 1 35 35 GLU CA C 13 59.320 0.080 . 1 . . . . . 891 E CA . 27626 1 430 . 1 1 35 35 GLU CB C 13 29.610 0.080 . 1 . . . . . 891 E CB . 27626 1 431 . 1 1 35 35 GLU CG C 13 36.546 0.080 . 1 . . . . . 891 E CG . 27626 1 432 . 1 1 35 35 GLU CD C 13 183.449 0.020 . 1 . . . . . 891 E CD . 27626 1 433 . 1 1 35 35 GLU N N 15 120.063 0.040 . 1 . . . . . 891 E N . 27626 1 434 . 1 1 36 36 GLU H H 1 8.451 0.010 . 1 . . . . . 892 E HN . 27626 1 435 . 1 1 36 36 GLU HA H 1 4.199 0.010 . 1 . . . . . 892 E HA . 27626 1 436 . 1 1 36 36 GLU HB2 H 1 2.173 0.020 . 2 . . . . . 892 E HB1 . 27626 1 437 . 1 1 36 36 GLU HB3 H 1 2.017 0.020 . 2 . . . . . 892 E HB2 . 27626 1 438 . 1 1 36 36 GLU HG2 H 1 2.345 0.020 . 2 . . . . . 892 E HG# . 27626 1 439 . 1 1 36 36 GLU HG3 H 1 2.345 0.020 . 2 . . . . . 892 E HG# . 27626 1 440 . 1 1 36 36 GLU C C 13 178.514 0.020 . 1 . . . . . 892 E C . 27626 1 441 . 1 1 36 36 GLU CA C 13 59.004 0.040 . 1 . . . . . 892 E CA . 27626 1 442 . 1 1 36 36 GLU CB C 13 29.549 0.080 . 1 . . . . . 892 E CB . 27626 1 443 . 1 1 36 36 GLU CD C 13 183.511 0.020 . 1 . . . . . 892 E CD . 27626 1 444 . 1 1 36 36 GLU N N 15 120.586 0.040 . 1 . . . . . 892 E N . 27626 1 445 . 1 1 37 37 ALA H H 1 8.120 0.010 . 1 . . . . . 893 A HN . 27626 1 446 . 1 1 37 37 ALA HA H 1 4.153 0.010 . 1 . . . . . 893 A HA . 27626 1 447 . 1 1 37 37 ALA HB1 H 1 1.583 0.010 . 1 . . . . . 893 A HB# . 27626 1 448 . 1 1 37 37 ALA HB2 H 1 1.583 0.010 . 1 . . . . . 893 A HB# . 27626 1 449 . 1 1 37 37 ALA HB3 H 1 1.583 0.010 . 1 . . . . . 893 A HB# . 27626 1 450 . 1 1 37 37 ALA C C 13 181.028 0.020 . 1 . . . . . 893 A C . 27626 1 451 . 1 1 37 37 ALA CA C 13 55.231 0.040 . 1 . . . . . 893 A CA . 27626 1 452 . 1 1 37 37 ALA CB C 13 17.888 0.040 . 1 . . . . . 893 A CB . 27626 1 453 . 1 1 37 37 ALA N N 15 122.197 0.040 . 1 . . . . . 893 A N . 27626 1 454 . 1 1 38 38 GLU H H 1 8.235 0.010 . 1 . . . . . 894 E HN . 27626 1 455 . 1 1 38 38 GLU HA H 1 4.208 0.020 . 1 . . . . . 894 E HA . 27626 1 456 . 1 1 38 38 GLU HB2 H 1 2.168 0.020 . 2 . . . . . 894 E HB# . 27626 1 457 . 1 1 38 38 GLU HB3 H 1 2.168 0.020 . 2 . . . . . 894 E HB# . 27626 1 458 . 1 1 38 38 GLU HG2 H 1 2.472 0.010 . 2 . . . . . 894 E HG1 . 27626 1 459 . 1 1 38 38 GLU HG3 H 1 2.369 0.010 . 2 . . . . . 894 E HG2 . 27626 1 460 . 1 1 38 38 GLU C C 13 178.758 0.021 . 1 . . . . . 894 E C . 27626 1 461 . 1 1 38 38 GLU CA C 13 59.105 0.040 . 1 . . . . . 894 E CA . 27626 1 462 . 1 1 38 38 GLU CB C 13 29.138 0.040 . 1 . . . . . 894 E CB . 27626 1 463 . 1 1 38 38 GLU CG C 13 36.179 0.040 . 1 . . . . . 894 E CG . 27626 1 464 . 1 1 38 38 GLU CD C 13 183.290 0.040 . 1 . . . . . 894 E CD . 27626 1 465 . 1 1 38 38 GLU N N 15 119.785 0.045 . 1 . . . . . 894 E N . 27626 1 466 . 1 1 39 39 ARG H H 1 8.138 0.010 . 1 . . . . . 895 R HN . 27626 1 467 . 1 1 39 39 ARG HA H 1 4.124 0.010 . 1 . . . . . 895 R HA . 27626 1 468 . 1 1 39 39 ARG HD2 H 1 3.288 0.020 . 2 . . . . . 895 R HD# . 27626 1 469 . 1 1 39 39 ARG HD3 H 1 3.288 0.020 . 2 . . . . . 895 R HD# . 27626 1 470 . 1 1 39 39 ARG C C 13 179.357 0.020 . 1 . . . . . 895 R C . 27626 1 471 . 1 1 39 39 ARG CA C 13 59.578 0.040 . 1 . . . . . 895 R CA . 27626 1 472 . 1 1 39 39 ARG CB C 13 29.911 0.100 . 1 . . . . . 895 R CB . 27626 1 473 . 1 1 39 39 ARG CG C 13 27.304 0.080 . 1 . . . . . 895 R CG . 27626 1 474 . 1 1 39 39 ARG CD C 13 43.318 0.080 . 1 . . . . . 895 R CD . 27626 1 475 . 1 1 39 39 ARG N N 15 121.313 0.040 . 1 . . . . . 895 R N . 27626 1 476 . 1 1 40 40 LYS H H 1 8.235 0.010 . 1 . . . . . 896 K HN . 27626 1 477 . 1 1 40 40 LYS HA H 1 4.094 0.010 . 1 . . . . . 896 K HA . 27626 1 478 . 1 1 40 40 LYS HB2 H 1 1.975 0.010 . 2 . . . . . 896 K HB# . 27626 1 479 . 1 1 40 40 LYS HB3 H 1 1.975 0.010 . 2 . . . . . 896 K HB# . 27626 1 480 . 1 1 40 40 LYS HG2 H 1 1.668 0.020 . 2 . . . . . 896 K HG# . 27626 1 481 . 1 1 40 40 LYS HG3 H 1 1.668 0.020 . 2 . . . . . 896 K HG# . 27626 1 482 . 1 1 40 40 LYS HE2 H 1 2.972 0.020 . 2 . . . . . 896 K HE# . 27626 1 483 . 1 1 40 40 LYS HE3 H 1 2.972 0.020 . 2 . . . . . 896 K HE# . 27626 1 484 . 1 1 40 40 LYS C C 13 179.335 0.020 . 1 . . . . . 896 K C . 27626 1 485 . 1 1 40 40 LYS CA C 13 59.205 0.080 . 1 . . . . . 896 K CA . 27626 1 486 . 1 1 40 40 LYS CB C 13 32.345 0.147 . 1 . . . . . 896 K CB . 27626 1 487 . 1 1 40 40 LYS CG C 13 25.449 0.080 . 1 . . . . . 896 K CG . 27626 1 488 . 1 1 40 40 LYS CD C 13 28.803 0.080 . 1 . . . . . 896 K CD . 27626 1 489 . 1 1 40 40 LYS CE C 13 42.128 0.080 . 1 . . . . . 896 K CE . 27626 1 490 . 1 1 40 40 LYS N N 15 119.140 0.040 . 1 . . . . . 896 K N . 27626 1 491 . 1 1 41 41 HIS H H 1 8.157 0.010 . 1 . . . . . 897 H HN . 27626 1 492 . 1 1 41 41 HIS HA H 1 4.486 0.010 . 1 . . . . . 897 H HA . 27626 1 493 . 1 1 41 41 HIS HB2 H 1 3.401 0.010 . 2 . . . . . 897 H HB1 . 27626 1 494 . 1 1 41 41 HIS HB3 H 1 3.189 0.010 . 2 . . . . . 897 H HB2 . 27626 1 495 . 1 1 41 41 HIS HD2 H 1 7.058 0.010 . 1 . . . . . 897 H HD2 . 27626 1 496 . 1 1 41 41 HIS HE1 H 1 7.754 0.010 . 1 . . . . . 897 H HE1 . 27626 1 497 . 1 1 41 41 HIS C C 13 177.306 0.020 . 1 . . . . . 897 H C . 27626 1 498 . 1 1 41 41 HIS CA C 13 59.512 0.040 . 1 . . . . . 897 H CA . 27626 1 499 . 1 1 41 41 HIS CB C 13 30.861 0.061 . 1 . . . . . 897 H CB . 27626 1 500 . 1 1 41 41 HIS CD2 C 13 119.373 0.080 . 1 . . . . . 897 H CD2 . 27626 1 501 . 1 1 41 41 HIS CE1 C 13 138.464 0.080 . 1 . . . . . 897 H CE1 . 27626 1 502 . 1 1 41 41 HIS N N 15 120.868 0.045 . 1 . . . . . 897 H N . 27626 1 503 . 1 1 42 42 GLN H H 1 8.342 0.010 . 1 . . . . . 898 Q HN . 27626 1 504 . 1 1 42 42 GLN HA H 1 3.888 0.010 . 1 . . . . . 898 Q HA . 27626 1 505 . 1 1 42 42 GLN HB2 H 1 2.244 0.010 . 2 . . . . . 898 Q HB1 . 27626 1 506 . 1 1 42 42 GLN HB3 H 1 2.228 0.010 . 2 . . . . . 898 Q HB2 . 27626 1 507 . 1 1 42 42 GLN HG2 H 1 2.608 0.010 . 2 . . . . . 898 Q HG# . 27626 1 508 . 1 1 42 42 GLN HG3 H 1 2.608 0.010 . 2 . . . . . 898 Q HG# . 27626 1 509 . 1 1 42 42 GLN HE21 H 1 6.869 0.010 . 1 . . . . . 898 Q HE21 . 27626 1 510 . 1 1 42 42 GLN HE22 H 1 7.757 0.010 . 1 . . . . . 898 Q HE22 . 27626 1 511 . 1 1 42 42 GLN C C 13 179.535 0.020 . 1 . . . . . 898 Q C . 27626 1 512 . 1 1 42 42 GLN CA C 13 58.764 0.040 . 1 . . . . . 898 Q CA . 27626 1 513 . 1 1 42 42 GLN CB C 13 27.840 0.096 . 1 . . . . . 898 Q CB . 27626 1 514 . 1 1 42 42 GLN CG C 13 33.716 0.044 . 1 . . . . . 898 Q CG . 27626 1 515 . 1 1 42 42 GLN CD C 13 179.958 0.020 . 1 . . . . . 898 Q CD . 27626 1 516 . 1 1 42 42 GLN N N 15 117.829 0.040 . 1 . . . . . 898 Q N . 27626 1 517 . 1 1 42 42 GLN NE2 N 15 112.577 0.040 . 1 . . . . . 898 Q NE2 . 27626 1 518 . 1 1 43 43 GLU H H 1 8.315 0.010 . 1 . . . . . 899 E HN . 27626 1 519 . 1 1 43 43 GLU HA H 1 4.118 0.010 . 1 . . . . . 899 E HA . 27626 1 520 . 1 1 43 43 GLU C C 13 179.121 0.020 . 1 . . . . . 899 E C . 27626 1 521 . 1 1 43 43 GLU CA C 13 59.262 0.080 . 1 . . . . . 899 E CA . 27626 1 522 . 1 1 43 43 GLU CB C 13 29.530 0.040 . 1 . . . . . 899 E CB . 27626 1 523 . 1 1 43 43 GLU CG C 13 36.386 0.080 . 1 . . . . . 899 E CG . 27626 1 524 . 1 1 43 43 GLU CD C 13 183.508 0.020 . 1 . . . . . 899 E CD . 27626 1 525 . 1 1 43 43 GLU N N 15 120.624 0.040 . 1 . . . . . 899 E N . 27626 1 526 . 1 1 44 44 ARG H H 1 8.035 0.010 . 1 . . . . . 900 R HN . 27626 1 527 . 1 1 44 44 ARG HA H 1 4.129 0.010 . 1 . . . . . 900 R HA . 27626 1 528 . 1 1 44 44 ARG HD2 H 1 3.293 0.020 . 2 . . . . . 900 R HD# . 27626 1 529 . 1 1 44 44 ARG HD3 H 1 3.293 0.020 . 2 . . . . . 900 R HD# . 27626 1 530 . 1 1 44 44 ARG C C 13 178.909 0.020 . 1 . . . . . 900 R C . 27626 1 531 . 1 1 44 44 ARG CA C 13 59.060 0.080 . 1 . . . . . 900 R CA . 27626 1 532 . 1 1 44 44 ARG CB C 13 29.588 0.040 . 1 . . . . . 900 R CB . 27626 1 533 . 1 1 44 44 ARG CG C 13 27.332 0.080 . 1 . . . . . 900 R CG . 27626 1 534 . 1 1 44 44 ARG CD C 13 43.258 0.080 . 1 . . . . . 900 R CD . 27626 1 535 . 1 1 44 44 ARG N N 15 121.885 0.047 . 1 . . . . . 900 R N . 27626 1 536 . 1 1 45 45 LEU H H 1 8.193 0.010 . 1 . . . . . 901 L HN . 27626 1 537 . 1 1 45 45 LEU HA H 1 3.982 0.010 . 1 . . . . . 901 L HA . 27626 1 538 . 1 1 45 45 LEU HB2 H 1 1.776 0.010 . 2 . . . . . 901 L HB1 . 27626 1 539 . 1 1 45 45 LEU HB3 H 1 1.437 0.010 . 2 . . . . . 901 L HB2 . 27626 1 540 . 1 1 45 45 LEU HG H 1 1.466 0.010 . 1 . . . . . 901 L HG . 27626 1 541 . 1 1 45 45 LEU HD11 H 1 0.737 0.010 . 2 . . . . . 901 L HD1# . 27626 1 542 . 1 1 45 45 LEU HD12 H 1 0.737 0.010 . 2 . . . . . 901 L HD1# . 27626 1 543 . 1 1 45 45 LEU HD13 H 1 0.737 0.010 . 2 . . . . . 901 L HD1# . 27626 1 544 . 1 1 45 45 LEU HD21 H 1 0.781 0.010 . 2 . . . . . 901 L HD2# . 27626 1 545 . 1 1 45 45 LEU HD22 H 1 0.781 0.010 . 2 . . . . . 901 L HD2# . 27626 1 546 . 1 1 45 45 LEU HD23 H 1 0.781 0.010 . 2 . . . . . 901 L HD2# . 27626 1 547 . 1 1 45 45 LEU C C 13 180.143 0.020 . 1 . . . . . 901 L C . 27626 1 548 . 1 1 45 45 LEU CA C 13 57.909 0.041 . 1 . . . . . 901 L CA . 27626 1 549 . 1 1 45 45 LEU CB C 13 41.336 0.042 . 1 . . . . . 901 L CB . 27626 1 550 . 1 1 45 45 LEU CG C 13 26.536 0.050 . 1 . . . . . 901 L CG . 27626 1 551 . 1 1 45 45 LEU CD1 C 13 25.117 0.057 . 2 . . . . . 901 L CD1 . 27626 1 552 . 1 1 45 45 LEU CD2 C 13 22.555 0.040 . 2 . . . . . 901 L CD2 . 27626 1 553 . 1 1 45 45 LEU N N 15 119.483 0.040 . 1 . . . . . 901 L N . 27626 1 554 . 1 1 46 46 ALA H H 1 8.024 0.010 . 1 . . . . . 902 A HN . 27626 1 555 . 1 1 46 46 ALA HA H 1 4.211 0.010 . 1 . . . . . 902 A HA . 27626 1 556 . 1 1 46 46 ALA HB1 H 1 1.527 0.010 . 1 . . . . . 902 A HB# . 27626 1 557 . 1 1 46 46 ALA HB2 H 1 1.527 0.010 . 1 . . . . . 902 A HB# . 27626 1 558 . 1 1 46 46 ALA HB3 H 1 1.527 0.010 . 1 . . . . . 902 A HB# . 27626 1 559 . 1 1 46 46 ALA C C 13 180.388 0.020 . 1 . . . . . 902 A C . 27626 1 560 . 1 1 46 46 ALA CA C 13 54.816 0.040 . 1 . . . . . 902 A CA . 27626 1 561 . 1 1 46 46 ALA CB C 13 17.802 0.040 . 1 . . . . . 902 A CB . 27626 1 562 . 1 1 46 46 ALA N N 15 122.261 0.051 . 1 . . . . . 902 A N . 27626 1 563 . 1 1 47 47 GLN H H 1 8.013 0.010 . 1 . . . . . 903 Q HN . 27626 1 564 . 1 1 47 47 GLN HA H 1 4.075 0.010 . 1 . . . . . 903 Q HA . 27626 1 565 . 1 1 47 47 GLN HB2 H 1 2.248 0.012 . 2 . . . . . 903 Q HB# . 27626 1 566 . 1 1 47 47 GLN HB3 H 1 2.247 0.012 . 2 . . . . . 903 Q HB# . 27626 1 567 . 1 1 47 47 GLN HG2 H 1 2.476 0.010 . 2 . . . . . 903 Q HG1 . 27626 1 568 . 1 1 47 47 GLN HG3 H 1 2.408 0.010 . 2 . . . . . 903 Q HG2 . 27626 1 569 . 1 1 47 47 GLN HE21 H 1 6.857 0.010 . 1 . . . . . 903 Q HE21 . 27626 1 570 . 1 1 47 47 GLN HE22 H 1 7.861 0.010 . 1 . . . . . 903 Q HE22 . 27626 1 571 . 1 1 47 47 GLN C C 13 178.316 0.020 . 1 . . . . . 903 Q C . 27626 1 572 . 1 1 47 47 GLN CA C 13 58.600 0.040 . 1 . . . . . 903 Q CA . 27626 1 573 . 1 1 47 47 GLN CB C 13 27.856 0.055 . 1 . . . . . 903 Q CB . 27626 1 574 . 1 1 47 47 GLN CG C 13 33.098 0.054 . 1 . . . . . 903 Q CG . 27626 1 575 . 1 1 47 47 GLN CD C 13 180.122 0.020 . 1 . . . . . 903 Q CD . 27626 1 576 . 1 1 47 47 GLN N N 15 120.193 0.041 . 1 . . . . . 903 Q N . 27626 1 577 . 1 1 47 47 GLN NE2 N 15 112.673 0.040 . 1 . . . . . 903 Q NE2 . 27626 1 578 . 1 1 48 48 LEU H H 1 8.225 0.010 . 1 . . . . . 904 L HN . 27626 1 579 . 1 1 48 48 LEU HA H 1 4.101 0.010 . 1 . . . . . 904 L HA . 27626 1 580 . 1 1 48 48 LEU HB2 H 1 1.836 0.010 . 2 . . . . . 904 L HB1 . 27626 1 581 . 1 1 48 48 LEU HB3 H 1 1.609 0.010 . 2 . . . . . 904 L HB2 . 27626 1 582 . 1 1 48 48 LEU HG H 1 1.779 0.010 . 1 . . . . . 904 L HG . 27626 1 583 . 1 1 48 48 LEU HD11 H 1 0.899 0.010 . 2 . . . . . 904 L HD# . 27626 1 584 . 1 1 48 48 LEU HD12 H 1 0.899 0.010 . 2 . . . . . 904 L HD# . 27626 1 585 . 1 1 48 48 LEU HD13 H 1 0.899 0.010 . 2 . . . . . 904 L HD# . 27626 1 586 . 1 1 48 48 LEU HD21 H 1 0.898 0.010 . 2 . . . . . 904 L HD# . 27626 1 587 . 1 1 48 48 LEU HD22 H 1 0.898 0.010 . 2 . . . . . 904 L HD# . 27626 1 588 . 1 1 48 48 LEU HD23 H 1 0.898 0.010 . 2 . . . . . 904 L HD# . 27626 1 589 . 1 1 48 48 LEU C C 13 179.122 0.020 . 1 . . . . . 904 L C . 27626 1 590 . 1 1 48 48 LEU CA C 13 57.700 0.040 . 1 . . . . . 904 L CA . 27626 1 591 . 1 1 48 48 LEU CB C 13 41.707 0.052 . 1 . . . . . 904 L CB . 27626 1 592 . 1 1 48 48 LEU CG C 13 27.003 0.069 . 1 . . . . . 904 L CG . 27626 1 593 . 1 1 48 48 LEU CD1 C 13 23.209 0.090 . 2 . . . . . 904 L CD1 . 27626 1 594 . 1 1 48 48 LEU CD2 C 13 25.315 0.040 . 2 . . . . . 904 L CD2 . 27626 1 595 . 1 1 48 48 LEU N N 15 120.701 0.046 . 1 . . . . . 904 L N . 27626 1 596 . 1 1 49 49 ALA H H 1 7.980 0.010 . 1 . . . . . 905 A HN . 27626 1 597 . 1 1 49 49 ALA HA H 1 4.268 0.010 . 1 . . . . . 905 A HA . 27626 1 598 . 1 1 49 49 ALA HB1 H 1 1.526 0.010 . 1 . . . . . 905 A HB# . 27626 1 599 . 1 1 49 49 ALA HB2 H 1 1.526 0.010 . 1 . . . . . 905 A HB# . 27626 1 600 . 1 1 49 49 ALA HB3 H 1 1.526 0.010 . 1 . . . . . 905 A HB# . 27626 1 601 . 1 1 49 49 ALA C C 13 180.786 0.024 . 1 . . . . . 905 A C . 27626 1 602 . 1 1 49 49 ALA CA C 13 54.756 0.040 . 1 . . . . . 905 A CA . 27626 1 603 . 1 1 49 49 ALA CB C 13 17.941 0.100 . 1 . . . . . 905 A CB . 27626 1 604 . 1 1 49 49 ALA N N 15 121.140 0.044 . 1 . . . . . 905 A N . 27626 1 605 . 1 1 50 50 ARG H H 1 7.930 0.010 . 1 . . . . . 906 R HN . 27626 1 606 . 1 1 50 50 ARG HG2 H 1 1.631 0.020 . 2 . . . . . 906 R HG# . 27626 1 607 . 1 1 50 50 ARG HG3 H 1 1.631 0.020 . 2 . . . . . 906 R HG# . 27626 1 608 . 1 1 50 50 ARG HD2 H 1 3.262 0.010 . 2 . . . . . 906 R HD# . 27626 1 609 . 1 1 50 50 ARG HD3 H 1 3.262 0.010 . 2 . . . . . 906 R HD# . 27626 1 610 . 1 1 50 50 ARG C C 13 178.795 0.040 . 1 . . . . . 906 R C . 27626 1 611 . 1 1 50 50 ARG CA C 13 59.211 0.040 . 1 . . . . . 906 R CA . 27626 1 612 . 1 1 50 50 ARG CB C 13 30.021 0.080 . 1 . . . . . 906 R CB . 27626 1 613 . 1 1 50 50 ARG CG C 13 27.559 0.080 . 1 . . . . . 906 R CG . 27626 1 614 . 1 1 50 50 ARG CD C 13 43.526 0.080 . 1 . . . . . 906 R CD . 27626 1 615 . 1 1 50 50 ARG N N 15 120.335 0.040 . 1 . . . . . 906 R N . 27626 1 616 . 1 1 51 51 GLU H H 1 8.325 0.010 . 1 . . . . . 907 E HN . 27626 1 617 . 1 1 51 51 GLU HA H 1 4.091 0.010 . 1 . . . . . 907 E HA . 27626 1 618 . 1 1 51 51 GLU HB2 H 1 2.120 0.020 . 2 . . . . . 907 E HB# . 27626 1 619 . 1 1 51 51 GLU HB3 H 1 2.120 0.020 . 2 . . . . . 907 E HB# . 27626 1 620 . 1 1 51 51 GLU HG2 H 1 2.295 0.013 . 2 . . . . . 907 E HG1 . 27626 1 621 . 1 1 51 51 GLU HG3 H 1 2.555 0.011 . 2 . . . . . 907 E HG2 . 27626 1 622 . 1 1 51 51 GLU C C 13 179.574 0.020 . 1 . . . . . 907 E C . 27626 1 623 . 1 1 51 51 GLU CA C 13 59.306 0.040 . 1 . . . . . 907 E CA . 27626 1 624 . 1 1 51 51 GLU CB C 13 29.479 0.080 . 1 . . . . . 907 E CB . 27626 1 625 . 1 1 51 51 GLU CG C 13 36.648 0.040 . 1 . . . . . 907 E CG . 27626 1 626 . 1 1 51 51 GLU CD C 13 183.386 0.020 . 1 . . . . . 907 E CD . 27626 1 627 . 1 1 51 51 GLU N N 15 120.554 0.040 . 1 . . . . . 907 E N . 27626 1 628 . 1 1 52 52 ASP H H 1 8.448 0.010 . 1 . . . . . 908 D HN . 27626 1 629 . 1 1 52 52 ASP HA H 1 4.500 0.010 . 1 . . . . . 908 D HA . 27626 1 630 . 1 1 52 52 ASP HB2 H 1 2.808 0.010 . 2 . . . . . 908 D HB1 . 27626 1 631 . 1 1 52 52 ASP HB3 H 1 2.720 0.010 . 2 . . . . . 908 D HB2 . 27626 1 632 . 1 1 52 52 ASP C C 13 178.153 0.020 . 1 . . . . . 908 D C . 27626 1 633 . 1 1 52 52 ASP CA C 13 57.196 0.044 . 1 . . . . . 908 D CA . 27626 1 634 . 1 1 52 52 ASP CB C 13 40.742 0.040 . 1 . . . . . 908 D CB . 27626 1 635 . 1 1 52 52 ASP CG C 13 179.226 0.020 . 1 . . . . . 908 D CG . 27626 1 636 . 1 1 52 52 ASP N N 15 121.049 0.040 . 1 . . . . . 908 D N . 27626 1 637 . 1 1 53 53 ALA H H 1 7.996 0.010 . 1 . . . . . 909 A HN . 27626 1 638 . 1 1 53 53 ALA HA H 1 4.223 0.010 . 1 . . . . . 909 A HA . 27626 1 639 . 1 1 53 53 ALA HB1 H 1 1.561 0.010 . 1 . . . . . 909 A HB# . 27626 1 640 . 1 1 53 53 ALA HB2 H 1 1.561 0.010 . 1 . . . . . 909 A HB# . 27626 1 641 . 1 1 53 53 ALA HB3 H 1 1.561 0.010 . 1 . . . . . 909 A HB# . 27626 1 642 . 1 1 53 53 ALA C C 13 180.755 0.020 . 1 . . . . . 909 A C . 27626 1 643 . 1 1 53 53 ALA CA C 13 54.992 0.040 . 1 . . . . . 909 A CA . 27626 1 644 . 1 1 53 53 ALA CB C 13 18.097 0.074 . 1 . . . . . 909 A CB . 27626 1 645 . 1 1 53 53 ALA N N 15 122.830 0.040 . 1 . . . . . 909 A N . 27626 1 646 . 1 1 54 54 GLU H H 1 8.222 0.010 . 1 . . . . . 910 E HN . 27626 1 647 . 1 1 54 54 GLU HA H 1 4.094 0.010 . 1 . . . . . 910 E HA . 27626 1 648 . 1 1 54 54 GLU HB2 H 1 2.134 0.010 . 2 . . . . . 910 E HB# . 27626 1 649 . 1 1 54 54 GLU HB3 H 1 2.134 0.010 . 2 . . . . . 910 E HB# . 27626 1 650 . 1 1 54 54 GLU HG2 H 1 2.487 0.010 . 2 . . . . . 910 E HG1 . 27626 1 651 . 1 1 54 54 GLU HG3 H 1 2.299 0.010 . 2 . . . . . 910 E HG2 . 27626 1 652 . 1 1 54 54 GLU C C 13 178.884 0.020 . 1 . . . . . 910 E C . 27626 1 653 . 1 1 54 54 GLU CA C 13 59.125 0.040 . 1 . . . . . 910 E CA . 27626 1 654 . 1 1 54 54 GLU CB C 13 29.588 0.080 . 1 . . . . . 910 E CB . 27626 1 655 . 1 1 54 54 GLU CG C 13 36.472 0.080 . 1 . . . . . 910 E CG . 27626 1 656 . 1 1 54 54 GLU CD C 13 183.406 0.020 . 1 . . . . . 910 E CD . 27626 1 657 . 1 1 54 54 GLU N N 15 118.949 0.040 . 1 . . . . . 910 E N . 27626 1 658 . 1 1 55 55 ARG H H 1 8.058 0.010 . 1 . . . . . 911 R HN . 27626 1 659 . 1 1 55 55 ARG HA H 1 4.088 0.010 . 1 . . . . . 911 R HA . 27626 1 660 . 1 1 55 55 ARG HB2 H 1 2.027 0.020 . 2 . . . . . 911 R HB# . 27626 1 661 . 1 1 55 55 ARG HB3 H 1 2.027 0.020 . 2 . . . . . 911 R HB# . 27626 1 662 . 1 1 55 55 ARG HD2 H 1 3.275 0.010 . 2 . . . . . 911 R HD# . 27626 1 663 . 1 1 55 55 ARG HD3 H 1 3.275 0.010 . 2 . . . . . 911 R HD# . 27626 1 664 . 1 1 55 55 ARG C C 13 178.629 0.020 . 1 . . . . . 911 R C . 27626 1 665 . 1 1 55 55 ARG CA C 13 59.602 0.040 . 1 . . . . . 911 R CA . 27626 1 666 . 1 1 55 55 ARG CB C 13 29.772 0.055 . 1 . . . . . 911 R CB . 27626 1 667 . 1 1 55 55 ARG CG C 13 27.268 0.080 . 1 . . . . . 911 R CG . 27626 1 668 . 1 1 55 55 ARG CD C 13 43.176 0.080 . 1 . . . . . 911 R CD . 27626 1 669 . 1 1 55 55 ARG N N 15 121.351 0.040 . 1 . . . . . 911 R N . 27626 1 670 . 1 1 56 56 GLU H H 1 8.186 0.010 . 1 . . . . . 912 E HN . 27626 1 671 . 1 1 56 56 GLU HA H 1 4.097 0.010 . 1 . . . . . 912 E HA . 27626 1 672 . 1 1 56 56 GLU HB2 H 1 2.103 0.010 . 2 . . . . . 912 E HB# . 27626 1 673 . 1 1 56 56 GLU HB3 H 1 2.103 0.010 . 2 . . . . . 912 E HB# . 27626 1 674 . 1 1 56 56 GLU HG2 H 1 2.423 0.010 . 2 . . . . . 912 E HG1 . 27626 1 675 . 1 1 56 56 GLU HG3 H 1 2.231 0.010 . 2 . . . . . 912 E HG2 . 27626 1 676 . 1 1 56 56 GLU C C 13 178.936 0.020 . 1 . . . . . 912 E C . 27626 1 677 . 1 1 56 56 GLU CA C 13 59.439 0.040 . 1 . . . . . 912 E CA . 27626 1 678 . 1 1 56 56 GLU CB C 13 29.551 0.089 . 1 . . . . . 912 E CB . 27626 1 679 . 1 1 56 56 GLU CG C 13 36.453 0.080 . 1 . . . . . 912 E CG . 27626 1 680 . 1 1 56 56 GLU CD C 13 183.583 0.020 . 1 . . . . . 912 E CD . 27626 1 681 . 1 1 56 56 GLU N N 15 119.575 0.043 . 1 . . . . . 912 E N . 27626 1 682 . 1 1 57 57 LEU H H 1 7.885 0.010 . 1 . . . . . 913 L HN . 27626 1 683 . 1 1 57 57 LEU HA H 1 4.136 0.010 . 1 . . . . . 913 L HA . 27626 1 684 . 1 1 57 57 LEU HB2 H 1 1.858 0.010 . 2 . . . . . 913 L HB1 . 27626 1 685 . 1 1 57 57 LEU HB3 H 1 1.744 0.010 . 2 . . . . . 913 L HB2 . 27626 1 686 . 1 1 57 57 LEU HG H 1 1.757 0.020 . 1 . . . . . 913 L HG . 27626 1 687 . 1 1 57 57 LEU HD11 H 1 0.965 0.010 . 2 . . . . . 913 L HD1# . 27626 1 688 . 1 1 57 57 LEU HD12 H 1 0.965 0.010 . 2 . . . . . 913 L HD1# . 27626 1 689 . 1 1 57 57 LEU HD13 H 1 0.965 0.010 . 2 . . . . . 913 L HD1# . 27626 1 690 . 1 1 57 57 LEU HD21 H 1 0.931 0.010 . 2 . . . . . 913 L HD2# . 27626 1 691 . 1 1 57 57 LEU HD22 H 1 0.931 0.010 . 2 . . . . . 913 L HD2# . 27626 1 692 . 1 1 57 57 LEU HD23 H 1 0.931 0.010 . 2 . . . . . 913 L HD2# . 27626 1 693 . 1 1 57 57 LEU C C 13 179.610 0.020 . 1 . . . . . 913 L C . 27626 1 694 . 1 1 57 57 LEU CA C 13 58.064 0.057 . 1 . . . . . 913 L CA . 27626 1 695 . 1 1 57 57 LEU CB C 13 41.801 0.040 . 1 . . . . . 913 L CB . 27626 1 696 . 1 1 57 57 LEU CG C 13 26.806 0.080 . 1 . . . . . 913 L CG . 27626 1 697 . 1 1 57 57 LEU CD1 C 13 24.758 0.040 . 2 . . . . . 913 L CD1 . 27626 1 698 . 1 1 57 57 LEU CD2 C 13 24.093 0.040 . 2 . . . . . 913 L CD2 . 27626 1 699 . 1 1 57 57 LEU N N 15 120.111 0.040 . 1 . . . . . 913 L N . 27626 1 700 . 1 1 58 58 LYS H H 1 8.030 0.010 . 1 . . . . . 914 K HN . 27626 1 701 . 1 1 58 58 LYS HA H 1 4.126 0.010 . 1 . . . . . 914 K HA . 27626 1 702 . 1 1 58 58 LYS HB2 H 1 1.997 0.010 . 2 . . . . . 914 K HB# . 27626 1 703 . 1 1 58 58 LYS HB3 H 1 1.997 0.010 . 2 . . . . . 914 K HB# . 27626 1 704 . 1 1 58 58 LYS HG2 H 1 1.548 0.020 . 2 . . . . . 914 K HG# . 27626 1 705 . 1 1 58 58 LYS HG3 H 1 1.548 0.020 . 2 . . . . . 914 K HG# . 27626 1 706 . 1 1 58 58 LYS HD2 H 1 1.704 0.020 . 2 . . . . . 914 K HD# . 27626 1 707 . 1 1 58 58 LYS HD3 H 1 1.704 0.020 . 2 . . . . . 914 K HD# . 27626 1 708 . 1 1 58 58 LYS HE2 H 1 3.020 0.020 . 2 . . . . . 914 K HE# . 27626 1 709 . 1 1 58 58 LYS HE3 H 1 3.020 0.020 . 2 . . . . . 914 K HE# . 27626 1 710 . 1 1 58 58 LYS C C 13 179.503 0.020 . 1 . . . . . 914 K C . 27626 1 711 . 1 1 58 58 LYS CA C 13 59.370 0.040 . 1 . . . . . 914 K CA . 27626 1 712 . 1 1 58 58 LYS CB C 13 32.263 0.054 . 1 . . . . . 914 K CB . 27626 1 713 . 1 1 58 58 LYS CG C 13 25.041 0.080 . 1 . . . . . 914 K CG . 27626 1 714 . 1 1 58 58 LYS CD C 13 29.276 0.080 . 1 . . . . . 914 K CD . 27626 1 715 . 1 1 58 58 LYS CE C 13 42.186 0.080 . 1 . . . . . 914 K CE . 27626 1 716 . 1 1 58 58 LYS N N 15 120.336 0.040 . 1 . . . . . 914 K N . 27626 1 717 . 1 1 59 59 GLU H H 1 8.375 0.010 . 1 . . . . . 915 E HN . 27626 1 718 . 1 1 59 59 GLU HA H 1 4.108 0.010 . 1 . . . . . 915 E HA . 27626 1 719 . 1 1 59 59 GLU HB2 H 1 2.125 0.020 . 2 . . . . . 915 E HB# . 27626 1 720 . 1 1 59 59 GLU HB3 H 1 2.125 0.020 . 2 . . . . . 915 E HB# . 27626 1 721 . 1 1 59 59 GLU HG2 H 1 2.502 0.010 . 2 . . . . . 915 E HG1 . 27626 1 722 . 1 1 59 59 GLU HG3 H 1 2.291 0.010 . 2 . . . . . 915 E HG2 . 27626 1 723 . 1 1 59 59 GLU C C 13 179.875 0.020 . 1 . . . . . 915 E C . 27626 1 724 . 1 1 59 59 GLU CA C 13 59.426 0.040 . 1 . . . . . 915 E CA . 27626 1 725 . 1 1 59 59 GLU CB C 13 29.462 0.040 . 1 . . . . . 915 E CB . 27626 1 726 . 1 1 59 59 GLU CG C 13 36.625 0.040 . 1 . . . . . 915 E CG . 27626 1 727 . 1 1 59 59 GLU CD C 13 183.474 0.020 . 1 . . . . . 915 E CD . 27626 1 728 . 1 1 59 59 GLU N N 15 119.975 0.040 . 1 . . . . . 915 E N . 27626 1 729 . 1 1 60 60 LYS H H 1 8.237 0.010 . 1 . . . . . 916 K HN . 27626 1 730 . 1 1 60 60 LYS HA H 1 4.149 0.010 . 1 . . . . . 916 K HA . 27626 1 731 . 1 1 60 60 LYS HB2 H 1 1.992 0.020 . 2 . . . . . 916 K HB# . 27626 1 732 . 1 1 60 60 LYS HB3 H 1 1.992 0.020 . 2 . . . . . 916 K HB# . 27626 1 733 . 1 1 60 60 LYS HG2 H 1 1.704 0.010 . 2 . . . . . 916 K HG1 . 27626 1 734 . 1 1 60 60 LYS HG3 H 1 1.505 0.020 . 2 . . . . . 916 K HG2 . 27626 1 735 . 1 1 60 60 LYS HD2 H 1 1.709 0.010 . 2 . . . . . 916 K HD# . 27626 1 736 . 1 1 60 60 LYS HD3 H 1 1.709 0.010 . 2 . . . . . 916 K HD# . 27626 1 737 . 1 1 60 60 LYS HE2 H 1 2.979 0.020 . 2 . . . . . 916 K HE# . 27626 1 738 . 1 1 60 60 LYS HE3 H 1 2.979 0.020 . 2 . . . . . 916 K HE# . 27626 1 739 . 1 1 60 60 LYS C C 13 179.649 0.020 . 1 . . . . . 916 K C . 27626 1 740 . 1 1 60 60 LYS CA C 13 59.491 0.040 . 1 . . . . . 916 K CA . 27626 1 741 . 1 1 60 60 LYS CB C 13 32.470 0.106 . 1 . . . . . 916 K CB . 27626 1 742 . 1 1 60 60 LYS CG C 13 25.580 0.040 . 1 . . . . . 916 K CG . 27626 1 743 . 1 1 60 60 LYS CD C 13 29.362 0.080 . 1 . . . . . 916 K CD . 27626 1 744 . 1 1 60 60 LYS CE C 13 42.254 0.080 . 1 . . . . . 916 K CE . 27626 1 745 . 1 1 60 60 LYS N N 15 121.100 0.047 . 1 . . . . . 916 K N . 27626 1 746 . 1 1 61 61 GLU H H 1 8.234 0.010 . 1 . . . . . 917 E HN . 27626 1 747 . 1 1 61 61 GLU HA H 1 4.238 0.010 . 1 . . . . . 917 E HA . 27626 1 748 . 1 1 61 61 GLU HB2 H 1 2.196 0.020 . 2 . . . . . 917 E HB1 . 27626 1 749 . 1 1 61 61 GLU HB3 H 1 2.028 0.020 . 2 . . . . . 917 E HB2 . 27626 1 750 . 1 1 61 61 GLU HG2 H 1 2.367 0.010 . 2 . . . . . 917 E HG# . 27626 1 751 . 1 1 61 61 GLU HG3 H 1 2.367 0.010 . 2 . . . . . 917 E HG# . 27626 1 752 . 1 1 61 61 GLU C C 13 178.881 0.020 . 1 . . . . . 917 E C . 27626 1 753 . 1 1 61 61 GLU CA C 13 58.961 0.040 . 1 . . . . . 917 E CA . 27626 1 754 . 1 1 61 61 GLU CB C 13 29.196 0.080 . 1 . . . . . 917 E CB . 27626 1 755 . 1 1 61 61 GLU CG C 13 36.059 0.080 . 1 . . . . . 917 E CG . 27626 1 756 . 1 1 61 61 GLU CD C 13 183.682 0.020 . 1 . . . . . 917 E CD . 27626 1 757 . 1 1 61 61 GLU N N 15 121.440 0.040 . 1 . . . . . 917 E N . 27626 1 758 . 1 1 62 62 GLU H H 1 8.335 0.010 . 1 . . . . . 918 E HN . 27626 1 759 . 1 1 62 62 GLU HA H 1 4.177 0.020 . 1 . . . . . 918 E HA . 27626 1 760 . 1 1 62 62 GLU HB2 H 1 2.123 0.020 . 2 . . . . . 918 E HB# . 27626 1 761 . 1 1 62 62 GLU HB3 H 1 2.123 0.020 . 2 . . . . . 918 E HB# . 27626 1 762 . 1 1 62 62 GLU HG2 H 1 2.365 0.020 . 2 . . . . . 918 E HG# . 27626 1 763 . 1 1 62 62 GLU HG3 H 1 2.365 0.020 . 2 . . . . . 918 E HG# . 27626 1 764 . 1 1 62 62 GLU C C 13 178.914 0.020 . 1 . . . . . 918 E C . 27626 1 765 . 1 1 62 62 GLU CA C 13 59.149 0.040 . 1 . . . . . 918 E CA . 27626 1 766 . 1 1 62 62 GLU CB C 13 29.369 0.069 . 1 . . . . . 918 E CB . 27626 1 767 . 1 1 62 62 GLU CG C 13 36.234 0.080 . 1 . . . . . 918 E CG . 27626 1 768 . 1 1 62 62 GLU CD C 13 183.495 0.020 . 1 . . . . . 918 E CD . 27626 1 769 . 1 1 62 62 GLU N N 15 120.585 0.040 . 1 . . . . . 918 E N . 27626 1 770 . 1 1 63 63 ALA H H 1 8.057 0.010 . 1 . . . . . 919 A HN . 27626 1 771 . 1 1 63 63 ALA HA H 1 4.160 0.015 . 1 . . . . . 919 A HA . 27626 1 772 . 1 1 63 63 ALA HB1 H 1 1.540 0.010 . 1 . . . . . 919 A HB# . 27626 1 773 . 1 1 63 63 ALA HB2 H 1 1.540 0.010 . 1 . . . . . 919 A HB# . 27626 1 774 . 1 1 63 63 ALA HB3 H 1 1.540 0.010 . 1 . . . . . 919 A HB# . 27626 1 775 . 1 1 63 63 ALA C C 13 180.597 0.020 . 1 . . . . . 919 A C . 27626 1 776 . 1 1 63 63 ALA CA C 13 55.024 0.040 . 1 . . . . . 919 A CA . 27626 1 777 . 1 1 63 63 ALA CB C 13 18.025 0.132 . 1 . . . . . 919 A CB . 27626 1 778 . 1 1 63 63 ALA N N 15 121.692 0.040 . 1 . . . . . 919 A N . 27626 1 779 . 1 1 64 64 ARG H H 1 7.981 0.010 . 1 . . . . . 920 R HN . 27626 1 780 . 1 1 64 64 ARG HA H 1 4.129 0.020 . 1 . . . . . 920 R HA . 27626 1 781 . 1 1 64 64 ARG HB2 H 1 1.994 0.020 . 2 . . . . . 920 R HB# . 27626 1 782 . 1 1 64 64 ARG HB3 H 1 1.994 0.020 . 2 . . . . . 920 R HB# . 27626 1 783 . 1 1 64 64 ARG HG2 H 1 1.713 0.020 . 2 . . . . . 920 R HG# . 27626 1 784 . 1 1 64 64 ARG HG3 H 1 1.713 0.020 . 2 . . . . . 920 R HG# . 27626 1 785 . 1 1 64 64 ARG HD2 H 1 3.248 0.020 . 2 . . . . . 920 R HD# . 27626 1 786 . 1 1 64 64 ARG HD3 H 1 3.248 0.020 . 2 . . . . . 920 R HD# . 27626 1 787 . 1 1 64 64 ARG C C 13 178.551 0.020 . 1 . . . . . 920 R C . 27626 1 788 . 1 1 64 64 ARG CA C 13 59.291 0.040 . 1 . . . . . 920 R CA . 27626 1 789 . 1 1 64 64 ARG CB C 13 29.830 0.040 . 1 . . . . . 920 R CB . 27626 1 790 . 1 1 64 64 ARG CG C 13 26.991 0.080 . 1 . . . . . 920 R CG . 27626 1 791 . 1 1 64 64 ARG CD C 13 43.126 0.080 . 1 . . . . . 920 R CD . 27626 1 792 . 1 1 64 64 ARG N N 15 120.259 0.040 . 1 . . . . . 920 R N . 27626 1 793 . 1 1 65 65 ARG H H 1 8.208 0.010 . 1 . . . . . 921 R HN . 27626 1 794 . 1 1 65 65 ARG HA H 1 4.090 0.010 . 1 . . . . . 921 R HA . 27626 1 795 . 1 1 65 65 ARG HB2 H 1 1.968 0.010 . 2 . . . . . 921 R HB# . 27626 1 796 . 1 1 65 65 ARG HB3 H 1 1.968 0.010 . 2 . . . . . 921 R HB# . 27626 1 797 . 1 1 65 65 ARG HG2 H 1 1.740 0.020 . 2 . . . . . 921 R HG# . 27626 1 798 . 1 1 65 65 ARG HG3 H 1 1.740 0.020 . 2 . . . . . 921 R HG# . 27626 1 799 . 1 1 65 65 ARG HD2 H 1 3.232 0.020 . 2 . . . . . 921 R HD# . 27626 1 800 . 1 1 65 65 ARG HD3 H 1 3.232 0.020 . 2 . . . . . 921 R HD# . 27626 1 801 . 1 1 65 65 ARG C C 13 178.973 0.020 . 1 . . . . . 921 R C . 27626 1 802 . 1 1 65 65 ARG CA C 13 59.096 0.040 . 1 . . . . . 921 R CA . 27626 1 803 . 1 1 65 65 ARG CB C 13 30.073 0.095 . 1 . . . . . 921 R CB . 27626 1 804 . 1 1 65 65 ARG CG C 13 27.453 0.080 . 1 . . . . . 921 R CG . 27626 1 805 . 1 1 65 65 ARG CD C 13 43.268 0.080 . 1 . . . . . 921 R CD . 27626 1 806 . 1 1 65 65 ARG N N 15 119.984 0.040 . 1 . . . . . 921 R N . 27626 1 807 . 1 1 66 66 LYS H H 1 8.089 0.010 . 1 . . . . . 922 K HN . 27626 1 808 . 1 1 66 66 LYS HA H 1 4.043 0.010 . 1 . . . . . 922 K HA . 27626 1 809 . 1 1 66 66 LYS HB2 H 1 1.912 0.010 . 2 . . . . . 922 K HB# . 27626 1 810 . 1 1 66 66 LYS HB3 H 1 1.912 0.010 . 2 . . . . . 922 K HB# . 27626 1 811 . 1 1 66 66 LYS HG2 H 1 1.636 0.020 . 2 . . . . . 922 K HG1 . 27626 1 812 . 1 1 66 66 LYS HG3 H 1 1.454 0.010 . 2 . . . . . 922 K HG2 . 27626 1 813 . 1 1 66 66 LYS HD2 H 1 1.690 0.020 . 2 . . . . . 922 K HD# . 27626 1 814 . 1 1 66 66 LYS HD3 H 1 1.690 0.020 . 2 . . . . . 922 K HD# . 27626 1 815 . 1 1 66 66 LYS HE2 H 1 2.986 0.010 . 2 . . . . . 922 K HE# . 27626 1 816 . 1 1 66 66 LYS HE3 H 1 2.986 0.010 . 2 . . . . . 922 K HE# . 27626 1 817 . 1 1 66 66 LYS C C 13 178.567 0.020 . 1 . . . . . 922 K C . 27626 1 818 . 1 1 66 66 LYS CA C 13 59.474 0.040 . 1 . . . . . 922 K CA . 27626 1 819 . 1 1 66 66 LYS CB C 13 32.518 0.068 . 1 . . . . . 922 K CB . 27626 1 820 . 1 1 66 66 LYS CG C 13 25.377 0.040 . 1 . . . . . 922 K CG . 27626 1 821 . 1 1 66 66 LYS CD C 13 29.286 0.080 . 1 . . . . . 922 K CD . 27626 1 822 . 1 1 66 66 LYS CE C 13 42.131 0.080 . 1 . . . . . 922 K CE . 27626 1 823 . 1 1 66 66 LYS N N 15 119.209 0.040 . 1 . . . . . 922 K N . 27626 1 824 . 1 1 67 67 LYS H H 1 7.832 0.010 . 1 . . . . . 923 K HN . 27626 1 825 . 1 1 67 67 LYS HA H 1 4.094 0.010 . 1 . . . . . 923 K HA . 27626 1 826 . 1 1 67 67 LYS HB2 H 1 1.990 0.010 . 2 . . . . . 923 K HB# . 27626 1 827 . 1 1 67 67 LYS HB3 H 1 1.990 0.010 . 2 . . . . . 923 K HB# . 27626 1 828 . 1 1 67 67 LYS HG2 H 1 1.557 0.020 . 2 . . . . . 923 K HG1 . 27626 1 829 . 1 1 67 67 LYS HG3 H 1 1.428 0.020 . 2 . . . . . 923 K HG2 . 27626 1 830 . 1 1 67 67 LYS HD2 H 1 1.697 0.020 . 2 . . . . . 923 K HD# . 27626 1 831 . 1 1 67 67 LYS HD3 H 1 1.697 0.020 . 2 . . . . . 923 K HD# . 27626 1 832 . 1 1 67 67 LYS HE2 H 1 2.983 0.010 . 2 . . . . . 923 K HE# . 27626 1 833 . 1 1 67 67 LYS HE3 H 1 2.983 0.010 . 2 . . . . . 923 K HE# . 27626 1 834 . 1 1 67 67 LYS C C 13 178.611 0.020 . 1 . . . . . 923 K C . 27626 1 835 . 1 1 67 67 LYS CA C 13 59.232 0.040 . 1 . . . . . 923 K CA . 27626 1 836 . 1 1 67 67 LYS CB C 13 32.597 0.043 . 1 . . . . . 923 K CB . 27626 1 837 . 1 1 67 67 LYS CG C 13 24.865 0.080 . 1 . . . . . 923 K CG . 27626 1 838 . 1 1 67 67 LYS CD C 13 29.653 0.080 . 1 . . . . . 923 K CD . 27626 1 839 . 1 1 67 67 LYS CE C 13 42.226 0.080 . 1 . . . . . 923 K CE . 27626 1 840 . 1 1 67 67 LYS N N 15 120.276 0.040 . 1 . . . . . 923 K N . 27626 1 841 . 1 1 68 68 GLU H H 1 8.207 0.010 . 1 . . . . . 924 E HN . 27626 1 842 . 1 1 68 68 GLU HA H 1 4.117 0.020 . 1 . . . . . 924 E HA . 27626 1 843 . 1 1 68 68 GLU HB2 H 1 2.116 0.010 . 2 . . . . . 924 E HB# . 27626 1 844 . 1 1 68 68 GLU HB3 H 1 2.116 0.010 . 2 . . . . . 924 E HB# . 27626 1 845 . 1 1 68 68 GLU HG2 H 1 2.471 0.010 . 2 . . . . . 924 E HG1 . 27626 1 846 . 1 1 68 68 GLU HG3 H 1 2.264 0.010 . 2 . . . . . 924 E HG2 . 27626 1 847 . 1 1 68 68 GLU C C 13 178.918 0.020 . 1 . . . . . 924 E C . 27626 1 848 . 1 1 68 68 GLU CA C 13 59.038 0.040 . 1 . . . . . 924 E CA . 27626 1 849 . 1 1 68 68 GLU CB C 13 29.561 0.040 . 1 . . . . . 924 E CB . 27626 1 850 . 1 1 68 68 GLU CG C 13 36.513 0.080 . 1 . . . . . 924 E CG . 27626 1 851 . 1 1 68 68 GLU CD C 13 183.653 0.020 . 1 . . . . . 924 E CD . 27626 1 852 . 1 1 68 68 GLU N N 15 119.401 0.053 . 1 . . . . . 924 E N . 27626 1 853 . 1 1 69 69 LEU H H 1 7.972 0.010 . 1 . . . . . 925 L HN . 27626 1 854 . 1 1 69 69 LEU HA H 1 4.184 0.012 . 1 . . . . . 925 L HA . 27626 1 855 . 1 1 69 69 LEU HB2 H 1 1.818 0.010 . 2 . . . . . 925 L HB1 . 27626 1 856 . 1 1 69 69 LEU HB3 H 1 1.704 0.010 . 2 . . . . . 925 L HB2 . 27626 1 857 . 1 1 69 69 LEU HG H 1 1.739 0.010 . 1 . . . . . 925 L HG . 27626 1 858 . 1 1 69 69 LEU HD11 H 1 0.921 0.013 . 2 . . . . . 925 L HD1# . 27626 1 859 . 1 1 69 69 LEU HD12 H 1 0.921 0.013 . 2 . . . . . 925 L HD1# . 27626 1 860 . 1 1 69 69 LEU HD13 H 1 0.921 0.013 . 2 . . . . . 925 L HD1# . 27626 1 861 . 1 1 69 69 LEU HD21 H 1 0.943 0.010 . 2 . . . . . 925 L HD2# . 27626 1 862 . 1 1 69 69 LEU HD22 H 1 0.943 0.010 . 2 . . . . . 925 L HD2# . 27626 1 863 . 1 1 69 69 LEU HD23 H 1 0.943 0.010 . 2 . . . . . 925 L HD2# . 27626 1 864 . 1 1 69 69 LEU C C 13 179.316 0.020 . 1 . . . . . 925 L C . 27626 1 865 . 1 1 69 69 LEU CA C 13 57.563 0.040 . 1 . . . . . 925 L CA . 27626 1 866 . 1 1 69 69 LEU CB C 13 41.949 0.047 . 1 . . . . . 925 L CB . 27626 1 867 . 1 1 69 69 LEU CG C 13 26.998 0.080 . 1 . . . . . 925 L CG . 27626 1 868 . 1 1 69 69 LEU CD1 C 13 23.933 0.040 . 1 . . . . . 925 L CD1 . 27626 1 869 . 1 1 69 69 LEU CD2 C 13 24.727 0.040 . 1 . . . . . 925 L CD2 . 27626 1 870 . 1 1 69 69 LEU N N 15 120.506 0.040 . 1 . . . . . 925 L N . 27626 1 871 . 1 1 70 70 LEU H H 1 7.922 0.010 . 1 . . . . . 926 L HN . 27626 1 872 . 1 1 70 70 LEU HA H 1 4.172 0.010 . 1 . . . . . 926 L HA . 27626 1 873 . 1 1 70 70 LEU HB2 H 1 1.860 0.012 . 2 . . . . . 926 L HB1 . 27626 1 874 . 1 1 70 70 LEU HB3 H 1 1.699 0.010 . 2 . . . . . 926 L HB2 . 27626 1 875 . 1 1 70 70 LEU HG H 1 1.766 0.020 . 1 . . . . . 926 L HG . 27626 1 876 . 1 1 70 70 LEU HD11 H 1 0.920 0.010 . 2 . . . . . 926 L HD1# . 27626 1 877 . 1 1 70 70 LEU HD12 H 1 0.920 0.010 . 2 . . . . . 926 L HD1# . 27626 1 878 . 1 1 70 70 LEU HD13 H 1 0.920 0.010 . 2 . . . . . 926 L HD1# . 27626 1 879 . 1 1 70 70 LEU HD21 H 1 0.938 0.010 . 2 . . . . . 926 L HD2# . 27626 1 880 . 1 1 70 70 LEU HD22 H 1 0.938 0.010 . 2 . . . . . 926 L HD2# . 27626 1 881 . 1 1 70 70 LEU HD23 H 1 0.938 0.010 . 2 . . . . . 926 L HD2# . 27626 1 882 . 1 1 70 70 LEU C C 13 179.596 0.020 . 1 . . . . . 926 L C . 27626 1 883 . 1 1 70 70 LEU CA C 13 57.671 0.055 . 1 . . . . . 926 L CA . 27626 1 884 . 1 1 70 70 LEU CB C 13 41.778 0.040 . 1 . . . . . 926 L CB . 27626 1 885 . 1 1 70 70 LEU CG C 13 26.897 0.080 . 1 . . . . . 926 L CG . 27626 1 886 . 1 1 70 70 LEU CD1 C 13 23.650 0.040 . 2 . . . . . 926 L CD1 . 27626 1 887 . 1 1 70 70 LEU CD2 C 13 24.960 0.052 . 2 . . . . . 926 L CD2 . 27626 1 888 . 1 1 70 70 LEU N N 15 120.321 0.040 . 1 . . . . . 926 L N . 27626 1 889 . 1 1 71 71 GLU H H 1 8.134 0.010 . 1 . . . . . 927 E HN . 27626 1 890 . 1 1 71 71 GLU HA H 1 4.130 0.010 . 1 . . . . . 927 E HA . 27626 1 891 . 1 1 71 71 GLU HB2 H 1 2.114 0.020 . 2 . . . . . 927 E HB# . 27626 1 892 . 1 1 71 71 GLU HB3 H 1 2.114 0.020 . 2 . . . . . 927 E HB# . 27626 1 893 . 1 1 71 71 GLU HG2 H 1 2.477 0.010 . 2 . . . . . 927 E HG1 . 27626 1 894 . 1 1 71 71 GLU HG3 H 1 2.256 0.010 . 2 . . . . . 927 E HG2 . 27626 1 895 . 1 1 71 71 GLU C C 13 178.660 0.020 . 1 . . . . . 927 E C . 27626 1 896 . 1 1 71 71 GLU CA C 13 58.697 0.040 . 1 . . . . . 927 E CA . 27626 1 897 . 1 1 71 71 GLU CB C 13 29.600 0.040 . 1 . . . . . 927 E CB . 27626 1 898 . 1 1 71 71 GLU CG C 13 36.650 0.080 . 1 . . . . . 927 E CG . 27626 1 899 . 1 1 71 71 GLU CD C 13 183.590 0.020 . 1 . . . . . 927 E CD . 27626 1 900 . 1 1 71 71 GLU N N 15 119.336 0.040 . 1 . . . . . 927 E N . 27626 1 901 . 1 1 72 72 GLN H H 1 8.057 0.010 . 1 . . . . . 928 Q HN . 27626 1 902 . 1 1 72 72 GLN HA H 1 4.151 0.010 . 1 . . . . . 928 Q HA . 27626 1 903 . 1 1 72 72 GLN HB2 H 1 2.204 0.010 . 2 . . . . . 928 Q HB# . 27626 1 904 . 1 1 72 72 GLN HB3 H 1 2.204 0.010 . 2 . . . . . 928 Q HB# . 27626 1 905 . 1 1 72 72 GLN HG2 H 1 2.535 0.010 . 2 . . . . . 928 Q HG1 . 27626 1 906 . 1 1 72 72 GLN HG3 H 1 2.460 0.010 . 2 . . . . . 928 Q HG2 . 27626 1 907 . 1 1 72 72 GLN HE21 H 1 6.825 0.010 . 1 . . . . . 928 Q HE21 . 27626 1 908 . 1 1 72 72 GLN HE22 H 1 7.528 0.010 . 1 . . . . . 928 Q HE22 . 27626 1 909 . 1 1 72 72 GLN C C 13 178.022 0.021 . 1 . . . . . 928 Q C . 27626 1 910 . 1 1 72 72 GLN CA C 13 57.740 0.040 . 1 . . . . . 928 Q CA . 27626 1 911 . 1 1 72 72 GLN CB C 13 28.612 0.040 . 1 . . . . . 928 Q CB . 27626 1 912 . 1 1 72 72 GLN CG C 13 33.836 0.040 . 1 . . . . . 928 Q CG . 27626 1 913 . 1 1 72 72 GLN CD C 13 180.277 0.020 . 1 . . . . . 928 Q CD . 27626 1 914 . 1 1 72 72 GLN N N 15 118.917 0.040 . 1 . . . . . 928 Q N . 27626 1 915 . 1 1 72 72 GLN NE2 N 15 111.839 0.040 . 1 . . . . . 928 Q NE2 . 27626 1 916 . 1 1 73 73 MET H H 1 8.129 0.010 . 1 . . . . . 929 M HN . 27626 1 917 . 1 1 73 73 MET HA H 1 4.292 0.010 . 1 . . . . . 929 M HA . 27626 1 918 . 1 1 73 73 MET HB2 H 1 2.179 0.010 . 2 . . . . . 929 M HB# . 27626 1 919 . 1 1 73 73 MET HB3 H 1 2.179 0.010 . 2 . . . . . 929 M HB# . 27626 1 920 . 1 1 73 73 MET HG2 H 1 2.604 0.010 . 2 . . . . . 929 M HG1 . 27626 1 921 . 1 1 73 73 MET HG3 H 1 2.748 0.010 . 2 . . . . . 929 M HG2 . 27626 1 922 . 1 1 73 73 MET HE1 H 1 2.113 0.020 . 1 . . . . . 929 M HE# . 27626 1 923 . 1 1 73 73 MET HE2 H 1 2.113 0.020 . 1 . . . . . 929 M HE# . 27626 1 924 . 1 1 73 73 MET HE3 H 1 2.113 0.020 . 1 . . . . . 929 M HE# . 27626 1 925 . 1 1 73 73 MET C C 13 177.776 0.020 . 1 . . . . . 929 M C . 27626 1 926 . 1 1 73 73 MET CA C 13 57.465 0.042 . 1 . . . . . 929 M CA . 27626 1 927 . 1 1 73 73 MET CB C 13 32.766 0.048 . 1 . . . . . 929 M CB . 27626 1 928 . 1 1 73 73 MET CG C 13 32.112 0.056 . 1 . . . . . 929 M CG . 27626 1 929 . 1 1 73 73 MET CE C 13 17.063 0.080 . 1 . . . . . 929 M CE . 27626 1 930 . 1 1 73 73 MET N N 15 119.488 0.070 . 1 . . . . . 929 M N . 27626 1 931 . 1 1 74 74 GLU H H 1 8.148 0.010 . 1 . . . . . 930 E HN . 27626 1 932 . 1 1 74 74 GLU HA H 1 4.171 0.010 . 1 . . . . . 930 E HA . 27626 1 933 . 1 1 74 74 GLU HB2 H 1 2.088 0.010 . 2 . . . . . 930 E HB# . 27626 1 934 . 1 1 74 74 GLU HB3 H 1 2.088 0.010 . 2 . . . . . 930 E HB# . 27626 1 935 . 1 1 74 74 GLU HG2 H 1 2.365 0.010 . 2 . . . . . 930 E HG1 . 27626 1 936 . 1 1 74 74 GLU HG3 H 1 2.295 0.010 . 2 . . . . . 930 E HG2 . 27626 1 937 . 1 1 74 74 GLU C C 13 177.727 0.020 . 1 . . . . . 930 E C . 27626 1 938 . 1 1 74 74 GLU CA C 13 57.924 0.040 . 1 . . . . . 930 E CA . 27626 1 939 . 1 1 74 74 GLU CB C 13 29.822 0.051 . 1 . . . . . 930 E CB . 27626 1 940 . 1 1 74 74 GLU CG C 13 36.252 0.080 . 1 . . . . . 930 E CG . 27626 1 941 . 1 1 74 74 GLU CD C 13 183.712 0.020 . 1 . . . . . 930 E CD . 27626 1 942 . 1 1 74 74 GLU N N 15 120.294 0.041 . 1 . . . . . 930 E N . 27626 1 943 . 1 1 75 75 LYS H H 1 7.971 0.010 . 1 . . . . . 931 K HN . 27626 1 944 . 1 1 75 75 LYS HA H 1 4.184 0.010 . 1 . . . . . 931 K HA . 27626 1 945 . 1 1 75 75 LYS HB2 H 1 1.881 0.010 . 2 . . . . . 931 K HB1 . 27626 1 946 . 1 1 75 75 LYS HB3 H 1 1.829 0.010 . 2 . . . . . 931 K HB2 . 27626 1 947 . 1 1 75 75 LYS HG2 H 1 1.536 0.010 . 2 . . . . . 931 K HG1 . 27626 1 948 . 1 1 75 75 LYS HG3 H 1 1.449 0.010 . 2 . . . . . 931 K HG2 . 27626 1 949 . 1 1 75 75 LYS HD2 H 1 1.670 0.014 . 2 . . . . . 931 K HD# . 27626 1 950 . 1 1 75 75 LYS HD3 H 1 1.670 0.014 . 2 . . . . . 931 K HD# . 27626 1 951 . 1 1 75 75 LYS HE2 H 1 2.975 0.010 . 2 . . . . . 931 K HE# . 27626 1 952 . 1 1 75 75 LYS HE3 H 1 2.975 0.010 . 2 . . . . . 931 K HE# . 27626 1 953 . 1 1 75 75 LYS C C 13 177.226 0.020 . 1 . . . . . 931 K C . 27626 1 954 . 1 1 75 75 LYS CA C 13 57.394 0.048 . 1 . . . . . 931 K CA . 27626 1 955 . 1 1 75 75 LYS CB C 13 32.756 0.040 . 1 . . . . . 931 K CB . 27626 1 956 . 1 1 75 75 LYS CG C 13 25.037 0.040 . 1 . . . . . 931 K CG . 27626 1 957 . 1 1 75 75 LYS CD C 13 29.208 0.040 . 1 . . . . . 931 K CD . 27626 1 958 . 1 1 75 75 LYS CE C 13 42.143 0.040 . 1 . . . . . 931 K CE . 27626 1 959 . 1 1 75 75 LYS N N 15 120.191 0.040 . 1 . . . . . 931 K N . 27626 1 960 . 1 1 76 76 ALA H H 1 7.943 0.010 . 1 . . . . . 932 A HN . 27626 1 961 . 1 1 76 76 ALA HA H 1 4.257 0.010 . 1 . . . . . 932 A HA . 27626 1 962 . 1 1 76 76 ALA HB1 H 1 1.403 0.010 . 1 . . . . . 932 A HB# . 27626 1 963 . 1 1 76 76 ALA HB2 H 1 1.403 0.010 . 1 . . . . . 932 A HB# . 27626 1 964 . 1 1 76 76 ALA HB3 H 1 1.403 0.010 . 1 . . . . . 932 A HB# . 27626 1 965 . 1 1 76 76 ALA C C 13 177.952 0.020 . 1 . . . . . 932 A C . 27626 1 966 . 1 1 76 76 ALA CA C 13 52.874 0.040 . 1 . . . . . 932 A CA . 27626 1 967 . 1 1 76 76 ALA CB C 13 18.935 0.052 . 1 . . . . . 932 A CB . 27626 1 968 . 1 1 76 76 ALA N N 15 122.668 0.040 . 1 . . . . . 932 A N . 27626 1 969 . 1 1 77 77 ARG H H 1 7.880 0.010 . 1 . . . . . 933 R HN . 27626 1 970 . 1 1 77 77 ARG HA H 1 4.093 0.010 . 1 . . . . . 933 R HA . 27626 1 971 . 1 1 77 77 ARG HB2 H 1 1.721 0.010 . 2 . . . . . 933 R HB1 . 27626 1 972 . 1 1 77 77 ARG HB3 H 1 1.695 0.010 . 2 . . . . . 933 R HB2 . 27626 1 973 . 1 1 77 77 ARG HG2 H 1 1.557 0.010 . 2 . . . . . 933 R HG1 . 27626 1 974 . 1 1 77 77 ARG HG3 H 1 1.466 0.010 . 2 . . . . . 933 R HG2 . 27626 1 975 . 1 1 77 77 ARG HD2 H 1 3.099 0.010 . 2 . . . . . 933 R HD# . 27626 1 976 . 1 1 77 77 ARG HD3 H 1 3.099 0.010 . 2 . . . . . 933 R HD# . 27626 1 977 . 1 1 77 77 ARG C C 13 176.188 0.020 . 1 . . . . . 933 R C . 27626 1 978 . 1 1 77 77 ARG CA C 13 56.537 0.046 . 1 . . . . . 933 R CA . 27626 1 979 . 1 1 77 77 ARG CB C 13 30.570 0.042 . 1 . . . . . 933 R CB . 27626 1 980 . 1 1 77 77 ARG CG C 13 27.062 0.040 . 1 . . . . . 933 R CG . 27626 1 981 . 1 1 77 77 ARG CD C 13 43.373 0.040 . 1 . . . . . 933 R CD . 27626 1 982 . 1 1 77 77 ARG N N 15 118.821 0.040 . 1 . . . . . 933 R N . 27626 1 983 . 1 1 78 78 HIS H H 1 8.018 0.010 . 1 . . . . . 934 H HN . 27626 1 984 . 1 1 78 78 HIS HA H 1 4.546 0.010 . 1 . . . . . 934 H HA . 27626 1 985 . 1 1 78 78 HIS HB2 H 1 2.953 0.010 . 2 . . . . . 934 H HB1 . 27626 1 986 . 1 1 78 78 HIS HB3 H 1 2.919 0.010 . 2 . . . . . 934 H HB2 . 27626 1 987 . 1 1 78 78 HIS HD2 H 1 6.885 0.010 . 1 . . . . . 934 H HD2 . 27626 1 988 . 1 1 78 78 HIS HE1 H 1 7.852 0.010 . 1 . . . . . 934 H HE1 . 27626 1 989 . 1 1 78 78 HIS C C 13 174.828 0.024 . 1 . . . . . 934 H C . 27626 1 990 . 1 1 78 78 HIS CA C 13 55.976 0.040 . 1 . . . . . 934 H CA . 27626 1 991 . 1 1 78 78 HIS CB C 13 30.607 0.040 . 1 . . . . . 934 H CB . 27626 1 992 . 1 1 78 78 HIS CD2 C 13 120.181 0.080 . 1 . . . . . 934 H CD2 . 27626 1 993 . 1 1 78 78 HIS CE1 C 13 138.025 0.080 . 1 . . . . . 934 H CE1 . 27626 1 994 . 1 1 78 78 HIS N N 15 119.407 0.040 . 1 . . . . . 934 H N . 27626 1 995 . 1 1 79 79 GLU H H 1 8.015 0.010 . 1 . . . . . 935 E HN . 27626 1 996 . 1 1 79 79 GLU HA H 1 4.262 0.010 . 1 . . . . . 935 E HA . 27626 1 997 . 1 1 79 79 GLU HB2 H 1 1.975 0.010 . 2 . . . . . 935 E HB1 . 27626 1 998 . 1 1 79 79 GLU HB3 H 1 1.810 0.010 . 2 . . . . . 935 E HB2 . 27626 1 999 . 1 1 79 79 GLU HG2 H 1 2.121 0.010 . 2 . . . . . 935 E HG1 . 27626 1 1000 . 1 1 79 79 GLU HG3 H 1 2.091 0.010 . 2 . . . . . 935 E HG2 . 27626 1 1001 . 1 1 79 79 GLU C C 13 175.005 0.020 . 1 . . . . . 935 E C . 27626 1 1002 . 1 1 79 79 GLU CA C 13 56.298 0.040 . 1 . . . . . 935 E CA . 27626 1 1003 . 1 1 79 79 GLU CB C 13 30.429 0.041 . 1 . . . . . 935 E CB . 27626 1 1004 . 1 1 79 79 GLU CG C 13 36.245 0.040 . 1 . . . . . 935 E CG . 27626 1 1005 . 1 1 79 79 GLU CD C 13 184.134 0.020 . 1 . . . . . 935 E CD . 27626 1 1006 . 1 1 79 79 GLU N N 15 121.654 0.040 . 1 . . . . . 935 E N . 27626 1 1007 . 1 1 80 80 TRP H H 1 7.654 0.010 . 1 . . . . . 936 W HN . 27626 1 1008 . 1 1 80 80 TRP HA H 1 4.498 0.010 . 1 . . . . . 936 W HA . 27626 1 1009 . 1 1 80 80 TRP HB2 H 1 3.341 0.010 . 2 . . . . . 936 W HB1 . 27626 1 1010 . 1 1 80 80 TRP HB3 H 1 3.157 0.010 . 2 . . . . . 936 W HB2 . 27626 1 1011 . 1 1 80 80 TRP HD1 H 1 7.181 0.010 . 1 . . . . . 936 W HD1 . 27626 1 1012 . 1 1 80 80 TRP HE1 H 1 10.008 0.010 . 1 . . . . . 936 W HE1 . 27626 1 1013 . 1 1 80 80 TRP HE3 H 1 7.660 0.010 . 1 . . . . . 936 W HE3 . 27626 1 1014 . 1 1 80 80 TRP HZ2 H 1 7.420 0.010 . 1 . . . . . 936 W HZ2 . 27626 1 1015 . 1 1 80 80 TRP HZ3 H 1 7.131 0.010 . 1 . . . . . 936 W HZ3 . 27626 1 1016 . 1 1 80 80 TRP HH2 H 1 7.181 0.010 . 1 . . . . . 936 W HH2 . 27626 1 1017 . 1 1 80 80 TRP C C 13 180.972 0.020 . 1 . . . . . 936 W C . 27626 1 1018 . 1 1 80 80 TRP CA C 13 58.462 0.040 . 1 . . . . . 936 W CA . 27626 1 1019 . 1 1 80 80 TRP CB C 13 30.137 0.048 . 1 . . . . . 936 W CB . 27626 1 1020 . 1 1 80 80 TRP CD1 C 13 126.922 0.080 . 1 . . . . . 936 W CD1 . 27626 1 1021 . 1 1 80 80 TRP CE3 C 13 121.207 0.080 . 1 . . . . . 936 W CE3 . 27626 1 1022 . 1 1 80 80 TRP CZ2 C 13 114.471 0.080 . 1 . . . . . 936 W CZ2 . 27626 1 1023 . 1 1 80 80 TRP CZ3 C 13 121.932 0.080 . 1 . . . . . 936 W CZ3 . 27626 1 1024 . 1 1 80 80 TRP CH2 C 13 124.462 0.080 . 1 . . . . . 936 W CH2 . 27626 1 1025 . 1 1 80 80 TRP N N 15 126.893 0.040 . 1 . . . . . 936 W N . 27626 1 1026 . 1 1 80 80 TRP NE1 N 15 128.575 0.040 . 1 . . . . . 936 W NE1 . 27626 1 stop_ save_