################################### # 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 16560 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 16560 1 2 '2D 1H-13C HSQC' . . . 16560 1 6 '3D HNCO' . . . 16560 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 4 $SPARKY . . 16560 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 5 5 SER H H 1 8.350 0.02 . 1 . . . . 5 Ser H . 16560 1 2 . 1 1 5 5 SER N N 15 116.816 0.2 . 1 . . . . 5 Ser N . 16560 1 3 . 1 1 9 9 GLN H H 1 8.479 0.02 . 1 . . . . 9 Gln H . 16560 1 4 . 1 1 9 9 GLN N N 15 121.973 0.2 . 1 . . . . 9 Gln N . 16560 1 5 . 1 1 10 10 PRO HA H 1 4.392 0.02 . 1 . . . . 10 Pro HA . 16560 1 6 . 1 1 10 10 PRO HB2 H 1 2.301 0.02 . 2 . . . . 10 Pro HB2 . 16560 1 7 . 1 1 10 10 PRO HB3 H 1 1.904 0.02 . 2 . . . . 10 Pro HB3 . 16560 1 8 . 1 1 10 10 PRO C C 13 176.702 0.2 . 1 . . . . 10 Pro C . 16560 1 9 . 1 1 10 10 PRO CA C 13 63.029 0.2 . 1 . . . . 10 Pro CA . 16560 1 10 . 1 1 10 10 PRO CB C 13 32.056 0.2 . 1 . . . . 10 Pro CB . 16560 1 11 . 1 1 11 11 ALA H H 1 8.421 0.02 . 1 . . . . 11 Ala H . 16560 1 12 . 1 1 11 11 ALA HA H 1 4.254 0.02 . 1 . . . . 11 Ala HA . 16560 1 13 . 1 1 11 11 ALA HB1 H 1 1.380 0.02 . 1 . . . . 11 Ala HB . 16560 1 14 . 1 1 11 11 ALA HB2 H 1 1.380 0.02 . 1 . . . . 11 Ala HB . 16560 1 15 . 1 1 11 11 ALA HB3 H 1 1.380 0.02 . 1 . . . . 11 Ala HB . 16560 1 16 . 1 1 11 11 ALA C C 13 177.592 0.2 . 1 . . . . 11 Ala C . 16560 1 17 . 1 1 11 11 ALA CA C 13 52.405 0.2 . 1 . . . . 11 Ala CA . 16560 1 18 . 1 1 11 11 ALA CB C 13 19.242 0.2 . 1 . . . . 11 Ala CB . 16560 1 19 . 1 1 11 11 ALA N N 15 124.566 0.2 . 1 . . . . 11 Ala N . 16560 1 20 . 1 1 12 12 ALA H H 1 8.297 0.02 . 1 . . . . 12 Ala H . 16560 1 21 . 1 1 12 12 ALA HA H 1 4.278 0.02 . 1 . . . . 12 Ala HA . 16560 1 22 . 1 1 12 12 ALA HB1 H 1 1.376 0.02 . 1 . . . . 12 Ala HB . 16560 1 23 . 1 1 12 12 ALA HB2 H 1 1.376 0.02 . 1 . . . . 12 Ala HB . 16560 1 24 . 1 1 12 12 ALA HB3 H 1 1.376 0.02 . 1 . . . . 12 Ala HB . 16560 1 25 . 1 1 12 12 ALA C C 13 177.607 0.2 . 1 . . . . 12 Ala C . 16560 1 26 . 1 1 12 12 ALA CA C 13 52.402 0.2 . 1 . . . . 12 Ala CA . 16560 1 27 . 1 1 12 12 ALA CB C 13 19.397 0.2 . 1 . . . . 12 Ala CB . 16560 1 28 . 1 1 12 12 ALA N N 15 123.470 0.2 . 1 . . . . 12 Ala N . 16560 1 29 . 1 1 13 13 GLN H H 1 8.302 0.02 . 1 . . . . 13 Gln H . 16560 1 30 . 1 1 13 13 GLN HA H 1 4.304 0.02 . 1 . . . . 13 Gln HA . 16560 1 31 . 1 1 13 13 GLN HB2 H 1 1.947 0.02 . 2 . . . . 13 Gln HB2 . 16560 1 32 . 1 1 13 13 GLN HB3 H 1 2.076 0.02 . 2 . . . . 13 Gln HB3 . 16560 1 33 . 1 1 13 13 GLN C C 13 175.344 0.2 . 1 . . . . 13 Gln C . 16560 1 34 . 1 1 13 13 GLN CA C 13 55.396 0.2 . 1 . . . . 13 Gln CA . 16560 1 35 . 1 1 13 13 GLN CB C 13 29.738 0.2 . 1 . . . . 13 Gln CB . 16560 1 36 . 1 1 13 13 GLN N N 15 119.718 0.2 . 1 . . . . 13 Gln N . 16560 1 37 . 1 1 14 14 ALA H H 1 8.405 0.02 . 1 . . . . 14 Ala H . 16560 1 38 . 1 1 14 14 ALA HA H 1 4.580 0.02 . 1 . . . . 14 Ala HA . 16560 1 39 . 1 1 14 14 ALA HB1 H 1 1.378 0.02 . 1 . . . . 14 Ala HB . 16560 1 40 . 1 1 14 14 ALA HB2 H 1 1.378 0.02 . 1 . . . . 14 Ala HB . 16560 1 41 . 1 1 14 14 ALA HB3 H 1 1.378 0.02 . 1 . . . . 14 Ala HB . 16560 1 42 . 1 1 14 14 ALA C C 13 175.619 0.2 . 1 . . . . 14 Ala C . 16560 1 43 . 1 1 14 14 ALA CA C 13 50.607 0.2 . 1 . . . . 14 Ala CA . 16560 1 44 . 1 1 14 14 ALA CB C 13 18.031 0.2 . 1 . . . . 14 Ala CB . 16560 1 45 . 1 1 14 14 ALA N N 15 127.291 0.2 . 1 . . . . 14 Ala N . 16560 1 46 . 1 1 15 15 PRO HA H 1 4.399 0.02 . 1 . . . . 15 Pro HA . 16560 1 47 . 1 1 15 15 PRO HB2 H 1 2.304 0.02 . 2 . . . . 15 Pro HB2 . 16560 1 48 . 1 1 15 15 PRO HB3 H 1 1.914 0.02 . 2 . . . . 15 Pro HB3 . 16560 1 49 . 1 1 15 15 PRO C C 13 177.086 0.2 . 1 . . . . 15 Pro C . 16560 1 50 . 1 1 15 15 PRO CA C 13 63.294 0.2 . 1 . . . . 15 Pro CA . 16560 1 51 . 1 1 15 15 PRO CB C 13 31.988 0.2 . 1 . . . . 15 Pro CB . 16560 1 52 . 1 1 16 16 GLU H H 1 8.656 0.02 . 1 . . . . 16 Glu H . 16560 1 53 . 1 1 16 16 GLU HA H 1 4.306 0.02 . 1 . . . . 16 Glu HA . 16560 1 54 . 1 1 16 16 GLU HB2 H 1 1.964 0.02 . 2 . . . . 16 Glu HB2 . 16560 1 55 . 1 1 16 16 GLU HB3 H 1 2.057 0.02 . 2 . . . . 16 Glu HB3 . 16560 1 56 . 1 1 16 16 GLU C C 13 176.897 0.2 . 1 . . . . 16 Glu C . 16560 1 57 . 1 1 16 16 GLU CA C 13 56.771 0.2 . 1 . . . . 16 Glu CA . 16560 1 58 . 1 1 16 16 GLU CB C 13 30.209 0.2 . 1 . . . . 16 Glu CB . 16560 1 59 . 1 1 16 16 GLU N N 15 120.957 0.2 . 1 . . . . 16 Glu N . 16560 1 60 . 1 1 17 17 THR H H 1 8.202 0.02 . 1 . . . . 17 Thr H . 16560 1 61 . 1 1 17 17 THR HA H 1 4.336 0.02 . 1 . . . . 17 Thr HA . 16560 1 62 . 1 1 17 17 THR HB H 1 4.219 0.02 . 1 . . . . 17 Thr HB . 16560 1 63 . 1 1 17 17 THR HG21 H 1 1.213 0.02 . 1 . . . . 17 Thr HG2 . 16560 1 64 . 1 1 17 17 THR HG22 H 1 1.213 0.02 . 1 . . . . 17 Thr HG2 . 16560 1 65 . 1 1 17 17 THR HG23 H 1 1.213 0.02 . 1 . . . . 17 Thr HG2 . 16560 1 66 . 1 1 17 17 THR C C 13 174.612 0.2 . 1 . . . . 17 Thr C . 16560 1 67 . 1 1 17 17 THR CA C 13 61.981 0.2 . 1 . . . . 17 Thr CA . 16560 1 68 . 1 1 17 17 THR CB C 13 69.928 0.2 . 1 . . . . 17 Thr CB . 16560 1 69 . 1 1 17 17 THR CG2 C 13 21.716 0.2 . 1 . . . . 17 Thr CG2 . 16560 1 70 . 1 1 17 17 THR N N 15 115.763 0.2 . 1 . . . . 17 Thr N . 16560 1 71 . 1 1 18 18 LYS H H 1 8.373 0.02 . 1 . . . . 18 Lys H . 16560 1 72 . 1 1 18 18 LYS HA H 1 4.365 0.02 . 1 . . . . 18 Lys HA . 16560 1 73 . 1 1 18 18 LYS HB2 H 1 1.866 0.02 . 2 . . . . 18 Lys HB2 . 16560 1 74 . 1 1 18 18 LYS HB3 H 1 1.791 0.02 . 2 . . . . 18 Lys HB3 . 16560 1 75 . 1 1 18 18 LYS HD2 H 1 1.691 0.02 . 2 . . . . 18 Lys HD2 . 16560 1 76 . 1 1 18 18 LYS HD3 H 1 1.691 0.02 . 2 . . . . 18 Lys HD3 . 16560 1 77 . 1 1 18 18 LYS HE2 H 1 3.009 0.02 . 2 . . . . 18 Lys HE2 . 16560 1 78 . 1 1 18 18 LYS HE3 H 1 3.009 0.02 . 2 . . . . 18 Lys HE3 . 16560 1 79 . 1 1 18 18 LYS HG2 H 1 1.457 0.02 . 2 . . . . 18 Lys HG2 . 16560 1 80 . 1 1 18 18 LYS HG3 H 1 1.444 0.02 . 2 . . . . 18 Lys HG3 . 16560 1 81 . 1 1 18 18 LYS C C 13 176.509 0.2 . 1 . . . . 18 Lys C . 16560 1 82 . 1 1 18 18 LYS CA C 13 56.348 0.2 . 1 . . . . 18 Lys CA . 16560 1 83 . 1 1 18 18 LYS CB C 13 33.051 0.2 . 1 . . . . 18 Lys CB . 16560 1 84 . 1 1 18 18 LYS CD C 13 29.146 0.2 . 1 . . . . 18 Lys CD . 16560 1 85 . 1 1 18 18 LYS CE C 13 42.188 0.2 . 1 . . . . 18 Lys CE . 16560 1 86 . 1 1 18 18 LYS CG C 13 24.832 0.2 . 1 . . . . 18 Lys CG . 16560 1 87 . 1 1 18 18 LYS N N 15 123.975 0.2 . 1 . . . . 18 Lys N . 16560 1 88 . 1 1 19 19 GLN H H 1 8.387 0.02 . 1 . . . . 19 Gln H . 16560 1 89 . 1 1 19 19 GLN HA H 1 4.378 0.02 . 1 . . . . 19 Gln HA . 16560 1 90 . 1 1 19 19 GLN HB2 H 1 2.173 0.02 . 2 . . . . 19 Gln HB2 . 16560 1 91 . 1 1 19 19 GLN HB3 H 1 1.973 0.02 . 2 . . . . 19 Gln HB3 . 16560 1 92 . 1 1 19 19 GLN HE21 H 1 7.557 0.02 . 1 . . . . 19 Gln HE21 . 16560 1 93 . 1 1 19 19 GLN HE22 H 1 6.913 0.02 . 1 . . . . 19 Gln HE22 . 16560 1 94 . 1 1 19 19 GLN HG2 H 1 2.394 0.02 . 2 . . . . 19 Gln HG2 . 16560 1 95 . 1 1 19 19 GLN HG3 H 1 2.395 0.02 . 2 . . . . 19 Gln HG3 . 16560 1 96 . 1 1 19 19 GLN C C 13 175.630 0.2 . 1 . . . . 19 Gln C . 16560 1 97 . 1 1 19 19 GLN CA C 13 55.614 0.2 . 1 . . . . 19 Gln CA . 16560 1 98 . 1 1 19 19 GLN CB C 13 29.749 0.2 . 1 . . . . 19 Gln CB . 16560 1 99 . 1 1 19 19 GLN CG C 13 33.841 0.2 . 1 . . . . 19 Gln CG . 16560 1 100 . 1 1 19 19 GLN N N 15 121.480 0.2 . 1 . . . . 19 Gln N . 16560 1 101 . 1 1 19 19 GLN NE2 N 15 112.988 0.2 . 1 . . . . 19 Gln NE2 . 16560 1 102 . 1 1 20 20 ALA H H 1 8.505 0.02 . 1 . . . . 20 Ala H . 16560 1 103 . 1 1 20 20 ALA HA H 1 4.449 0.02 . 1 . . . . 20 Ala HA . 16560 1 104 . 1 1 20 20 ALA HB1 H 1 1.473 0.02 . 1 . . . . 20 Ala HB . 16560 1 105 . 1 1 20 20 ALA HB2 H 1 1.473 0.02 . 1 . . . . 20 Ala HB . 16560 1 106 . 1 1 20 20 ALA HB3 H 1 1.473 0.02 . 1 . . . . 20 Ala HB . 16560 1 107 . 1 1 20 20 ALA C C 13 177.361 0.2 . 1 . . . . 20 Ala C . 16560 1 108 . 1 1 20 20 ALA CA C 13 52.165 0.2 . 1 . . . . 20 Ala CA . 16560 1 109 . 1 1 20 20 ALA CB C 13 19.253 0.2 . 1 . . . . 20 Ala CB . 16560 1 110 . 1 1 20 20 ALA N N 15 125.974 0.2 . 1 . . . . 20 Ala N . 16560 1 111 . 1 1 21 21 PHE H H 1 8.851 0.02 . 1 . . . . 21 Phe H . 16560 1 112 . 1 1 21 21 PHE HA H 1 4.422 0.02 . 1 . . . . 21 Phe HA . 16560 1 113 . 1 1 21 21 PHE HB2 H 1 3.236 0.02 . 2 . . . . 21 Phe HB2 . 16560 1 114 . 1 1 21 21 PHE HB3 H 1 3.098 0.02 . 2 . . . . 21 Phe HB3 . 16560 1 115 . 1 1 21 21 PHE HD1 H 1 6.984 0.02 . 3 . . . . 21 Phe HD1 . 16560 1 116 . 1 1 21 21 PHE HD2 H 1 6.984 0.02 . 3 . . . . 21 Phe HD2 . 16560 1 117 . 1 1 21 21 PHE HE1 H 1 7.056 0.02 . 3 . . . . 21 Phe HE1 . 16560 1 118 . 1 1 21 21 PHE HE2 H 1 7.056 0.02 . 3 . . . . 21 Phe HE2 . 16560 1 119 . 1 1 21 21 PHE HZ H 1 7.042 0.02 . 1 . . . . 21 Phe HZ . 16560 1 120 . 1 1 21 21 PHE C C 13 176.063 0.2 . 1 . . . . 21 Phe C . 16560 1 121 . 1 1 21 21 PHE CA C 13 56.142 0.2 . 1 . . . . 21 Phe CA . 16560 1 122 . 1 1 21 21 PHE CB C 13 39.867 0.2 . 1 . . . . 21 Phe CB . 16560 1 123 . 1 1 21 21 PHE CD1 C 13 132.480 0.2 . 3 . . . . 21 Phe CD1 . 16560 1 124 . 1 1 21 21 PHE CD2 C 13 132.480 0.2 . 3 . . . . 21 Phe CD2 . 16560 1 125 . 1 1 21 21 PHE CE1 C 13 130.224 0.2 . 3 . . . . 21 Phe CE1 . 16560 1 126 . 1 1 21 21 PHE CE2 C 13 130.224 0.2 . 3 . . . . 21 Phe CE2 . 16560 1 127 . 1 1 21 21 PHE CZ C 13 128.339 0.2 . 1 . . . . 21 Phe CZ . 16560 1 128 . 1 1 21 21 PHE N N 15 124.486 0.2 . 1 . . . . 21 Phe N . 16560 1 129 . 1 1 22 22 PRO HA H 1 4.856 0.02 . 1 . . . . 22 Pro HA . 16560 1 130 . 1 1 22 22 PRO HB2 H 1 2.388 0.02 . 2 . . . . 22 Pro HB2 . 16560 1 131 . 1 1 22 22 PRO HB3 H 1 1.939 0.02 . 2 . . . . 22 Pro HB3 . 16560 1 132 . 1 1 22 22 PRO HD2 H 1 3.438 0.02 . 2 . . . . 22 Pro HD2 . 16560 1 133 . 1 1 22 22 PRO HD3 H 1 2.066 0.02 . 2 . . . . 22 Pro HD3 . 16560 1 134 . 1 1 22 22 PRO HG2 H 1 1.514 0.02 . 2 . . . . 22 Pro HG2 . 16560 1 135 . 1 1 22 22 PRO HG3 H 1 1.514 0.02 . 2 . . . . 22 Pro HG3 . 16560 1 136 . 1 1 22 22 PRO C C 13 174.848 0.2 . 1 . . . . 22 Pro C . 16560 1 137 . 1 1 22 22 PRO CA C 13 62.078 0.2 . 1 . . . . 22 Pro CA . 16560 1 138 . 1 1 22 22 PRO CB C 13 28.563 0.2 . 1 . . . . 22 Pro CB . 16560 1 139 . 1 1 22 22 PRO CD C 13 50.241 0.2 . 1 . . . . 22 Pro CD . 16560 1 140 . 1 1 22 22 PRO CG C 13 27.165 0.2 . 1 . . . . 22 Pro CG . 16560 1 141 . 1 1 23 23 ARG H H 1 8.356 0.02 . 1 . . . . 23 Arg H . 16560 1 142 . 1 1 23 23 ARG HA H 1 3.650 0.02 . 1 . . . . 23 Arg HA . 16560 1 143 . 1 1 23 23 ARG HB2 H 1 2.051 0.02 . 2 . . . . 23 Arg HB2 . 16560 1 144 . 1 1 23 23 ARG HB3 H 1 1.923 0.02 . 2 . . . . 23 Arg HB3 . 16560 1 145 . 1 1 23 23 ARG HD2 H 1 3.296 0.02 . 2 . . . . 23 Arg HD2 . 16560 1 146 . 1 1 23 23 ARG HD3 H 1 3.244 0.02 . 2 . . . . 23 Arg HD3 . 16560 1 147 . 1 1 23 23 ARG HG2 H 1 1.596 0.02 . 2 . . . . 23 Arg HG2 . 16560 1 148 . 1 1 23 23 ARG HG3 H 1 1.579 0.02 . 2 . . . . 23 Arg HG3 . 16560 1 149 . 1 1 23 23 ARG C C 13 176.762 0.2 . 1 . . . . 23 Arg C . 16560 1 150 . 1 1 23 23 ARG CA C 13 60.448 0.2 . 1 . . . . 23 Arg CA . 16560 1 151 . 1 1 23 23 ARG CB C 13 31.422 0.2 . 1 . . . . 23 Arg CB . 16560 1 152 . 1 1 23 23 ARG CD C 13 43.424 0.2 . 1 . . . . 23 Arg CD . 16560 1 153 . 1 1 23 23 ARG CG C 13 27.790 0.2 . 1 . . . . 23 Arg CG . 16560 1 154 . 1 1 23 23 ARG N N 15 126.815 0.2 . 1 . . . . 23 Arg N . 16560 1 155 . 1 1 24 24 LYS H H 1 8.555 0.02 . 1 . . . . 24 Lys H . 16560 1 156 . 1 1 24 24 LYS HA H 1 3.926 0.02 . 1 . . . . 24 Lys HA . 16560 1 157 . 1 1 24 24 LYS HB2 H 1 1.788 0.02 . 2 . . . . 24 Lys HB2 . 16560 1 158 . 1 1 24 24 LYS HB3 H 1 1.607 0.02 . 2 . . . . 24 Lys HB3 . 16560 1 159 . 1 1 24 24 LYS HD2 H 1 1.564 0.02 . 2 . . . . 24 Lys HD2 . 16560 1 160 . 1 1 24 24 LYS HD3 H 1 1.564 0.02 . 2 . . . . 24 Lys HD3 . 16560 1 161 . 1 1 24 24 LYS HE2 H 1 2.861 0.02 . 2 . . . . 24 Lys HE2 . 16560 1 162 . 1 1 24 24 LYS HE3 H 1 2.861 0.02 . 2 . . . . 24 Lys HE3 . 16560 1 163 . 1 1 24 24 LYS HG2 H 1 1.330 0.02 . 2 . . . . 24 Lys HG2 . 16560 1 164 . 1 1 24 24 LYS HG3 H 1 1.161 0.02 . 2 . . . . 24 Lys HG3 . 16560 1 165 . 1 1 24 24 LYS C C 13 179.506 0.2 . 1 . . . . 24 Lys C . 16560 1 166 . 1 1 24 24 LYS CA C 13 59.888 0.2 . 1 . . . . 24 Lys CA . 16560 1 167 . 1 1 24 24 LYS CB C 13 31.782 0.2 . 1 . . . . 24 Lys CB . 16560 1 168 . 1 1 24 24 LYS CD C 13 29.229 0.2 . 1 . . . . 24 Lys CD . 16560 1 169 . 1 1 24 24 LYS CE C 13 42.017 0.2 . 1 . . . . 24 Lys CE . 16560 1 170 . 1 1 24 24 LYS CG C 13 24.963 0.2 . 1 . . . . 24 Lys CG . 16560 1 171 . 1 1 24 24 LYS N N 15 116.573 0.2 . 1 . . . . 24 Lys N . 16560 1 172 . 1 1 25 25 PHE H H 1 7.575 0.02 . 1 . . . . 25 Phe H . 16560 1 173 . 1 1 25 25 PHE HA H 1 4.487 0.02 . 1 . . . . 25 Phe HA . 16560 1 174 . 1 1 25 25 PHE HB2 H 1 3.028 0.02 . 2 . . . . 25 Phe HB2 . 16560 1 175 . 1 1 25 25 PHE HB3 H 1 2.971 0.02 . 2 . . . . 25 Phe HB3 . 16560 1 176 . 1 1 25 25 PHE HD1 H 1 7.158 0.02 . 3 . . . . 25 Phe HD1 . 16560 1 177 . 1 1 25 25 PHE HD2 H 1 7.158 0.02 . 3 . . . . 25 Phe HD2 . 16560 1 178 . 1 1 25 25 PHE HE1 H 1 7.313 0.02 . 3 . . . . 25 Phe HE1 . 16560 1 179 . 1 1 25 25 PHE HE2 H 1 7.313 0.02 . 3 . . . . 25 Phe HE2 . 16560 1 180 . 1 1 25 25 PHE HZ H 1 7.321 0.02 . 1 . . . . 25 Phe HZ . 16560 1 181 . 1 1 25 25 PHE C C 13 177.447 0.2 . 1 . . . . 25 Phe C . 16560 1 182 . 1 1 25 25 PHE CA C 13 59.779 0.2 . 1 . . . . 25 Phe CA . 16560 1 183 . 1 1 25 25 PHE CB C 13 38.791 0.2 . 1 . . . . 25 Phe CB . 16560 1 184 . 1 1 25 25 PHE CD1 C 13 130.994 0.2 . 3 . . . . 25 Phe CD1 . 16560 1 185 . 1 1 25 25 PHE CD2 C 13 130.994 0.2 . 3 . . . . 25 Phe CD2 . 16560 1 186 . 1 1 25 25 PHE CE1 C 13 131.790 0.2 . 3 . . . . 25 Phe CE1 . 16560 1 187 . 1 1 25 25 PHE CE2 C 13 131.790 0.2 . 3 . . . . 25 Phe CE2 . 16560 1 188 . 1 1 25 25 PHE CZ C 13 130.304 0.2 . 1 . . . . 25 Phe CZ . 16560 1 189 . 1 1 25 25 PHE N N 15 118.123 0.2 . 1 . . . . 25 Phe N . 16560 1 190 . 1 1 26 26 VAL H H 1 8.024 0.02 . 1 . . . . 26 Val H . 16560 1 191 . 1 1 26 26 VAL HA H 1 3.608 0.02 . 1 . . . . 26 Val HA . 16560 1 192 . 1 1 26 26 VAL HB H 1 2.231 0.02 . 1 . . . . 26 Val HB . 16560 1 193 . 1 1 26 26 VAL HG11 H 1 1.130 0.02 . 1 . . . . 26 Val HG1 . 16560 1 194 . 1 1 26 26 VAL HG12 H 1 1.130 0.02 . 1 . . . . 26 Val HG1 . 16560 1 195 . 1 1 26 26 VAL HG13 H 1 1.130 0.02 . 1 . . . . 26 Val HG1 . 16560 1 196 . 1 1 26 26 VAL HG21 H 1 0.931 0.02 . 1 . . . . 26 Val HG2 . 16560 1 197 . 1 1 26 26 VAL HG22 H 1 0.931 0.02 . 1 . . . . 26 Val HG2 . 16560 1 198 . 1 1 26 26 VAL HG23 H 1 0.931 0.02 . 1 . . . . 26 Val HG2 . 16560 1 199 . 1 1 26 26 VAL C C 13 177.770 0.2 . 1 . . . . 26 Val C . 16560 1 200 . 1 1 26 26 VAL CA C 13 66.473 0.2 . 1 . . . . 26 Val CA . 16560 1 201 . 1 1 26 26 VAL CB C 13 31.408 0.2 . 1 . . . . 26 Val CB . 16560 1 202 . 1 1 26 26 VAL CG1 C 13 22.074 0.2 . 1 . . . . 26 Val CG1 . 16560 1 203 . 1 1 26 26 VAL CG2 C 13 22.652 0.2 . 1 . . . . 26 Val CG2 . 16560 1 204 . 1 1 26 26 VAL N N 15 117.081 0.2 . 1 . . . . 26 Val N . 16560 1 205 . 1 1 27 27 LEU H H 1 8.220 0.02 . 1 . . . . 27 Leu H . 16560 1 206 . 1 1 27 27 LEU HA H 1 4.234 0.02 . 1 . . . . 27 Leu HA . 16560 1 207 . 1 1 27 27 LEU HB2 H 1 1.868 0.02 . 2 . . . . 27 Leu HB2 . 16560 1 208 . 1 1 27 27 LEU HB3 H 1 1.505 0.02 . 2 . . . . 27 Leu HB3 . 16560 1 209 . 1 1 27 27 LEU HD11 H 1 0.853 0.02 . 1 . . . . 27 Leu HD1 . 16560 1 210 . 1 1 27 27 LEU HD12 H 1 0.853 0.02 . 1 . . . . 27 Leu HD1 . 16560 1 211 . 1 1 27 27 LEU HD13 H 1 0.853 0.02 . 1 . . . . 27 Leu HD1 . 16560 1 212 . 1 1 27 27 LEU HD21 H 1 0.825 0.02 . 1 . . . . 27 Leu HD2 . 16560 1 213 . 1 1 27 27 LEU HD22 H 1 0.825 0.02 . 1 . . . . 27 Leu HD2 . 16560 1 214 . 1 1 27 27 LEU HD23 H 1 0.825 0.02 . 1 . . . . 27 Leu HD2 . 16560 1 215 . 1 1 27 27 LEU HG H 1 1.840 0.02 . 1 . . . . 27 Leu HG . 16560 1 216 . 1 1 27 27 LEU C C 13 180.010 0.2 . 1 . . . . 27 Leu C . 16560 1 217 . 1 1 27 27 LEU CA C 13 57.864 0.2 . 1 . . . . 27 Leu CA . 16560 1 218 . 1 1 27 27 LEU CB C 13 40.488 0.2 . 1 . . . . 27 Leu CB . 16560 1 219 . 1 1 27 27 LEU CD1 C 13 25.521 0.2 . 1 . . . . 27 Leu CD1 . 16560 1 220 . 1 1 27 27 LEU CD2 C 13 22.018 0.2 . 1 . . . . 27 Leu CD2 . 16560 1 221 . 1 1 27 27 LEU CG C 13 27.321 0.2 . 1 . . . . 27 Leu CG . 16560 1 222 . 1 1 27 27 LEU N N 15 118.748 0.2 . 1 . . . . 27 Leu N . 16560 1 223 . 1 1 28 28 ALA H H 1 8.014 0.02 . 1 . . . . 28 Ala H . 16560 1 224 . 1 1 28 28 ALA HA H 1 4.289 0.02 . 1 . . . . 28 Ala HA . 16560 1 225 . 1 1 28 28 ALA HB1 H 1 1.538 0.02 . 1 . . . . 28 Ala HB . 16560 1 226 . 1 1 28 28 ALA HB2 H 1 1.538 0.02 . 1 . . . . 28 Ala HB . 16560 1 227 . 1 1 28 28 ALA HB3 H 1 1.538 0.02 . 1 . . . . 28 Ala HB . 16560 1 228 . 1 1 28 28 ALA C C 13 179.951 0.2 . 1 . . . . 28 Ala C . 16560 1 229 . 1 1 28 28 ALA CA C 13 55.110 0.2 . 1 . . . . 28 Ala CA . 16560 1 230 . 1 1 28 28 ALA CB C 13 17.970 0.2 . 1 . . . . 28 Ala CB . 16560 1 231 . 1 1 28 28 ALA N N 15 124.088 0.2 . 1 . . . . 28 Ala N . 16560 1 232 . 1 1 29 29 ALA H H 1 8.259 0.02 . 1 . . . . 29 Ala H . 16560 1 233 . 1 1 29 29 ALA HA H 1 3.942 0.02 . 1 . . . . 29 Ala HA . 16560 1 234 . 1 1 29 29 ALA HB1 H 1 1.298 0.02 . 1 . . . . 29 Ala HB . 16560 1 235 . 1 1 29 29 ALA HB2 H 1 1.298 0.02 . 1 . . . . 29 Ala HB . 16560 1 236 . 1 1 29 29 ALA HB3 H 1 1.298 0.02 . 1 . . . . 29 Ala HB . 16560 1 237 . 1 1 29 29 ALA C C 13 180.505 0.2 . 1 . . . . 29 Ala C . 16560 1 238 . 1 1 29 29 ALA CA C 13 54.976 0.2 . 1 . . . . 29 Ala CA . 16560 1 239 . 1 1 29 29 ALA CB C 13 17.923 0.2 . 1 . . . . 29 Ala CB . 16560 1 240 . 1 1 29 29 ALA N N 15 120.431 0.2 . 1 . . . . 29 Ala N . 16560 1 241 . 1 1 30 30 LEU H H 1 8.098 0.02 . 1 . . . . 30 Leu H . 16560 1 242 . 1 1 30 30 LEU HA H 1 4.007 0.02 . 1 . . . . 30 Leu HA . 16560 1 243 . 1 1 30 30 LEU HB2 H 1 2.096 0.02 . 2 . . . . 30 Leu HB2 . 16560 1 244 . 1 1 30 30 LEU HB3 H 1 1.513 0.02 . 2 . . . . 30 Leu HB3 . 16560 1 245 . 1 1 30 30 LEU HD11 H 1 0.534 0.02 . 1 . . . . 30 Leu HD1 . 16560 1 246 . 1 1 30 30 LEU HD12 H 1 0.534 0.02 . 1 . . . . 30 Leu HD1 . 16560 1 247 . 1 1 30 30 LEU HD13 H 1 0.534 0.02 . 1 . . . . 30 Leu HD1 . 16560 1 248 . 1 1 30 30 LEU HD21 H 1 0.782 0.02 . 1 . . . . 30 Leu HD2 . 16560 1 249 . 1 1 30 30 LEU HD22 H 1 0.782 0.02 . 1 . . . . 30 Leu HD2 . 16560 1 250 . 1 1 30 30 LEU HD23 H 1 0.782 0.02 . 1 . . . . 30 Leu HD2 . 16560 1 251 . 1 1 30 30 LEU HG H 1 1.543 0.02 . 1 . . . . 30 Leu HG . 16560 1 252 . 1 1 30 30 LEU C C 13 178.315 0.2 . 1 . . . . 30 Leu C . 16560 1 253 . 1 1 30 30 LEU CA C 13 58.096 0.2 . 1 . . . . 30 Leu CA . 16560 1 254 . 1 1 30 30 LEU CB C 13 41.486 0.2 . 1 . . . . 30 Leu CB . 16560 1 255 . 1 1 30 30 LEU CD1 C 13 23.822 0.2 . 1 . . . . 30 Leu CD1 . 16560 1 256 . 1 1 30 30 LEU CD2 C 13 25.929 0.2 . 1 . . . . 30 Leu CD2 . 16560 1 257 . 1 1 30 30 LEU CG C 13 26.825 0.2 . 1 . . . . 30 Leu CG . 16560 1 258 . 1 1 30 30 LEU N N 15 120.849 0.2 . 1 . . . . 30 Leu N . 16560 1 259 . 1 1 31 31 GLU H H 1 8.115 0.02 . 1 . . . . 31 Glu H . 16560 1 260 . 1 1 31 31 GLU HA H 1 3.967 0.02 . 1 . . . . 31 Glu HA . 16560 1 261 . 1 1 31 31 GLU HB2 H 1 2.180 0.02 . 2 . . . . 31 Glu HB2 . 16560 1 262 . 1 1 31 31 GLU HB3 H 1 2.166 0.02 . 2 . . . . 31 Glu HB3 . 16560 1 263 . 1 1 31 31 GLU HG2 H 1 2.356 0.02 . 2 . . . . 31 Glu HG2 . 16560 1 264 . 1 1 31 31 GLU HG3 H 1 2.220 0.02 . 2 . . . . 31 Glu HG3 . 16560 1 265 . 1 1 31 31 GLU C C 13 179.473 0.2 . 1 . . . . 31 Glu C . 16560 1 266 . 1 1 31 31 GLU CA C 13 59.683 0.2 . 1 . . . . 31 Glu CA . 16560 1 267 . 1 1 31 31 GLU CB C 13 29.402 0.2 . 1 . . . . 31 Glu CB . 16560 1 268 . 1 1 31 31 GLU CG C 13 36.136 0.2 . 1 . . . . 31 Glu CG . 16560 1 269 . 1 1 31 31 GLU N N 15 120.752 0.2 . 1 . . . . 31 Glu N . 16560 1 270 . 1 1 32 32 GLN H H 1 7.812 0.02 . 1 . . . . 32 Gln H . 16560 1 271 . 1 1 32 32 GLN HA H 1 4.001 0.02 . 1 . . . . 32 Gln HA . 16560 1 272 . 1 1 32 32 GLN HB2 H 1 1.798 0.02 . 2 . . . . 32 Gln HB2 . 16560 1 273 . 1 1 32 32 GLN HB3 H 1 1.531 0.02 . 2 . . . . 32 Gln HB3 . 16560 1 274 . 1 1 32 32 GLN HE21 H 1 7.390 0.02 . 1 . . . . 32 Gln HE21 . 16560 1 275 . 1 1 32 32 GLN HE22 H 1 6.673 0.02 . 1 . . . . 32 Gln HE22 . 16560 1 276 . 1 1 32 32 GLN HG2 H 1 2.469 0.02 . 2 . . . . 32 Gln HG2 . 16560 1 277 . 1 1 32 32 GLN HG3 H 1 2.348 0.02 . 2 . . . . 32 Gln HG3 . 16560 1 278 . 1 1 32 32 GLN C C 13 176.519 0.2 . 1 . . . . 32 Gln C . 16560 1 279 . 1 1 32 32 GLN CA C 13 57.576 0.2 . 1 . . . . 32 Gln CA . 16560 1 280 . 1 1 32 32 GLN CB C 13 29.108 0.2 . 1 . . . . 32 Gln CB . 16560 1 281 . 1 1 32 32 GLN CG C 13 34.169 0.2 . 1 . . . . 32 Gln CG . 16560 1 282 . 1 1 32 32 GLN N N 15 114.711 0.2 . 1 . . . . 32 Gln N . 16560 1 283 . 1 1 32 32 GLN NE2 N 15 110.930 0.2 . 1 . . . . 32 Gln NE2 . 16560 1 284 . 1 1 33 33 SER H H 1 7.460 0.02 . 1 . . . . 33 Ser H . 16560 1 285 . 1 1 33 33 SER HA H 1 4.257 0.02 . 1 . . . . 33 Ser HA . 16560 1 286 . 1 1 33 33 SER HB2 H 1 3.594 0.02 . 2 . . . . 33 Ser HB2 . 16560 1 287 . 1 1 33 33 SER HB3 H 1 3.824 0.02 . 2 . . . . 33 Ser HB3 . 16560 1 288 . 1 1 33 33 SER C C 13 174.508 0.2 . 1 . . . . 33 Ser C . 16560 1 289 . 1 1 33 33 SER CA C 13 58.504 0.2 . 1 . . . . 33 Ser CA . 16560 1 290 . 1 1 33 33 SER CB C 13 65.131 0.2 . 1 . . . . 33 Ser CB . 16560 1 291 . 1 1 33 33 SER N N 15 110.604 0.2 . 1 . . . . 33 Ser N . 16560 1 292 . 1 1 34 34 SER H H 1 7.429 0.02 . 1 . . . . 34 Ser H . 16560 1 293 . 1 1 34 34 SER HA H 1 4.468 0.02 . 1 . . . . 34 Ser HA . 16560 1 294 . 1 1 34 34 SER HB2 H 1 3.826 0.02 . 2 . . . . 34 Ser HB2 . 16560 1 295 . 1 1 34 34 SER HB3 H 1 3.731 0.02 . 2 . . . . 34 Ser HB3 . 16560 1 296 . 1 1 34 34 SER C C 13 174.588 0.2 . 1 . . . . 34 Ser C . 16560 1 297 . 1 1 34 34 SER CA C 13 58.556 0.2 . 1 . . . . 34 Ser CA . 16560 1 298 . 1 1 34 34 SER CB C 13 65.278 0.2 . 1 . . . . 34 Ser CB . 16560 1 299 . 1 1 34 34 SER N N 15 117.544 0.2 . 1 . . . . 34 Ser N . 16560 1 300 . 1 1 35 35 ASP H H 1 8.822 0.02 . 1 . . . . 35 Asp H . 16560 1 301 . 1 1 35 35 ASP HA H 1 4.778 0.02 . 1 . . . . 35 Asp HA . 16560 1 302 . 1 1 35 35 ASP HB2 H 1 3.433 0.02 . 2 . . . . 35 Asp HB2 . 16560 1 303 . 1 1 35 35 ASP HB3 H 1 2.985 0.02 . 2 . . . . 35 Asp HB3 . 16560 1 304 . 1 1 35 35 ASP C C 13 178.268 0.2 . 1 . . . . 35 Asp C . 16560 1 305 . 1 1 35 35 ASP CA C 13 52.849 0.2 . 1 . . . . 35 Asp CA . 16560 1 306 . 1 1 35 35 ASP CB C 13 41.314 0.2 . 1 . . . . 35 Asp CB . 16560 1 307 . 1 1 35 35 ASP N N 15 121.575 0.2 . 1 . . . . 35 Asp N . 16560 1 308 . 1 1 36 36 ASP H H 1 8.483 0.02 . 1 . . . . 36 Asp H . 16560 1 309 . 1 1 36 36 ASP HA H 1 4.414 0.02 . 1 . . . . 36 Asp HA . 16560 1 310 . 1 1 36 36 ASP HB2 H 1 2.740 0.02 . 2 . . . . 36 Asp HB2 . 16560 1 311 . 1 1 36 36 ASP HB3 H 1 2.740 0.02 . 2 . . . . 36 Asp HB3 . 16560 1 312 . 1 1 36 36 ASP C C 13 176.670 0.2 . 1 . . . . 36 Asp C . 16560 1 313 . 1 1 36 36 ASP CA C 13 56.605 0.2 . 1 . . . . 36 Asp CA . 16560 1 314 . 1 1 36 36 ASP CB C 13 40.286 0.2 . 1 . . . . 36 Asp CB . 16560 1 315 . 1 1 36 36 ASP N N 15 117.398 0.2 . 1 . . . . 36 Asp N . 16560 1 316 . 1 1 37 37 ALA H H 1 8.242 0.02 . 1 . . . . 37 Ala H . 16560 1 317 . 1 1 37 37 ALA HA H 1 4.532 0.02 . 1 . . . . 37 Ala HA . 16560 1 318 . 1 1 37 37 ALA HB1 H 1 1.699 0.02 . 1 . . . . 37 Ala HB . 16560 1 319 . 1 1 37 37 ALA HB2 H 1 1.699 0.02 . 1 . . . . 37 Ala HB . 16560 1 320 . 1 1 37 37 ALA HB3 H 1 1.699 0.02 . 1 . . . . 37 Ala HB . 16560 1 321 . 1 1 37 37 ALA C C 13 177.407 0.2 . 1 . . . . 37 Ala C . 16560 1 322 . 1 1 37 37 ALA CA C 13 51.677 0.2 . 1 . . . . 37 Ala CA . 16560 1 323 . 1 1 37 37 ALA CB C 13 19.774 0.2 . 1 . . . . 37 Ala CB . 16560 1 324 . 1 1 37 37 ALA N N 15 122.052 0.2 . 1 . . . . 37 Ala N . 16560 1 325 . 1 1 38 38 GLY H H 1 8.155 0.02 . 1 . . . . 38 Gly H . 16560 1 326 . 1 1 38 38 GLY HA2 H 1 3.624 0.02 . 2 . . . . 38 Gly HA2 . 16560 1 327 . 1 1 38 38 GLY HA3 H 1 4.080 0.02 . 2 . . . . 38 Gly HA3 . 16560 1 328 . 1 1 38 38 GLY C C 13 173.417 0.2 . 1 . . . . 38 Gly C . 16560 1 329 . 1 1 38 38 GLY CA C 13 45.093 0.2 . 1 . . . . 38 Gly CA . 16560 1 330 . 1 1 38 38 GLY N N 15 107.721 0.2 . 1 . . . . 38 Gly N . 16560 1 331 . 1 1 39 39 TRP H H 1 8.449 0.02 . 1 . . . . 39 Trp H . 16560 1 332 . 1 1 39 39 TRP HA H 1 5.054 0.02 . 1 . . . . 39 Trp HA . 16560 1 333 . 1 1 39 39 TRP HB2 H 1 3.428 0.02 . 2 . . . . 39 Trp HB2 . 16560 1 334 . 1 1 39 39 TRP HB3 H 1 3.033 0.02 . 2 . . . . 39 Trp HB3 . 16560 1 335 . 1 1 39 39 TRP HD1 H 1 7.091 0.02 . 1 . . . . 39 Trp HD1 . 16560 1 336 . 1 1 39 39 TRP HE1 H 1 10.138 0.02 . 1 . . . . 39 Trp HE1 . 16560 1 337 . 1 1 39 39 TRP HE3 H 1 7.368 0.02 . 1 . . . . 39 Trp HE3 . 16560 1 338 . 1 1 39 39 TRP HH2 H 1 6.855 0.02 . 1 . . . . 39 Trp HH2 . 16560 1 339 . 1 1 39 39 TRP HZ2 H 1 7.370 0.02 . 1 . . . . 39 Trp HZ2 . 16560 1 340 . 1 1 39 39 TRP HZ3 H 1 6.802 0.02 . 1 . . . . 39 Trp HZ3 . 16560 1 341 . 1 1 39 39 TRP C C 13 176.577 0.2 . 1 . . . . 39 Trp C . 16560 1 342 . 1 1 39 39 TRP CA C 13 56.596 0.2 . 1 . . . . 39 Trp CA . 16560 1 343 . 1 1 39 39 TRP CB C 13 32.184 0.2 . 1 . . . . 39 Trp CB . 16560 1 344 . 1 1 39 39 TRP CD1 C 13 127.943 0.2 . 1 . . . . 39 Trp CD1 . 16560 1 345 . 1 1 39 39 TRP CE3 C 13 120.412 0.2 . 1 . . . . 39 Trp CE3 . 16560 1 346 . 1 1 39 39 TRP CH2 C 13 124.499 0.2 . 1 . . . . 39 Trp CH2 . 16560 1 347 . 1 1 39 39 TRP CZ2 C 13 115.016 0.2 . 1 . . . . 39 Trp CZ2 . 16560 1 348 . 1 1 39 39 TRP CZ3 C 13 122.292 0.2 . 1 . . . . 39 Trp CZ3 . 16560 1 349 . 1 1 39 39 TRP N N 15 119.797 0.2 . 1 . . . . 39 Trp N . 16560 1 350 . 1 1 39 39 TRP NE1 N 15 128.725 0.2 . 1 . . . . 39 Trp NE1 . 16560 1 351 . 1 1 40 40 ALA H H 1 9.855 0.02 . 1 . . . . 40 Ala H . 16560 1 352 . 1 1 40 40 ALA HA H 1 5.099 0.02 . 1 . . . . 40 Ala HA . 16560 1 353 . 1 1 40 40 ALA HB1 H 1 1.179 0.02 . 1 . . . . 40 Ala HB . 16560 1 354 . 1 1 40 40 ALA HB2 H 1 1.179 0.02 . 1 . . . . 40 Ala HB . 16560 1 355 . 1 1 40 40 ALA HB3 H 1 1.179 0.02 . 1 . . . . 40 Ala HB . 16560 1 356 . 1 1 40 40 ALA C C 13 176.165 0.2 . 1 . . . . 40 Ala C . 16560 1 357 . 1 1 40 40 ALA CA C 13 50.202 0.2 . 1 . . . . 40 Ala CA . 16560 1 358 . 1 1 40 40 ALA CB C 13 23.153 0.2 . 1 . . . . 40 Ala CB . 16560 1 359 . 1 1 40 40 ALA N N 15 124.618 0.2 . 1 . . . . 40 Ala N . 16560 1 360 . 1 1 41 41 ASN H H 1 8.794 0.02 . 1 . . . . 41 Asn H . 16560 1 361 . 1 1 41 41 ASN HA H 1 3.771 0.02 . 1 . . . . 41 Asn HA . 16560 1 362 . 1 1 41 41 ASN HB2 H 1 2.497 0.02 . 2 . . . . 41 Asn HB2 . 16560 1 363 . 1 1 41 41 ASN HB3 H 1 2.406 0.02 . 2 . . . . 41 Asn HB3 . 16560 1 364 . 1 1 41 41 ASN HD21 H 1 7.050 0.02 . 1 . . . . 41 Asn HD21 . 16560 1 365 . 1 1 41 41 ASN HD22 H 1 6.730 0.02 . 1 . . . . 41 Asn HD22 . 16560 1 366 . 1 1 41 41 ASN C C 13 175.824 0.2 . 1 . . . . 41 Asn C . 16560 1 367 . 1 1 41 41 ASN CA C 13 52.724 0.2 . 1 . . . . 41 Asn CA . 16560 1 368 . 1 1 41 41 ASN CB C 13 39.927 0.2 . 1 . . . . 41 Asn CB . 16560 1 369 . 1 1 41 41 ASN N N 15 121.050 0.2 . 1 . . . . 41 Asn N . 16560 1 370 . 1 1 41 41 ASN ND2 N 15 112.300 0.2 . 1 . . . . 41 Asn ND2 . 16560 1 371 . 1 1 42 42 LEU H H 1 8.493 0.02 . 1 . . . . 42 Leu H . 16560 1 372 . 1 1 42 42 LEU HA H 1 3.834 0.02 . 1 . . . . 42 Leu HA . 16560 1 373 . 1 1 42 42 LEU HB2 H 1 1.885 0.02 . 2 . . . . 42 Leu HB2 . 16560 1 374 . 1 1 42 42 LEU HB3 H 1 1.422 0.02 . 2 . . . . 42 Leu HB3 . 16560 1 375 . 1 1 42 42 LEU HD11 H 1 0.851 0.02 . 1 . . . . 42 Leu HD1 . 16560 1 376 . 1 1 42 42 LEU HD12 H 1 0.851 0.02 . 1 . . . . 42 Leu HD1 . 16560 1 377 . 1 1 42 42 LEU HD13 H 1 0.851 0.02 . 1 . . . . 42 Leu HD1 . 16560 1 378 . 1 1 42 42 LEU HD21 H 1 0.947 0.02 . 1 . . . . 42 Leu HD2 . 16560 1 379 . 1 1 42 42 LEU HD22 H 1 0.947 0.02 . 1 . . . . 42 Leu HD2 . 16560 1 380 . 1 1 42 42 LEU HD23 H 1 0.947 0.02 . 1 . . . . 42 Leu HD2 . 16560 1 381 . 1 1 42 42 LEU HG H 1 1.747 0.02 . 1 . . . . 42 Leu HG . 16560 1 382 . 1 1 42 42 LEU C C 13 178.256 0.2 . 1 . . . . 42 Leu C . 16560 1 383 . 1 1 42 42 LEU CA C 13 58.859 0.2 . 1 . . . . 42 Leu CA . 16560 1 384 . 1 1 42 42 LEU CB C 13 42.233 0.2 . 1 . . . . 42 Leu CB . 16560 1 385 . 1 1 42 42 LEU CD1 C 13 24.590 0.2 . 1 . . . . 42 Leu CD1 . 16560 1 386 . 1 1 42 42 LEU CD2 C 13 26.355 0.2 . 1 . . . . 42 Leu CD2 . 16560 1 387 . 1 1 42 42 LEU CG C 13 27.228 0.2 . 1 . . . . 42 Leu CG . 16560 1 388 . 1 1 42 42 LEU N N 15 126.418 0.2 . 1 . . . . 42 Leu N . 16560 1 389 . 1 1 43 43 GLY H H 1 8.440 0.02 . 1 . . . . 43 Gly H . 16560 1 390 . 1 1 43 43 GLY HA2 H 1 3.912 0.02 . 2 . . . . 43 Gly HA2 . 16560 1 391 . 1 1 43 43 GLY HA3 H 1 3.822 0.02 . 2 . . . . 43 Gly HA3 . 16560 1 392 . 1 1 43 43 GLY C C 13 176.344 0.2 . 1 . . . . 43 Gly C . 16560 1 393 . 1 1 43 43 GLY CA C 13 47.070 0.2 . 1 . . . . 43 Gly CA . 16560 1 394 . 1 1 43 43 GLY N N 15 106.800 0.2 . 1 . . . . 43 Gly N . 16560 1 395 . 1 1 44 44 ASN H H 1 7.916 0.02 . 1 . . . . 44 Asn H . 16560 1 396 . 1 1 44 44 ASN HA H 1 4.472 0.02 . 1 . . . . 44 Asn HA . 16560 1 397 . 1 1 44 44 ASN HB2 H 1 3.027 0.02 . 2 . . . . 44 Asn HB2 . 16560 1 398 . 1 1 44 44 ASN HB3 H 1 2.846 0.02 . 2 . . . . 44 Asn HB3 . 16560 1 399 . 1 1 44 44 ASN HD21 H 1 7.989 0.02 . 1 . . . . 44 Asn HD21 . 16560 1 400 . 1 1 44 44 ASN HD22 H 1 7.236 0.02 . 1 . . . . 44 Asn HD22 . 16560 1 401 . 1 1 44 44 ASN C C 13 177.888 0.2 . 1 . . . . 44 Asn C . 16560 1 402 . 1 1 44 44 ASN CA C 13 56.004 0.2 . 1 . . . . 44 Asn CA . 16560 1 403 . 1 1 44 44 ASN CB C 13 38.316 0.2 . 1 . . . . 44 Asn CB . 16560 1 404 . 1 1 44 44 ASN N N 15 121.472 0.2 . 1 . . . . 44 Asn N . 16560 1 405 . 1 1 44 44 ASN ND2 N 15 113.299 0.2 . 1 . . . . 44 Asn ND2 . 16560 1 406 . 1 1 45 45 PHE H H 1 8.563 0.02 . 1 . . . . 45 Phe H . 16560 1 407 . 1 1 45 45 PHE HA H 1 4.498 0.02 . 1 . . . . 45 Phe HA . 16560 1 408 . 1 1 45 45 PHE HB2 H 1 3.030 0.02 . 2 . . . . 45 Phe HB2 . 16560 1 409 . 1 1 45 45 PHE HB3 H 1 3.028 0.02 . 2 . . . . 45 Phe HB3 . 16560 1 410 . 1 1 45 45 PHE HD1 H 1 6.869 0.02 . 3 . . . . 45 Phe HD1 . 16560 1 411 . 1 1 45 45 PHE HD2 H 1 6.869 0.02 . 3 . . . . 45 Phe HD2 . 16560 1 412 . 1 1 45 45 PHE HE1 H 1 7.074 0.02 . 3 . . . . 45 Phe HE1 . 16560 1 413 . 1 1 45 45 PHE HE2 H 1 7.074 0.02 . 3 . . . . 45 Phe HE2 . 16560 1 414 . 1 1 45 45 PHE HZ H 1 6.884 0.02 . 1 . . . . 45 Phe HZ . 16560 1 415 . 1 1 45 45 PHE C C 13 176.732 0.2 . 1 . . . . 45 Phe C . 16560 1 416 . 1 1 45 45 PHE CA C 13 60.350 0.2 . 1 . . . . 45 Phe CA . 16560 1 417 . 1 1 45 45 PHE CB C 13 38.824 0.2 . 1 . . . . 45 Phe CB . 16560 1 418 . 1 1 45 45 PHE CD1 C 13 131.723 0.2 . 3 . . . . 45 Phe CD1 . 16560 1 419 . 1 1 45 45 PHE CD2 C 13 131.723 0.2 . 3 . . . . 45 Phe CD2 . 16560 1 420 . 1 1 45 45 PHE CE1 C 13 130.727 0.2 . 3 . . . . 45 Phe CE1 . 16560 1 421 . 1 1 45 45 PHE CE2 C 13 130.727 0.2 . 3 . . . . 45 Phe CE2 . 16560 1 422 . 1 1 45 45 PHE CZ C 13 128.702 0.2 . 1 . . . . 45 Phe CZ . 16560 1 423 . 1 1 45 45 PHE N N 15 121.835 0.2 . 1 . . . . 45 Phe N . 16560 1 424 . 1 1 46 46 GLY H H 1 8.933 0.02 . 1 . . . . 46 Gly H . 16560 1 425 . 1 1 46 46 GLY HA2 H 1 3.820 0.02 . 2 . . . . 46 Gly HA2 . 16560 1 426 . 1 1 46 46 GLY HA3 H 1 3.186 0.02 . 2 . . . . 46 Gly HA3 . 16560 1 427 . 1 1 46 46 GLY C C 13 176.053 0.2 . 1 . . . . 46 Gly C . 16560 1 428 . 1 1 46 46 GLY CA C 13 47.171 0.2 . 1 . . . . 46 Gly CA . 16560 1 429 . 1 1 46 46 GLY N N 15 106.269 0.2 . 1 . . . . 46 Gly N . 16560 1 430 . 1 1 47 47 ASN H H 1 7.812 0.02 . 1 . . . . 47 Asn H . 16560 1 431 . 1 1 47 47 ASN HA H 1 4.470 0.02 . 1 . . . . 47 Asn HA . 16560 1 432 . 1 1 47 47 ASN HB2 H 1 3.016 0.02 . 2 . . . . 47 Asn HB2 . 16560 1 433 . 1 1 47 47 ASN HB3 H 1 2.842 0.02 . 2 . . . . 47 Asn HB3 . 16560 1 434 . 1 1 47 47 ASN HD21 H 1 7.583 0.02 . 1 . . . . 47 Asn HD21 . 16560 1 435 . 1 1 47 47 ASN HD22 H 1 6.847 0.02 . 1 . . . . 47 Asn HD22 . 16560 1 436 . 1 1 47 47 ASN C C 13 178.087 0.2 . 1 . . . . 47 Asn C . 16560 1 437 . 1 1 47 47 ASN CA C 13 55.974 0.2 . 1 . . . . 47 Asn CA . 16560 1 438 . 1 1 47 47 ASN CB C 13 38.149 0.2 . 1 . . . . 47 Asn CB . 16560 1 439 . 1 1 47 47 ASN N N 15 120.030 0.2 . 1 . . . . 47 Asn N . 16560 1 440 . 1 1 47 47 ASN ND2 N 15 112.055 0.2 . 1 . . . . 47 Asn ND2 . 16560 1 441 . 1 1 48 48 TYR H H 1 8.093 0.02 . 1 . . . . 48 Tyr H . 16560 1 442 . 1 1 48 48 TYR HA H 1 4.007 0.02 . 1 . . . . 48 Tyr HA . 16560 1 443 . 1 1 48 48 TYR HB2 H 1 3.060 0.02 . 2 . . . . 48 Tyr HB2 . 16560 1 444 . 1 1 48 48 TYR HB3 H 1 2.890 0.02 . 2 . . . . 48 Tyr HB3 . 16560 1 445 . 1 1 48 48 TYR HD1 H 1 7.171 0.02 . 3 . . . . 48 Tyr HD1 . 16560 1 446 . 1 1 48 48 TYR HD2 H 1 7.171 0.02 . 3 . . . . 48 Tyr HD2 . 16560 1 447 . 1 1 48 48 TYR HE1 H 1 6.827 0.02 . 3 . . . . 48 Tyr HE1 . 16560 1 448 . 1 1 48 48 TYR HE2 H 1 6.827 0.02 . 3 . . . . 48 Tyr HE2 . 16560 1 449 . 1 1 48 48 TYR C C 13 178.310 0.2 . 1 . . . . 48 Tyr C . 16560 1 450 . 1 1 48 48 TYR CA C 13 62.527 0.2 . 1 . . . . 48 Tyr CA . 16560 1 451 . 1 1 48 48 TYR CB C 13 38.254 0.2 . 1 . . . . 48 Tyr CB . 16560 1 452 . 1 1 48 48 TYR CD1 C 13 132.921 0.2 . 3 . . . . 48 Tyr CD1 . 16560 1 453 . 1 1 48 48 TYR CD2 C 13 132.921 0.2 . 3 . . . . 48 Tyr CD2 . 16560 1 454 . 1 1 48 48 TYR CE1 C 13 118.312 0.2 . 3 . . . . 48 Tyr CE1 . 16560 1 455 . 1 1 48 48 TYR CE2 C 13 118.322 0.2 . 3 . . . . 48 Tyr CE2 . 16560 1 456 . 1 1 48 48 TYR N N 15 121.030 0.2 . 1 . . . . 48 Tyr N . 16560 1 457 . 1 1 49 49 LEU H H 1 8.480 0.02 . 1 . . . . 49 Leu H . 16560 1 458 . 1 1 49 49 LEU HA H 1 3.624 0.02 . 1 . . . . 49 Leu HA . 16560 1 459 . 1 1 49 49 LEU HB2 H 1 1.137 0.02 . 2 . . . . 49 Leu HB2 . 16560 1 460 . 1 1 49 49 LEU HB3 H 1 0.801 0.02 . 2 . . . . 49 Leu HB3 . 16560 1 461 . 1 1 49 49 LEU HD11 H 1 0.173 0.02 . 1 . . . . 49 Leu HD1 . 16560 1 462 . 1 1 49 49 LEU HD12 H 1 0.173 0.02 . 1 . . . . 49 Leu HD1 . 16560 1 463 . 1 1 49 49 LEU HD13 H 1 0.173 0.02 . 1 . . . . 49 Leu HD1 . 16560 1 464 . 1 1 49 49 LEU HD21 H 1 -0.236 0.02 . 1 . . . . 49 Leu HD2 . 16560 1 465 . 1 1 49 49 LEU HD22 H 1 -0.236 0.02 . 1 . . . . 49 Leu HD2 . 16560 1 466 . 1 1 49 49 LEU HD23 H 1 -0.236 0.02 . 1 . . . . 49 Leu HD2 . 16560 1 467 . 1 1 49 49 LEU HG H 1 0.814 0.02 . 1 . . . . 49 Leu HG . 16560 1 468 . 1 1 49 49 LEU C C 13 177.653 0.2 . 1 . . . . 49 Leu C . 16560 1 469 . 1 1 49 49 LEU CA C 13 58.321 0.2 . 1 . . . . 49 Leu CA . 16560 1 470 . 1 1 49 49 LEU CB C 13 41.046 0.2 . 1 . . . . 49 Leu CB . 16560 1 471 . 1 1 49 49 LEU CD1 C 13 23.508 0.2 . 1 . . . . 49 Leu CD1 . 16560 1 472 . 1 1 49 49 LEU CD2 C 13 24.808 0.2 . 1 . . . . 49 Leu CD2 . 16560 1 473 . 1 1 49 49 LEU CG C 13 26.223 0.2 . 1 . . . . 49 Leu CG . 16560 1 474 . 1 1 49 49 LEU N N 15 121.024 0.2 . 1 . . . . 49 Leu N . 16560 1 475 . 1 1 50 50 ASN H H 1 7.564 0.02 . 1 . . . . 50 Asn H . 16560 1 476 . 1 1 50 50 ASN HA H 1 4.493 0.02 . 1 . . . . 50 Asn HA . 16560 1 477 . 1 1 50 50 ASN HB2 H 1 2.784 0.02 . 2 . . . . 50 Asn HB2 . 16560 1 478 . 1 1 50 50 ASN HB3 H 1 2.732 0.02 . 2 . . . . 50 Asn HB3 . 16560 1 479 . 1 1 50 50 ASN HD21 H 1 7.516 0.02 . 1 . . . . 50 Asn HD21 . 16560 1 480 . 1 1 50 50 ASN HD22 H 1 7.028 0.02 . 1 . . . . 50 Asn HD22 . 16560 1 481 . 1 1 50 50 ASN C C 13 176.498 0.2 . 1 . . . . 50 Asn C . 16560 1 482 . 1 1 50 50 ASN CA C 13 55.479 0.2 . 1 . . . . 50 Asn CA . 16560 1 483 . 1 1 50 50 ASN CB C 13 39.302 0.2 . 1 . . . . 50 Asn CB . 16560 1 484 . 1 1 50 50 ASN N N 15 114.582 0.2 . 1 . . . . 50 Asn N . 16560 1 485 . 1 1 50 50 ASN ND2 N 15 111.057 0.2 . 1 . . . . 50 Asn ND2 . 16560 1 486 . 1 1 51 51 LYS H H 1 7.370 0.02 . 1 . . . . 51 Lys H . 16560 1 487 . 1 1 51 51 LYS HA H 1 3.990 0.02 . 1 . . . . 51 Lys HA . 16560 1 488 . 1 1 51 51 LYS HB2 H 1 1.807 0.02 . 2 . . . . 51 Lys HB2 . 16560 1 489 . 1 1 51 51 LYS HB3 H 1 1.807 0.02 . 2 . . . . 51 Lys HB3 . 16560 1 490 . 1 1 51 51 LYS HD2 H 1 1.466 0.02 . 2 . . . . 51 Lys HD2 . 16560 1 491 . 1 1 51 51 LYS HD3 H 1 1.467 0.02 . 2 . . . . 51 Lys HD3 . 16560 1 492 . 1 1 51 51 LYS HE2 H 1 2.823 0.02 . 2 . . . . 51 Lys HE2 . 16560 1 493 . 1 1 51 51 LYS HE3 H 1 2.823 0.02 . 2 . . . . 51 Lys HE3 . 16560 1 494 . 1 1 51 51 LYS HG2 H 1 1.459 0.02 . 2 . . . . 51 Lys HG2 . 16560 1 495 . 1 1 51 51 LYS HG3 H 1 1.299 0.02 . 2 . . . . 51 Lys HG3 . 16560 1 496 . 1 1 51 51 LYS C C 13 178.403 0.2 . 1 . . . . 51 Lys C . 16560 1 497 . 1 1 51 51 LYS CA C 13 58.512 0.2 . 1 . . . . 51 Lys CA . 16560 1 498 . 1 1 51 51 LYS CB C 13 32.245 0.2 . 1 . . . . 51 Lys CB . 16560 1 499 . 1 1 51 51 LYS CD C 13 29.087 0.2 . 1 . . . . 51 Lys CD . 16560 1 500 . 1 1 51 51 LYS CE C 13 41.842 0.2 . 1 . . . . 51 Lys CE . 16560 1 501 . 1 1 51 51 LYS CG C 13 24.914 0.2 . 1 . . . . 51 Lys CG . 16560 1 502 . 1 1 51 51 LYS N N 15 118.289 0.2 . 1 . . . . 51 Lys N . 16560 1 503 . 1 1 52 52 LEU H H 1 7.518 0.02 . 1 . . . . 52 Leu H . 16560 1 504 . 1 1 52 52 LEU HA H 1 4.085 0.02 . 1 . . . . 52 Leu HA . 16560 1 505 . 1 1 52 52 LEU HB2 H 1 1.755 0.02 . 2 . . . . 52 Leu HB2 . 16560 1 506 . 1 1 52 52 LEU HB3 H 1 1.372 0.02 . 2 . . . . 52 Leu HB3 . 16560 1 507 . 1 1 52 52 LEU HD11 H 1 0.884 0.02 . 1 . . . . 52 Leu HD1 . 16560 1 508 . 1 1 52 52 LEU HD12 H 1 0.884 0.02 . 1 . . . . 52 Leu HD1 . 16560 1 509 . 1 1 52 52 LEU HD13 H 1 0.884 0.02 . 1 . . . . 52 Leu HD1 . 16560 1 510 . 1 1 52 52 LEU HD21 H 1 0.869 0.02 . 1 . . . . 52 Leu HD2 . 16560 1 511 . 1 1 52 52 LEU HD22 H 1 0.869 0.02 . 1 . . . . 52 Leu HD2 . 16560 1 512 . 1 1 52 52 LEU HD23 H 1 0.869 0.02 . 1 . . . . 52 Leu HD2 . 16560 1 513 . 1 1 52 52 LEU HG H 1 1.737 0.02 . 1 . . . . 52 Leu HG . 16560 1 514 . 1 1 52 52 LEU C C 13 177.924 0.2 . 1 . . . . 52 Leu C . 16560 1 515 . 1 1 52 52 LEU CA C 13 56.424 0.2 . 1 . . . . 52 Leu CA . 16560 1 516 . 1 1 52 52 LEU CB C 13 42.952 0.2 . 1 . . . . 52 Leu CB . 16560 1 517 . 1 1 52 52 LEU CD1 C 13 25.694 0.2 . 1 . . . . 52 Leu CD1 . 16560 1 518 . 1 1 52 52 LEU CD2 C 13 22.636 0.2 . 1 . . . . 52 Leu CD2 . 16560 1 519 . 1 1 52 52 LEU CG C 13 26.661 0.2 . 1 . . . . 52 Leu CG . 16560 1 520 . 1 1 52 52 LEU N N 15 117.841 0.2 . 1 . . . . 52 Leu N . 16560 1 521 . 1 1 53 53 GLN H H 1 8.438 0.02 . 1 . . . . 53 Gln H . 16560 1 522 . 1 1 53 53 GLN HA H 1 4.583 0.02 . 1 . . . . 53 Gln HA . 16560 1 523 . 1 1 53 53 GLN HB2 H 1 2.119 0.02 . 2 . . . . 53 Gln HB2 . 16560 1 524 . 1 1 53 53 GLN HB3 H 1 1.685 0.02 . 2 . . . . 53 Gln HB3 . 16560 1 525 . 1 1 53 53 GLN HE21 H 1 7.103 0.02 . 1 . . . . 53 Gln HE21 . 16560 1 526 . 1 1 53 53 GLN HE22 H 1 6.344 0.02 . 1 . . . . 53 Gln HE22 . 16560 1 527 . 1 1 53 53 GLN HG2 H 1 1.981 0.02 . 2 . . . . 53 Gln HG2 . 16560 1 528 . 1 1 53 53 GLN HG3 H 1 1.947 0.02 . 2 . . . . 53 Gln HG3 . 16560 1 529 . 1 1 53 53 GLN C C 13 172.039 0.2 . 1 . . . . 53 Gln C . 16560 1 530 . 1 1 53 53 GLN CA C 13 52.780 0.2 . 1 . . . . 53 Gln CA . 16560 1 531 . 1 1 53 53 GLN CB C 13 29.902 0.2 . 1 . . . . 53 Gln CB . 16560 1 532 . 1 1 53 53 GLN CG C 13 34.251 0.2 . 1 . . . . 53 Gln CG . 16560 1 533 . 1 1 53 53 GLN N N 15 118.578 0.2 . 1 . . . . 53 Gln N . 16560 1 534 . 1 1 53 53 GLN NE2 N 15 111.075 0.2 . 1 . . . . 53 Gln NE2 . 16560 1 535 . 1 1 54 54 PRO HA H 1 4.718 0.02 . 1 . . . . 54 Pro HA . 16560 1 536 . 1 1 54 54 PRO HB2 H 1 2.382 0.02 . 2 . . . . 54 Pro HB2 . 16560 1 537 . 1 1 54 54 PRO HB3 H 1 1.888 0.02 . 2 . . . . 54 Pro HB3 . 16560 1 538 . 1 1 54 54 PRO HD2 H 1 3.618 0.02 . 2 . . . . 54 Pro HD2 . 16560 1 539 . 1 1 54 54 PRO HD3 H 1 3.299 0.02 . 2 . . . . 54 Pro HD3 . 16560 1 540 . 1 1 54 54 PRO HG2 H 1 1.988 0.02 . 2 . . . . 54 Pro HG2 . 16560 1 541 . 1 1 54 54 PRO HG3 H 1 1.988 0.02 . 2 . . . . 54 Pro HG3 . 16560 1 542 . 1 1 54 54 PRO C C 13 177.295 0.2 . 1 . . . . 54 Pro C . 16560 1 543 . 1 1 54 54 PRO CA C 13 64.754 0.2 . 1 . . . . 54 Pro CA . 16560 1 544 . 1 1 54 54 PRO CB C 13 31.924 0.2 . 1 . . . . 54 Pro CB . 16560 1 545 . 1 1 54 54 PRO CD C 13 50.065 0.2 . 1 . . . . 54 Pro CD . 16560 1 546 . 1 1 54 54 PRO CG C 13 27.238 0.2 . 1 . . . . 54 Pro CG . 16560 1 547 . 1 1 55 55 ASP H H 1 8.349 0.02 . 1 . . . . 55 Asp H . 16560 1 548 . 1 1 55 55 ASP HA H 1 4.596 0.02 . 1 . . . . 55 Asp HA . 16560 1 549 . 1 1 55 55 ASP HB2 H 1 2.705 0.02 . 2 . . . . 55 Asp HB2 . 16560 1 550 . 1 1 55 55 ASP HB3 H 1 2.705 0.02 . 2 . . . . 55 Asp HB3 . 16560 1 551 . 1 1 55 55 ASP C C 13 176.361 0.2 . 1 . . . . 55 Asp C . 16560 1 552 . 1 1 55 55 ASP CA C 13 53.467 0.2 . 1 . . . . 55 Asp CA . 16560 1 553 . 1 1 55 55 ASP CB C 13 40.050 0.2 . 1 . . . . 55 Asp CB . 16560 1 554 . 1 1 55 55 ASP N N 15 114.766 0.2 . 1 . . . . 55 Asp N . 16560 1 555 . 1 1 56 56 PHE H H 1 8.187 0.02 . 1 . . . . 56 Phe H . 16560 1 556 . 1 1 56 56 PHE HA H 1 4.055 0.02 . 1 . . . . 56 Phe HA . 16560 1 557 . 1 1 56 56 PHE HB2 H 1 3.257 0.02 . 2 . . . . 56 Phe HB2 . 16560 1 558 . 1 1 56 56 PHE HB3 H 1 3.024 0.02 . 2 . . . . 56 Phe HB3 . 16560 1 559 . 1 1 56 56 PHE HD1 H 1 7.255 0.02 . 3 . . . . 56 Phe HD1 . 16560 1 560 . 1 1 56 56 PHE HD2 H 1 7.255 0.02 . 3 . . . . 56 Phe HD2 . 16560 1 561 . 1 1 56 56 PHE HE1 H 1 7.032 0.02 . 3 . . . . 56 Phe HE1 . 16560 1 562 . 1 1 56 56 PHE HE2 H 1 7.032 0.02 . 3 . . . . 56 Phe HE2 . 16560 1 563 . 1 1 56 56 PHE HZ H 1 6.893 0.02 . 1 . . . . 56 Phe HZ . 16560 1 564 . 1 1 56 56 PHE C C 13 175.257 0.2 . 1 . . . . 56 Phe C . 16560 1 565 . 1 1 56 56 PHE CA C 13 61.149 0.2 . 1 . . . . 56 Phe CA . 16560 1 566 . 1 1 56 56 PHE CB C 13 38.680 0.2 . 1 . . . . 56 Phe CB . 16560 1 567 . 1 1 56 56 PHE CD1 C 13 132.401 0.2 . 3 . . . . 56 Phe CD1 . 16560 1 568 . 1 1 56 56 PHE CD2 C 13 132.401 0.2 . 3 . . . . 56 Phe CD2 . 16560 1 569 . 1 1 56 56 PHE CE1 C 13 130.861 0.2 . 3 . . . . 56 Phe CE1 . 16560 1 570 . 1 1 56 56 PHE CE2 C 13 130.861 0.2 . 3 . . . . 56 Phe CE2 . 16560 1 571 . 1 1 56 56 PHE CZ C 13 127.802 0.2 . 1 . . . . 56 Phe CZ . 16560 1 572 . 1 1 56 56 PHE N N 15 122.323 0.2 . 1 . . . . 56 Phe N . 16560 1 573 . 1 1 57 57 ASP H H 1 6.887 0.02 . 1 . . . . 57 Asp H . 16560 1 574 . 1 1 57 57 ASP HA H 1 4.670 0.02 . 1 . . . . 57 Asp HA . 16560 1 575 . 1 1 57 57 ASP HB2 H 1 2.605 0.02 . 2 . . . . 57 Asp HB2 . 16560 1 576 . 1 1 57 57 ASP HB3 H 1 2.534 0.02 . 2 . . . . 57 Asp HB3 . 16560 1 577 . 1 1 57 57 ASP C C 13 176.308 0.2 . 1 . . . . 57 Asp C . 16560 1 578 . 1 1 57 57 ASP CA C 13 52.895 0.2 . 1 . . . . 57 Asp CA . 16560 1 579 . 1 1 57 57 ASP CB C 13 42.942 0.2 . 1 . . . . 57 Asp CB . 16560 1 580 . 1 1 57 57 ASP N N 15 127.342 0.2 . 1 . . . . 57 Asp N . 16560 1 581 . 1 1 58 58 SER H H 1 9.284 0.02 . 1 . . . . 58 Ser H . 16560 1 582 . 1 1 58 58 SER HA H 1 3.991 0.02 . 1 . . . . 58 Ser HA . 16560 1 583 . 1 1 58 58 SER HB2 H 1 3.800 0.02 . 2 . . . . 58 Ser HB2 . 16560 1 584 . 1 1 58 58 SER HB3 H 1 3.876 0.02 . 2 . . . . 58 Ser HB3 . 16560 1 585 . 1 1 58 58 SER C C 13 176.248 0.2 . 1 . . . . 58 Ser C . 16560 1 586 . 1 1 58 58 SER CA C 13 63.050 0.2 . 1 . . . . 58 Ser CA . 16560 1 587 . 1 1 58 58 SER CB C 13 63.339 0.2 . 1 . . . . 58 Ser CB . 16560 1 588 . 1 1 58 58 SER N N 15 123.478 0.2 . 1 . . . . 58 Ser N . 16560 1 589 . 1 1 59 59 ARG H H 1 8.639 0.02 . 1 . . . . 59 Arg H . 16560 1 590 . 1 1 59 59 ARG HA H 1 4.073 0.02 . 1 . . . . 59 Arg HA . 16560 1 591 . 1 1 59 59 ARG HB2 H 1 1.770 0.02 . 2 . . . . 59 Arg HB2 . 16560 1 592 . 1 1 59 59 ARG HB3 H 1 1.770 0.02 . 2 . . . . 59 Arg HB3 . 16560 1 593 . 1 1 59 59 ARG HD2 H 1 3.345 0.02 . 2 . . . . 59 Arg HD2 . 16560 1 594 . 1 1 59 59 ARG HD3 H 1 3.137 0.02 . 2 . . . . 59 Arg HD3 . 16560 1 595 . 1 1 59 59 ARG HG2 H 1 1.765 0.02 . 2 . . . . 59 Arg HG2 . 16560 1 596 . 1 1 59 59 ARG HG3 H 1 1.760 0.02 . 2 . . . . 59 Arg HG3 . 16560 1 597 . 1 1 59 59 ARG C C 13 180.693 0.2 . 1 . . . . 59 Arg C . 16560 1 598 . 1 1 59 59 ARG CA C 13 58.787 0.2 . 1 . . . . 59 Arg CA . 16560 1 599 . 1 1 59 59 ARG CB C 13 29.824 0.2 . 1 . . . . 59 Arg CB . 16560 1 600 . 1 1 59 59 ARG CD C 13 43.418 0.2 . 1 . . . . 59 Arg CD . 16560 1 601 . 1 1 59 59 ARG CG C 13 27.404 0.2 . 1 . . . . 59 Arg CG . 16560 1 602 . 1 1 59 59 ARG N N 15 123.207 0.2 . 1 . . . . 59 Arg N . 16560 1 603 . 1 1 60 60 LEU H H 1 7.460 0.02 . 1 . . . . 60 Leu H . 16560 1 604 . 1 1 60 60 LEU HA H 1 3.841 0.02 . 1 . . . . 60 Leu HA . 16560 1 605 . 1 1 60 60 LEU HB2 H 1 1.045 0.02 . 2 . . . . 60 Leu HB2 . 16560 1 606 . 1 1 60 60 LEU HB3 H 1 0.801 0.02 . 2 . . . . 60 Leu HB3 . 16560 1 607 . 1 1 60 60 LEU HD11 H 1 0.826 0.02 . 1 . . . . 60 Leu HD1 . 16560 1 608 . 1 1 60 60 LEU HD12 H 1 0.826 0.02 . 1 . . . . 60 Leu HD1 . 16560 1 609 . 1 1 60 60 LEU HD13 H 1 0.826 0.02 . 1 . . . . 60 Leu HD1 . 16560 1 610 . 1 1 60 60 LEU HD21 H 1 0.698 0.02 . 1 . . . . 60 Leu HD2 . 16560 1 611 . 1 1 60 60 LEU HD22 H 1 0.698 0.02 . 1 . . . . 60 Leu HD2 . 16560 1 612 . 1 1 60 60 LEU HD23 H 1 0.698 0.02 . 1 . . . . 60 Leu HD2 . 16560 1 613 . 1 1 60 60 LEU HG H 1 1.344 0.02 . 1 . . . . 60 Leu HG . 16560 1 614 . 1 1 60 60 LEU C C 13 177.018 0.2 . 1 . . . . 60 Leu C . 16560 1 615 . 1 1 60 60 LEU CA C 13 56.556 0.2 . 1 . . . . 60 Leu CA . 16560 1 616 . 1 1 60 60 LEU CB C 13 41.013 0.2 . 1 . . . . 60 Leu CB . 16560 1 617 . 1 1 60 60 LEU CD1 C 13 24.808 0.2 . 1 . . . . 60 Leu CD1 . 16560 1 618 . 1 1 60 60 LEU CD2 C 13 22.945 0.2 . 1 . . . . 60 Leu CD2 . 16560 1 619 . 1 1 60 60 LEU CG C 13 26.893 0.2 . 1 . . . . 60 Leu CG . 16560 1 620 . 1 1 60 60 LEU N N 15 120.191 0.2 . 1 . . . . 60 Leu N . 16560 1 621 . 1 1 61 61 TYR H H 1 7.200 0.02 . 1 . . . . 61 Tyr H . 16560 1 622 . 1 1 61 61 TYR HA H 1 4.781 0.02 . 1 . . . . 61 Tyr HA . 16560 1 623 . 1 1 61 61 TYR HB2 H 1 3.941 0.02 . 2 . . . . 61 Tyr HB2 . 16560 1 624 . 1 1 61 61 TYR HB3 H 1 2.854 0.02 . 2 . . . . 61 Tyr HB3 . 16560 1 625 . 1 1 61 61 TYR HD1 H 1 7.090 0.02 . 3 . . . . 61 Tyr HD1 . 16560 1 626 . 1 1 61 61 TYR HD2 H 1 7.090 0.02 . 3 . . . . 61 Tyr HD2 . 16560 1 627 . 1 1 61 61 TYR HE1 H 1 6.521 0.02 . 3 . . . . 61 Tyr HE1 . 16560 1 628 . 1 1 61 61 TYR HE2 H 1 6.521 0.02 . 3 . . . . 61 Tyr HE2 . 16560 1 629 . 1 1 61 61 TYR C C 13 175.303 0.2 . 1 . . . . 61 Tyr C . 16560 1 630 . 1 1 61 61 TYR CA C 13 56.371 0.2 . 1 . . . . 61 Tyr CA . 16560 1 631 . 1 1 61 61 TYR CB C 13 38.825 0.2 . 1 . . . . 61 Tyr CB . 16560 1 632 . 1 1 61 61 TYR CD1 C 13 133.048 0.2 . 3 . . . . 61 Tyr CD1 . 16560 1 633 . 1 1 61 61 TYR CD2 C 13 133.048 0.2 . 3 . . . . 61 Tyr CD2 . 16560 1 634 . 1 1 61 61 TYR CE1 C 13 118.889 0.2 . 3 . . . . 61 Tyr CE1 . 16560 1 635 . 1 1 61 61 TYR CE2 C 13 118.889 0.2 . 3 . . . . 61 Tyr CE2 . 16560 1 636 . 1 1 61 61 TYR N N 15 114.720 0.2 . 1 . . . . 61 Tyr N . 16560 1 637 . 1 1 62 62 GLY H H 1 7.354 0.02 . 1 . . . . 62 Gly H . 16560 1 638 . 1 1 62 62 GLY HA2 H 1 3.968 0.02 . 2 . . . . 62 Gly HA2 . 16560 1 639 . 1 1 62 62 GLY HA3 H 1 3.552 0.02 . 2 . . . . 62 Gly HA3 . 16560 1 640 . 1 1 62 62 GLY C C 13 173.542 0.2 . 1 . . . . 62 Gly C . 16560 1 641 . 1 1 62 62 GLY CA C 13 44.889 0.2 . 1 . . . . 62 Gly CA . 16560 1 642 . 1 1 62 62 GLY N N 15 104.100 0.2 . 1 . . . . 62 Gly N . 16560 1 643 . 1 1 63 63 TYR H H 1 7.377 0.02 . 1 . . . . 63 Tyr H . 16560 1 644 . 1 1 63 63 TYR HA H 1 4.937 0.02 . 1 . . . . 63 Tyr HA . 16560 1 645 . 1 1 63 63 TYR HB2 H 1 3.167 0.02 . 2 . . . . 63 Tyr HB2 . 16560 1 646 . 1 1 63 63 TYR HB3 H 1 2.450 0.02 . 2 . . . . 63 Tyr HB3 . 16560 1 647 . 1 1 63 63 TYR HD1 H 1 7.021 0.02 . 3 . . . . 63 Tyr HD1 . 16560 1 648 . 1 1 63 63 TYR HD2 H 1 7.021 0.02 . 3 . . . . 63 Tyr HD2 . 16560 1 649 . 1 1 63 63 TYR HE1 H 1 6.801 0.02 . 3 . . . . 63 Tyr HE1 . 16560 1 650 . 1 1 63 63 TYR HE2 H 1 6.801 0.02 . 3 . . . . 63 Tyr HE2 . 16560 1 651 . 1 1 63 63 TYR C C 13 175.675 0.2 . 1 . . . . 63 Tyr C . 16560 1 652 . 1 1 63 63 TYR CA C 13 56.902 0.2 . 1 . . . . 63 Tyr CA . 16560 1 653 . 1 1 63 63 TYR CB C 13 42.609 0.2 . 1 . . . . 63 Tyr CB . 16560 1 654 . 1 1 63 63 TYR CD1 C 13 133.135 0.2 . 3 . . . . 63 Tyr CD1 . 16560 1 655 . 1 1 63 63 TYR CD2 C 13 133.135 0.2 . 3 . . . . 63 Tyr CD2 . 16560 1 656 . 1 1 63 63 TYR CE1 C 13 118.380 0.2 . 3 . . . . 63 Tyr CE1 . 16560 1 657 . 1 1 63 63 TYR CE2 C 13 118.380 0.2 . 3 . . . . 63 Tyr CE2 . 16560 1 658 . 1 1 63 63 TYR N N 15 117.874 0.2 . 1 . . . . 63 Tyr N . 16560 1 659 . 1 1 64 64 LYS H H 1 9.403 0.02 . 1 . . . . 64 Lys H . 16560 1 660 . 1 1 64 64 LYS HA H 1 3.914 0.02 . 1 . . . . 64 Lys HA . 16560 1 661 . 1 1 64 64 LYS HB2 H 1 1.939 0.02 . 2 . . . . 64 Lys HB2 . 16560 1 662 . 1 1 64 64 LYS HB3 H 1 1.901 0.02 . 2 . . . . 64 Lys HB3 . 16560 1 663 . 1 1 64 64 LYS HD2 H 1 1.748 0.02 . 2 . . . . 64 Lys HD2 . 16560 1 664 . 1 1 64 64 LYS HD3 H 1 1.748 0.02 . 2 . . . . 64 Lys HD3 . 16560 1 665 . 1 1 64 64 LYS HE2 H 1 3.038 0.02 . 2 . . . . 64 Lys HE2 . 16560 1 666 . 1 1 64 64 LYS HE3 H 1 3.038 0.02 . 2 . . . . 64 Lys HE3 . 16560 1 667 . 1 1 64 64 LYS HG2 H 1 1.617 0.02 . 2 . . . . 64 Lys HG2 . 16560 1 668 . 1 1 64 64 LYS HG3 H 1 1.478 0.02 . 2 . . . . 64 Lys HG3 . 16560 1 669 . 1 1 64 64 LYS C C 13 176.334 0.2 . 1 . . . . 64 Lys C . 16560 1 670 . 1 1 64 64 LYS CA C 13 59.534 0.2 . 1 . . . . 64 Lys CA . 16560 1 671 . 1 1 64 64 LYS CB C 13 32.892 0.2 . 1 . . . . 64 Lys CB . 16560 1 672 . 1 1 64 64 LYS CD C 13 29.310 0.2 . 1 . . . . 64 Lys CD . 16560 1 673 . 1 1 64 64 LYS CE C 13 42.306 0.2 . 1 . . . . 64 Lys CE . 16560 1 674 . 1 1 64 64 LYS CG C 13 25.713 0.2 . 1 . . . . 64 Lys CG . 16560 1 675 . 1 1 64 64 LYS N N 15 123.946 0.2 . 1 . . . . 64 Lys N . 16560 1 676 . 1 1 65 65 LYS H H 1 7.635 0.02 . 1 . . . . 65 Lys H . 16560 1 677 . 1 1 65 65 LYS HA H 1 4.787 0.02 . 1 . . . . 65 Lys HA . 16560 1 678 . 1 1 65 65 LYS HB2 H 1 2.145 0.02 . 2 . . . . 65 Lys HB2 . 16560 1 679 . 1 1 65 65 LYS HB3 H 1 1.828 0.02 . 2 . . . . 65 Lys HB3 . 16560 1 680 . 1 1 65 65 LYS HD2 H 1 1.744 0.02 . 2 . . . . 65 Lys HD2 . 16560 1 681 . 1 1 65 65 LYS HD3 H 1 1.744 0.02 . 2 . . . . 65 Lys HD3 . 16560 1 682 . 1 1 65 65 LYS HE2 H 1 3.038 0.02 . 2 . . . . 65 Lys HE2 . 16560 1 683 . 1 1 65 65 LYS HE3 H 1 3.038 0.02 . 2 . . . . 65 Lys HE3 . 16560 1 684 . 1 1 65 65 LYS HG2 H 1 1.454 0.02 . 2 . . . . 65 Lys HG2 . 16560 1 685 . 1 1 65 65 LYS HG3 H 1 1.382 0.02 . 2 . . . . 65 Lys HG3 . 16560 1 686 . 1 1 65 65 LYS C C 13 177.231 0.2 . 1 . . . . 65 Lys C . 16560 1 687 . 1 1 65 65 LYS CA C 13 54.089 0.2 . 1 . . . . 65 Lys CA . 16560 1 688 . 1 1 65 65 LYS CB C 13 35.722 0.2 . 1 . . . . 65 Lys CB . 16560 1 689 . 1 1 65 65 LYS CD C 13 29.255 0.2 . 1 . . . . 65 Lys CD . 16560 1 690 . 1 1 65 65 LYS CE C 13 42.025 0.2 . 1 . . . . 65 Lys CE . 16560 1 691 . 1 1 65 65 LYS CG C 13 24.276 0.2 . 1 . . . . 65 Lys CG . 16560 1 692 . 1 1 65 65 LYS N N 15 112.461 0.2 . 1 . . . . 65 Lys N . 16560 1 693 . 1 1 66 66 LEU H H 1 9.090 0.02 . 1 . . . . 66 Leu H . 16560 1 694 . 1 1 66 66 LEU HA H 1 4.240 0.02 . 1 . . . . 66 Leu HA . 16560 1 695 . 1 1 66 66 LEU HB2 H 1 1.990 0.02 . 2 . . . . 66 Leu HB2 . 16560 1 696 . 1 1 66 66 LEU HB3 H 1 1.817 0.02 . 2 . . . . 66 Leu HB3 . 16560 1 697 . 1 1 66 66 LEU HD11 H 1 1.053 0.02 . 1 . . . . 66 Leu HD1 . 16560 1 698 . 1 1 66 66 LEU HD12 H 1 1.053 0.02 . 1 . . . . 66 Leu HD1 . 16560 1 699 . 1 1 66 66 LEU HD13 H 1 1.053 0.02 . 1 . . . . 66 Leu HD1 . 16560 1 700 . 1 1 66 66 LEU HD21 H 1 0.921 0.02 . 1 . . . . 66 Leu HD2 . 16560 1 701 . 1 1 66 66 LEU HD22 H 1 0.921 0.02 . 1 . . . . 66 Leu HD2 . 16560 1 702 . 1 1 66 66 LEU HD23 H 1 0.921 0.02 . 1 . . . . 66 Leu HD2 . 16560 1 703 . 1 1 66 66 LEU HG H 1 1.648 0.02 . 1 . . . . 66 Leu HG . 16560 1 704 . 1 1 66 66 LEU C C 13 178.820 0.2 . 1 . . . . 66 Leu C . 16560 1 705 . 1 1 66 66 LEU CA C 13 58.129 0.2 . 1 . . . . 66 Leu CA . 16560 1 706 . 1 1 66 66 LEU CB C 13 41.476 0.2 . 1 . . . . 66 Leu CB . 16560 1 707 . 1 1 66 66 LEU CD1 C 13 23.130 0.2 . 1 . . . . 66 Leu CD1 . 16560 1 708 . 1 1 66 66 LEU CD2 C 13 25.727 0.2 . 1 . . . . 66 Leu CD2 . 16560 1 709 . 1 1 66 66 LEU CG C 13 27.157 0.2 . 1 . . . . 66 Leu CG . 16560 1 710 . 1 1 66 66 LEU N N 15 124.584 0.2 . 1 . . . . 66 Leu N . 16560 1 711 . 1 1 67 67 SER H H 1 8.867 0.02 . 1 . . . . 67 Ser H . 16560 1 712 . 1 1 67 67 SER HA H 1 3.697 0.02 . 1 . . . . 67 Ser HA . 16560 1 713 . 1 1 67 67 SER HB2 H 1 3.839 0.02 . 2 . . . . 67 Ser HB2 . 16560 1 714 . 1 1 67 67 SER HB3 H 1 3.789 0.02 . 2 . . . . 67 Ser HB3 . 16560 1 715 . 1 1 67 67 SER C C 13 175.588 0.2 . 1 . . . . 67 Ser C . 16560 1 716 . 1 1 67 67 SER CA C 13 61.518 0.2 . 1 . . . . 67 Ser CA . 16560 1 717 . 1 1 67 67 SER CB C 13 61.537 0.2 . 1 . . . . 67 Ser CB . 16560 1 718 . 1 1 67 67 SER N N 15 112.095 0.2 . 1 . . . . 67 Ser N . 16560 1 719 . 1 1 68 68 ASP H H 1 6.783 0.02 . 1 . . . . 68 Asp H . 16560 1 720 . 1 1 68 68 ASP HA H 1 4.356 0.02 . 1 . . . . 68 Asp HA . 16560 1 721 . 1 1 68 68 ASP HB2 H 1 3.018 0.02 . 2 . . . . 68 Asp HB2 . 16560 1 722 . 1 1 68 68 ASP HB3 H 1 3.018 0.02 . 2 . . . . 68 Asp HB3 . 16560 1 723 . 1 1 68 68 ASP C C 13 177.827 0.2 . 1 . . . . 68 Asp C . 16560 1 724 . 1 1 68 68 ASP CA C 13 57.170 0.2 . 1 . . . . 68 Asp CA . 16560 1 725 . 1 1 68 68 ASP CB C 13 41.380 0.2 . 1 . . . . 68 Asp CB . 16560 1 726 . 1 1 68 68 ASP N N 15 119.720 0.2 . 1 . . . . 68 Asp N . 16560 1 727 . 1 1 69 69 LEU H H 1 7.153 0.02 . 1 . . . . 69 Leu H . 16560 1 728 . 1 1 69 69 LEU HA H 1 2.561 0.02 . 1 . . . . 69 Leu HA . 16560 1 729 . 1 1 69 69 LEU HB2 H 1 2.144 0.02 . 2 . . . . 69 Leu HB2 . 16560 1 730 . 1 1 69 69 LEU HB3 H 1 1.403 0.02 . 2 . . . . 69 Leu HB3 . 16560 1 731 . 1 1 69 69 LEU HD11 H 1 1.207 0.02 . 1 . . . . 69 Leu HD1 . 16560 1 732 . 1 1 69 69 LEU HD12 H 1 1.207 0.02 . 1 . . . . 69 Leu HD1 . 16560 1 733 . 1 1 69 69 LEU HD13 H 1 1.207 0.02 . 1 . . . . 69 Leu HD1 . 16560 1 734 . 1 1 69 69 LEU HD21 H 1 0.935 0.02 . 1 . . . . 69 Leu HD2 . 16560 1 735 . 1 1 69 69 LEU HD22 H 1 0.935 0.02 . 1 . . . . 69 Leu HD2 . 16560 1 736 . 1 1 69 69 LEU HD23 H 1 0.935 0.02 . 1 . . . . 69 Leu HD2 . 16560 1 737 . 1 1 69 69 LEU HG H 1 1.535 0.02 . 1 . . . . 69 Leu HG . 16560 1 738 . 1 1 69 69 LEU C C 13 177.830 0.2 . 1 . . . . 69 Leu C . 16560 1 739 . 1 1 69 69 LEU CA C 13 58.843 0.2 . 1 . . . . 69 Leu CA . 16560 1 740 . 1 1 69 69 LEU CB C 13 42.203 0.2 . 1 . . . . 69 Leu CB . 16560 1 741 . 1 1 69 69 LEU CD1 C 13 27.601 0.2 . 1 . . . . 69 Leu CD1 . 16560 1 742 . 1 1 69 69 LEU CD2 C 13 24.114 0.2 . 1 . . . . 69 Leu CD2 . 16560 1 743 . 1 1 69 69 LEU CG C 13 27.716 0.2 . 1 . . . . 69 Leu CG . 16560 1 744 . 1 1 69 69 LEU N N 15 122.181 0.2 . 1 . . . . 69 Leu N . 16560 1 745 . 1 1 70 70 VAL H H 1 8.167 0.02 . 1 . . . . 70 Val H . 16560 1 746 . 1 1 70 70 VAL HA H 1 3.509 0.02 . 1 . . . . 70 Val HA . 16560 1 747 . 1 1 70 70 VAL HB H 1 1.682 0.02 . 1 . . . . 70 Val HB . 16560 1 748 . 1 1 70 70 VAL HG11 H 1 0.373 0.02 . 1 . . . . 70 Val HG1 . 16560 1 749 . 1 1 70 70 VAL HG12 H 1 0.373 0.02 . 1 . . . . 70 Val HG1 . 16560 1 750 . 1 1 70 70 VAL HG13 H 1 0.373 0.02 . 1 . . . . 70 Val HG1 . 16560 1 751 . 1 1 70 70 VAL HG21 H 1 0.627 0.02 . 1 . . . . 70 Val HG2 . 16560 1 752 . 1 1 70 70 VAL HG22 H 1 0.627 0.02 . 1 . . . . 70 Val HG2 . 16560 1 753 . 1 1 70 70 VAL HG23 H 1 0.627 0.02 . 1 . . . . 70 Val HG2 . 16560 1 754 . 1 1 70 70 VAL C C 13 177.695 0.2 . 1 . . . . 70 Val C . 16560 1 755 . 1 1 70 70 VAL CA C 13 65.582 0.2 . 1 . . . . 70 Val CA . 16560 1 756 . 1 1 70 70 VAL CB C 13 31.409 0.2 . 1 . . . . 70 Val CB . 16560 1 757 . 1 1 70 70 VAL CG1 C 13 21.735 0.2 . 1 . . . . 70 Val CG1 . 16560 1 758 . 1 1 70 70 VAL CG2 C 13 21.883 0.2 . 1 . . . . 70 Val CG2 . 16560 1 759 . 1 1 70 70 VAL N N 15 116.117 0.2 . 1 . . . . 70 Val N . 16560 1 760 . 1 1 71 71 LYS H H 1 7.665 0.02 . 1 . . . . 71 Lys H . 16560 1 761 . 1 1 71 71 LYS HA H 1 3.854 0.02 . 1 . . . . 71 Lys HA . 16560 1 762 . 1 1 71 71 LYS HB2 H 1 1.799 0.02 . 2 . . . . 71 Lys HB2 . 16560 1 763 . 1 1 71 71 LYS HB3 H 1 1.865 0.02 . 2 . . . . 71 Lys HB3 . 16560 1 764 . 1 1 71 71 LYS HD2 H 1 1.723 0.02 . 2 . . . . 71 Lys HD2 . 16560 1 765 . 1 1 71 71 LYS HD3 H 1 1.723 0.02 . 2 . . . . 71 Lys HD3 . 16560 1 766 . 1 1 71 71 LYS HE2 H 1 3.026 0.02 . 2 . . . . 71 Lys HE2 . 16560 1 767 . 1 1 71 71 LYS HE3 H 1 3.026 0.02 . 2 . . . . 71 Lys HE3 . 16560 1 768 . 1 1 71 71 LYS HG2 H 1 1.702 0.02 . 2 . . . . 71 Lys HG2 . 16560 1 769 . 1 1 71 71 LYS HG3 H 1 1.428 0.02 . 2 . . . . 71 Lys HG3 . 16560 1 770 . 1 1 71 71 LYS C C 13 177.406 0.2 . 1 . . . . 71 Lys C . 16560 1 771 . 1 1 71 71 LYS CA C 13 59.175 0.2 . 1 . . . . 71 Lys CA . 16560 1 772 . 1 1 71 71 LYS CB C 13 32.804 0.2 . 1 . . . . 71 Lys CB . 16560 1 773 . 1 1 71 71 LYS CD C 13 29.190 0.2 . 1 . . . . 71 Lys CD . 16560 1 774 . 1 1 71 71 LYS CE C 13 42.194 0.2 . 1 . . . . 71 Lys CE . 16560 1 775 . 1 1 71 71 LYS CG C 13 26.613 0.2 . 1 . . . . 71 Lys CG . 16560 1 776 . 1 1 71 71 LYS N N 15 116.326 0.2 . 1 . . . . 71 Lys N . 16560 1 777 . 1 1 72 72 ALA H H 1 7.506 0.02 . 1 . . . . 72 Ala H . 16560 1 778 . 1 1 72 72 ALA HA H 1 4.391 0.02 . 1 . . . . 72 Ala HA . 16560 1 779 . 1 1 72 72 ALA HB1 H 1 1.567 0.02 . 1 . . . . 72 Ala HB . 16560 1 780 . 1 1 72 72 ALA HB2 H 1 1.567 0.02 . 1 . . . . 72 Ala HB . 16560 1 781 . 1 1 72 72 ALA HB3 H 1 1.567 0.02 . 1 . . . . 72 Ala HB . 16560 1 782 . 1 1 72 72 ALA C C 13 180.756 0.2 . 1 . . . . 72 Ala C . 16560 1 783 . 1 1 72 72 ALA CA C 13 53.691 0.2 . 1 . . . . 72 Ala CA . 16560 1 784 . 1 1 72 72 ALA CB C 13 20.243 0.2 . 1 . . . . 72 Ala CB . 16560 1 785 . 1 1 72 72 ALA N N 15 118.313 0.2 . 1 . . . . 72 Ala N . 16560 1 786 . 1 1 73 73 ARG H H 1 7.603 0.02 . 1 . . . . 73 Arg H . 16560 1 787 . 1 1 73 73 ARG HA H 1 4.872 0.02 . 1 . . . . 73 Arg HA . 16560 1 788 . 1 1 73 73 ARG HB2 H 1 1.787 0.02 . 2 . . . . 73 Arg HB2 . 16560 1 789 . 1 1 73 73 ARG HB3 H 1 1.228 0.02 . 2 . . . . 73 Arg HB3 . 16560 1 790 . 1 1 73 73 ARG HD2 H 1 3.184 0.02 . 2 . . . . 73 Arg HD2 . 16560 1 791 . 1 1 73 73 ARG HD3 H 1 2.990 0.02 . 2 . . . . 73 Arg HD3 . 16560 1 792 . 1 1 73 73 ARG HE H 1 8.726 0.02 . 1 . . . . 73 Arg HE . 16560 1 793 . 1 1 73 73 ARG HG2 H 1 2.060 0.02 . 2 . . . . 73 Arg HG2 . 16560 1 794 . 1 1 73 73 ARG HG3 H 1 1.782 0.02 . 2 . . . . 73 Arg HG3 . 16560 1 795 . 1 1 73 73 ARG C C 13 177.558 0.2 . 1 . . . . 73 Arg C . 16560 1 796 . 1 1 73 73 ARG CA C 13 51.230 0.2 . 1 . . . . 73 Arg CA . 16560 1 797 . 1 1 73 73 ARG CB C 13 25.568 0.2 . 1 . . . . 73 Arg CB . 16560 1 798 . 1 1 73 73 ARG CD C 13 39.229 0.2 . 1 . . . . 73 Arg CD . 16560 1 799 . 1 1 73 73 ARG CG C 13 25.581 0.2 . 1 . . . . 73 Arg CG . 16560 1 800 . 1 1 73 73 ARG N N 15 118.690 0.2 . 1 . . . . 73 Arg N . 16560 1 801 . 1 1 73 73 ARG NE N 15 108.843 0.2 . 1 . . . . 73 Arg NE . 16560 1 802 . 1 1 74 74 THR H H 1 8.261 0.02 . 1 . . . . 74 Thr H . 16560 1 803 . 1 1 74 74 THR HA H 1 4.552 0.02 . 1 . . . . 74 Thr HA . 16560 1 804 . 1 1 74 74 THR HB H 1 4.546 0.02 . 1 . . . . 74 Thr HB . 16560 1 805 . 1 1 74 74 THR HG21 H 1 1.463 0.02 . 1 . . . . 74 Thr HG2 . 16560 1 806 . 1 1 74 74 THR HG22 H 1 1.463 0.02 . 1 . . . . 74 Thr HG2 . 16560 1 807 . 1 1 74 74 THR HG23 H 1 1.463 0.02 . 1 . . . . 74 Thr HG2 . 16560 1 808 . 1 1 74 74 THR C C 13 174.706 0.2 . 1 . . . . 74 Thr C . 16560 1 809 . 1 1 74 74 THR CA C 13 62.876 0.2 . 1 . . . . 74 Thr CA . 16560 1 810 . 1 1 74 74 THR CB C 13 68.716 0.2 . 1 . . . . 74 Thr CB . 16560 1 811 . 1 1 74 74 THR CG2 C 13 22.593 0.2 . 1 . . . . 74 Thr CG2 . 16560 1 812 . 1 1 74 74 THR N N 15 115.950 0.2 . 1 . . . . 74 Thr N . 16560 1 813 . 1 1 75 75 ASP H H 1 9.542 0.02 . 1 . . . . 75 Asp H . 16560 1 814 . 1 1 75 75 ASP HA H 1 4.310 0.02 . 1 . . . . 75 Asp HA . 16560 1 815 . 1 1 75 75 ASP HB2 H 1 2.699 0.02 . 2 . . . . 75 Asp HB2 . 16560 1 816 . 1 1 75 75 ASP HB3 H 1 2.509 0.02 . 2 . . . . 75 Asp HB3 . 16560 1 817 . 1 1 75 75 ASP C C 13 175.958 0.2 . 1 . . . . 75 Asp C . 16560 1 818 . 1 1 75 75 ASP CA C 13 54.476 0.2 . 1 . . . . 75 Asp CA . 16560 1 819 . 1 1 75 75 ASP CB C 13 38.969 0.2 . 1 . . . . 75 Asp CB . 16560 1 820 . 1 1 75 75 ASP N N 15 116.582 0.2 . 1 . . . . 75 Asp N . 16560 1 821 . 1 1 76 76 LEU H H 1 7.078 0.02 . 1 . . . . 76 Leu H . 16560 1 822 . 1 1 76 76 LEU HA H 1 4.225 0.02 . 1 . . . . 76 Leu HA . 16560 1 823 . 1 1 76 76 LEU HB2 H 1 0.768 0.02 . 2 . . . . 76 Leu HB2 . 16560 1 824 . 1 1 76 76 LEU HB3 H 1 0.166 0.02 . 2 . . . . 76 Leu HB3 . 16560 1 825 . 1 1 76 76 LEU HD11 H 1 0.527 0.02 . 1 . . . . 76 Leu HD1 . 16560 1 826 . 1 1 76 76 LEU HD12 H 1 0.527 0.02 . 1 . . . . 76 Leu HD1 . 16560 1 827 . 1 1 76 76 LEU HD13 H 1 0.527 0.02 . 1 . . . . 76 Leu HD1 . 16560 1 828 . 1 1 76 76 LEU HD21 H 1 0.533 0.02 . 1 . . . . 76 Leu HD2 . 16560 1 829 . 1 1 76 76 LEU HD22 H 1 0.533 0.02 . 1 . . . . 76 Leu HD2 . 16560 1 830 . 1 1 76 76 LEU HD23 H 1 0.533 0.02 . 1 . . . . 76 Leu HD2 . 16560 1 831 . 1 1 76 76 LEU HG H 1 1.233 0.02 . 1 . . . . 76 Leu HG . 16560 1 832 . 1 1 76 76 LEU C C 13 177.244 0.2 . 1 . . . . 76 Leu C . 16560 1 833 . 1 1 76 76 LEU CA C 13 55.349 0.2 . 1 . . . . 76 Leu CA . 16560 1 834 . 1 1 76 76 LEU CB C 13 43.508 0.2 . 1 . . . . 76 Leu CB . 16560 1 835 . 1 1 76 76 LEU CD1 C 13 25.602 0.2 . 1 . . . . 76 Leu CD1 . 16560 1 836 . 1 1 76 76 LEU CD2 C 13 22.982 0.2 . 1 . . . . 76 Leu CD2 . 16560 1 837 . 1 1 76 76 LEU CG C 13 25.818 0.2 . 1 . . . . 76 Leu CG . 16560 1 838 . 1 1 76 76 LEU N N 15 117.639 0.2 . 1 . . . . 76 Leu N . 16560 1 839 . 1 1 77 77 PHE H H 1 7.977 0.02 . 1 . . . . 77 Phe H . 16560 1 840 . 1 1 77 77 PHE HA H 1 5.648 0.02 . 1 . . . . 77 Phe HA . 16560 1 841 . 1 1 77 77 PHE HB2 H 1 2.918 0.02 . 2 . . . . 77 Phe HB2 . 16560 1 842 . 1 1 77 77 PHE HB3 H 1 2.657 0.02 . 2 . . . . 77 Phe HB3 . 16560 1 843 . 1 1 77 77 PHE HD1 H 1 7.225 0.02 . 3 . . . . 77 Phe HD1 . 16560 1 844 . 1 1 77 77 PHE HD2 H 1 7.225 0.02 . 3 . . . . 77 Phe HD2 . 16560 1 845 . 1 1 77 77 PHE HE1 H 1 6.833 0.02 . 3 . . . . 77 Phe HE1 . 16560 1 846 . 1 1 77 77 PHE HE2 H 1 6.833 0.02 . 3 . . . . 77 Phe HE2 . 16560 1 847 . 1 1 77 77 PHE HZ H 1 6.938 0.02 . 1 . . . . 77 Phe HZ . 16560 1 848 . 1 1 77 77 PHE C C 13 175.868 0.2 . 1 . . . . 77 Phe C . 16560 1 849 . 1 1 77 77 PHE CA C 13 54.878 0.2 . 1 . . . . 77 Phe CA . 16560 1 850 . 1 1 77 77 PHE CB C 13 42.833 0.2 . 1 . . . . 77 Phe CB . 16560 1 851 . 1 1 77 77 PHE CD1 C 13 133.610 0.2 . 3 . . . . 77 Phe CD1 . 16560 1 852 . 1 1 77 77 PHE CD2 C 13 133.610 0.2 . 3 . . . . 77 Phe CD2 . 16560 1 853 . 1 1 77 77 PHE CE1 C 13 129.753 0.2 . 3 . . . . 77 Phe CE1 . 16560 1 854 . 1 1 77 77 PHE CE2 C 13 129.753 0.2 . 3 . . . . 77 Phe CE2 . 16560 1 855 . 1 1 77 77 PHE CZ C 13 128.294 0.2 . 1 . . . . 77 Phe CZ . 16560 1 856 . 1 1 77 77 PHE N N 15 115.989 0.2 . 1 . . . . 77 Phe N . 16560 1 857 . 1 1 78 78 VAL H H 1 8.863 0.02 . 1 . . . . 78 Val H . 16560 1 858 . 1 1 78 78 VAL HA H 1 4.425 0.02 . 1 . . . . 78 Val HA . 16560 1 859 . 1 1 78 78 VAL HB H 1 1.648 0.02 . 1 . . . . 78 Val HB . 16560 1 860 . 1 1 78 78 VAL HG11 H 1 1.049 0.02 . 1 . . . . 78 Val HG1 . 16560 1 861 . 1 1 78 78 VAL HG12 H 1 1.049 0.02 . 1 . . . . 78 Val HG1 . 16560 1 862 . 1 1 78 78 VAL HG13 H 1 1.049 0.02 . 1 . . . . 78 Val HG1 . 16560 1 863 . 1 1 78 78 VAL HG21 H 1 0.852 0.02 . 1 . . . . 78 Val HG2 . 16560 1 864 . 1 1 78 78 VAL HG22 H 1 0.852 0.02 . 1 . . . . 78 Val HG2 . 16560 1 865 . 1 1 78 78 VAL HG23 H 1 0.852 0.02 . 1 . . . . 78 Val HG2 . 16560 1 866 . 1 1 78 78 VAL C C 13 175.288 0.2 . 1 . . . . 78 Val C . 16560 1 867 . 1 1 78 78 VAL CA C 13 61.575 0.2 . 1 . . . . 78 Val CA . 16560 1 868 . 1 1 78 78 VAL CB C 13 33.988 0.2 . 1 . . . . 78 Val CB . 16560 1 869 . 1 1 78 78 VAL CG1 C 13 21.216 0.2 . 1 . . . . 78 Val CG1 . 16560 1 870 . 1 1 78 78 VAL CG2 C 13 21.276 0.2 . 1 . . . . 78 Val CG2 . 16560 1 871 . 1 1 78 78 VAL N N 15 123.339 0.2 . 1 . . . . 78 Val N . 16560 1 872 . 1 1 79 79 THR H H 1 8.305 0.02 . 1 . . . . 79 Thr H . 16560 1 873 . 1 1 79 79 THR HA H 1 5.882 0.02 . 1 . . . . 79 Thr HA . 16560 1 874 . 1 1 79 79 THR HB H 1 4.245 0.02 . 1 . . . . 79 Thr HB . 16560 1 875 . 1 1 79 79 THR HG21 H 1 1.023 0.02 . 1 . . . . 79 Thr HG2 . 16560 1 876 . 1 1 79 79 THR HG22 H 1 1.023 0.02 . 1 . . . . 79 Thr HG2 . 16560 1 877 . 1 1 79 79 THR HG23 H 1 1.023 0.02 . 1 . . . . 79 Thr HG2 . 16560 1 878 . 1 1 79 79 THR C C 13 174.566 0.2 . 1 . . . . 79 Thr C . 16560 1 879 . 1 1 79 79 THR CA C 13 59.476 0.2 . 1 . . . . 79 Thr CA . 16560 1 880 . 1 1 79 79 THR CB C 13 73.090 0.2 . 1 . . . . 79 Thr CB . 16560 1 881 . 1 1 79 79 THR CG2 C 13 22.156 0.2 . 1 . . . . 79 Thr CG2 . 16560 1 882 . 1 1 79 79 THR N N 15 113.057 0.2 . 1 . . . . 79 Thr N . 16560 1 883 . 1 1 80 80 GLU H H 1 8.962 0.02 . 1 . . . . 80 Glu H . 16560 1 884 . 1 1 80 80 GLU HA H 1 4.589 0.02 . 1 . . . . 80 Glu HA . 16560 1 885 . 1 1 80 80 GLU HB2 H 1 1.824 0.02 . 2 . . . . 80 Glu HB2 . 16560 1 886 . 1 1 80 80 GLU HB3 H 1 1.749 0.02 . 2 . . . . 80 Glu HB3 . 16560 1 887 . 1 1 80 80 GLU HG2 H 1 1.749 0.02 . 2 . . . . 80 Glu HG2 . 16560 1 888 . 1 1 80 80 GLU HG3 H 1 1.671 0.02 . 2 . . . . 80 Glu HG3 . 16560 1 889 . 1 1 80 80 GLU C C 13 174.040 0.2 . 1 . . . . 80 Glu C . 16560 1 890 . 1 1 80 80 GLU CA C 13 55.878 0.2 . 1 . . . . 80 Glu CA . 16560 1 891 . 1 1 80 80 GLU CB C 13 33.399 0.2 . 1 . . . . 80 Glu CB . 16560 1 892 . 1 1 80 80 GLU CG C 13 35.324 0.2 . 1 . . . . 80 Glu CG . 16560 1 893 . 1 1 80 80 GLU N N 15 117.934 0.2 . 1 . . . . 80 Glu N . 16560 1 894 . 1 1 81 81 GLU H H 1 8.687 0.02 . 1 . . . . 81 Glu H . 16560 1 895 . 1 1 81 81 GLU HA H 1 5.213 0.02 . 1 . . . . 81 Glu HA . 16560 1 896 . 1 1 81 81 GLU HB2 H 1 1.891 0.02 . 2 . . . . 81 Glu HB2 . 16560 1 897 . 1 1 81 81 GLU HB3 H 1 1.772 0.02 . 2 . . . . 81 Glu HB3 . 16560 1 898 . 1 1 81 81 GLU HG2 H 1 2.249 0.02 . 2 . . . . 81 Glu HG2 . 16560 1 899 . 1 1 81 81 GLU HG3 H 1 1.985 0.02 . 2 . . . . 81 Glu HG3 . 16560 1 900 . 1 1 81 81 GLU C C 13 176.406 0.2 . 1 . . . . 81 Glu C . 16560 1 901 . 1 1 81 81 GLU CA C 13 55.186 0.2 . 1 . . . . 81 Glu CA . 16560 1 902 . 1 1 81 81 GLU CB C 13 31.544 0.2 . 1 . . . . 81 Glu CB . 16560 1 903 . 1 1 81 81 GLU CG C 13 37.499 0.2 . 1 . . . . 81 Glu CG . 16560 1 904 . 1 1 81 81 GLU N N 15 122.400 0.2 . 1 . . . . 81 Glu N . 16560 1 905 . 1 1 82 82 ARG H H 1 9.118 0.02 . 1 . . . . 82 Arg H . 16560 1 906 . 1 1 82 82 ARG HA H 1 4.635 0.02 . 1 . . . . 82 Arg HA . 16560 1 907 . 1 1 82 82 ARG HB2 H 1 1.628 0.02 . 2 . . . . 82 Arg HB2 . 16560 1 908 . 1 1 82 82 ARG HB3 H 1 1.431 0.02 . 2 . . . . 82 Arg HB3 . 16560 1 909 . 1 1 82 82 ARG HD2 H 1 2.377 0.02 . 2 . . . . 82 Arg HD2 . 16560 1 910 . 1 1 82 82 ARG HD3 H 1 2.376 0.02 . 2 . . . . 82 Arg HD3 . 16560 1 911 . 1 1 82 82 ARG HE H 1 6.873 0.02 . 1 . . . . 82 Arg HE . 16560 1 912 . 1 1 82 82 ARG HG2 H 1 1.230 0.02 . 2 . . . . 82 Arg HG2 . 16560 1 913 . 1 1 82 82 ARG HG3 H 1 1.028 0.02 . 2 . . . . 82 Arg HG3 . 16560 1 914 . 1 1 82 82 ARG C C 13 175.222 0.2 . 1 . . . . 82 Arg C . 16560 1 915 . 1 1 82 82 ARG CA C 13 54.746 0.2 . 1 . . . . 82 Arg CA . 16560 1 916 . 1 1 82 82 ARG CB C 13 33.719 0.2 . 1 . . . . 82 Arg CB . 16560 1 917 . 1 1 82 82 ARG CD C 13 42.655 0.2 . 1 . . . . 82 Arg CD . 16560 1 918 . 1 1 82 82 ARG CG C 13 26.926 0.2 . 1 . . . . 82 Arg CG . 16560 1 919 . 1 1 82 82 ARG N N 15 121.851 0.2 . 1 . . . . 82 Arg N . 16560 1 920 . 1 1 82 82 ARG NE N 15 110.810 0.2 . 1 . . . . 82 Arg NE . 16560 1 921 . 1 1 83 83 GLN H H 1 8.642 0.02 . 1 . . . . 83 Gln H . 16560 1 922 . 1 1 83 83 GLN HA H 1 4.340 0.02 . 1 . . . . 83 Gln HA . 16560 1 923 . 1 1 83 83 GLN HB2 H 1 1.893 0.02 . 2 . . . . 83 Gln HB2 . 16560 1 924 . 1 1 83 83 GLN HB3 H 1 1.989 0.02 . 2 . . . . 83 Gln HB3 . 16560 1 925 . 1 1 83 83 GLN HG2 H 1 2.306 0.02 . 2 . . . . 83 Gln HG2 . 16560 1 926 . 1 1 83 83 GLN HG3 H 1 2.249 0.02 . 2 . . . . 83 Gln HG3 . 16560 1 927 . 1 1 83 83 GLN C C 13 175.705 0.2 . 1 . . . . 83 Gln C . 16560 1 928 . 1 1 83 83 GLN CA C 13 56.094 0.2 . 1 . . . . 83 Gln CA . 16560 1 929 . 1 1 83 83 GLN CB C 13 29.424 0.2 . 1 . . . . 83 Gln CB . 16560 1 930 . 1 1 83 83 GLN CG C 13 33.941 0.2 . 1 . . . . 83 Gln CG . 16560 1 931 . 1 1 83 83 GLN N N 15 121.976 0.2 . 1 . . . . 83 Gln N . 16560 1 932 . 1 1 84 84 VAL H H 1 8.818 0.02 . 1 . . . . 84 Val H . 16560 1 933 . 1 1 84 84 VAL HA H 1 4.399 0.02 . 1 . . . . 84 Val HA . 16560 1 934 . 1 1 84 84 VAL HB H 1 2.027 0.02 . 1 . . . . 84 Val HB . 16560 1 935 . 1 1 84 84 VAL HG11 H 1 0.968 0.02 . 1 . . . . 84 Val HG1 . 16560 1 936 . 1 1 84 84 VAL HG12 H 1 0.968 0.02 . 1 . . . . 84 Val HG1 . 16560 1 937 . 1 1 84 84 VAL HG13 H 1 0.968 0.02 . 1 . . . . 84 Val HG1 . 16560 1 938 . 1 1 84 84 VAL HG21 H 1 0.964 0.02 . 1 . . . . 84 Val HG2 . 16560 1 939 . 1 1 84 84 VAL HG22 H 1 0.964 0.02 . 1 . . . . 84 Val HG2 . 16560 1 940 . 1 1 84 84 VAL HG23 H 1 0.964 0.02 . 1 . . . . 84 Val HG2 . 16560 1 941 . 1 1 84 84 VAL C C 13 174.439 0.2 . 1 . . . . 84 Val C . 16560 1 942 . 1 1 84 84 VAL CA C 13 59.977 0.2 . 1 . . . . 84 Val CA . 16560 1 943 . 1 1 84 84 VAL CB C 13 32.948 0.2 . 1 . . . . 84 Val CB . 16560 1 944 . 1 1 84 84 VAL CG1 C 13 20.436 0.2 . 1 . . . . 84 Val CG1 . 16560 1 945 . 1 1 84 84 VAL CG2 C 13 21.453 0.2 . 1 . . . . 84 Val CG2 . 16560 1 946 . 1 1 84 84 VAL N N 15 128.548 0.2 . 1 . . . . 84 Val N . 16560 1 947 . 1 1 85 85 PRO HA H 1 4.313 0.02 . 1 . . . . 85 Pro HA . 16560 1 948 . 1 1 85 85 PRO HB2 H 1 2.305 0.02 . 2 . . . . 85 Pro HB2 . 16560 1 949 . 1 1 85 85 PRO HB3 H 1 1.897 0.02 . 2 . . . . 85 Pro HB3 . 16560 1 950 . 1 1 85 85 PRO HD2 H 1 3.985 0.02 . 2 . . . . 85 Pro HD2 . 16560 1 951 . 1 1 85 85 PRO HD3 H 1 3.675 0.02 . 2 . . . . 85 Pro HD3 . 16560 1 952 . 1 1 85 85 PRO HG2 H 1 2.136 0.02 . 2 . . . . 85 Pro HG2 . 16560 1 953 . 1 1 85 85 PRO HG3 H 1 1.964 0.02 . 2 . . . . 85 Pro HG3 . 16560 1 954 . 1 1 85 85 PRO C C 13 178.026 0.2 . 1 . . . . 85 Pro C . 16560 1 955 . 1 1 85 85 PRO CA C 13 64.139 0.2 . 1 . . . . 85 Pro CA . 16560 1 956 . 1 1 85 85 PRO CB C 13 31.744 0.2 . 1 . . . . 85 Pro CB . 16560 1 957 . 1 1 85 85 PRO CD C 13 51.208 0.2 . 1 . . . . 85 Pro CD . 16560 1 958 . 1 1 85 85 PRO CG C 13 27.846 0.2 . 1 . . . . 85 Pro CG . 16560 1 959 . 1 1 86 86 GLY H H 1 8.815 0.02 . 1 . . . . 86 Gly H . 16560 1 960 . 1 1 86 86 GLY HA2 H 1 3.751 0.02 . 2 . . . . 86 Gly HA2 . 16560 1 961 . 1 1 86 86 GLY HA3 H 1 4.148 0.02 . 2 . . . . 86 Gly HA3 . 16560 1 962 . 1 1 86 86 GLY C C 13 173.673 0.2 . 1 . . . . 86 Gly C . 16560 1 963 . 1 1 86 86 GLY CA C 13 45.661 0.2 . 1 . . . . 86 Gly CA . 16560 1 964 . 1 1 86 86 GLY N N 15 111.839 0.2 . 1 . . . . 86 Gly N . 16560 1 965 . 1 1 87 87 SER H H 1 8.029 0.02 . 1 . . . . 87 Ser H . 16560 1 966 . 1 1 87 87 SER HA H 1 4.955 0.02 . 1 . . . . 87 Ser HA . 16560 1 967 . 1 1 87 87 SER HB2 H 1 3.884 0.02 . 2 . . . . 87 Ser HB2 . 16560 1 968 . 1 1 87 87 SER HB3 H 1 3.716 0.02 . 2 . . . . 87 Ser HB3 . 16560 1 969 . 1 1 87 87 SER C C 13 174.293 0.2 . 1 . . . . 87 Ser C . 16560 1 970 . 1 1 87 87 SER CA C 13 56.119 0.2 . 1 . . . . 87 Ser CA . 16560 1 971 . 1 1 87 87 SER CB C 13 65.288 0.2 . 1 . . . . 87 Ser CB . 16560 1 972 . 1 1 87 87 SER N N 15 114.255 0.2 . 1 . . . . 87 Ser N . 16560 1 973 . 1 1 88 88 THR H H 1 8.366 0.02 . 1 . . . . 88 Thr H . 16560 1 974 . 1 1 88 88 THR HA H 1 4.438 0.02 . 1 . . . . 88 Thr HA . 16560 1 975 . 1 1 88 88 THR HB H 1 4.479 0.02 . 1 . . . . 88 Thr HB . 16560 1 976 . 1 1 88 88 THR HG21 H 1 1.238 0.02 . 1 . . . . 88 Thr HG2 . 16560 1 977 . 1 1 88 88 THR HG22 H 1 1.238 0.02 . 1 . . . . 88 Thr HG2 . 16560 1 978 . 1 1 88 88 THR HG23 H 1 1.238 0.02 . 1 . . . . 88 Thr HG2 . 16560 1 979 . 1 1 88 88 THR C C 13 175.360 0.2 . 1 . . . . 88 Thr C . 16560 1 980 . 1 1 88 88 THR CA C 13 62.103 0.2 . 1 . . . . 88 Thr CA . 16560 1 981 . 1 1 88 88 THR CB C 13 69.017 0.2 . 1 . . . . 88 Thr CB . 16560 1 982 . 1 1 88 88 THR CG2 C 13 21.765 0.2 . 1 . . . . 88 Thr CG2 . 16560 1 983 . 1 1 88 88 THR N N 15 112.921 0.2 . 1 . . . . 88 Thr N . 16560 1 984 . 1 1 89 89 GLN H H 1 8.342 0.02 . 1 . . . . 89 Gln H . 16560 1 985 . 1 1 89 89 GLN HA H 1 4.382 0.02 . 1 . . . . 89 Gln HA . 16560 1 986 . 1 1 89 89 GLN HB2 H 1 2.080 0.02 . 2 . . . . 89 Gln HB2 . 16560 1 987 . 1 1 89 89 GLN HB3 H 1 1.955 0.02 . 2 . . . . 89 Gln HB3 . 16560 1 988 . 1 1 89 89 GLN HG2 H 1 2.401 0.02 . 2 . . . . 89 Gln HG2 . 16560 1 989 . 1 1 89 89 GLN HG3 H 1 2.401 0.02 . 2 . . . . 89 Gln HG3 . 16560 1 990 . 1 1 89 89 GLN C C 13 175.462 0.2 . 1 . . . . 89 Gln C . 16560 1 991 . 1 1 89 89 GLN CA C 13 55.599 0.2 . 1 . . . . 89 Gln CA . 16560 1 992 . 1 1 89 89 GLN CB C 13 30.016 0.2 . 1 . . . . 89 Gln CB . 16560 1 993 . 1 1 89 89 GLN CG C 13 34.079 0.2 . 1 . . . . 89 Gln CG . 16560 1 994 . 1 1 89 89 GLN N N 15 122.086 0.2 . 1 . . . . 89 Gln N . 16560 1 995 . 1 1 90 90 LYS H H 1 8.584 0.02 . 1 . . . . 90 Lys H . 16560 1 996 . 1 1 90 90 LYS HA H 1 4.779 0.02 . 1 . . . . 90 Lys HA . 16560 1 997 . 1 1 90 90 LYS HB2 H 1 1.657 0.02 . 2 . . . . 90 Lys HB2 . 16560 1 998 . 1 1 90 90 LYS HB3 H 1 1.525 0.02 . 2 . . . . 90 Lys HB3 . 16560 1 999 . 1 1 90 90 LYS HD2 H 1 1.500 0.02 . 2 . . . . 90 Lys HD2 . 16560 1 1000 . 1 1 90 90 LYS HD3 H 1 1.497 0.02 . 2 . . . . 90 Lys HD3 . 16560 1 1001 . 1 1 90 90 LYS HE2 H 1 2.917 0.02 . 2 . . . . 90 Lys HE2 . 16560 1 1002 . 1 1 90 90 LYS HE3 H 1 2.917 0.02 . 2 . . . . 90 Lys HE3 . 16560 1 1003 . 1 1 90 90 LYS HG2 H 1 1.478 0.02 . 2 . . . . 90 Lys HG2 . 16560 1 1004 . 1 1 90 90 LYS HG3 H 1 1.168 0.02 . 2 . . . . 90 Lys HG3 . 16560 1 1005 . 1 1 90 90 LYS C C 13 175.897 0.2 . 1 . . . . 90 Lys C . 16560 1 1006 . 1 1 90 90 LYS CA C 13 55.590 0.2 . 1 . . . . 90 Lys CA . 16560 1 1007 . 1 1 90 90 LYS CB C 13 34.742 0.2 . 1 . . . . 90 Lys CB . 16560 1 1008 . 1 1 90 90 LYS CD C 13 29.244 0.2 . 1 . . . . 90 Lys CD . 16560 1 1009 . 1 1 90 90 LYS CE C 13 42.239 0.2 . 1 . . . . 90 Lys CE . 16560 1 1010 . 1 1 90 90 LYS CG C 13 25.569 0.2 . 1 . . . . 90 Lys CG . 16560 1 1011 . 1 1 90 90 LYS N N 15 121.945 0.2 . 1 . . . . 90 Lys N . 16560 1 1012 . 1 1 91 91 ALA H H 1 8.975 0.02 . 1 . . . . 91 Ala H . 16560 1 1013 . 1 1 91 91 ALA HA H 1 4.738 0.02 . 1 . . . . 91 Ala HA . 16560 1 1014 . 1 1 91 91 ALA HB1 H 1 1.389 0.02 . 1 . . . . 91 Ala HB . 16560 1 1015 . 1 1 91 91 ALA HB2 H 1 1.389 0.02 . 1 . . . . 91 Ala HB . 16560 1 1016 . 1 1 91 91 ALA HB3 H 1 1.389 0.02 . 1 . . . . 91 Ala HB . 16560 1 1017 . 1 1 91 91 ALA C C 13 175.585 0.2 . 1 . . . . 91 Ala C . 16560 1 1018 . 1 1 91 91 ALA CA C 13 50.741 0.2 . 1 . . . . 91 Ala CA . 16560 1 1019 . 1 1 91 91 ALA CB C 13 22.890 0.2 . 1 . . . . 91 Ala CB . 16560 1 1020 . 1 1 91 91 ALA N N 15 124.604 0.2 . 1 . . . . 91 Ala N . 16560 1 1021 . 1 1 92 92 LEU H H 1 8.523 0.02 . 1 . . . . 92 Leu H . 16560 1 1022 . 1 1 92 92 LEU HA H 1 4.707 0.02 . 1 . . . . 92 Leu HA . 16560 1 1023 . 1 1 92 92 LEU HB2 H 1 1.752 0.02 . 2 . . . . 92 Leu HB2 . 16560 1 1024 . 1 1 92 92 LEU HB3 H 1 1.535 0.02 . 2 . . . . 92 Leu HB3 . 16560 1 1025 . 1 1 92 92 LEU HD11 H 1 0.954 0.02 . 1 . . . . 92 Leu HD1 . 16560 1 1026 . 1 1 92 92 LEU HD12 H 1 0.954 0.02 . 1 . . . . 92 Leu HD1 . 16560 1 1027 . 1 1 92 92 LEU HD13 H 1 0.954 0.02 . 1 . . . . 92 Leu HD1 . 16560 1 1028 . 1 1 92 92 LEU HD21 H 1 0.843 0.02 . 1 . . . . 92 Leu HD2 . 16560 1 1029 . 1 1 92 92 LEU HD22 H 1 0.843 0.02 . 1 . . . . 92 Leu HD2 . 16560 1 1030 . 1 1 92 92 LEU HD23 H 1 0.843 0.02 . 1 . . . . 92 Leu HD2 . 16560 1 1031 . 1 1 92 92 LEU HG H 1 1.535 0.02 . 1 . . . . 92 Leu HG . 16560 1 1032 . 1 1 92 92 LEU C C 13 174.752 0.2 . 1 . . . . 92 Leu C . 16560 1 1033 . 1 1 92 92 LEU CA C 13 55.285 0.2 . 1 . . . . 92 Leu CA . 16560 1 1034 . 1 1 92 92 LEU CB C 13 43.267 0.2 . 1 . . . . 92 Leu CB . 16560 1 1035 . 1 1 92 92 LEU CD1 C 13 24.599 0.2 . 1 . . . . 92 Leu CD1 . 16560 1 1036 . 1 1 92 92 LEU CD2 C 13 26.278 0.2 . 1 . . . . 92 Leu CD2 . 16560 1 1037 . 1 1 92 92 LEU CG C 13 27.445 0.2 . 1 . . . . 92 Leu CG . 16560 1 1038 . 1 1 92 92 LEU N N 15 123.888 0.2 . 1 . . . . 92 Leu N . 16560 1 1039 . 1 1 93 93 TYR H H 1 9.289 0.02 . 1 . . . . 93 Tyr H . 16560 1 1040 . 1 1 93 93 TYR HA H 1 5.269 0.02 . 1 . . . . 93 Tyr HA . 16560 1 1041 . 1 1 93 93 TYR HB2 H 1 2.857 0.02 . 2 . . . . 93 Tyr HB2 . 16560 1 1042 . 1 1 93 93 TYR HB3 H 1 2.653 0.02 . 2 . . . . 93 Tyr HB3 . 16560 1 1043 . 1 1 93 93 TYR HD1 H 1 6.971 0.02 . 3 . . . . 93 Tyr HD1 . 16560 1 1044 . 1 1 93 93 TYR HD2 H 1 6.971 0.02 . 3 . . . . 93 Tyr HD2 . 16560 1 1045 . 1 1 93 93 TYR HE1 H 1 6.767 0.02 . 3 . . . . 93 Tyr HE1 . 16560 1 1046 . 1 1 93 93 TYR HE2 H 1 6.767 0.02 . 3 . . . . 93 Tyr HE2 . 16560 1 1047 . 1 1 93 93 TYR C C 13 174.528 0.2 . 1 . . . . 93 Tyr C . 16560 1 1048 . 1 1 93 93 TYR CA C 13 56.505 0.2 . 1 . . . . 93 Tyr CA . 16560 1 1049 . 1 1 93 93 TYR CB C 13 41.881 0.2 . 1 . . . . 93 Tyr CB . 16560 1 1050 . 1 1 93 93 TYR CD1 C 13 132.498 0.2 . 3 . . . . 93 Tyr CD1 . 16560 1 1051 . 1 1 93 93 TYR CD2 C 13 132.498 0.2 . 3 . . . . 93 Tyr CD2 . 16560 1 1052 . 1 1 93 93 TYR CE1 C 13 118.409 0.2 . 3 . . . . 93 Tyr CE1 . 16560 1 1053 . 1 1 93 93 TYR CE2 C 13 118.409 0.2 . 3 . . . . 93 Tyr CE2 . 16560 1 1054 . 1 1 93 93 TYR N N 15 126.872 0.2 . 1 . . . . 93 Tyr N . 16560 1 1055 . 1 1 94 94 LEU H H 1 9.551 0.02 . 1 . . . . 94 Leu H . 16560 1 1056 . 1 1 94 94 LEU HA H 1 5.869 0.02 . 1 . . . . 94 Leu HA . 16560 1 1057 . 1 1 94 94 LEU HB2 H 1 1.315 0.02 . 2 . . . . 94 Leu HB2 . 16560 1 1058 . 1 1 94 94 LEU HB3 H 1 1.146 0.02 . 2 . . . . 94 Leu HB3 . 16560 1 1059 . 1 1 94 94 LEU HD11 H 1 -0.533 0.02 . 1 . . . . 94 Leu HD1 . 16560 1 1060 . 1 1 94 94 LEU HD12 H 1 -0.533 0.02 . 1 . . . . 94 Leu HD1 . 16560 1 1061 . 1 1 94 94 LEU HD13 H 1 -0.533 0.02 . 1 . . . . 94 Leu HD1 . 16560 1 1062 . 1 1 94 94 LEU HD21 H 1 0.375 0.02 . 1 . . . . 94 Leu HD2 . 16560 1 1063 . 1 1 94 94 LEU HD22 H 1 0.375 0.02 . 1 . . . . 94 Leu HD2 . 16560 1 1064 . 1 1 94 94 LEU HD23 H 1 0.375 0.02 . 1 . . . . 94 Leu HD2 . 16560 1 1065 . 1 1 94 94 LEU HG H 1 1.308 0.02 . 1 . . . . 94 Leu HG . 16560 1 1066 . 1 1 94 94 LEU C C 13 173.433 0.2 . 1 . . . . 94 Leu C . 16560 1 1067 . 1 1 94 94 LEU CA C 13 54.131 0.2 . 1 . . . . 94 Leu CA . 16560 1 1068 . 1 1 94 94 LEU CB C 13 46.320 0.2 . 1 . . . . 94 Leu CB . 16560 1 1069 . 1 1 94 94 LEU CD1 C 13 27.431 0.2 . 1 . . . . 94 Leu CD1 . 16560 1 1070 . 1 1 94 94 LEU CD2 C 13 25.617 0.2 . 1 . . . . 94 Leu CD2 . 16560 1 1071 . 1 1 94 94 LEU CG C 13 25.832 0.2 . 1 . . . . 94 Leu CG . 16560 1 1072 . 1 1 94 94 LEU N N 15 117.884 0.2 . 1 . . . . 94 Leu N . 16560 1 1073 . 1 1 95 95 ARG H H 1 8.603 0.02 . 1 . . . . 95 Arg H . 16560 1 1074 . 1 1 95 95 ARG HA H 1 4.707 0.02 . 1 . . . . 95 Arg HA . 16560 1 1075 . 1 1 95 95 ARG HB2 H 1 0.825 0.02 . 2 . . . . 95 Arg HB2 . 16560 1 1076 . 1 1 95 95 ARG HB3 H 1 0.461 0.02 . 2 . . . . 95 Arg HB3 . 16560 1 1077 . 1 1 95 95 ARG HD2 H 1 1.808 0.02 . 2 . . . . 95 Arg HD2 . 16560 1 1078 . 1 1 95 95 ARG HD3 H 1 1.640 0.02 . 2 . . . . 95 Arg HD3 . 16560 1 1079 . 1 1 95 95 ARG HE H 1 6.468 0.02 . 1 . . . . 95 Arg HE . 16560 1 1080 . 1 1 95 95 ARG HG2 H 1 0.633 0.02 . 2 . . . . 95 Arg HG2 . 16560 1 1081 . 1 1 95 95 ARG HG3 H 1 0.488 0.02 . 2 . . . . 95 Arg HG3 . 16560 1 1082 . 1 1 95 95 ARG C C 13 174.605 0.2 . 1 . . . . 95 Arg C . 16560 1 1083 . 1 1 95 95 ARG CA C 13 53.795 0.2 . 1 . . . . 95 Arg CA . 16560 1 1084 . 1 1 95 95 ARG CB C 13 33.468 0.2 . 1 . . . . 95 Arg CB . 16560 1 1085 . 1 1 95 95 ARG CD C 13 42.983 0.2 . 1 . . . . 95 Arg CD . 16560 1 1086 . 1 1 95 95 ARG CG C 13 25.632 0.2 . 1 . . . . 95 Arg CG . 16560 1 1087 . 1 1 95 95 ARG N N 15 116.939 0.2 . 1 . . . . 95 Arg N . 16560 1 1088 . 1 1 95 95 ARG NE N 15 111.784 0.2 . 1 . . . . 95 Arg NE . 16560 1 1089 . 1 1 96 96 ALA H H 1 9.072 0.02 . 1 . . . . 96 Ala H . 16560 1 1090 . 1 1 96 96 ALA HA H 1 4.404 0.02 . 1 . . . . 96 Ala HA . 16560 1 1091 . 1 1 96 96 ALA HB1 H 1 1.308 0.02 . 1 . . . . 96 Ala HB . 16560 1 1092 . 1 1 96 96 ALA HB2 H 1 1.308 0.02 . 1 . . . . 96 Ala HB . 16560 1 1093 . 1 1 96 96 ALA HB3 H 1 1.308 0.02 . 1 . . . . 96 Ala HB . 16560 1 1094 . 1 1 96 96 ALA C C 13 177.811 0.2 . 1 . . . . 96 Ala C . 16560 1 1095 . 1 1 96 96 ALA CA C 13 52.324 0.2 . 1 . . . . 96 Ala CA . 16560 1 1096 . 1 1 96 96 ALA CB C 13 18.248 0.2 . 1 . . . . 96 Ala CB . 16560 1 1097 . 1 1 96 96 ALA N N 15 124.914 0.2 . 1 . . . . 96 Ala N . 16560 1 1098 . 1 1 97 97 LYS H H 1 7.989 0.02 . 1 . . . . 97 Lys H . 16560 1 1099 . 1 1 97 97 LYS HA H 1 3.922 0.02 . 1 . . . . 97 Lys HA . 16560 1 1100 . 1 1 97 97 LYS HB2 H 1 1.498 0.02 . 2 . . . . 97 Lys HB2 . 16560 1 1101 . 1 1 97 97 LYS HB3 H 1 1.152 0.02 . 2 . . . . 97 Lys HB3 . 16560 1 1102 . 1 1 97 97 LYS HD2 H 1 1.613 0.02 . 2 . . . . 97 Lys HD2 . 16560 1 1103 . 1 1 97 97 LYS HD3 H 1 1.612 0.02 . 2 . . . . 97 Lys HD3 . 16560 1 1104 . 1 1 97 97 LYS HE2 H 1 2.909 0.02 . 2 . . . . 97 Lys HE2 . 16560 1 1105 . 1 1 97 97 LYS HE3 H 1 2.909 0.02 . 2 . . . . 97 Lys HE3 . 16560 1 1106 . 1 1 97 97 LYS HG2 H 1 1.196 0.02 . 2 . . . . 97 Lys HG2 . 16560 1 1107 . 1 1 97 97 LYS HG3 H 1 1.200 0.02 . 2 . . . . 97 Lys HG3 . 16560 1 1108 . 1 1 97 97 LYS C C 13 175.978 0.2 . 1 . . . . 97 Lys C . 16560 1 1109 . 1 1 97 97 LYS CA C 13 56.915 0.2 . 1 . . . . 97 Lys CA . 16560 1 1110 . 1 1 97 97 LYS CB C 13 32.864 0.2 . 1 . . . . 97 Lys CB . 16560 1 1111 . 1 1 97 97 LYS CD C 13 29.058 0.2 . 1 . . . . 97 Lys CD . 16560 1 1112 . 1 1 97 97 LYS CE C 13 42.305 0.2 . 1 . . . . 97 Lys CE . 16560 1 1113 . 1 1 97 97 LYS CG C 13 24.959 0.2 . 1 . . . . 97 Lys CG . 16560 1 1114 . 1 1 97 97 LYS N N 15 123.129 0.2 . 1 . . . . 97 Lys N . 16560 1 1115 . 1 1 98 98 LEU H H 1 8.118 0.02 . 1 . . . . 98 Leu H . 16560 1 1116 . 1 1 98 98 LEU HA H 1 4.321 0.02 . 1 . . . . 98 Leu HA . 16560 1 1117 . 1 1 98 98 LEU HB2 H 1 1.465 0.02 . 2 . . . . 98 Leu HB2 . 16560 1 1118 . 1 1 98 98 LEU HB3 H 1 1.416 0.02 . 2 . . . . 98 Leu HB3 . 16560 1 1119 . 1 1 98 98 LEU HD11 H 1 0.823 0.02 . 1 . . . . 98 Leu HD1 . 16560 1 1120 . 1 1 98 98 LEU HD12 H 1 0.823 0.02 . 1 . . . . 98 Leu HD1 . 16560 1 1121 . 1 1 98 98 LEU HD13 H 1 0.823 0.02 . 1 . . . . 98 Leu HD1 . 16560 1 1122 . 1 1 98 98 LEU HD21 H 1 0.772 0.02 . 1 . . . . 98 Leu HD2 . 16560 1 1123 . 1 1 98 98 LEU HD22 H 1 0.772 0.02 . 1 . . . . 98 Leu HD2 . 16560 1 1124 . 1 1 98 98 LEU HD23 H 1 0.772 0.02 . 1 . . . . 98 Leu HD2 . 16560 1 1125 . 1 1 98 98 LEU HG H 1 1.459 0.02 . 1 . . . . 98 Leu HG . 16560 1 1126 . 1 1 98 98 LEU C C 13 176.592 0.2 . 1 . . . . 98 Leu C . 16560 1 1127 . 1 1 98 98 LEU CA C 13 54.627 0.2 . 1 . . . . 98 Leu CA . 16560 1 1128 . 1 1 98 98 LEU CB C 13 42.566 0.2 . 1 . . . . 98 Leu CB . 16560 1 1129 . 1 1 98 98 LEU CD1 C 13 24.935 0.2 . 1 . . . . 98 Leu CD1 . 16560 1 1130 . 1 1 98 98 LEU CD2 C 13 23.426 0.2 . 1 . . . . 98 Leu CD2 . 16560 1 1131 . 1 1 98 98 LEU CG C 13 26.870 0.2 . 1 . . . . 98 Leu CG . 16560 1 1132 . 1 1 98 98 LEU N N 15 123.816 0.2 . 1 . . . . 98 Leu N . 16560 1 1133 . 1 1 99 99 GLU H H 1 8.376 0.02 . 1 . . . . 99 Glu H . 16560 1 1134 . 1 1 99 99 GLU C C 13 175.790 0.2 . 1 . . . . 99 Glu C . 16560 1 1135 . 1 1 99 99 GLU N N 15 122.215 0.2 . 1 . . . . 99 Glu N . 16560 1 stop_ save_