################################### # 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 16773 _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 3D_15N-separated_NOESY . . . 16773 1 2 3D_13C-separated_NOESY . . . 16773 1 3 '3D_13C-separated_NOESY (AROMATIC)' . . . 16773 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 3 3 GLU C C 13 175.812 0.200 . 1 . . . . 578 GLU C . 16773 1 2 . 1 1 4 4 ALA H H 1 8.046 0.020 . 1 . . . . 579 ALA H . 16773 1 3 . 1 1 4 4 ALA HA H 1 4.275 0.020 . 1 . . . . 579 ALA HA . 16773 1 4 . 1 1 4 4 ALA HB1 H 1 1.303 0.020 . 1 . . . . 579 ALA QB . 16773 1 5 . 1 1 4 4 ALA HB2 H 1 1.303 0.020 . 1 . . . . 579 ALA QB . 16773 1 6 . 1 1 4 4 ALA HB3 H 1 1.303 0.020 . 1 . . . . 579 ALA QB . 16773 1 7 . 1 1 4 4 ALA CA C 13 53.211 0.200 . 1 . . . . 579 ALA CA . 16773 1 8 . 1 1 4 4 ALA CB C 13 19.506 0.200 . 1 . . . . 579 ALA CB . 16773 1 9 . 1 1 4 4 ALA N N 15 125.551 0.200 . 1 . . . . 579 ALA N . 16773 1 10 . 1 1 5 5 GLU H H 1 8.465 0.020 . 1 . . . . 580 GLU H . 16773 1 11 . 1 1 5 5 GLU HA H 1 4.327 0.010 . 1 . . . . 580 GLU HA . 16773 1 12 . 1 1 5 5 GLU HB2 H 1 1.987 0.010 . 2 . . . . 580 GLU HB2 . 16773 1 13 . 1 1 5 5 GLU HB3 H 1 1.929 0.010 . 2 . . . . 580 GLU HB3 . 16773 1 14 . 1 1 5 5 GLU HG2 H 1 2.245 0.010 . 2 . . . . 580 GLU HG2 . 16773 1 15 . 1 1 5 5 GLU HG3 H 1 2.214 0.010 . 2 . . . . 580 GLU HG3 . 16773 1 16 . 1 1 5 5 GLU C C 13 175.931 0.200 . 1 . . . . 580 GLU C . 16773 1 17 . 1 1 5 5 GLU CA C 13 57.057 0.200 . 1 . . . . 580 GLU CA . 16773 1 18 . 1 1 5 5 GLU CB C 13 30.940 0.200 . 1 . . . . 580 GLU CB . 16773 1 19 . 1 1 5 5 GLU CG C 13 36.607 0.200 . 1 . . . . 580 GLU CG . 16773 1 20 . 1 1 5 5 GLU N N 15 120.827 0.200 . 1 . . . . 580 GLU N . 16773 1 21 . 1 1 6 6 PHE H H 1 8.318 0.020 . 1 . . . . 581 PHE H . 16773 1 22 . 1 1 6 6 PHE HA H 1 4.673 0.010 . 1 . . . . 581 PHE HA . 16773 1 23 . 1 1 6 6 PHE HB2 H 1 3.165 0.010 . 2 . . . . 581 PHE HB2 . 16773 1 24 . 1 1 6 6 PHE HB3 H 1 3.033 0.010 . 2 . . . . 581 PHE HB3 . 16773 1 25 . 1 1 6 6 PHE CA C 13 57.899 0.200 . 1 . . . . 581 PHE CA . 16773 1 26 . 1 1 6 6 PHE CB C 13 40.102 0.200 . 1 . . . . 581 PHE CB . 16773 1 27 . 1 1 6 6 PHE N N 15 121.479 0.200 . 1 . . . . 581 PHE N . 16773 1 28 . 1 1 7 7 LEU H H 1 8.085 0.020 . 1 . . . . 582 LEU H . 16773 1 29 . 1 1 7 7 LEU HA H 1 4.415 0.020 . 1 . . . . 582 LEU HA . 16773 1 30 . 1 1 7 7 LEU HB2 H 1 1.637 0.010 . 2 . . . . 582 LEU HB2 . 16773 1 31 . 1 1 7 7 LEU HB3 H 1 1.637 0.010 . 2 . . . . 582 LEU HB3 . 16773 1 32 . 1 1 7 7 LEU HD11 H 1 0.897 0.010 . 2 . . . . 582 LEU QD1 . 16773 1 33 . 1 1 7 7 LEU HD12 H 1 0.897 0.010 . 2 . . . . 582 LEU QD1 . 16773 1 34 . 1 1 7 7 LEU HD13 H 1 0.897 0.010 . 2 . . . . 582 LEU QD1 . 16773 1 35 . 1 1 7 7 LEU HD21 H 1 0.866 0.010 . 2 . . . . 582 LEU QD2 . 16773 1 36 . 1 1 7 7 LEU HD22 H 1 0.866 0.010 . 2 . . . . 582 LEU QD2 . 16773 1 37 . 1 1 7 7 LEU HD23 H 1 0.866 0.010 . 2 . . . . 582 LEU QD2 . 16773 1 38 . 1 1 7 7 LEU HG H 1 1.572 0.010 . 1 . . . . 582 LEU HG . 16773 1 39 . 1 1 7 7 LEU C C 13 174.259 0.200 . 1 . . . . 582 LEU C . 16773 1 40 . 1 1 7 7 LEU CA C 13 55.421 0.200 . 1 . . . . 582 LEU CA . 16773 1 41 . 1 1 7 7 LEU CB C 13 43.084 0.200 . 1 . . . . 582 LEU CB . 16773 1 42 . 1 1 7 7 LEU CD1 C 13 25.366 0.200 . 1 . . . . 582 LEU CD1 . 16773 1 43 . 1 1 7 7 LEU CD2 C 13 24.072 0.200 . 1 . . . . 582 LEU CD2 . 16773 1 44 . 1 1 7 7 LEU CG C 13 27.576 0.200 . 1 . . . . 582 LEU CG . 16773 1 45 . 1 1 7 7 LEU N N 15 123.994 0.200 . 1 . . . . 582 LEU N . 16773 1 46 . 1 1 8 8 SER H H 1 8.111 0.020 . 1 . . . . 583 SER H . 16773 1 47 . 1 1 8 8 SER HA H 1 4.563 0.009 . 1 . . . . 583 SER HA . 16773 1 48 . 1 1 8 8 SER HB3 H 1 3.936 0.010 . 2 . . . . 583 SER HB3 . 16773 1 49 . 1 1 8 8 SER C C 13 174.130 0.200 . 1 . . . . 583 SER C . 16773 1 50 . 1 1 8 8 SER CA C 13 58.536 0.200 . 1 . . . . 583 SER CA . 16773 1 51 . 1 1 8 8 SER CB C 13 64.919 0.200 . 1 . . . . 583 SER CB . 16773 1 52 . 1 1 8 8 SER N N 15 116.302 0.200 . 1 . . . . 583 SER N . 16773 1 53 . 1 1 9 9 ARG H H 1 8.346 0.020 . 1 . . . . 584 ARG H . 16773 1 54 . 1 1 9 9 ARG HA H 1 4.989 0.020 . 1 . . . . 584 ARG HA . 16773 1 55 . 1 1 9 9 ARG HB2 H 1 1.841 0.020 . 2 . . . . 584 ARG HB2 . 16773 1 56 . 1 1 9 9 ARG HB3 H 1 1.777 0.010 . 2 . . . . 584 ARG HB3 . 16773 1 57 . 1 1 9 9 ARG HD2 H 1 3.139 0.015 . 2 . . . . 584 ARG HD2 . 16773 1 58 . 1 1 9 9 ARG HD3 H 1 3.086 0.016 . 2 . . . . 584 ARG HD3 . 16773 1 59 . 1 1 9 9 ARG HG2 H 1 1.581 0.020 . 2 . . . . 584 ARG HG2 . 16773 1 60 . 1 1 9 9 ARG HG3 H 1 1.490 0.020 . 2 . . . . 584 ARG HG3 . 16773 1 61 . 1 1 9 9 ARG C C 13 176.231 0.200 . 1 . . . . 584 ARG C . 16773 1 62 . 1 1 9 9 ARG CA C 13 56.428 0.200 . 1 . . . . 584 ARG CA . 16773 1 63 . 1 1 9 9 ARG CB C 13 32.376 0.102 . 1 . . . . 584 ARG CB . 16773 1 64 . 1 1 9 9 ARG CD C 13 44.132 0.200 . 1 . . . . 584 ARG CD . 16773 1 65 . 1 1 9 9 ARG CG C 13 27.718 0.200 . 1 . . . . 584 ARG CG . 16773 1 66 . 1 1 9 9 ARG N N 15 123.531 0.200 . 1 . . . . 584 ARG N . 16773 1 67 . 1 1 10 10 THR H H 1 8.799 0.020 . 1 . . . . 585 THR H . 16773 1 68 . 1 1 10 10 THR HA H 1 4.703 0.015 . 1 . . . . 585 THR HA . 16773 1 69 . 1 1 10 10 THR HB H 1 4.316 0.020 . 1 . . . . 585 THR HB . 16773 1 70 . 1 1 10 10 THR HG21 H 1 1.433 0.020 . 1 . . . . 585 THR QG2 . 16773 1 71 . 1 1 10 10 THR HG22 H 1 1.433 0.020 . 1 . . . . 585 THR QG2 . 16773 1 72 . 1 1 10 10 THR HG23 H 1 1.433 0.020 . 1 . . . . 585 THR QG2 . 16773 1 73 . 1 1 10 10 THR C C 13 173.377 0.200 . 1 . . . . 585 THR C . 16773 1 74 . 1 1 10 10 THR CA C 13 62.725 0.200 . 1 . . . . 585 THR CA . 16773 1 75 . 1 1 10 10 THR CB C 13 71.278 0.200 . 1 . . . . 585 THR CB . 16773 1 76 . 1 1 10 10 THR CG2 C 13 22.682 0.200 . 1 . . . . 585 THR CG2 . 16773 1 77 . 1 1 10 10 THR N N 15 120.600 0.200 . 1 . . . . 585 THR N . 16773 1 78 . 1 1 11 11 GLU H H 1 8.688 0.020 . 1 . . . . 586 GLU H . 16773 1 79 . 1 1 11 11 GLU HA H 1 5.159 0.020 . 1 . . . . 586 GLU HA . 16773 1 80 . 1 1 11 11 GLU HB2 H 1 2.192 0.020 . 2 . . . . 586 GLU HB2 . 16773 1 81 . 1 1 11 11 GLU HB3 H 1 2.005 0.020 . 2 . . . . 586 GLU HB3 . 16773 1 82 . 1 1 11 11 GLU HG2 H 1 2.357 0.015 . 2 . . . . 586 GLU HG2 . 16773 1 83 . 1 1 11 11 GLU HG3 H 1 2.303 0.010 . 2 . . . . 586 GLU HG3 . 16773 1 84 . 1 1 11 11 GLU C C 13 176.589 0.200 . 1 . . . . 586 GLU C . 16773 1 85 . 1 1 11 11 GLU CA C 13 55.907 0.200 . 1 . . . . 586 GLU CA . 16773 1 86 . 1 1 11 11 GLU CB C 13 32.808 0.200 . 1 . . . . 586 GLU CB . 16773 1 87 . 1 1 11 11 GLU CG C 13 36.967 0.200 . 1 . . . . 586 GLU CG . 16773 1 88 . 1 1 11 11 GLU N N 15 125.265 0.200 . 1 . . . . 586 GLU N . 16773 1 89 . 1 1 12 12 GLY H H 1 8.942 0.020 . 1 . . . . 587 GLY H . 16773 1 90 . 1 1 12 12 GLY HA2 H 1 4.597 0.020 . 2 . . . . 587 GLY HA2 . 16773 1 91 . 1 1 12 12 GLY HA3 H 1 4.477 0.020 . 2 . . . . 587 GLY HA3 . 16773 1 92 . 1 1 12 12 GLY C C 13 172.971 0.200 . 1 . . . . 587 GLY C . 16773 1 93 . 1 1 12 12 GLY CA C 13 44.901 0.200 . 1 . . . . 587 GLY CA . 16773 1 94 . 1 1 12 12 GLY N N 15 112.806 0.200 . 1 . . . . 587 GLY N . 16773 1 95 . 1 1 13 13 ASP H H 1 8.194 0.020 . 1 . . . . 588 ASP H . 16773 1 96 . 1 1 13 13 ASP HA H 1 5.193 0.020 . 1 . . . . 588 ASP HA . 16773 1 97 . 1 1 13 13 ASP HB2 H 1 2.665 0.020 . 2 . . . . 588 ASP HB2 . 16773 1 98 . 1 1 13 13 ASP HB3 H 1 2.665 0.020 . 2 . . . . 588 ASP HB3 . 16773 1 99 . 1 1 13 13 ASP C C 13 176.486 0.200 . 1 . . . . 588 ASP C . 16773 1 100 . 1 1 13 13 ASP CA C 13 53.327 0.200 . 1 . . . . 588 ASP CA . 16773 1 101 . 1 1 13 13 ASP CB C 13 43.809 0.200 . 1 . . . . 588 ASP CB . 16773 1 102 . 1 1 13 13 ASP N N 15 117.475 0.200 . 1 . . . . 588 ASP N . 16773 1 103 . 1 1 14 14 ASN H H 1 9.454 0.020 . 1 . . . . 589 ASN H . 16773 1 104 . 1 1 14 14 ASN HA H 1 4.496 0.009 . 1 . . . . 589 ASN HA . 16773 1 105 . 1 1 14 14 ASN HB2 H 1 3.042 0.020 . 2 . . . . 589 ASN HB2 . 16773 1 106 . 1 1 14 14 ASN HB3 H 1 2.914 0.009 . 2 . . . . 589 ASN HB3 . 16773 1 107 . 1 1 14 14 ASN HD21 H 1 8.586 0.020 . 2 . . . . 589 ASN HD21 . 16773 1 108 . 1 1 14 14 ASN HD22 H 1 6.556 0.020 . 2 . . . . 589 ASN HD22 . 16773 1 109 . 1 1 14 14 ASN C C 13 174.340 0.200 . 1 . . . . 589 ASN C . 16773 1 110 . 1 1 14 14 ASN CA C 13 54.042 0.200 . 1 . . . . 589 ASN CA . 16773 1 111 . 1 1 14 14 ASN CB C 13 38.469 0.200 . 1 . . . . 589 ASN CB . 16773 1 112 . 1 1 14 14 ASN N N 15 117.443 0.200 . 1 . . . . 589 ASN N . 16773 1 113 . 1 1 14 14 ASN ND2 N 15 131.642 0.200 . 1 . . . . 589 ASN ND2 . 16773 1 114 . 1 1 15 15 CYS H H 1 9.966 0.020 . 1 . . . . 590 CYS H . 16773 1 115 . 1 1 15 15 CYS HA H 1 3.803 0.020 . 1 . . . . 590 CYS HA . 16773 1 116 . 1 1 15 15 CYS HB2 H 1 2.821 0.020 . 2 . . . . 590 CYS HB2 . 16773 1 117 . 1 1 15 15 CYS HB3 H 1 3.889 0.020 . 2 . . . . 590 CYS HB3 . 16773 1 118 . 1 1 15 15 CYS C C 13 173.004 0.200 . 1 . . . . 590 CYS C . 16773 1 119 . 1 1 15 15 CYS CA C 13 59.999 0.200 . 1 . . . . 590 CYS CA . 16773 1 120 . 1 1 15 15 CYS CB C 13 42.515 0.200 . 1 . . . . 590 CYS CB . 16773 1 121 . 1 1 15 15 CYS N N 15 118.872 0.200 . 1 . . . . 590 CYS N . 16773 1 122 . 1 1 16 16 THR H H 1 7.548 0.020 . 1 . . . . 591 THR H . 16773 1 123 . 1 1 16 16 THR HA H 1 5.334 0.020 . 1 . . . . 591 THR HA . 16773 1 124 . 1 1 16 16 THR HB H 1 4.271 0.020 . 1 . . . . 591 THR HB . 16773 1 125 . 1 1 16 16 THR HG21 H 1 1.236 0.008 . 1 . . . . 591 THR QG2 . 16773 1 126 . 1 1 16 16 THR HG22 H 1 1.236 0.008 . 1 . . . . 591 THR QG2 . 16773 1 127 . 1 1 16 16 THR HG23 H 1 1.236 0.008 . 1 . . . . 591 THR QG2 . 16773 1 128 . 1 1 16 16 THR C C 13 172.794 0.200 . 1 . . . . 591 THR C . 16773 1 129 . 1 1 16 16 THR CA C 13 59.907 0.200 . 1 . . . . 591 THR CA . 16773 1 130 . 1 1 16 16 THR CB C 13 73.816 0.200 . 1 . . . . 591 THR CB . 16773 1 131 . 1 1 16 16 THR CG2 C 13 21.449 0.200 . 1 . . . . 591 THR CG2 . 16773 1 132 . 1 1 16 16 THR N N 15 107.574 0.200 . 1 . . . . 591 THR N . 16773 1 133 . 1 1 17 17 VAL H H 1 8.456 0.020 . 1 . . . . 592 VAL H . 16773 1 134 . 1 1 17 17 VAL HA H 1 4.578 0.010 . 1 . . . . 592 VAL HA . 16773 1 135 . 1 1 17 17 VAL HB H 1 2.213 0.008 . 1 . . . . 592 VAL HB . 16773 1 136 . 1 1 17 17 VAL HG11 H 1 0.982 0.007 . 2 . . . . 592 VAL QG1 . 16773 1 137 . 1 1 17 17 VAL HG12 H 1 0.982 0.007 . 2 . . . . 592 VAL QG1 . 16773 1 138 . 1 1 17 17 VAL HG13 H 1 0.982 0.007 . 2 . . . . 592 VAL QG1 . 16773 1 139 . 1 1 17 17 VAL HG21 H 1 0.875 0.020 . 2 . . . . 592 VAL QG2 . 16773 1 140 . 1 1 17 17 VAL HG22 H 1 0.875 0.020 . 2 . . . . 592 VAL QG2 . 16773 1 141 . 1 1 17 17 VAL HG23 H 1 0.875 0.020 . 2 . . . . 592 VAL QG2 . 16773 1 142 . 1 1 17 17 VAL C C 13 171.878 0.200 . 1 . . . . 592 VAL C . 16773 1 143 . 1 1 17 17 VAL CA C 13 61.985 0.200 . 1 . . . . 592 VAL CA . 16773 1 144 . 1 1 17 17 VAL CB C 13 34.306 0.200 . 1 . . . . 592 VAL CB . 16773 1 145 . 1 1 17 17 VAL CG1 C 13 22.991 0.200 . 1 . . . . 592 VAL CG1 . 16773 1 146 . 1 1 17 17 VAL CG2 C 13 20.421 0.200 . 1 . . . . 592 VAL CG2 . 16773 1 147 . 1 1 17 17 VAL N N 15 117.346 0.200 . 1 . . . . 592 VAL N . 16773 1 148 . 1 1 18 18 PHE H H 1 8.335 0.020 . 1 . . . . 593 PHE H . 16773 1 149 . 1 1 18 18 PHE HA H 1 5.231 0.020 . 1 . . . . 593 PHE HA . 16773 1 150 . 1 1 18 18 PHE HB2 H 1 3.090 0.020 . 2 . . . . 593 PHE HB2 . 16773 1 151 . 1 1 18 18 PHE HB3 H 1 3.051 0.020 . 2 . . . . 593 PHE HB3 . 16773 1 152 . 1 1 18 18 PHE HD1 H 1 7.165 0.020 . 1 . . . . 593 PHE HD1 . 16773 1 153 . 1 1 18 18 PHE HD2 H 1 7.165 0.020 . 1 . . . . 593 PHE HD2 . 16773 1 154 . 1 1 18 18 PHE HE1 H 1 7.274 0.020 . 1 . . . . 593 PHE HE1 . 16773 1 155 . 1 1 18 18 PHE HE2 H 1 7.274 0.020 . 1 . . . . 593 PHE HE2 . 16773 1 156 . 1 1 18 18 PHE HZ H 1 7.291 0.020 . 1 . . . . 593 PHE HZ . 16773 1 157 . 1 1 18 18 PHE C C 13 174.025 0.200 . 1 . . . . 593 PHE C . 16773 1 158 . 1 1 18 18 PHE CA C 13 56.104 0.200 . 1 . . . . 593 PHE CA . 16773 1 159 . 1 1 18 18 PHE CB C 13 42.191 0.200 . 1 . . . . 593 PHE CB . 16773 1 160 . 1 1 18 18 PHE CD1 C 13 132.565 0.200 . 1 . . . . 593 PHE CD1 . 16773 1 161 . 1 1 18 18 PHE CE1 C 13 131.789 0.200 . 1 . . . . 593 PHE CE1 . 16773 1 162 . 1 1 18 18 PHE CZ C 13 129.977 0.200 . 1 . . . . 593 PHE CZ . 16773 1 163 . 1 1 18 18 PHE N N 15 126.274 0.200 . 1 . . . . 593 PHE N . 16773 1 164 . 1 1 19 19 ASP H H 1 8.059 0.020 . 1 . . . . 594 ASP H . 16773 1 165 . 1 1 19 19 ASP HA H 1 4.719 0.020 . 1 . . . . 594 ASP HA . 16773 1 166 . 1 1 19 19 ASP HB2 H 1 2.376 0.020 . 2 . . . . 594 ASP HB2 . 16773 1 167 . 1 1 19 19 ASP HB3 H 1 2.208 0.020 . 2 . . . . 594 ASP HB3 . 16773 1 168 . 1 1 19 19 ASP C C 13 176.388 0.200 . 1 . . . . 594 ASP C . 16773 1 169 . 1 1 19 19 ASP CA C 13 53.397 0.200 . 1 . . . . 594 ASP CA . 16773 1 170 . 1 1 19 19 ASP CB C 13 43.809 0.200 . 1 . . . . 594 ASP CB . 16773 1 171 . 1 1 19 19 ASP N N 15 122.302 0.200 . 1 . . . . 594 ASP N . 16773 1 172 . 1 1 20 20 SER H H 1 8.664 0.020 . 1 . . . . 595 SER H . 16773 1 173 . 1 1 20 20 SER HA H 1 4.046 0.020 . 1 . . . . 595 SER HA . 16773 1 174 . 1 1 20 20 SER HB3 H 1 3.932 0.020 . 2 . . . . 595 SER HB3 . 16773 1 175 . 1 1 20 20 SER C C 13 175.946 0.200 . 1 . . . . 595 SER C . 16773 1 176 . 1 1 20 20 SER CA C 13 60.634 0.200 . 1 . . . . 595 SER CA . 16773 1 177 . 1 1 20 20 SER CB C 13 63.962 0.200 . 1 . . . . 595 SER CB . 16773 1 178 . 1 1 20 20 SER N N 15 121.383 0.200 . 1 . . . . 595 SER N . 16773 1 179 . 1 1 21 21 GLN H H 1 8.220 0.020 . 1 . . . . 596 GLN H . 16773 1 180 . 1 1 21 21 GLN HA H 1 4.196 0.020 . 1 . . . . 596 GLN HA . 16773 1 181 . 1 1 21 21 GLN HB2 H 1 2.248 0.020 . 2 . . . . 596 GLN HB2 . 16773 1 182 . 1 1 21 21 GLN HB3 H 1 2.217 0.015 . 2 . . . . 596 GLN HB3 . 16773 1 183 . 1 1 21 21 GLN HE21 H 1 7.570 0.020 . 2 . . . . 596 GLN HE21 . 16773 1 184 . 1 1 21 21 GLN HE22 H 1 6.845 0.020 . 2 . . . . 596 GLN HE22 . 16773 1 185 . 1 1 21 21 GLN HG2 H 1 2.462 0.020 . 2 . . . . 596 GLN HG2 . 16773 1 186 . 1 1 21 21 GLN HG3 H 1 2.393 0.020 . 2 . . . . 596 GLN HG3 . 16773 1 187 . 1 1 21 21 GLN C C 13 177.357 0.200 . 1 . . . . 596 GLN C . 16773 1 188 . 1 1 21 21 GLN CA C 13 58.614 0.200 . 1 . . . . 596 GLN CA . 16773 1 189 . 1 1 21 21 GLN CB C 13 28.823 0.200 . 1 . . . . 596 GLN CB . 16773 1 190 . 1 1 21 21 GLN CG C 13 34.817 0.200 . 1 . . . . 596 GLN CG . 16773 1 191 . 1 1 21 21 GLN N N 15 122.048 0.200 . 1 . . . . 596 GLN N . 16773 1 192 . 1 1 21 21 GLN NE2 N 15 112.387 0.200 . 1 . . . . 596 GLN NE2 . 16773 1 193 . 1 1 22 22 ALA H H 1 7.956 0.020 . 1 . . . . 597 ALA H . 16773 1 194 . 1 1 22 22 ALA HA H 1 4.173 0.020 . 1 . . . . 597 ALA HA . 16773 1 195 . 1 1 22 22 ALA HB1 H 1 1.006 0.007 . 1 . . . . 597 ALA QB . 16773 1 196 . 1 1 22 22 ALA HB2 H 1 1.006 0.007 . 1 . . . . 597 ALA QB . 16773 1 197 . 1 1 22 22 ALA HB3 H 1 1.006 0.007 . 1 . . . . 597 ALA QB . 16773 1 198 . 1 1 22 22 ALA C C 13 178.423 0.200 . 1 . . . . 597 ALA C . 16773 1 199 . 1 1 22 22 ALA CA C 13 52.613 0.200 . 1 . . . . 597 ALA CA . 16773 1 200 . 1 1 22 22 ALA CB C 13 19.955 0.200 . 1 . . . . 597 ALA CB . 16773 1 201 . 1 1 22 22 ALA N N 15 120.539 0.200 . 1 . . . . 597 ALA N . 16773 1 202 . 1 1 23 23 GLY H H 1 7.823 0.020 . 1 . . . . 598 GLY H . 16773 1 203 . 1 1 23 23 GLY HA2 H 1 3.973 0.009 . 2 . . . . 598 GLY HA2 . 16773 1 204 . 1 1 23 23 GLY HA3 H 1 3.662 0.009 . 2 . . . . 598 GLY HA3 . 16773 1 205 . 1 1 23 23 GLY C C 13 174.400 0.200 . 1 . . . . 598 GLY C . 16773 1 206 . 1 1 23 23 GLY CA C 13 46.357 0.200 . 1 . . . . 598 GLY CA . 16773 1 207 . 1 1 23 23 GLY N N 15 105.439 0.200 . 1 . . . . 598 GLY N . 16773 1 208 . 1 1 24 24 PHE H H 1 6.834 0.020 . 1 . . . . 599 PHE H . 16773 1 209 . 1 1 24 24 PHE HA H 1 4.964 0.020 . 1 . . . . 599 PHE HA . 16773 1 210 . 1 1 24 24 PHE HB2 H 1 2.769 0.020 . 2 . . . . 599 PHE HB2 . 16773 1 211 . 1 1 24 24 PHE HB3 H 1 2.583 0.020 . 2 . . . . 599 PHE HB3 . 16773 1 212 . 1 1 24 24 PHE C C 13 174.259 0.200 . 1 . . . . 599 PHE C . 16773 1 213 . 1 1 24 24 PHE CA C 13 54.732 0.200 . 1 . . . . 599 PHE CA . 16773 1 214 . 1 1 24 24 PHE CB C 13 42.046 0.157 . 1 . . . . 599 PHE CB . 16773 1 215 . 1 1 24 24 PHE N N 15 116.620 0.200 . 1 . . . . 599 PHE N . 16773 1 216 . 1 1 25 25 SER H H 1 8.106 0.020 . 1 . . . . 600 SER H . 16773 1 217 . 1 1 25 25 SER HA H 1 4.938 0.020 . 1 . . . . 600 SER HA . 16773 1 218 . 1 1 25 25 SER HB2 H 1 3.662 0.020 . 2 . . . . 600 SER HB2 . 16773 1 219 . 1 1 25 25 SER C C 13 172.674 0.200 . 1 . . . . 600 SER C . 16773 1 220 . 1 1 25 25 SER CA C 13 57.332 0.200 . 1 . . . . 600 SER CA . 16773 1 221 . 1 1 25 25 SER CB C 13 65.642 0.200 . 1 . . . . 600 SER CB . 16773 1 222 . 1 1 25 25 SER N N 15 116.011 0.200 . 1 . . . . 600 SER N . 16773 1 223 . 1 1 26 26 PHE H H 1 8.779 0.020 . 1 . . . . 601 PHE H . 16773 1 224 . 1 1 26 26 PHE HA H 1 4.958 0.020 . 1 . . . . 601 PHE HA . 16773 1 225 . 1 1 26 26 PHE HB2 H 1 2.814 0.020 . 2 . . . . 601 PHE HB2 . 16773 1 226 . 1 1 26 26 PHE HB3 H 1 2.631 0.020 . 2 . . . . 601 PHE HB3 . 16773 1 227 . 1 1 26 26 PHE HD1 H 1 6.984 0.020 . 1 . . . . 601 PHE HD1 . 16773 1 228 . 1 1 26 26 PHE HD2 H 1 6.984 0.020 . 1 . . . . 601 PHE HD2 . 16773 1 229 . 1 1 26 26 PHE HE1 H 1 6.400 0.020 . 1 . . . . 601 PHE HE1 . 16773 1 230 . 1 1 26 26 PHE HE2 H 1 6.400 0.020 . 1 . . . . 601 PHE HE2 . 16773 1 231 . 1 1 26 26 PHE C C 13 175.195 0.200 . 1 . . . . 601 PHE C . 16773 1 232 . 1 1 26 26 PHE CA C 13 57.082 0.200 . 1 . . . . 601 PHE CA . 16773 1 233 . 1 1 26 26 PHE CB C 13 42.288 0.200 . 1 . . . . 601 PHE CB . 16773 1 234 . 1 1 26 26 PHE CD1 C 13 132.047 0.200 . 1 . . . . 601 PHE CD1 . 16773 1 235 . 1 1 26 26 PHE CE1 C 13 131.271 0.200 . 1 . . . . 601 PHE CE1 . 16773 1 236 . 1 1 26 26 PHE N N 15 122.083 0.200 . 1 . . . . 601 PHE N . 16773 1 237 . 1 1 27 27 ASP H H 1 9.004 0.020 . 1 . . . . 602 ASP H . 16773 1 238 . 1 1 27 27 ASP HA H 1 5.042 0.020 . 1 . . . . 602 ASP HA . 16773 1 239 . 1 1 27 27 ASP HB2 H 1 2.960 0.020 . 2 . . . . 602 ASP HB2 . 16773 1 240 . 1 1 27 27 ASP HB3 H 1 2.576 0.020 . 2 . . . . 602 ASP HB3 . 16773 1 241 . 1 1 27 27 ASP C C 13 175.316 0.200 . 1 . . . . 602 ASP C . 16773 1 242 . 1 1 27 27 ASP CA C 13 53.787 0.200 . 1 . . . . 602 ASP CA . 16773 1 243 . 1 1 27 27 ASP CB C 13 42.578 0.200 . 1 . . . . 602 ASP CB . 16773 1 244 . 1 1 27 27 ASP N N 15 123.191 0.200 . 1 . . . . 602 ASP N . 16773 1 245 . 1 1 28 28 LEU H H 1 8.185 0.020 . 1 . . . . 603 LEU H . 16773 1 246 . 1 1 28 28 LEU HA H 1 4.312 0.020 . 1 . . . . 603 LEU HA . 16773 1 247 . 1 1 28 28 LEU HB2 H 1 1.386 0.020 . 2 . . . . 603 LEU HB2 . 16773 1 248 . 1 1 28 28 LEU HB3 H 1 1.237 0.020 . 2 . . . . 603 LEU HB3 . 16773 1 249 . 1 1 28 28 LEU HD11 H 1 -0.106 0.020 . 2 . . . . 603 LEU QD1 . 16773 1 250 . 1 1 28 28 LEU HD12 H 1 -0.106 0.020 . 2 . . . . 603 LEU QD1 . 16773 1 251 . 1 1 28 28 LEU HD13 H 1 -0.106 0.020 . 2 . . . . 603 LEU QD1 . 16773 1 252 . 1 1 28 28 LEU HD21 H 1 -0.149 0.020 . 2 . . . . 603 LEU QD2 . 16773 1 253 . 1 1 28 28 LEU HD22 H 1 -0.149 0.020 . 2 . . . . 603 LEU QD2 . 16773 1 254 . 1 1 28 28 LEU HD23 H 1 -0.149 0.020 . 2 . . . . 603 LEU QD2 . 16773 1 255 . 1 1 28 28 LEU HG H 1 0.955 0.020 . 1 . . . . 603 LEU HG . 16773 1 256 . 1 1 28 28 LEU C C 13 176.997 0.200 . 1 . . . . 603 LEU C . 16773 1 257 . 1 1 28 28 LEU CA C 13 54.528 0.200 . 1 . . . . 603 LEU CA . 16773 1 258 . 1 1 28 28 LEU CB C 13 41.220 0.200 . 1 . . . . 603 LEU CB . 16773 1 259 . 1 1 28 28 LEU CD1 C 13 24.709 0.200 . 1 . . . . 603 LEU CD1 . 16773 1 260 . 1 1 28 28 LEU CD2 C 13 23.425 0.200 . 1 . . . . 603 LEU CD2 . 16773 1 261 . 1 1 28 28 LEU CG C 13 29.249 0.200 . 1 . . . . 603 LEU CG . 16773 1 262 . 1 1 28 28 LEU N N 15 123.167 0.200 . 1 . . . . 603 LEU N . 16773 1 263 . 1 1 29 29 THR H H 1 8.770 0.020 . 1 . . . . 604 THR H . 16773 1 264 . 1 1 29 29 THR HA H 1 4.070 0.020 . 1 . . . . 604 THR HA . 16773 1 265 . 1 1 29 29 THR HB H 1 4.256 0.020 . 1 . . . . 604 THR HB . 16773 1 266 . 1 1 29 29 THR HG21 H 1 1.388 0.020 . 1 . . . . 604 THR QG2 . 16773 1 267 . 1 1 29 29 THR HG22 H 1 1.388 0.020 . 1 . . . . 604 THR QG2 . 16773 1 268 . 1 1 29 29 THR HG23 H 1 1.388 0.020 . 1 . . . . 604 THR QG2 . 16773 1 269 . 1 1 29 29 THR CA C 13 67.753 0.200 . 1 . . . . 604 THR CA . 16773 1 270 . 1 1 29 29 THR CB C 13 69.370 0.200 . 1 . . . . 604 THR CB . 16773 1 271 . 1 1 29 29 THR CG2 C 13 23.425 0.200 . 1 . . . . 604 THR CG2 . 16773 1 272 . 1 1 29 29 THR N N 15 116.479 0.200 . 1 . . . . 604 THR N . 16773 1 273 . 1 1 30 30 PRO HA H 1 4.357 0.020 . 1 . . . . 605 PRO HA . 16773 1 274 . 1 1 30 30 PRO HB2 H 1 2.215 0.020 . 2 . . . . 605 PRO HB2 . 16773 1 275 . 1 1 30 30 PRO HB3 H 1 0.714 0.015 . 2 . . . . 605 PRO HB3 . 16773 1 276 . 1 1 30 30 PRO HD2 H 1 3.672 0.020 . 2 . . . . 605 PRO HD2 . 16773 1 277 . 1 1 30 30 PRO HD3 H 1 2.804 0.020 . 2 . . . . 605 PRO HD3 . 16773 1 278 . 1 1 30 30 PRO HG2 H 1 1.662 0.020 . 2 . . . . 605 PRO HG2 . 16773 1 279 . 1 1 30 30 PRO HG3 H 1 1.662 0.020 . 2 . . . . 605 PRO HG3 . 16773 1 280 . 1 1 30 30 PRO C C 13 176.696 0.200 . 1 . . . . 605 PRO C . 16773 1 281 . 1 1 30 30 PRO CA C 13 65.541 0.200 . 1 . . . . 605 PRO CA . 16773 1 282 . 1 1 30 30 PRO CB C 13 31.604 0.200 . 1 . . . . 605 PRO CB . 16773 1 283 . 1 1 30 30 PRO CD C 13 51.251 0.200 . 1 . . . . 605 PRO CD . 16773 1 284 . 1 1 30 30 PRO CG C 13 28.540 0.200 . 1 . . . . 605 PRO CG . 16773 1 285 . 1 1 31 31 LEU H H 1 7.970 0.020 . 1 . . . . 606 LEU H . 16773 1 286 . 1 1 31 31 LEU HA H 1 4.219 0.020 . 1 . . . . 606 LEU HA . 16773 1 287 . 1 1 31 31 LEU HB2 H 1 1.677 0.020 . 2 . . . . 606 LEU HB2 . 16773 1 288 . 1 1 31 31 LEU HB3 H 1 1.432 0.020 . 2 . . . . 606 LEU HB3 . 16773 1 289 . 1 1 31 31 LEU HD11 H 1 0.552 0.020 . 2 . . . . 606 LEU QD1 . 16773 1 290 . 1 1 31 31 LEU HD12 H 1 0.552 0.020 . 2 . . . . 606 LEU QD1 . 16773 1 291 . 1 1 31 31 LEU HD13 H 1 0.552 0.020 . 2 . . . . 606 LEU QD1 . 16773 1 292 . 1 1 31 31 LEU HD21 H 1 0.324 0.020 . 2 . . . . 606 LEU QD2 . 16773 1 293 . 1 1 31 31 LEU HD22 H 1 0.324 0.020 . 2 . . . . 606 LEU QD2 . 16773 1 294 . 1 1 31 31 LEU HD23 H 1 0.324 0.020 . 2 . . . . 606 LEU QD2 . 16773 1 295 . 1 1 31 31 LEU HG H 1 1.485 0.020 . 1 . . . . 606 LEU HG . 16773 1 296 . 1 1 31 31 LEU C C 13 179.233 0.200 . 1 . . . . 606 LEU C . 16773 1 297 . 1 1 31 31 LEU CA C 13 56.264 0.200 . 1 . . . . 606 LEU CA . 16773 1 298 . 1 1 31 31 LEU CB C 13 41.738 0.207 . 1 . . . . 606 LEU CB . 16773 1 299 . 1 1 31 31 LEU CD1 C 13 25.149 0.200 . 1 . . . . 606 LEU CD1 . 16773 1 300 . 1 1 31 31 LEU CD2 C 13 25.690 0.200 . 1 . . . . 606 LEU CD2 . 16773 1 301 . 1 1 31 31 LEU CG C 13 29.572 0.200 . 1 . . . . 606 LEU CG . 16773 1 302 . 1 1 31 31 LEU N N 15 114.215 0.200 . 1 . . . . 606 LEU N . 16773 1 303 . 1 1 32 32 THR H H 1 7.938 0.020 . 1 . . . . 607 THR H . 16773 1 304 . 1 1 32 32 THR HA H 1 4.246 0.020 . 1 . . . . 607 THR HA . 16773 1 305 . 1 1 32 32 THR HB H 1 4.025 0.020 . 1 . . . . 607 THR HB . 16773 1 306 . 1 1 32 32 THR HG21 H 1 1.255 0.020 . 1 . . . . 607 THR QG2 . 16773 1 307 . 1 1 32 32 THR HG22 H 1 1.255 0.020 . 1 . . . . 607 THR QG2 . 16773 1 308 . 1 1 32 32 THR HG23 H 1 1.255 0.020 . 1 . . . . 607 THR QG2 . 16773 1 309 . 1 1 32 32 THR C C 13 174.910 0.200 . 1 . . . . 607 THR C . 16773 1 310 . 1 1 32 32 THR CA C 13 66.096 0.200 . 1 . . . . 607 THR CA . 16773 1 311 . 1 1 32 32 THR CB C 13 69.534 0.200 . 1 . . . . 607 THR CB . 16773 1 312 . 1 1 32 32 THR CG2 C 13 22.169 0.200 . 1 . . . . 607 THR CG2 . 16773 1 313 . 1 1 32 32 THR N N 15 119.564 0.200 . 1 . . . . 607 THR N . 16773 1 314 . 1 1 33 33 LYS H H 1 9.098 0.020 . 1 . . . . 608 LYS H . 16773 1 315 . 1 1 33 33 LYS HA H 1 4.771 0.020 . 1 . . . . 608 LYS HA . 16773 1 316 . 1 1 33 33 LYS HB2 H 1 1.826 0.010 . 2 . . . . 608 LYS HB2 . 16773 1 317 . 1 1 33 33 LYS HB3 H 1 1.567 0.020 . 2 . . . . 608 LYS HB3 . 16773 1 318 . 1 1 33 33 LYS HD2 H 1 1.100 0.020 . 2 . . . . 608 LYS HD2 . 16773 1 319 . 1 1 33 33 LYS HE2 H 1 2.806 0.010 . 2 . . . . 608 LYS HE2 . 16773 1 320 . 1 1 33 33 LYS HG2 H 1 1.508 0.020 . 2 . . . . 608 LYS HG2 . 16773 1 321 . 1 1 33 33 LYS HG3 H 1 1.432 0.020 . 2 . . . . 608 LYS HG3 . 16773 1 322 . 1 1 33 33 LYS C C 13 177.297 0.200 . 1 . . . . 608 LYS C . 16773 1 323 . 1 1 33 33 LYS CA C 13 55.601 0.200 . 1 . . . . 608 LYS CA . 16773 1 324 . 1 1 33 33 LYS CB C 13 37.175 0.200 . 1 . . . . 608 LYS CB . 16773 1 325 . 1 1 33 33 LYS CD C 13 29.260 0.200 . 1 . . . . 608 LYS CD . 16773 1 326 . 1 1 33 33 LYS CE C 13 41.868 0.200 . 1 . . . . 608 LYS CE . 16773 1 327 . 1 1 33 33 LYS CG C 13 26.013 0.200 . 1 . . . . 608 LYS CG . 16773 1 328 . 1 1 33 33 LYS N N 15 130.300 0.200 . 1 . . . . 608 LYS N . 16773 1 329 . 1 1 34 34 LYS H H 1 8.723 0.020 . 1 . . . . 609 LYS H . 16773 1 330 . 1 1 34 34 LYS HA H 1 4.171 0.020 . 1 . . . . 609 LYS HA . 16773 1 331 . 1 1 34 34 LYS HB2 H 1 1.841 0.020 . 2 . . . . 609 LYS HB2 . 16773 1 332 . 1 1 34 34 LYS HD2 H 1 1.726 0.020 . 2 . . . . 609 LYS HD2 . 16773 1 333 . 1 1 34 34 LYS HE2 H 1 3.045 0.020 . 2 . . . . 609 LYS HE2 . 16773 1 334 . 1 1 34 34 LYS HE3 H 1 3.045 0.020 . 2 . . . . 609 LYS HE3 . 16773 1 335 . 1 1 34 34 LYS HG2 H 1 1.487 0.020 . 2 . . . . 609 LYS HG2 . 16773 1 336 . 1 1 34 34 LYS C C 13 176.967 0.200 . 1 . . . . 609 LYS C . 16773 1 337 . 1 1 34 34 LYS CA C 13 59.016 0.200 . 1 . . . . 609 LYS CA . 16773 1 338 . 1 1 34 34 LYS CB C 13 32.898 0.200 . 1 . . . . 609 LYS CB . 16773 1 339 . 1 1 34 34 LYS CD C 13 29.054 0.200 . 1 . . . . 609 LYS CD . 16773 1 340 . 1 1 34 34 LYS CE C 13 42.760 0.200 . 1 . . . . 609 LYS CE . 16773 1 341 . 1 1 34 34 LYS CG C 13 25.042 0.200 . 1 . . . . 609 LYS CG . 16773 1 342 . 1 1 34 34 LYS N N 15 121.658 0.200 . 1 . . . . 609 LYS N . 16773 1 343 . 1 1 35 35 ASP H H 1 7.920 0.020 . 1 . . . . 610 ASP H . 16773 1 344 . 1 1 35 35 ASP HA H 1 4.767 0.020 . 1 . . . . 610 ASP HA . 16773 1 345 . 1 1 35 35 ASP HB2 H 1 2.730 0.020 . 2 . . . . 610 ASP HB2 . 16773 1 346 . 1 1 35 35 ASP C C 13 174.640 0.200 . 1 . . . . 610 ASP C . 16773 1 347 . 1 1 35 35 ASP CA C 13 54.299 0.200 . 1 . . . . 610 ASP CA . 16773 1 348 . 1 1 35 35 ASP CB C 13 41.115 0.200 . 1 . . . . 610 ASP CB . 16773 1 349 . 1 1 35 35 ASP N N 15 116.388 0.200 . 1 . . . . 610 ASP N . 16773 1 350 . 1 1 36 36 ALA H H 1 8.418 0.020 . 1 . . . . 611 ALA H . 16773 1 351 . 1 1 36 36 ALA HA H 1 4.105 0.006 . 1 . . . . 611 ALA HA . 16773 1 352 . 1 1 36 36 ALA HB1 H 1 1.660 0.020 . 1 . . . . 611 ALA QB . 16773 1 353 . 1 1 36 36 ALA HB2 H 1 1.660 0.020 . 1 . . . . 611 ALA QB . 16773 1 354 . 1 1 36 36 ALA HB3 H 1 1.660 0.020 . 1 . . . . 611 ALA QB . 16773 1 355 . 1 1 36 36 ALA C C 13 176.141 0.200 . 1 . . . . 611 ALA C . 16773 1 356 . 1 1 36 36 ALA CA C 13 53.516 0.200 . 1 . . . . 611 ALA CA . 16773 1 357 . 1 1 36 36 ALA CB C 13 21.483 0.200 . 1 . . . . 611 ALA CB . 16773 1 358 . 1 1 36 36 ALA N N 15 118.502 0.200 . 1 . . . . 611 ALA N . 16773 1 359 . 1 1 37 37 TYR H H 1 9.142 0.020 . 1 . . . . 612 TYR H . 16773 1 360 . 1 1 37 37 TYR HA H 1 4.599 0.020 . 1 . . . . 612 TYR HA . 16773 1 361 . 1 1 37 37 TYR HB2 H 1 2.834 0.020 . 2 . . . . 612 TYR HB2 . 16773 1 362 . 1 1 37 37 TYR HB3 H 1 2.405 0.020 . 2 . . . . 612 TYR HB3 . 16773 1 363 . 1 1 37 37 TYR HD1 H 1 7.427 0.001 . 1 . . . . 612 TYR HD1 . 16773 1 364 . 1 1 37 37 TYR HD2 H 1 7.427 0.001 . 1 . . . . 612 TYR HD2 . 16773 1 365 . 1 1 37 37 TYR HE1 H 1 7.353 0.020 . 1 . . . . 612 TYR HE1 . 16773 1 366 . 1 1 37 37 TYR HE2 H 1 7.353 0.020 . 1 . . . . 612 TYR HE2 . 16773 1 367 . 1 1 37 37 TYR HH H 1 10.608 0.020 . 1 . . . . 612 TYR HH . 16773 1 368 . 1 1 37 37 TYR C C 13 175.015 0.200 . 1 . . . . 612 TYR C . 16773 1 369 . 1 1 37 37 TYR CA C 13 58.435 0.200 . 1 . . . . 612 TYR CA . 16773 1 370 . 1 1 37 37 TYR CB C 13 39.300 0.200 . 1 . . . . 612 TYR CB . 16773 1 371 . 1 1 37 37 TYR CD1 C 13 134.118 0.200 . 1 . . . . 612 TYR CD1 . 16773 1 372 . 1 1 37 37 TYR CE1 C 13 119.105 0.200 . 1 . . . . 612 TYR CE1 . 16773 1 373 . 1 1 37 37 TYR N N 15 119.819 0.200 . 1 . . . . 612 TYR N . 16773 1 374 . 1 1 38 38 LYS H H 1 8.711 0.020 . 1 . . . . 613 LYS H . 16773 1 375 . 1 1 38 38 LYS HA H 1 5.241 0.010 . 1 . . . . 613 LYS HA . 16773 1 376 . 1 1 38 38 LYS HB2 H 1 1.858 0.010 . 2 . . . . 613 LYS HB2 . 16773 1 377 . 1 1 38 38 LYS HB3 H 1 1.659 0.010 . 2 . . . . 613 LYS HB3 . 16773 1 378 . 1 1 38 38 LYS HD2 H 1 1.680 0.010 . 2 . . . . 613 LYS HD2 . 16773 1 379 . 1 1 38 38 LYS HE2 H 1 3.017 0.020 . 2 . . . . 613 LYS HE2 . 16773 1 380 . 1 1 38 38 LYS HE3 H 1 2.866 0.020 . 2 . . . . 613 LYS HE3 . 16773 1 381 . 1 1 38 38 LYS HG2 H 1 0.976 0.010 . 2 . . . . 613 LYS HG2 . 16773 1 382 . 1 1 38 38 LYS HG3 H 1 0.908 0.010 . 2 . . . . 613 LYS HG3 . 16773 1 383 . 1 1 38 38 LYS C C 13 175.766 0.200 . 1 . . . . 613 LYS C . 16773 1 384 . 1 1 38 38 LYS CA C 13 55.422 0.200 . 1 . . . . 613 LYS CA . 16773 1 385 . 1 1 38 38 LYS CB C 13 34.756 0.200 . 1 . . . . 613 LYS CB . 16773 1 386 . 1 1 38 38 LYS CD C 13 29.876 0.200 . 1 . . . . 613 LYS CD . 16773 1 387 . 1 1 38 38 LYS CE C 13 42.191 0.200 . 1 . . . . 613 LYS CE . 16773 1 388 . 1 1 38 38 LYS CG C 13 25.252 0.200 . 1 . . . . 613 LYS CG . 16773 1 389 . 1 1 38 38 LYS N N 15 124.475 0.200 . 1 . . . . 613 LYS N . 16773 1 390 . 1 1 39 39 VAL H H 1 9.351 0.020 . 1 . . . . 614 VAL H . 16773 1 391 . 1 1 39 39 VAL HA H 1 4.536 0.020 . 1 . . . . 614 VAL HA . 16773 1 392 . 1 1 39 39 VAL HB H 1 2.300 0.020 . 1 . . . . 614 VAL HB . 16773 1 393 . 1 1 39 39 VAL HG11 H 1 1.260 0.020 . 2 . . . . 614 VAL QG1 . 16773 1 394 . 1 1 39 39 VAL HG12 H 1 1.260 0.020 . 2 . . . . 614 VAL QG1 . 16773 1 395 . 1 1 39 39 VAL HG13 H 1 1.260 0.020 . 2 . . . . 614 VAL QG1 . 16773 1 396 . 1 1 39 39 VAL HG21 H 1 0.948 0.020 . 2 . . . . 614 VAL QG2 . 16773 1 397 . 1 1 39 39 VAL HG22 H 1 0.948 0.020 . 2 . . . . 614 VAL QG2 . 16773 1 398 . 1 1 39 39 VAL HG23 H 1 0.948 0.020 . 2 . . . . 614 VAL QG2 . 16773 1 399 . 1 1 39 39 VAL C C 13 175.240 0.200 . 1 . . . . 614 VAL C . 16773 1 400 . 1 1 39 39 VAL CA C 13 61.754 0.200 . 1 . . . . 614 VAL CA . 16773 1 401 . 1 1 39 39 VAL CB C 13 35.093 0.200 . 1 . . . . 614 VAL CB . 16773 1 402 . 1 1 39 39 VAL CG1 C 13 21.807 0.200 . 1 . . . . 614 VAL CG1 . 16773 1 403 . 1 1 39 39 VAL CG2 C 13 21.757 0.200 . 1 . . . . 614 VAL CG2 . 16773 1 404 . 1 1 39 39 VAL N N 15 127.808 0.200 . 1 . . . . 614 VAL N . 16773 1 405 . 1 1 40 40 GLU H H 1 9.048 0.020 . 1 . . . . 615 GLU H . 16773 1 406 . 1 1 40 40 GLU HA H 1 5.142 0.020 . 1 . . . . 615 GLU HA . 16773 1 407 . 1 1 40 40 GLU HB2 H 1 2.097 0.020 . 2 . . . . 615 GLU HB2 . 16773 1 408 . 1 1 40 40 GLU HB3 H 1 2.076 0.020 . 2 . . . . 615 GLU HB3 . 16773 1 409 . 1 1 40 40 GLU HG2 H 1 2.328 0.020 . 2 . . . . 615 GLU HG2 . 16773 1 410 . 1 1 40 40 GLU HG3 H 1 2.243 0.020 . 2 . . . . 615 GLU HG3 . 16773 1 411 . 1 1 40 40 GLU C C 13 176.546 0.200 . 1 . . . . 615 GLU C . 16773 1 412 . 1 1 40 40 GLU CA C 13 56.392 0.200 . 1 . . . . 615 GLU CA . 16773 1 413 . 1 1 40 40 GLU CB C 13 33.145 0.200 . 1 . . . . 615 GLU CB . 16773 1 414 . 1 1 40 40 GLU CG C 13 37.725 0.200 . 1 . . . . 615 GLU CG . 16773 1 415 . 1 1 40 40 GLU N N 15 126.794 0.200 . 1 . . . . 615 GLU N . 16773 1 416 . 1 1 41 41 THR H H 1 8.988 0.020 . 1 . . . . 616 THR H . 16773 1 417 . 1 1 41 41 THR HA H 1 5.063 0.020 . 1 . . . . 616 THR HA . 16773 1 418 . 1 1 41 41 THR HB H 1 4.896 0.020 . 1 . . . . 616 THR HB . 16773 1 419 . 1 1 41 41 THR HG21 H 1 1.433 0.020 . 1 . . . . 616 THR QG2 . 16773 1 420 . 1 1 41 41 THR HG22 H 1 1.433 0.020 . 1 . . . . 616 THR QG2 . 16773 1 421 . 1 1 41 41 THR HG23 H 1 1.433 0.020 . 1 . . . . 616 THR QG2 . 16773 1 422 . 1 1 41 41 THR C C 13 174.340 0.200 . 1 . . . . 616 THR C . 16773 1 423 . 1 1 41 41 THR CA C 13 60.069 0.200 . 1 . . . . 616 THR CA . 16773 1 424 . 1 1 41 41 THR CB C 13 72.235 0.200 . 1 . . . . 616 THR CB . 16773 1 425 . 1 1 41 41 THR CG2 C 13 22.477 0.200 . 1 . . . . 616 THR CG2 . 16773 1 426 . 1 1 41 41 THR N N 15 115.810 0.200 . 1 . . . . 616 THR N . 16773 1 427 . 1 1 42 42 ASP H H 1 8.775 0.020 . 1 . . . . 617 ASP H . 16773 1 428 . 1 1 42 42 ASP HA H 1 4.360 0.009 . 1 . . . . 617 ASP HA . 16773 1 429 . 1 1 42 42 ASP HB2 H 1 2.799 0.009 . 2 . . . . 617 ASP HB2 . 16773 1 430 . 1 1 42 42 ASP HB3 H 1 2.780 0.010 . 2 . . . . 617 ASP HB3 . 16773 1 431 . 1 1 42 42 ASP C C 13 177.971 0.200 . 1 . . . . 617 ASP C . 16773 1 432 . 1 1 42 42 ASP CA C 13 58.000 0.200 . 1 . . . . 617 ASP CA . 16773 1 433 . 1 1 42 42 ASP CB C 13 40.946 0.200 . 1 . . . . 617 ASP CB . 16773 1 434 . 1 1 42 42 ASP N N 15 118.253 0.200 . 1 . . . . 617 ASP N . 16773 1 435 . 1 1 43 43 LYS H H 1 7.924 0.020 . 1 . . . . 618 LYS H . 16773 1 436 . 1 1 43 43 LYS HA H 1 4.274 0.020 . 1 . . . . 618 LYS HA . 16773 1 437 . 1 1 43 43 LYS HB2 H 1 1.185 0.020 . 2 . . . . 618 LYS HB2 . 16773 1 438 . 1 1 43 43 LYS HB3 H 1 0.976 0.020 . 2 . . . . 618 LYS HB3 . 16773 1 439 . 1 1 43 43 LYS HD2 H 1 1.614 0.020 . 2 . . . . 618 LYS HD2 . 16773 1 440 . 1 1 43 43 LYS HE2 H 1 3.031 0.020 . 2 . . . . 618 LYS HE2 . 16773 1 441 . 1 1 43 43 LYS HE3 H 1 3.031 0.020 . 2 . . . . 618 LYS HE3 . 16773 1 442 . 1 1 43 43 LYS HG2 H 1 1.336 0.020 . 2 . . . . 618 LYS HG2 . 16773 1 443 . 1 1 43 43 LYS C C 13 177.147 0.200 . 1 . . . . 618 LYS C . 16773 1 444 . 1 1 43 43 LYS CA C 13 57.208 0.200 . 1 . . . . 618 LYS CA . 16773 1 445 . 1 1 43 43 LYS CB C 13 35.657 0.200 . 1 . . . . 618 LYS CB . 16773 1 446 . 1 1 43 43 LYS CD C 13 29.362 0.200 . 1 . . . . 618 LYS CD . 16773 1 447 . 1 1 43 43 LYS CE C 13 42.672 0.200 . 1 . . . . 618 LYS CE . 16773 1 448 . 1 1 43 43 LYS CG C 13 25.457 0.200 . 1 . . . . 618 LYS CG . 16773 1 449 . 1 1 43 43 LYS N N 15 114.247 0.200 . 1 . . . . 618 LYS N . 16773 1 450 . 1 1 44 44 TYR H H 1 7.522 0.020 . 1 . . . . 619 TYR H . 16773 1 451 . 1 1 44 44 TYR HA H 1 5.549 0.020 . 1 . . . . 619 TYR HA . 16773 1 452 . 1 1 44 44 TYR HB2 H 1 2.231 0.020 . 2 . . . . 619 TYR HB2 . 16773 1 453 . 1 1 44 44 TYR HB3 H 1 2.115 0.020 . 2 . . . . 619 TYR HB3 . 16773 1 454 . 1 1 44 44 TYR HD1 H 1 7.010 0.020 . 1 . . . . 619 TYR HD1 . 16773 1 455 . 1 1 44 44 TYR HD2 H 1 7.010 0.020 . 1 . . . . 619 TYR HD2 . 16773 1 456 . 1 1 44 44 TYR HE1 H 1 6.889 0.020 . 1 . . . . 619 TYR HE1 . 16773 1 457 . 1 1 44 44 TYR HE2 H 1 6.889 0.020 . 1 . . . . 619 TYR HE2 . 16773 1 458 . 1 1 44 44 TYR C C 13 174.559 0.200 . 1 . . . . 619 TYR C . 16773 1 459 . 1 1 44 44 TYR CA C 13 56.767 0.200 . 1 . . . . 619 TYR CA . 16773 1 460 . 1 1 44 44 TYR CB C 13 43.647 0.200 . 1 . . . . 619 TYR CB . 16773 1 461 . 1 1 44 44 TYR CD1 C 13 134.118 0.200 . 1 . . . . 619 TYR CD1 . 16773 1 462 . 1 1 44 44 TYR CE1 C 13 119.105 0.200 . 1 . . . . 619 TYR CE1 . 16773 1 463 . 1 1 44 44 TYR N N 15 115.682 0.200 . 1 . . . . 619 TYR N . 16773 1 464 . 1 1 45 45 GLU H H 1 9.125 0.020 . 1 . . . . 620 GLU H . 16773 1 465 . 1 1 45 45 GLU HA H 1 4.869 0.020 . 1 . . . . 620 GLU HA . 16773 1 466 . 1 1 45 45 GLU HB2 H 1 2.000 0.020 . 2 . . . . 620 GLU HB2 . 16773 1 467 . 1 1 45 45 GLU HB3 H 1 1.751 0.020 . 2 . . . . 620 GLU HB3 . 16773 1 468 . 1 1 45 45 GLU HG2 H 1 2.260 0.020 . 2 . . . . 620 GLU HG2 . 16773 1 469 . 1 1 45 45 GLU HG3 H 1 2.155 0.020 . 2 . . . . 620 GLU HG3 . 16773 1 470 . 1 1 45 45 GLU C C 13 175.406 0.200 . 1 . . . . 620 GLU C . 16773 1 471 . 1 1 45 45 GLU CA C 13 55.269 0.200 . 1 . . . . 620 GLU CA . 16773 1 472 . 1 1 45 45 GLU CB C 13 33.012 0.200 . 1 . . . . 620 GLU CB . 16773 1 473 . 1 1 45 45 GLU CG C 13 36.691 0.200 . 1 . . . . 620 GLU CG . 16773 1 474 . 1 1 45 45 GLU N N 15 118.807 0.200 . 1 . . . . 620 GLU N . 16773 1 475 . 1 1 46 46 PHE H H 1 9.464 0.020 . 1 . . . . 621 PHE H . 16773 1 476 . 1 1 46 46 PHE HA H 1 5.549 0.020 . 1 . . . . 621 PHE HA . 16773 1 477 . 1 1 46 46 PHE HB2 H 1 3.148 0.020 . 2 . . . . 621 PHE HB2 . 16773 1 478 . 1 1 46 46 PHE HB3 H 1 2.799 0.020 . 2 . . . . 621 PHE HB3 . 16773 1 479 . 1 1 46 46 PHE HD1 H 1 7.040 0.020 . 1 . . . . 621 PHE HD1 . 16773 1 480 . 1 1 46 46 PHE HD2 H 1 7.040 0.020 . 1 . . . . 621 PHE HD2 . 16773 1 481 . 1 1 46 46 PHE HE1 H 1 6.836 0.020 . 1 . . . . 621 PHE HE1 . 16773 1 482 . 1 1 46 46 PHE HE2 H 1 6.836 0.020 . 1 . . . . 621 PHE HE2 . 16773 1 483 . 1 1 46 46 PHE HZ H 1 6.294 0.020 . 1 . . . . 621 PHE HZ . 16773 1 484 . 1 1 46 46 PHE C C 13 174.550 0.200 . 1 . . . . 621 PHE C . 16773 1 485 . 1 1 46 46 PHE CA C 13 57.101 0.200 . 1 . . . . 621 PHE CA . 16773 1 486 . 1 1 46 46 PHE CB C 13 41.959 0.200 . 1 . . . . 621 PHE CB . 16773 1 487 . 1 1 46 46 PHE CD1 C 13 131.530 0.200 . 1 . . . . 621 PHE CD1 . 16773 1 488 . 1 1 46 46 PHE CE1 C 13 131.530 0.200 . 1 . . . . 621 PHE CE1 . 16773 1 489 . 1 1 46 46 PHE CZ C 13 129.459 0.200 . 1 . . . . 621 PHE CZ . 16773 1 490 . 1 1 46 46 PHE N N 15 121.900 0.200 . 1 . . . . 621 PHE N . 16773 1 491 . 1 1 47 47 HIS H H 1 9.225 0.020 . 1 . . . . 622 HIS H . 16773 1 492 . 1 1 47 47 HIS HA H 1 5.547 0.020 . 1 . . . . 622 HIS HA . 16773 1 493 . 1 1 47 47 HIS HB2 H 1 2.902 0.020 . 2 . . . . 622 HIS HB2 . 16773 1 494 . 1 1 47 47 HIS HB3 H 1 2.742 0.020 . 2 . . . . 622 HIS HB3 . 16773 1 495 . 1 1 47 47 HIS HD1 H 1 6.671 0.020 . 1 . . . . 622 HIS HD1 . 16773 1 496 . 1 1 47 47 HIS HD2 H 1 6.671 0.020 . 1 . . . . 622 HIS HD2 . 16773 1 497 . 1 1 47 47 HIS HE1 H 1 7.672 0.003 . 1 . . . . 622 HIS HE1 . 16773 1 498 . 1 1 47 47 HIS C C 13 175.442 0.200 . 1 . . . . 622 HIS C . 16773 1 499 . 1 1 47 47 HIS CA C 13 54.810 0.200 . 1 . . . . 622 HIS CA . 16773 1 500 . 1 1 47 47 HIS CB C 13 34.102 0.200 . 1 . . . . 622 HIS CB . 16773 1 501 . 1 1 47 47 HIS CD2 C 13 118.329 0.200 . 1 . . . . 622 HIS CD2 . 16773 1 502 . 1 1 47 47 HIS CE1 C 13 138.260 0.200 . 1 . . . . 622 HIS CE1 . 16773 1 503 . 1 1 47 47 HIS N N 15 122.583 0.200 . 1 . . . . 622 HIS N . 16773 1 504 . 1 1 48 48 ILE H H 1 9.327 0.020 . 1 . . . . 623 ILE H . 16773 1 505 . 1 1 48 48 ILE HA H 1 5.242 0.020 . 1 . . . . 623 ILE HA . 16773 1 506 . 1 1 48 48 ILE HB H 1 1.579 0.020 . 1 . . . . 623 ILE HB . 16773 1 507 . 1 1 48 48 ILE HD11 H 1 -0.029 0.020 . 1 . . . . 623 ILE QD1 . 16773 1 508 . 1 1 48 48 ILE HD12 H 1 -0.029 0.020 . 1 . . . . 623 ILE QD1 . 16773 1 509 . 1 1 48 48 ILE HD13 H 1 -0.029 0.020 . 1 . . . . 623 ILE QD1 . 16773 1 510 . 1 1 48 48 ILE HG12 H 1 1.381 0.020 . 2 . . . . 623 ILE HG12 . 16773 1 511 . 1 1 48 48 ILE HG13 H 1 0.804 0.020 . 2 . . . . 623 ILE HG13 . 16773 1 512 . 1 1 48 48 ILE HG21 H 1 0.616 0.020 . 1 . . . . 623 ILE QG2 . 16773 1 513 . 1 1 48 48 ILE HG22 H 1 0.616 0.020 . 1 . . . . 623 ILE QG2 . 16773 1 514 . 1 1 48 48 ILE HG23 H 1 0.616 0.020 . 1 . . . . 623 ILE QG2 . 16773 1 515 . 1 1 48 48 ILE C C 13 173.624 0.200 . 1 . . . . 623 ILE C . 16773 1 516 . 1 1 48 48 ILE CA C 13 59.850 0.200 . 1 . . . . 623 ILE CA . 16773 1 517 . 1 1 48 48 ILE CB C 13 43.873 0.200 . 1 . . . . 623 ILE CB . 16773 1 518 . 1 1 48 48 ILE CD1 C 13 13.639 0.200 . 1 . . . . 623 ILE CD1 . 16773 1 519 . 1 1 48 48 ILE CG1 C 13 27.924 0.200 . 1 . . . . 623 ILE CG1 . 16773 1 520 . 1 1 48 48 ILE CG2 C 13 17.441 0.200 . 1 . . . . 623 ILE CG2 . 16773 1 521 . 1 1 48 48 ILE N N 15 121.497 0.200 . 1 . . . . 623 ILE N . 16773 1 522 . 1 1 49 49 ASN H H 1 8.715 0.020 . 1 . . . . 624 ASN H . 16773 1 523 . 1 1 49 49 ASN HA H 1 5.640 0.020 . 1 . . . . 624 ASN HA . 16773 1 524 . 1 1 49 49 ASN HB2 H 1 3.453 0.020 . 2 . . . . 624 ASN HB2 . 16773 1 525 . 1 1 49 49 ASN HB3 H 1 2.505 0.020 . 2 . . . . 624 ASN HB3 . 16773 1 526 . 1 1 49 49 ASN HD21 H 1 7.370 0.020 . 2 . . . . 624 ASN HD21 . 16773 1 527 . 1 1 49 49 ASN HD22 H 1 7.189 0.020 . 2 . . . . 624 ASN HD22 . 16773 1 528 . 1 1 49 49 ASN C C 13 174.745 0.200 . 1 . . . . 624 ASN C . 16773 1 529 . 1 1 49 49 ASN CA C 13 50.204 0.200 . 1 . . . . 624 ASN CA . 16773 1 530 . 1 1 49 49 ASN CB C 13 41.635 0.200 . 1 . . . . 624 ASN CB . 16773 1 531 . 1 1 49 49 ASN N N 15 120.895 0.200 . 1 . . . . 624 ASN N . 16773 1 532 . 1 1 49 49 ASN ND2 N 15 110.136 0.200 . 1 . . . . 624 ASN ND2 . 16773 1 533 . 1 1 50 50 VAL H H 1 8.567 0.020 . 1 . . . . 625 VAL H . 16773 1 534 . 1 1 50 50 VAL HA H 1 3.847 0.020 . 1 . . . . 625 VAL HA . 16773 1 535 . 1 1 50 50 VAL HB H 1 1.551 0.010 . 1 . . . . 625 VAL HB . 16773 1 536 . 1 1 50 50 VAL HG11 H 1 0.624 0.020 . 2 . . . . 625 VAL QG1 . 16773 1 537 . 1 1 50 50 VAL HG12 H 1 0.624 0.020 . 2 . . . . 625 VAL QG1 . 16773 1 538 . 1 1 50 50 VAL HG13 H 1 0.624 0.020 . 2 . . . . 625 VAL QG1 . 16773 1 539 . 1 1 50 50 VAL HG21 H 1 0.617 0.020 . 2 . . . . 625 VAL QG2 . 16773 1 540 . 1 1 50 50 VAL HG22 H 1 0.617 0.020 . 2 . . . . 625 VAL QG2 . 16773 1 541 . 1 1 50 50 VAL HG23 H 1 0.617 0.020 . 2 . . . . 625 VAL QG2 . 16773 1 542 . 1 1 50 50 VAL C C 13 174.506 0.200 . 1 . . . . 625 VAL C . 16773 1 543 . 1 1 50 50 VAL CA C 13 63.226 0.200 . 1 . . . . 625 VAL CA . 16773 1 544 . 1 1 50 50 VAL CB C 13 34.163 0.200 . 1 . . . . 625 VAL CB . 16773 1 545 . 1 1 50 50 VAL CG1 C 13 24.072 0.200 . 1 . . . . 625 VAL CG1 . 16773 1 546 . 1 1 50 50 VAL CG2 C 13 21.483 0.200 . 1 . . . . 625 VAL CG2 . 16773 1 547 . 1 1 50 50 VAL N N 15 122.563 0.200 . 1 . . . . 625 VAL N . 16773 1 548 . 1 1 51 51 CYS H H 1 8.017 0.373 . 1 . . . . 626 CYS H . 16773 1 549 . 1 1 51 51 CYS HA H 1 4.578 0.010 . 1 . . . . 626 CYS HA . 16773 1 550 . 1 1 51 51 CYS HB2 H 1 4.100 0.020 . 2 . . . . 626 CYS HB2 . 16773 1 551 . 1 1 51 51 CYS HB3 H 1 3.098 0.008 . 2 . . . . 626 CYS HB3 . 16773 1 552 . 1 1 51 51 CYS C C 13 172.178 0.200 . 1 . . . . 626 CYS C . 16773 1 553 . 1 1 51 51 CYS CA C 13 56.582 0.200 . 1 . . . . 626 CYS CA . 16773 1 554 . 1 1 51 51 CYS CB C 13 42.515 0.200 . 1 . . . . 626 CYS CB . 16773 1 555 . 1 1 51 51 CYS N N 15 118.358 0.148 . 1 . . . . 626 CYS N . 16773 1 556 . 1 1 52 52 GLY H H 1 7.283 0.020 . 1 . . . . 627 GLY H . 16773 1 557 . 1 1 52 52 GLY HA2 H 1 4.113 0.020 . 2 . . . . 627 GLY HA2 . 16773 1 558 . 1 1 52 52 GLY HA3 H 1 3.730 0.008 . 2 . . . . 627 GLY HA3 . 16773 1 559 . 1 1 52 52 GLY CA C 13 45.103 0.200 . 1 . . . . 627 GLY CA . 16773 1 560 . 1 1 52 52 GLY N N 15 104.168 0.200 . 1 . . . . 627 GLY N . 16773 1 561 . 1 1 53 53 PRO HA H 1 4.851 0.020 . 1 . . . . 628 PRO HA . 16773 1 562 . 1 1 53 53 PRO HB2 H 1 2.150 0.020 . 2 . . . . 628 PRO HB2 . 16773 1 563 . 1 1 53 53 PRO HB3 H 1 1.970 0.020 . 2 . . . . 628 PRO HB3 . 16773 1 564 . 1 1 53 53 PRO HD2 H 1 3.503 0.020 . 2 . . . . 628 PRO HD2 . 16773 1 565 . 1 1 53 53 PRO HD3 H 1 3.419 0.020 . 2 . . . . 628 PRO HD3 . 16773 1 566 . 1 1 53 53 PRO HG2 H 1 2.028 0.009 . 2 . . . . 628 PRO HG2 . 16773 1 567 . 1 1 53 53 PRO HG3 H 1 1.886 0.010 . 2 . . . . 628 PRO HG3 . 16773 1 568 . 1 1 53 53 PRO C C 13 179.024 0.200 . 1 . . . . 628 PRO C . 16773 1 569 . 1 1 53 53 PRO CA C 13 62.445 0.200 . 1 . . . . 628 PRO CA . 16773 1 570 . 1 1 53 53 PRO CB C 13 33.370 0.200 . 1 . . . . 628 PRO CB . 16773 1 571 . 1 1 53 53 PRO CD C 13 49.309 0.200 . 1 . . . . 628 PRO CD . 16773 1 572 . 1 1 53 53 PRO CG C 13 26.660 0.200 . 1 . . . . 628 PRO CG . 16773 1 573 . 1 1 54 54 VAL H H 1 8.823 0.020 . 1 . . . . 629 VAL H . 16773 1 574 . 1 1 54 54 VAL HA H 1 4.509 0.010 . 1 . . . . 629 VAL HA . 16773 1 575 . 1 1 54 54 VAL HB H 1 2.082 0.009 . 1 . . . . 629 VAL HB . 16773 1 576 . 1 1 54 54 VAL HG11 H 1 0.856 0.007 . 2 . . . . 629 VAL QG1 . 16773 1 577 . 1 1 54 54 VAL HG12 H 1 0.856 0.007 . 2 . . . . 629 VAL QG1 . 16773 1 578 . 1 1 54 54 VAL HG13 H 1 0.856 0.007 . 2 . . . . 629 VAL QG1 . 16773 1 579 . 1 1 54 54 VAL HG21 H 1 0.877 0.007 . 2 . . . . 629 VAL QG2 . 16773 1 580 . 1 1 54 54 VAL HG22 H 1 0.877 0.007 . 2 . . . . 629 VAL QG2 . 16773 1 581 . 1 1 54 54 VAL HG23 H 1 0.877 0.007 . 2 . . . . 629 VAL QG2 . 16773 1 582 . 1 1 54 54 VAL C C 13 176.095 0.200 . 1 . . . . 629 VAL C . 16773 1 583 . 1 1 54 54 VAL CA C 13 61.090 0.200 . 1 . . . . 629 VAL CA . 16773 1 584 . 1 1 54 54 VAL CB C 13 33.687 0.200 . 1 . . . . 629 VAL CB . 16773 1 585 . 1 1 54 54 VAL CG1 C 13 19.188 0.200 . 1 . . . . 629 VAL CG1 . 16773 1 586 . 1 1 54 54 VAL CG2 C 13 23.093 0.200 . 1 . . . . 629 VAL CG2 . 16773 1 587 . 1 1 54 54 VAL N N 15 115.038 0.200 . 1 . . . . 629 VAL N . 16773 1 588 . 1 1 55 55 SER H H 1 8.564 0.020 . 1 . . . . 630 SER H . 16773 1 589 . 1 1 55 55 SER HA H 1 4.683 0.008 . 1 . . . . 630 SER HA . 16773 1 590 . 1 1 55 55 SER HB2 H 1 3.970 0.009 . 2 . . . . 630 SER HB2 . 16773 1 591 . 1 1 55 55 SER HB3 H 1 3.824 0.010 . 2 . . . . 630 SER HB3 . 16773 1 592 . 1 1 55 55 SER C C 13 173.845 0.200 . 1 . . . . 630 SER C . 16773 1 593 . 1 1 55 55 SER CA C 13 57.030 0.200 . 1 . . . . 630 SER CA . 16773 1 594 . 1 1 55 55 SER CB C 13 63.394 0.242 . 1 . . . . 630 SER CB . 16773 1 595 . 1 1 55 55 SER N N 15 118.366 0.200 . 1 . . . . 630 SER N . 16773 1 596 . 1 1 56 56 VAL H H 1 7.732 0.020 . 1 . . . . 631 VAL H . 16773 1 597 . 1 1 56 56 VAL HA H 1 4.150 0.009 . 1 . . . . 631 VAL HA . 16773 1 598 . 1 1 56 56 VAL HB H 1 1.580 0.020 . 1 . . . . 631 VAL HB . 16773 1 599 . 1 1 56 56 VAL HG11 H 1 0.427 0.020 . 2 . . . . 631 VAL QG1 . 16773 1 600 . 1 1 56 56 VAL HG12 H 1 0.427 0.020 . 2 . . . . 631 VAL QG1 . 16773 1 601 . 1 1 56 56 VAL HG13 H 1 0.427 0.020 . 2 . . . . 631 VAL QG1 . 16773 1 602 . 1 1 56 56 VAL HG21 H 1 0.528 0.007 . 2 . . . . 631 VAL QG2 . 16773 1 603 . 1 1 56 56 VAL HG22 H 1 0.528 0.007 . 2 . . . . 631 VAL QG2 . 16773 1 604 . 1 1 56 56 VAL HG23 H 1 0.528 0.007 . 2 . . . . 631 VAL QG2 . 16773 1 605 . 1 1 56 56 VAL CA C 13 61.218 0.200 . 1 . . . . 631 VAL CA . 16773 1 606 . 1 1 56 56 VAL CB C 13 35.506 0.200 . 1 . . . . 631 VAL CB . 16773 1 607 . 1 1 56 56 VAL CG1 C 13 20.836 0.200 . 1 . . . . 631 VAL CG1 . 16773 1 608 . 1 1 56 56 VAL CG2 C 13 21.038 0.200 . 1 . . . . 631 VAL CG2 . 16773 1 609 . 1 1 56 56 VAL N N 15 121.712 0.200 . 1 . . . . 631 VAL N . 16773 1 610 . 1 1 57 57 GLY H H 1 8.596 0.020 . 1 . . . . 632 GLY H . 16773 1 611 . 1 1 57 57 GLY HA2 H 1 3.789 0.006 . 2 . . . . 632 GLY HA2 . 16773 1 612 . 1 1 57 57 GLY HA3 H 1 3.789 0.006 . 2 . . . . 632 GLY HA3 . 16773 1 613 . 1 1 57 57 GLY C C 13 174.542 0.200 . 1 . . . . 632 GLY C . 16773 1 614 . 1 1 57 57 GLY CA C 13 47.583 0.200 . 1 . . . . 632 GLY CA . 16773 1 615 . 1 1 57 57 GLY N N 15 114.247 0.200 . 1 . . . . 632 GLY N . 16773 1 616 . 1 1 58 58 ALA H H 1 7.533 0.020 . 1 . . . . 633 ALA H . 16773 1 617 . 1 1 58 58 ALA HA H 1 4.274 0.020 . 1 . . . . 633 ALA HA . 16773 1 618 . 1 1 58 58 ALA HB1 H 1 1.304 0.020 . 1 . . . . 633 ALA QB . 16773 1 619 . 1 1 58 58 ALA HB2 H 1 1.304 0.020 . 1 . . . . 633 ALA QB . 16773 1 620 . 1 1 58 58 ALA HB3 H 1 1.304 0.020 . 1 . . . . 633 ALA QB . 16773 1 621 . 1 1 58 58 ALA C C 13 177.912 0.200 . 1 . . . . 633 ALA C . 16773 1 622 . 1 1 58 58 ALA CA C 13 52.545 0.200 . 1 . . . . 633 ALA CA . 16773 1 623 . 1 1 58 58 ALA CB C 13 20.012 0.200 . 1 . . . . 633 ALA CB . 16773 1 624 . 1 1 58 58 ALA N N 15 121.101 0.200 . 1 . . . . 633 ALA N . 16773 1 625 . 1 1 59 59 CYS H H 1 7.821 0.020 . 1 . . . . 634 CYS H . 16773 1 626 . 1 1 59 59 CYS HA H 1 4.294 0.020 . 1 . . . . 634 CYS HA . 16773 1 627 . 1 1 59 59 CYS HB2 H 1 3.013 0.009 . 2 . . . . 634 CYS HB2 . 16773 1 628 . 1 1 59 59 CYS CA C 13 55.457 0.200 . 1 . . . . 634 CYS CA . 16773 1 629 . 1 1 59 59 CYS CB C 13 43.796 0.200 . 1 . . . . 634 CYS CB . 16773 1 630 . 1 1 59 59 CYS N N 15 116.533 0.200 . 1 . . . . 634 CYS N . 16773 1 631 . 1 1 60 60 PRO HA H 1 4.750 0.020 . 1 . . . . 635 PRO HA . 16773 1 632 . 1 1 60 60 PRO HB2 H 1 2.582 0.010 . 2 . . . . 635 PRO HB2 . 16773 1 633 . 1 1 60 60 PRO HB3 H 1 1.943 0.009 . 2 . . . . 635 PRO HB3 . 16773 1 634 . 1 1 60 60 PRO HD2 H 1 3.950 0.020 . 2 . . . . 635 PRO HD2 . 16773 1 635 . 1 1 60 60 PRO HD3 H 1 3.396 0.020 . 2 . . . . 635 PRO HD3 . 16773 1 636 . 1 1 60 60 PRO HG2 H 1 2.118 0.010 . 2 . . . . 635 PRO HG2 . 16773 1 637 . 1 1 60 60 PRO HG3 H 1 2.047 0.010 . 2 . . . . 635 PRO HG3 . 16773 1 638 . 1 1 60 60 PRO CA C 13 61.928 0.200 . 1 . . . . 635 PRO CA . 16773 1 639 . 1 1 60 60 PRO CB C 13 31.514 0.200 . 1 . . . . 635 PRO CB . 16773 1 640 . 1 1 60 60 PRO CD C 13 50.604 0.200 . 1 . . . . 635 PRO CD . 16773 1 641 . 1 1 60 60 PRO CG C 13 28.602 0.200 . 1 . . . . 635 PRO CG . 16773 1 642 . 1 1 61 61 PRO HA H 1 4.529 0.010 . 1 . . . . 636 PRO HA . 16773 1 643 . 1 1 61 61 PRO HB2 H 1 2.369 0.010 . 2 . . . . 636 PRO HB2 . 16773 1 644 . 1 1 61 61 PRO HB3 H 1 2.005 0.010 . 2 . . . . 636 PRO HB3 . 16773 1 645 . 1 1 61 61 PRO HD2 H 1 3.819 0.010 . 2 . . . . 636 PRO HD2 . 16773 1 646 . 1 1 61 61 PRO HD3 H 1 3.730 0.010 . 2 . . . . 636 PRO HD3 . 16773 1 647 . 1 1 61 61 PRO HG2 H 1 2.065 0.010 . 2 . . . . 636 PRO HG2 . 16773 1 648 . 1 1 61 61 PRO C C 13 176.216 0.200 . 1 . . . . 636 PRO C . 16773 1 649 . 1 1 61 61 PRO CA C 13 64.323 0.200 . 1 . . . . 636 PRO CA . 16773 1 650 . 1 1 61 61 PRO CB C 13 32.392 0.200 . 1 . . . . 636 PRO CB . 16773 1 651 . 1 1 61 61 PRO CD C 13 51.251 0.200 . 1 . . . . 636 PRO CD . 16773 1 652 . 1 1 61 61 PRO CG C 13 27.512 0.200 . 1 . . . . 636 PRO CG . 16773 1 653 . 1 1 62 62 ASP H H 1 8.293 0.020 . 1 . . . . 637 ASP H . 16773 1 654 . 1 1 62 62 ASP HA H 1 4.474 0.010 . 1 . . . . 637 ASP HA . 16773 1 655 . 1 1 62 62 ASP HB2 H 1 2.884 0.020 . 2 . . . . 637 ASP HB2 . 16773 1 656 . 1 1 62 62 ASP HB3 H 1 2.744 0.009 . 2 . . . . 637 ASP HB3 . 16773 1 657 . 1 1 62 62 ASP C C 13 175.961 0.200 . 1 . . . . 637 ASP C . 16773 1 658 . 1 1 62 62 ASP CA C 13 53.711 0.200 . 1 . . . . 637 ASP CA . 16773 1 659 . 1 1 62 62 ASP CB C 13 40.383 0.200 . 1 . . . . 637 ASP CB . 16773 1 660 . 1 1 62 62 ASP N N 15 115.531 0.200 . 1 . . . . 637 ASP N . 16773 1 661 . 1 1 63 63 SER H H 1 7.938 0.020 . 1 . . . . 638 SER H . 16773 1 662 . 1 1 63 63 SER HA H 1 4.518 0.015 . 1 . . . . 638 SER HA . 16773 1 663 . 1 1 63 63 SER HB2 H 1 3.752 0.020 . 2 . . . . 638 SER HB2 . 16773 1 664 . 1 1 63 63 SER C C 13 174.940 0.200 . 1 . . . . 638 SER C . 16773 1 665 . 1 1 63 63 SER CA C 13 58.869 0.200 . 1 . . . . 638 SER CA . 16773 1 666 . 1 1 63 63 SER CB C 13 65.482 0.200 . 1 . . . . 638 SER CB . 16773 1 667 . 1 1 63 63 SER N N 15 116.272 0.200 . 1 . . . . 638 SER N . 16773 1 668 . 1 1 64 64 GLY H H 1 9.488 0.020 . 1 . . . . 639 GLY H . 16773 1 669 . 1 1 64 64 GLY HA2 H 1 4.200 0.020 . 2 . . . . 639 GLY HA2 . 16773 1 670 . 1 1 64 64 GLY HA3 H 1 2.511 0.020 . 2 . . . . 639 GLY HA3 . 16773 1 671 . 1 1 64 64 GLY C C 13 171.541 0.200 . 1 . . . . 639 GLY C . 16773 1 672 . 1 1 64 64 GLY CA C 13 46.076 0.200 . 1 . . . . 639 GLY CA . 16773 1 673 . 1 1 64 64 GLY N N 15 114.692 0.200 . 1 . . . . 639 GLY N . 16773 1 674 . 1 1 65 65 ALA H H 1 7.529 0.020 . 1 . . . . 640 ALA H . 16773 1 675 . 1 1 65 65 ALA HA H 1 5.391 0.020 . 1 . . . . 640 ALA HA . 16773 1 676 . 1 1 65 65 ALA HB1 H 1 1.481 0.020 . 1 . . . . 640 ALA QB . 16773 1 677 . 1 1 65 65 ALA HB2 H 1 1.481 0.020 . 1 . . . . 640 ALA QB . 16773 1 678 . 1 1 65 65 ALA HB3 H 1 1.481 0.020 . 1 . . . . 640 ALA QB . 16773 1 679 . 1 1 65 65 ALA C C 13 174.630 0.200 . 1 . . . . 640 ALA C . 16773 1 680 . 1 1 65 65 ALA CA C 13 51.566 0.200 . 1 . . . . 640 ALA CA . 16773 1 681 . 1 1 65 65 ALA CB C 13 23.388 0.200 . 1 . . . . 640 ALA CB . 16773 1 682 . 1 1 65 65 ALA N N 15 118.107 0.200 . 1 . . . . 640 ALA N . 16773 1 683 . 1 1 66 66 CYS H H 1 9.495 0.020 . 1 . . . . 641 CYS H . 16773 1 684 . 1 1 66 66 CYS HA H 1 5.338 0.020 . 1 . . . . 641 CYS HA . 16773 1 685 . 1 1 66 66 CYS HB2 H 1 3.397 0.020 . 2 . . . . 641 CYS HB2 . 16773 1 686 . 1 1 66 66 CYS HB3 H 1 3.003 0.020 . 2 . . . . 641 CYS HB3 . 16773 1 687 . 1 1 66 66 CYS C C 13 171.630 0.200 . 1 . . . . 641 CYS C . 16773 1 688 . 1 1 66 66 CYS CA C 13 54.272 0.200 . 1 . . . . 641 CYS CA . 16773 1 689 . 1 1 66 66 CYS CB C 13 46.721 0.200 . 1 . . . . 641 CYS CB . 16773 1 690 . 1 1 66 66 CYS N N 15 122.908 0.200 . 1 . . . . 641 CYS N . 16773 1 691 . 1 1 67 67 GLN H H 1 8.989 0.020 . 1 . . . . 642 GLN H . 16773 1 692 . 1 1 67 67 GLN HA H 1 4.990 0.015 . 1 . . . . 642 GLN HA . 16773 1 693 . 1 1 67 67 GLN HB2 H 1 1.663 0.020 . 2 . . . . 642 GLN HB2 . 16773 1 694 . 1 1 67 67 GLN HB3 H 1 0.999 0.020 . 2 . . . . 642 GLN HB3 . 16773 1 695 . 1 1 67 67 GLN HE21 H 1 6.449 0.020 . 2 . . . . 642 GLN HE21 . 16773 1 696 . 1 1 67 67 GLN HG2 H 1 2.551 0.020 . 2 . . . . 642 GLN HG2 . 16773 1 697 . 1 1 67 67 GLN C C 13 173.447 0.200 . 1 . . . . 642 GLN C . 16773 1 698 . 1 1 67 67 GLN CA C 13 54.197 0.200 . 1 . . . . 642 GLN CA . 16773 1 699 . 1 1 67 67 GLN CB C 13 33.771 0.045 . 1 . . . . 642 GLN CB . 16773 1 700 . 1 1 67 67 GLN CG C 13 34.102 0.200 . 1 . . . . 642 GLN CG . 16773 1 701 . 1 1 67 67 GLN N N 15 130.692 0.200 . 1 . . . . 642 GLN N . 16773 1 702 . 1 1 67 67 GLN NE2 N 15 106.110 0.200 . 1 . . . . 642 GLN NE2 . 16773 1 703 . 1 1 68 68 VAL H H 1 9.340 0.020 . 1 . . . . 643 VAL H . 16773 1 704 . 1 1 68 68 VAL HA H 1 4.966 0.013 . 1 . . . . 643 VAL HA . 16773 1 705 . 1 1 68 68 VAL HB H 1 2.130 0.020 . 1 . . . . 643 VAL HB . 16773 1 706 . 1 1 68 68 VAL HG11 H 1 0.876 0.020 . 2 . . . . 643 VAL QG1 . 16773 1 707 . 1 1 68 68 VAL HG12 H 1 0.876 0.020 . 2 . . . . 643 VAL QG1 . 16773 1 708 . 1 1 68 68 VAL HG13 H 1 0.876 0.020 . 2 . . . . 643 VAL QG1 . 16773 1 709 . 1 1 68 68 VAL HG21 H 1 0.842 0.020 . 2 . . . . 643 VAL QG2 . 16773 1 710 . 1 1 68 68 VAL HG22 H 1 0.842 0.020 . 2 . . . . 643 VAL QG2 . 16773 1 711 . 1 1 68 68 VAL HG23 H 1 0.842 0.020 . 2 . . . . 643 VAL QG2 . 16773 1 712 . 1 1 68 68 VAL C C 13 177.242 0.200 . 1 . . . . 643 VAL C . 16773 1 713 . 1 1 68 68 VAL CA C 13 61.090 0.200 . 1 . . . . 643 VAL CA . 16773 1 714 . 1 1 68 68 VAL CB C 13 35.881 0.200 . 1 . . . . 643 VAL CB . 16773 1 715 . 1 1 68 68 VAL CG1 C 13 21.807 0.200 . 1 . . . . 643 VAL CG1 . 16773 1 716 . 1 1 68 68 VAL CG2 C 13 20.836 0.200 . 1 . . . . 643 VAL CG2 . 16773 1 717 . 1 1 68 68 VAL N N 15 126.805 0.200 . 1 . . . . 643 VAL N . 16773 1 718 . 1 1 69 69 SER H H 1 9.455 0.020 . 1 . . . . 644 SER H . 16773 1 719 . 1 1 69 69 SER HA H 1 4.901 0.010 . 1 . . . . 644 SER HA . 16773 1 720 . 1 1 69 69 SER HB2 H 1 4.413 0.020 . 2 . . . . 644 SER HB2 . 16773 1 721 . 1 1 69 69 SER C C 13 176.465 0.200 . 1 . . . . 644 SER C . 16773 1 722 . 1 1 69 69 SER CA C 13 58.369 0.200 . 1 . . . . 644 SER CA . 16773 1 723 . 1 1 69 69 SER CB C 13 64.193 0.200 . 1 . . . . 644 SER CB . 16773 1 724 . 1 1 69 69 SER N N 15 121.400 0.200 . 1 . . . . 644 SER N . 16773 1 725 . 1 1 70 70 ARG H H 1 8.308 0.020 . 1 . . . . 645 ARG H . 16773 1 726 . 1 1 70 70 ARG HA H 1 4.125 0.020 . 1 . . . . 645 ARG HA . 16773 1 727 . 1 1 70 70 ARG HB2 H 1 2.067 0.015 . 2 . . . . 645 ARG HB2 . 16773 1 728 . 1 1 70 70 ARG HB3 H 1 1.494 0.015 . 2 . . . . 645 ARG HB3 . 16773 1 729 . 1 1 70 70 ARG HD2 H 1 3.231 0.020 . 2 . . . . 645 ARG HD2 . 16773 1 730 . 1 1 70 70 ARG HD3 H 1 3.040 0.009 . 2 . . . . 645 ARG HD3 . 16773 1 731 . 1 1 70 70 ARG HG2 H 1 1.635 0.015 . 2 . . . . 645 ARG HG2 . 16773 1 732 . 1 1 70 70 ARG HG3 H 1 1.527 0.020 . 2 . . . . 645 ARG HG3 . 16773 1 733 . 1 1 70 70 ARG C C 13 177.560 0.200 . 1 . . . . 645 ARG C . 16773 1 734 . 1 1 70 70 ARG CA C 13 59.380 0.200 . 1 . . . . 645 ARG CA . 16773 1 735 . 1 1 70 70 ARG CB C 13 30.986 0.200 . 1 . . . . 645 ARG CB . 16773 1 736 . 1 1 70 70 ARG CD C 13 43.955 0.200 . 1 . . . . 645 ARG CD . 16773 1 737 . 1 1 70 70 ARG CG C 13 28.925 0.200 . 1 . . . . 645 ARG CG . 16773 1 738 . 1 1 70 70 ARG N N 15 126.994 0.200 . 1 . . . . 645 ARG N . 16773 1 739 . 1 1 71 71 SER H H 1 8.364 0.020 . 1 . . . . 646 SER H . 16773 1 740 . 1 1 71 71 SER HA H 1 4.386 0.020 . 1 . . . . 646 SER HA . 16773 1 741 . 1 1 71 71 SER HB2 H 1 3.926 0.020 . 2 . . . . 646 SER HB2 . 16773 1 742 . 1 1 71 71 SER HB3 H 1 3.876 0.020 . 2 . . . . 646 SER HB3 . 16773 1 743 . 1 1 71 71 SER C C 13 175.901 0.200 . 1 . . . . 646 SER C . 16773 1 744 . 1 1 71 71 SER CA C 13 59.987 0.200 . 1 . . . . 646 SER CA . 16773 1 745 . 1 1 71 71 SER CB C 13 63.608 0.032 . 1 . . . . 646 SER CB . 16773 1 746 . 1 1 71 71 SER N N 15 112.722 0.200 . 1 . . . . 646 SER N . 16773 1 747 . 1 1 72 72 ASP H H 1 7.684 0.005 . 1 . . . . 647 ASP H . 16773 1 748 . 1 1 72 72 ASP HA H 1 4.749 0.020 . 1 . . . . 647 ASP HA . 16773 1 749 . 1 1 72 72 ASP HB2 H 1 2.961 0.020 . 2 . . . . 647 ASP HB2 . 16773 1 750 . 1 1 72 72 ASP HB3 H 1 2.612 0.020 . 2 . . . . 647 ASP HB3 . 16773 1 751 . 1 1 72 72 ASP C C 13 176.351 0.200 . 1 . . . . 647 ASP C . 16773 1 752 . 1 1 72 72 ASP CA C 13 53.633 0.200 . 1 . . . . 647 ASP CA . 16773 1 753 . 1 1 72 72 ASP CB C 13 42.184 0.200 . 1 . . . . 647 ASP CB . 16773 1 754 . 1 1 72 72 ASP N N 15 118.021 0.200 . 1 . . . . 647 ASP N . 16773 1 755 . 1 1 73 73 ARG H H 1 7.868 0.020 . 1 . . . . 648 ARG H . 16773 1 756 . 1 1 73 73 ARG HA H 1 4.115 0.020 . 1 . . . . 648 ARG HA . 16773 1 757 . 1 1 73 73 ARG HB2 H 1 1.655 0.020 . 2 . . . . 648 ARG HB2 . 16773 1 758 . 1 1 73 73 ARG HB3 H 1 1.556 0.020 . 2 . . . . 648 ARG HB3 . 16773 1 759 . 1 1 73 73 ARG HD2 H 1 3.192 0.020 . 2 . . . . 648 ARG HD2 . 16773 1 760 . 1 1 73 73 ARG HG2 H 1 2.026 0.020 . 2 . . . . 648 ARG HG2 . 16773 1 761 . 1 1 73 73 ARG HG3 H 1 1.999 0.010 . 2 . . . . 648 ARG HG3 . 16773 1 762 . 1 1 73 73 ARG C C 13 175.826 0.200 . 1 . . . . 648 ARG C . 16773 1 763 . 1 1 73 73 ARG CA C 13 57.061 0.200 . 1 . . . . 648 ARG CA . 16773 1 764 . 1 1 73 73 ARG CB C 13 26.984 0.200 . 1 . . . . 648 ARG CB . 16773 1 765 . 1 1 73 73 ARG CD C 13 43.031 0.200 . 1 . . . . 648 ARG CD . 16773 1 766 . 1 1 73 73 ARG CG C 13 26.484 0.200 . 1 . . . . 648 ARG CG . 16773 1 767 . 1 1 73 73 ARG N N 15 114.194 0.200 . 1 . . . . 648 ARG N . 16773 1 768 . 1 1 74 74 LYS H H 1 7.610 0.020 . 1 . . . . 649 LYS H . 16773 1 769 . 1 1 74 74 LYS HA H 1 4.030 0.015 . 1 . . . . 649 LYS HA . 16773 1 770 . 1 1 74 74 LYS HB2 H 1 1.536 0.020 . 2 . . . . 649 LYS HB2 . 16773 1 771 . 1 1 74 74 LYS HB3 H 1 1.213 0.015 . 2 . . . . 649 LYS HB3 . 16773 1 772 . 1 1 74 74 LYS HD2 H 1 1.717 0.015 . 2 . . . . 649 LYS HD2 . 16773 1 773 . 1 1 74 74 LYS HE2 H 1 3.024 0.020 . 2 . . . . 649 LYS HE2 . 16773 1 774 . 1 1 74 74 LYS HE3 H 1 2.936 0.020 . 2 . . . . 649 LYS HE3 . 16773 1 775 . 1 1 74 74 LYS HG2 H 1 1.185 0.020 . 2 . . . . 649 LYS HG2 . 16773 1 776 . 1 1 74 74 LYS HG3 H 1 1.016 0.015 . 2 . . . . 649 LYS HG3 . 16773 1 777 . 1 1 74 74 LYS C C 13 174.418 0.200 . 1 . . . . 649 LYS C . 16773 1 778 . 1 1 74 74 LYS CA C 13 57.191 0.200 . 1 . . . . 649 LYS CA . 16773 1 779 . 1 1 74 74 LYS CB C 13 33.968 0.200 . 1 . . . . 649 LYS CB . 16773 1 780 . 1 1 74 74 LYS CD C 13 29.362 0.200 . 1 . . . . 649 LYS CD . 16773 1 781 . 1 1 74 74 LYS CE C 13 42.799 0.200 . 1 . . . . 649 LYS CE . 16773 1 782 . 1 1 74 74 LYS CG C 13 25.663 0.200 . 1 . . . . 649 LYS CG . 16773 1 783 . 1 1 74 74 LYS N N 15 120.902 0.200 . 1 . . . . 649 LYS N . 16773 1 784 . 1 1 75 75 SER H H 1 7.443 0.020 . 1 . . . . 650 SER H . 16773 1 785 . 1 1 75 75 SER HA H 1 5.643 0.020 . 1 . . . . 650 SER HA . 16773 1 786 . 1 1 75 75 SER HB2 H 1 3.729 0.020 . 2 . . . . 650 SER HB2 . 16773 1 787 . 1 1 75 75 SER HB3 H 1 3.651 0.020 . 2 . . . . 650 SER HB3 . 16773 1 788 . 1 1 75 75 SER C C 13 173.324 0.200 . 1 . . . . 650 SER C . 16773 1 789 . 1 1 75 75 SER CA C 13 56.162 0.200 . 1 . . . . 650 SER CA . 16773 1 790 . 1 1 75 75 SER CB C 13 68.425 0.200 . 1 . . . . 650 SER CB . 16773 1 791 . 1 1 75 75 SER N N 15 113.178 0.200 . 1 . . . . 650 SER N . 16773 1 792 . 1 1 76 76 TRP H H 1 9.176 0.020 . 1 . . . . 651 TRP H . 16773 1 793 . 1 1 76 76 TRP HA H 1 4.571 0.020 . 1 . . . . 651 TRP HA . 16773 1 794 . 1 1 76 76 TRP HB2 H 1 3.140 0.020 . 2 . . . . 651 TRP HB2 . 16773 1 795 . 1 1 76 76 TRP HB3 H 1 2.570 0.020 . 2 . . . . 651 TRP HB3 . 16773 1 796 . 1 1 76 76 TRP HD1 H 1 6.863 0.020 . 1 . . . . 651 TRP HD1 . 16773 1 797 . 1 1 76 76 TRP HE1 H 1 9.806 0.020 . 1 . . . . 651 TRP HE1 . 16773 1 798 . 1 1 76 76 TRP HE3 H 1 7.339 0.020 . 1 . . . . 651 TRP HE3 . 16773 1 799 . 1 1 76 76 TRP HH2 H 1 7.318 0.020 . 1 . . . . 651 TRP HH2 . 16773 1 800 . 1 1 76 76 TRP HZ2 H 1 7.465 0.020 . 1 . . . . 651 TRP HZ2 . 16773 1 801 . 1 1 76 76 TRP HZ3 H 1 6.724 0.020 . 1 . . . . 651 TRP HZ3 . 16773 1 802 . 1 1 76 76 TRP C C 13 174.312 0.200 . 1 . . . . 651 TRP C . 16773 1 803 . 1 1 76 76 TRP CA C 13 59.340 0.200 . 1 . . . . 651 TRP CA . 16773 1 804 . 1 1 76 76 TRP CB C 13 33.405 0.200 . 1 . . . . 651 TRP CB . 16773 1 805 . 1 1 76 76 TRP CD1 C 13 125.318 0.200 . 1 . . . . 651 TRP CD1 . 16773 1 806 . 1 1 76 76 TRP CE3 C 13 122.729 0.200 . 1 . . . . 651 TRP CE3 . 16773 1 807 . 1 1 76 76 TRP CH2 C 13 124.282 0.200 . 1 . . . . 651 TRP CH2 . 16773 1 808 . 1 1 76 76 TRP CZ2 C 13 114.446 0.200 . 1 . . . . 651 TRP CZ2 . 16773 1 809 . 1 1 76 76 TRP CZ3 C 13 120.400 0.200 . 1 . . . . 651 TRP CZ3 . 16773 1 810 . 1 1 76 76 TRP N N 15 118.924 0.200 . 1 . . . . 651 TRP N . 16773 1 811 . 1 1 76 76 TRP NE1 N 15 127.489 0.200 . 1 . . . . 651 TRP NE1 . 16773 1 812 . 1 1 77 77 ASN H H 1 8.660 0.020 . 1 . . . . 652 ASN H . 16773 1 813 . 1 1 77 77 ASN HA H 1 4.903 0.020 . 1 . . . . 652 ASN HA . 16773 1 814 . 1 1 77 77 ASN HB2 H 1 3.502 0.020 . 2 . . . . 652 ASN HB2 . 16773 1 815 . 1 1 77 77 ASN HB3 H 1 2.589 0.020 . 2 . . . . 652 ASN HB3 . 16773 1 816 . 1 1 77 77 ASN HD21 H 1 7.643 0.020 . 2 . . . . 652 ASN HD21 . 16773 1 817 . 1 1 77 77 ASN HD22 H 1 6.287 0.020 . 2 . . . . 652 ASN HD22 . 16773 1 818 . 1 1 77 77 ASN C C 13 175.766 0.200 . 1 . . . . 652 ASN C . 16773 1 819 . 1 1 77 77 ASN CA C 13 53.226 0.200 . 1 . . . . 652 ASN CA . 16773 1 820 . 1 1 77 77 ASN CB C 13 39.069 0.123 . 1 . . . . 652 ASN CB . 16773 1 821 . 1 1 77 77 ASN N N 15 121.829 0.200 . 1 . . . . 652 ASN N . 16773 1 822 . 1 1 77 77 ASN ND2 N 15 109.514 0.200 . 1 . . . . 652 ASN ND2 . 16773 1 823 . 1 1 78 78 LEU H H 1 9.044 0.001 . 1 . . . . 653 LEU H . 16773 1 824 . 1 1 78 78 LEU HA H 1 4.155 0.020 . 1 . . . . 653 LEU HA . 16773 1 825 . 1 1 78 78 LEU HB2 H 1 1.618 0.010 . 2 . . . . 653 LEU HB2 . 16773 1 826 . 1 1 78 78 LEU HB3 H 1 1.429 0.020 . 2 . . . . 653 LEU HB3 . 16773 1 827 . 1 1 78 78 LEU HD11 H 1 0.071 0.020 . 2 . . . . 653 LEU QD1 . 16773 1 828 . 1 1 78 78 LEU HD12 H 1 0.071 0.020 . 2 . . . . 653 LEU QD1 . 16773 1 829 . 1 1 78 78 LEU HD13 H 1 0.071 0.020 . 2 . . . . 653 LEU QD1 . 16773 1 830 . 1 1 78 78 LEU HD21 H 1 0.542 0.020 . 2 . . . . 653 LEU QD2 . 16773 1 831 . 1 1 78 78 LEU HD22 H 1 0.542 0.020 . 2 . . . . 653 LEU QD2 . 16773 1 832 . 1 1 78 78 LEU HD23 H 1 0.542 0.020 . 2 . . . . 653 LEU QD2 . 16773 1 833 . 1 1 78 78 LEU HG H 1 1.267 0.020 . 1 . . . . 653 LEU HG . 16773 1 834 . 1 1 78 78 LEU C C 13 175.777 0.200 . 1 . . . . 653 LEU C . 16773 1 835 . 1 1 78 78 LEU CA C 13 54.486 0.200 . 1 . . . . 653 LEU CA . 16773 1 836 . 1 1 78 78 LEU CB C 13 40.573 0.200 . 1 . . . . 653 LEU CB . 16773 1 837 . 1 1 78 78 LEU CD1 C 13 21.807 0.200 . 1 . . . . 653 LEU CD1 . 16773 1 838 . 1 1 78 78 LEU CD2 C 13 25.042 0.200 . 1 . . . . 653 LEU CD2 . 16773 1 839 . 1 1 78 78 LEU CG C 13 27.307 0.200 . 1 . . . . 653 LEU CG . 16773 1 840 . 1 1 78 78 LEU N N 15 127.448 0.200 . 1 . . . . 653 LEU N . 16773 1 841 . 1 1 79 79 GLY H H 1 7.957 0.020 . 1 . . . . 654 GLY H . 16773 1 842 . 1 1 79 79 GLY HA2 H 1 4.335 0.020 . 2 . . . . 654 GLY HA2 . 16773 1 843 . 1 1 79 79 GLY HA3 H 1 3.064 0.020 . 2 . . . . 654 GLY HA3 . 16773 1 844 . 1 1 79 79 GLY C C 13 172.989 0.200 . 1 . . . . 654 GLY C . 16773 1 845 . 1 1 79 79 GLY CA C 13 44.952 0.200 . 1 . . . . 654 GLY CA . 16773 1 846 . 1 1 79 79 GLY N N 15 106.009 0.200 . 1 . . . . 654 GLY N . 16773 1 847 . 1 1 80 80 ARG H H 1 8.980 0.020 . 1 . . . . 655 ARG H . 16773 1 848 . 1 1 80 80 ARG HA H 1 4.538 0.020 . 1 . . . . 655 ARG HA . 16773 1 849 . 1 1 80 80 ARG HB2 H 1 1.941 0.020 . 2 . . . . 655 ARG HB2 . 16773 1 850 . 1 1 80 80 ARG HB3 H 1 1.860 0.020 . 2 . . . . 655 ARG HB3 . 16773 1 851 . 1 1 80 80 ARG HD2 H 1 3.367 0.009 . 2 . . . . 655 ARG HD2 . 16773 1 852 . 1 1 80 80 ARG C C 13 177.365 0.200 . 1 . . . . 655 ARG C . 16773 1 853 . 1 1 80 80 ARG CA C 13 56.698 0.200 . 1 . . . . 655 ARG CA . 16773 1 854 . 1 1 80 80 ARG CB C 13 31.210 0.200 . 1 . . . . 655 ARG CB . 16773 1 855 . 1 1 80 80 ARG CD C 13 44.572 0.200 . 1 . . . . 655 ARG CD . 16773 1 856 . 1 1 80 80 ARG N N 15 125.941 0.200 . 1 . . . . 655 ARG N . 16773 1 857 . 1 1 81 81 SER H H 1 8.106 0.020 . 1 . . . . 656 SER H . 16773 1 858 . 1 1 81 81 SER HA H 1 2.861 0.020 . 1 . . . . 656 SER HA . 16773 1 859 . 1 1 81 81 SER HB2 H 1 3.152 0.020 . 2 . . . . 656 SER HB2 . 16773 1 860 . 1 1 81 81 SER HB3 H 1 3.082 0.020 . 2 . . . . 656 SER HB3 . 16773 1 861 . 1 1 81 81 SER C C 13 173.379 0.200 . 1 . . . . 656 SER C . 16773 1 862 . 1 1 81 81 SER CA C 13 60.018 0.200 . 1 . . . . 656 SER CA . 16773 1 863 . 1 1 81 81 SER CB C 13 64.116 0.200 . 1 . . . . 656 SER CB . 16773 1 864 . 1 1 81 81 SER N N 15 118.358 0.200 . 1 . . . . 656 SER N . 16773 1 865 . 1 1 82 82 ASN H H 1 7.285 0.020 . 1 . . . . 657 ASN H . 16773 1 866 . 1 1 82 82 ASN HA H 1 4.692 0.020 . 1 . . . . 657 ASN HA . 16773 1 867 . 1 1 82 82 ASN HB2 H 1 3.147 0.020 . 2 . . . . 657 ASN HB2 . 16773 1 868 . 1 1 82 82 ASN HB3 H 1 2.995 0.020 . 2 . . . . 657 ASN HB3 . 16773 1 869 . 1 1 82 82 ASN HD21 H 1 7.579 0.020 . 2 . . . . 657 ASN HD21 . 16773 1 870 . 1 1 82 82 ASN HD22 H 1 6.733 0.020 . 2 . . . . 657 ASN HD22 . 16773 1 871 . 1 1 82 82 ASN C C 13 171.938 0.200 . 1 . . . . 657 ASN C . 16773 1 872 . 1 1 82 82 ASN CA C 13 53.787 0.200 . 1 . . . . 657 ASN CA . 16773 1 873 . 1 1 82 82 ASN CB C 13 41.509 0.200 . 1 . . . . 657 ASN CB . 16773 1 874 . 1 1 82 82 ASN N N 15 115.702 0.200 . 1 . . . . 657 ASN N . 16773 1 875 . 1 1 82 82 ASN ND2 N 15 113.211 0.200 . 1 . . . . 657 ASN ND2 . 16773 1 876 . 1 1 83 83 ALA H H 1 8.869 0.020 . 1 . . . . 658 ALA H . 16773 1 877 . 1 1 83 83 ALA HA H 1 5.083 0.020 . 1 . . . . 658 ALA HA . 16773 1 878 . 1 1 83 83 ALA HB1 H 1 1.535 0.006 . 1 . . . . 658 ALA QB . 16773 1 879 . 1 1 83 83 ALA HB2 H 1 1.535 0.006 . 1 . . . . 658 ALA QB . 16773 1 880 . 1 1 83 83 ALA HB3 H 1 1.535 0.006 . 1 . . . . 658 ALA QB . 16773 1 881 . 1 1 83 83 ALA C C 13 177.162 0.200 . 1 . . . . 658 ALA C . 16773 1 882 . 1 1 83 83 ALA CA C 13 50.774 0.200 . 1 . . . . 658 ALA CA . 16773 1 883 . 1 1 83 83 ALA CB C 13 20.189 0.200 . 1 . . . . 658 ALA CB . 16773 1 884 . 1 1 83 83 ALA N N 15 121.540 0.200 . 1 . . . . 658 ALA N . 16773 1 885 . 1 1 84 84 LYS H H 1 8.367 0.020 . 1 . . . . 659 LYS H . 16773 1 886 . 1 1 84 84 LYS HA H 1 4.789 0.020 . 1 . . . . 659 LYS HA . 16773 1 887 . 1 1 84 84 LYS HB2 H 1 1.936 0.020 . 2 . . . . 659 LYS HB2 . 16773 1 888 . 1 1 84 84 LYS HB3 H 1 1.863 0.015 . 2 . . . . 659 LYS HB3 . 16773 1 889 . 1 1 84 84 LYS HD2 H 1 1.625 0.020 . 2 . . . . 659 LYS HD2 . 16773 1 890 . 1 1 84 84 LYS HD3 H 1 1.559 0.010 . 2 . . . . 659 LYS HD3 . 16773 1 891 . 1 1 84 84 LYS HE2 H 1 3.118 0.020 . 2 . . . . 659 LYS HE2 . 16773 1 892 . 1 1 84 84 LYS HE3 H 1 3.118 0.020 . 2 . . . . 659 LYS HE3 . 16773 1 893 . 1 1 84 84 LYS HG2 H 1 1.684 0.020 . 2 . . . . 659 LYS HG2 . 16773 1 894 . 1 1 84 84 LYS C C 13 175.841 0.200 . 1 . . . . 659 LYS C . 16773 1 895 . 1 1 84 84 LYS CA C 13 56.034 0.200 . 1 . . . . 659 LYS CA . 16773 1 896 . 1 1 84 84 LYS CB C 13 31.779 0.200 . 1 . . . . 659 LYS CB . 16773 1 897 . 1 1 84 84 LYS CD C 13 25.042 0.200 . 1 . . . . 659 LYS CD . 16773 1 898 . 1 1 84 84 LYS CE C 13 42.838 0.200 . 1 . . . . 659 LYS CE . 16773 1 899 . 1 1 84 84 LYS N N 15 122.117 0.200 . 1 . . . . 659 LYS N . 16773 1 900 . 1 1 85 85 LEU H H 1 7.739 0.020 . 1 . . . . 660 LEU H . 16773 1 901 . 1 1 85 85 LEU HA H 1 4.781 0.009 . 1 . . . . 660 LEU HA . 16773 1 902 . 1 1 85 85 LEU HB2 H 1 1.434 0.020 . 2 . . . . 660 LEU HB2 . 16773 1 903 . 1 1 85 85 LEU HB3 H 1 1.215 0.010 . 2 . . . . 660 LEU HB3 . 16773 1 904 . 1 1 85 85 LEU HD11 H 1 0.641 0.020 . 2 . . . . 660 LEU QD1 . 16773 1 905 . 1 1 85 85 LEU HD12 H 1 0.641 0.020 . 2 . . . . 660 LEU QD1 . 16773 1 906 . 1 1 85 85 LEU HD13 H 1 0.641 0.020 . 2 . . . . 660 LEU QD1 . 16773 1 907 . 1 1 85 85 LEU HD21 H 1 0.528 0.009 . 2 . . . . 660 LEU QD2 . 16773 1 908 . 1 1 85 85 LEU HD22 H 1 0.528 0.009 . 2 . . . . 660 LEU QD2 . 16773 1 909 . 1 1 85 85 LEU HD23 H 1 0.528 0.009 . 2 . . . . 660 LEU QD2 . 16773 1 910 . 1 1 85 85 LEU HG H 1 1.444 0.020 . 1 . . . . 660 LEU HG . 16773 1 911 . 1 1 85 85 LEU C C 13 176.359 0.200 . 1 . . . . 660 LEU C . 16773 1 912 . 1 1 85 85 LEU CA C 13 54.451 0.200 . 1 . . . . 660 LEU CA . 16773 1 913 . 1 1 85 85 LEU CB C 13 44.604 0.200 . 1 . . . . 660 LEU CB . 16773 1 914 . 1 1 85 85 LEU CD1 C 13 24.072 0.200 . 1 . . . . 660 LEU CD1 . 16773 1 915 . 1 1 85 85 LEU CD2 C 13 26.074 0.200 . 1 . . . . 660 LEU CD2 . 16773 1 916 . 1 1 85 85 LEU CG C 13 27.661 0.200 . 1 . . . . 660 LEU CG . 16773 1 917 . 1 1 85 85 LEU N N 15 125.272 0.200 . 1 . . . . 660 LEU N . 16773 1 918 . 1 1 86 86 SER H H 1 8.775 0.020 . 1 . . . . 661 SER H . 16773 1 919 . 1 1 86 86 SER HA H 1 5.404 0.009 . 1 . . . . 661 SER HA . 16773 1 920 . 1 1 86 86 SER HB2 H 1 3.852 0.006 . 2 . . . . 661 SER HB2 . 16773 1 921 . 1 1 86 86 SER C C 13 173.184 0.200 . 1 . . . . 661 SER C . 16773 1 922 . 1 1 86 86 SER CA C 13 57.516 0.200 . 1 . . . . 661 SER CA . 16773 1 923 . 1 1 86 86 SER CB C 13 66.551 0.200 . 1 . . . . 661 SER CB . 16773 1 924 . 1 1 86 86 SER N N 15 115.433 0.200 . 1 . . . . 661 SER N . 16773 1 925 . 1 1 87 87 TYR H H 1 9.119 0.020 . 1 . . . . 662 TYR H . 16773 1 926 . 1 1 87 87 TYR HA H 1 5.435 0.020 . 1 . . . . 662 TYR HA . 16773 1 927 . 1 1 87 87 TYR HB2 H 1 2.905 0.020 . 2 . . . . 662 TYR HB2 . 16773 1 928 . 1 1 87 87 TYR HB3 H 1 2.675 0.020 . 2 . . . . 662 TYR HB3 . 16773 1 929 . 1 1 87 87 TYR HD1 H 1 6.808 0.020 . 1 . . . . 662 TYR HD1 . 16773 1 930 . 1 1 87 87 TYR HD2 H 1 6.808 0.020 . 1 . . . . 662 TYR HD2 . 16773 1 931 . 1 1 87 87 TYR HE1 H 1 6.596 0.020 . 1 . . . . 662 TYR HE1 . 16773 1 932 . 1 1 87 87 TYR HE2 H 1 6.596 0.020 . 1 . . . . 662 TYR HE2 . 16773 1 933 . 1 1 87 87 TYR C C 13 174.595 0.200 . 1 . . . . 662 TYR C . 16773 1 934 . 1 1 87 87 TYR CA C 13 56.826 0.200 . 1 . . . . 662 TYR CA . 16773 1 935 . 1 1 87 87 TYR CB C 13 42.515 0.200 . 1 . . . . 662 TYR CB . 16773 1 936 . 1 1 87 87 TYR CD1 C 13 133.859 0.200 . 1 . . . . 662 TYR CD1 . 16773 1 937 . 1 1 87 87 TYR CE1 C 13 118.329 0.200 . 1 . . . . 662 TYR CE1 . 16773 1 938 . 1 1 87 87 TYR N N 15 124.724 0.200 . 1 . . . . 662 TYR N . 16773 1 939 . 1 1 88 88 TYR H H 1 8.251 0.020 . 1 . . . . 663 TYR H . 16773 1 940 . 1 1 88 88 TYR HA H 1 4.465 0.020 . 1 . . . . 663 TYR HA . 16773 1 941 . 1 1 88 88 TYR HB2 H 1 2.901 0.020 . 2 . . . . 663 TYR HB2 . 16773 1 942 . 1 1 88 88 TYR HB3 H 1 2.821 0.020 . 2 . . . . 663 TYR HB3 . 16773 1 943 . 1 1 88 88 TYR HD1 H 1 6.952 0.001 . 1 . . . . 663 TYR HD1 . 16773 1 944 . 1 1 88 88 TYR HD2 H 1 6.952 0.001 . 1 . . . . 663 TYR HD2 . 16773 1 945 . 1 1 88 88 TYR HE1 H 1 6.692 0.028 . 1 . . . . 663 TYR HE1 . 16773 1 946 . 1 1 88 88 TYR HE2 H 1 6.692 0.028 . 1 . . . . 663 TYR HE2 . 16773 1 947 . 1 1 88 88 TYR C C 13 174.277 0.200 . 1 . . . . 663 TYR C . 16773 1 948 . 1 1 88 88 TYR CA C 13 58.046 0.200 . 1 . . . . 663 TYR CA . 16773 1 949 . 1 1 88 88 TYR CB C 13 40.573 0.200 . 1 . . . . 663 TYR CB . 16773 1 950 . 1 1 88 88 TYR CD1 C 13 133.342 0.200 . 1 . . . . 663 TYR CD1 . 16773 1 951 . 1 1 88 88 TYR CE1 C 13 119.105 0.200 . 1 . . . . 663 TYR CE1 . 16773 1 952 . 1 1 88 88 TYR N N 15 126.775 0.200 . 1 . . . . 663 TYR N . 16773 1 953 . 1 1 89 89 ASP H H 1 8.636 0.020 . 1 . . . . 664 ASP H . 16773 1 954 . 1 1 89 89 ASP HA H 1 4.439 0.010 . 1 . . . . 664 ASP HA . 16773 1 955 . 1 1 89 89 ASP HB2 H 1 1.648 0.010 . 2 . . . . 664 ASP HB2 . 16773 1 956 . 1 1 89 89 ASP HB3 H 1 1.582 0.010 . 2 . . . . 664 ASP HB3 . 16773 1 957 . 1 1 89 89 ASP C C 13 175.364 0.200 . 1 . . . . 664 ASP C . 16773 1 958 . 1 1 89 89 ASP CA C 13 55.197 0.200 . 1 . . . . 664 ASP CA . 16773 1 959 . 1 1 89 89 ASP CB C 13 40.600 0.200 . 1 . . . . 664 ASP CB . 16773 1 960 . 1 1 89 89 ASP N N 15 124.267 0.200 . 1 . . . . 664 ASP N . 16773 1 961 . 1 1 90 90 GLY H H 1 6.772 0.020 . 1 . . . . 665 GLY H . 16773 1 962 . 1 1 90 90 GLY HA2 H 1 4.199 0.020 . 2 . . . . 665 GLY HA2 . 16773 1 963 . 1 1 90 90 GLY HA3 H 1 3.681 0.020 . 2 . . . . 665 GLY HA3 . 16773 1 964 . 1 1 90 90 GLY C C 13 173.770 0.200 . 1 . . . . 665 GLY C . 16773 1 965 . 1 1 90 90 GLY CA C 13 45.796 0.200 . 1 . . . . 665 GLY CA . 16773 1 966 . 1 1 90 90 GLY N N 15 101.144 0.200 . 1 . . . . 665 GLY N . 16773 1 967 . 1 1 91 91 MET H H 1 7.752 0.020 . 1 . . . . 666 MET H . 16773 1 968 . 1 1 91 91 MET HA H 1 4.818 0.010 . 1 . . . . 666 MET HA . 16773 1 969 . 1 1 91 91 MET HB2 H 1 2.070 0.010 . 2 . . . . 666 MET HB2 . 16773 1 970 . 1 1 91 91 MET HB3 H 1 1.750 0.009 . 2 . . . . 666 MET HB3 . 16773 1 971 . 1 1 91 91 MET HG2 H 1 2.357 0.009 . 2 . . . . 666 MET HG2 . 16773 1 972 . 1 1 91 91 MET C C 13 173.871 0.200 . 1 . . . . 666 MET C . 16773 1 973 . 1 1 91 91 MET CA C 13 54.630 0.200 . 1 . . . . 666 MET CA . 16773 1 974 . 1 1 91 91 MET CB C 13 35.938 0.200 . 1 . . . . 666 MET CB . 16773 1 975 . 1 1 91 91 MET CG C 13 31.837 0.200 . 1 . . . . 666 MET CG . 16773 1 976 . 1 1 91 91 MET N N 15 120.230 0.200 . 1 . . . . 666 MET N . 16773 1 977 . 1 1 92 92 ILE H H 1 8.104 0.020 . 1 . . . . 667 ILE H . 16773 1 978 . 1 1 92 92 ILE HA H 1 5.209 0.020 . 1 . . . . 667 ILE HA . 16773 1 979 . 1 1 92 92 ILE HB H 1 1.655 0.020 . 1 . . . . 667 ILE HB . 16773 1 980 . 1 1 92 92 ILE HD11 H 1 0.048 0.020 . 1 . . . . 667 ILE QD1 . 16773 1 981 . 1 1 92 92 ILE HD12 H 1 0.048 0.020 . 1 . . . . 667 ILE QD1 . 16773 1 982 . 1 1 92 92 ILE HD13 H 1 0.048 0.020 . 1 . . . . 667 ILE QD1 . 16773 1 983 . 1 1 92 92 ILE HG12 H 1 1.347 0.020 . 2 . . . . 667 ILE HG12 . 16773 1 984 . 1 1 92 92 ILE HG13 H 1 0.588 0.020 . 2 . . . . 667 ILE HG13 . 16773 1 985 . 1 1 92 92 ILE HG21 H 1 0.789 0.020 . 1 . . . . 667 ILE QG2 . 16773 1 986 . 1 1 92 92 ILE HG22 H 1 0.789 0.020 . 1 . . . . 667 ILE QG2 . 16773 1 987 . 1 1 92 92 ILE HG23 H 1 0.789 0.020 . 1 . . . . 667 ILE QG2 . 16773 1 988 . 1 1 92 92 ILE C C 13 175.676 0.200 . 1 . . . . 667 ILE C . 16773 1 989 . 1 1 92 92 ILE CA C 13 59.839 0.200 . 1 . . . . 667 ILE CA . 16773 1 990 . 1 1 92 92 ILE CB C 13 40.655 0.200 . 1 . . . . 667 ILE CB . 16773 1 991 . 1 1 92 92 ILE CD1 C 13 13.742 0.200 . 1 . . . . 667 ILE CD1 . 16773 1 992 . 1 1 92 92 ILE CG1 C 13 29.197 0.200 . 1 . . . . 667 ILE CG1 . 16773 1 993 . 1 1 92 92 ILE CG2 C 13 20.113 0.200 . 1 . . . . 667 ILE CG2 . 16773 1 994 . 1 1 92 92 ILE N N 15 121.431 0.200 . 1 . . . . 667 ILE N . 16773 1 995 . 1 1 93 93 GLN H H 1 9.245 0.020 . 1 . . . . 668 GLN H . 16773 1 996 . 1 1 93 93 GLN HA H 1 5.839 0.020 . 1 . . . . 668 GLN HA . 16773 1 997 . 1 1 93 93 GLN HB2 H 1 1.899 0.020 . 2 . . . . 668 GLN HB2 . 16773 1 998 . 1 1 93 93 GLN HB3 H 1 1.899 0.020 . 2 . . . . 668 GLN HB3 . 16773 1 999 . 1 1 93 93 GLN HE21 H 1 7.294 0.020 . 2 . . . . 668 GLN HE21 . 16773 1 1000 . 1 1 93 93 GLN HE22 H 1 6.818 0.020 . 2 . . . . 668 GLN HE22 . 16773 1 1001 . 1 1 93 93 GLN HG2 H 1 2.451 0.020 . 2 . . . . 668 GLN HG2 . 16773 1 1002 . 1 1 93 93 GLN HG3 H 1 2.198 0.020 . 2 . . . . 668 GLN HG3 . 16773 1 1003 . 1 1 93 93 GLN C C 13 175.142 0.200 . 1 . . . . 668 GLN C . 16773 1 1004 . 1 1 93 93 GLN CA C 13 54.706 0.200 . 1 . . . . 668 GLN CA . 16773 1 1005 . 1 1 93 93 GLN CB C 13 34.137 0.200 . 1 . . . . 668 GLN CB . 16773 1 1006 . 1 1 93 93 GLN CG C 13 35.396 0.200 . 1 . . . . 668 GLN CG . 16773 1 1007 . 1 1 93 93 GLN N N 15 124.343 0.200 . 1 . . . . 668 GLN N . 16773 1 1008 . 1 1 93 93 GLN NE2 N 15 112.648 0.200 . 1 . . . . 668 GLN NE2 . 16773 1 1009 . 1 1 94 94 LEU H H 1 8.635 0.020 . 1 . . . . 669 LEU H . 16773 1 1010 . 1 1 94 94 LEU HA H 1 4.742 0.020 . 1 . . . . 669 LEU HA . 16773 1 1011 . 1 1 94 94 LEU HB2 H 1 1.569 0.020 . 2 . . . . 669 LEU HB2 . 16773 1 1012 . 1 1 94 94 LEU HB3 H 1 1.402 0.020 . 2 . . . . 669 LEU HB3 . 16773 1 1013 . 1 1 94 94 LEU HD11 H 1 1.055 0.020 . 2 . . . . 669 LEU QD1 . 16773 1 1014 . 1 1 94 94 LEU HD12 H 1 1.055 0.020 . 2 . . . . 669 LEU QD1 . 16773 1 1015 . 1 1 94 94 LEU HD13 H 1 1.055 0.020 . 2 . . . . 669 LEU QD1 . 16773 1 1016 . 1 1 94 94 LEU HD21 H 1 1.040 0.020 . 2 . . . . 669 LEU QD2 . 16773 1 1017 . 1 1 94 94 LEU HD22 H 1 1.040 0.020 . 2 . . . . 669 LEU QD2 . 16773 1 1018 . 1 1 94 94 LEU HD23 H 1 1.040 0.020 . 2 . . . . 669 LEU QD2 . 16773 1 1019 . 1 1 94 94 LEU HG H 1 1.301 0.020 . 1 . . . . 669 LEU HG . 16773 1 1020 . 1 1 94 94 LEU C C 13 174.445 0.200 . 1 . . . . 669 LEU C . 16773 1 1021 . 1 1 94 94 LEU CA C 13 54.425 0.200 . 1 . . . . 669 LEU CA . 16773 1 1022 . 1 1 94 94 LEU CB C 13 48.487 0.200 . 1 . . . . 669 LEU CB . 16773 1 1023 . 1 1 94 94 LEU CD1 C 13 24.395 0.200 . 1 . . . . 669 LEU CD1 . 16773 1 1024 . 1 1 94 94 LEU CD2 C 13 26.999 0.200 . 1 . . . . 669 LEU CD2 . 16773 1 1025 . 1 1 94 94 LEU CG C 13 27.631 0.200 . 1 . . . . 669 LEU CG . 16773 1 1026 . 1 1 94 94 LEU N N 15 124.700 0.200 . 1 . . . . 669 LEU N . 16773 1 1027 . 1 1 95 95 THR H H 1 9.174 0.020 . 1 . . . . 670 THR H . 16773 1 1028 . 1 1 95 95 THR HA H 1 5.444 0.020 . 1 . . . . 670 THR HA . 16773 1 1029 . 1 1 95 95 THR HB H 1 4.012 0.020 . 1 . . . . 670 THR HB . 16773 1 1030 . 1 1 95 95 THR HG21 H 1 1.152 0.020 . 1 . . . . 670 THR QG2 . 16773 1 1031 . 1 1 95 95 THR HG22 H 1 1.152 0.020 . 1 . . . . 670 THR QG2 . 16773 1 1032 . 1 1 95 95 THR HG23 H 1 1.152 0.020 . 1 . . . . 670 THR QG2 . 16773 1 1033 . 1 1 95 95 THR C C 13 174.312 0.200 . 1 . . . . 670 THR C . 16773 1 1034 . 1 1 95 95 THR CA C 13 60.784 0.200 . 1 . . . . 670 THR CA . 16773 1 1035 . 1 1 95 95 THR CB C 13 71.391 0.200 . 1 . . . . 670 THR CB . 16773 1 1036 . 1 1 95 95 THR CG2 C 13 20.935 0.200 . 1 . . . . 670 THR CG2 . 16773 1 1037 . 1 1 95 95 THR N N 15 119.899 0.200 . 1 . . . . 670 THR N . 16773 1 1038 . 1 1 96 96 TYR H H 1 9.335 0.020 . 1 . . . . 671 TYR H . 16773 1 1039 . 1 1 96 96 TYR HA H 1 5.240 0.020 . 1 . . . . 671 TYR HA . 16773 1 1040 . 1 1 96 96 TYR HB2 H 1 3.041 0.020 . 2 . . . . 671 TYR HB2 . 16773 1 1041 . 1 1 96 96 TYR HB3 H 1 2.879 0.020 . 2 . . . . 671 TYR HB3 . 16773 1 1042 . 1 1 96 96 TYR HD1 H 1 6.933 0.020 . 1 . . . . 671 TYR HD1 . 16773 1 1043 . 1 1 96 96 TYR HD2 H 1 6.933 0.020 . 1 . . . . 671 TYR HD2 . 16773 1 1044 . 1 1 96 96 TYR HE1 H 1 7.212 0.020 . 1 . . . . 671 TYR HE1 . 16773 1 1045 . 1 1 96 96 TYR HE2 H 1 7.212 0.020 . 1 . . . . 671 TYR HE2 . 16773 1 1046 . 1 1 96 96 TYR HH H 1 9.576 0.020 . 1 . . . . 671 TYR HH . 16773 1 1047 . 1 1 96 96 TYR C C 13 175.270 0.200 . 1 . . . . 671 TYR C . 16773 1 1048 . 1 1 96 96 TYR CA C 13 53.353 0.200 . 1 . . . . 671 TYR CA . 16773 1 1049 . 1 1 96 96 TYR CB C 13 39.314 0.200 . 1 . . . . 671 TYR CB . 16773 1 1050 . 1 1 96 96 TYR CD1 C 13 132.047 0.200 . 1 . . . . 671 TYR CD1 . 16773 1 1051 . 1 1 96 96 TYR CE1 C 13 117.552 0.200 . 1 . . . . 671 TYR CE1 . 16773 1 1052 . 1 1 96 96 TYR N N 15 127.824 0.200 . 1 . . . . 671 TYR N . 16773 1 1053 . 1 1 97 97 ARG H H 1 8.972 0.020 . 1 . . . . 672 ARG H . 16773 1 1054 . 1 1 97 97 ARG HA H 1 5.162 0.020 . 1 . . . . 672 ARG HA . 16773 1 1055 . 1 1 97 97 ARG HB2 H 1 2.051 0.020 . 2 . . . . 672 ARG HB2 . 16773 1 1056 . 1 1 97 97 ARG HB3 H 1 1.834 0.020 . 2 . . . . 672 ARG HB3 . 16773 1 1057 . 1 1 97 97 ARG HD2 H 1 3.298 0.020 . 2 . . . . 672 ARG HD2 . 16773 1 1058 . 1 1 97 97 ARG HG2 H 1 1.701 0.020 . 2 . . . . 672 ARG HG2 . 16773 1 1059 . 1 1 97 97 ARG C C 13 176.291 0.200 . 1 . . . . 672 ARG C . 16773 1 1060 . 1 1 97 97 ARG CA C 13 55.217 0.200 . 1 . . . . 672 ARG CA . 16773 1 1061 . 1 1 97 97 ARG CB C 13 34.362 0.200 . 1 . . . . 672 ARG CB . 16773 1 1062 . 1 1 97 97 ARG CD C 13 43.955 0.200 . 1 . . . . 672 ARG CD . 16773 1 1063 . 1 1 97 97 ARG CG C 13 28.643 0.200 . 1 . . . . 672 ARG CG . 16773 1 1064 . 1 1 97 97 ARG N N 15 121.884 0.200 . 1 . . . . 672 ARG N . 16773 1 1065 . 1 1 98 98 ASP H H 1 9.286 0.020 . 1 . . . . 673 ASP H . 16773 1 1066 . 1 1 98 98 ASP HA H 1 4.362 0.020 . 1 . . . . 673 ASP HA . 16773 1 1067 . 1 1 98 98 ASP HB2 H 1 3.086 0.020 . 2 . . . . 673 ASP HB2 . 16773 1 1068 . 1 1 98 98 ASP HB3 H 1 2.900 0.009 . 2 . . . . 673 ASP HB3 . 16773 1 1069 . 1 1 98 98 ASP C C 13 176.000 0.200 . 1 . . . . 673 ASP C . 16773 1 1070 . 1 1 98 98 ASP CA C 13 56.673 0.200 . 1 . . . . 673 ASP CA . 16773 1 1071 . 1 1 98 98 ASP CB C 13 39.539 0.200 . 1 . . . . 673 ASP CB . 16773 1 1072 . 1 1 98 98 ASP N N 15 114.726 0.200 . 1 . . . . 673 ASP N . 16773 1 1073 . 1 1 99 99 GLY H H 1 8.570 0.020 . 1 . . . . 674 GLY H . 16773 1 1074 . 1 1 99 99 GLY HA2 H 1 3.988 0.020 . 2 . . . . 674 GLY HA2 . 16773 1 1075 . 1 1 99 99 GLY HA3 H 1 3.406 0.020 . 2 . . . . 674 GLY HA3 . 16773 1 1076 . 1 1 99 99 GLY C C 13 173.112 0.200 . 1 . . . . 674 GLY C . 16773 1 1077 . 1 1 99 99 GLY CA C 13 44.007 0.200 . 1 . . . . 674 GLY CA . 16773 1 1078 . 1 1 99 99 GLY N N 15 104.562 0.200 . 1 . . . . 674 GLY N . 16773 1 1079 . 1 1 100 100 THR H H 1 9.640 0.020 . 1 . . . . 675 THR H . 16773 1 1080 . 1 1 100 100 THR HA H 1 4.492 0.020 . 1 . . . . 675 THR HA . 16773 1 1081 . 1 1 100 100 THR HB H 1 4.132 0.008 . 1 . . . . 675 THR HB . 16773 1 1082 . 1 1 100 100 THR HG21 H 1 1.748 0.020 . 1 . . . . 675 THR QG2 . 16773 1 1083 . 1 1 100 100 THR HG22 H 1 1.748 0.020 . 1 . . . . 675 THR QG2 . 16773 1 1084 . 1 1 100 100 THR HG23 H 1 1.748 0.020 . 1 . . . . 675 THR QG2 . 16773 1 1085 . 1 1 100 100 THR CA C 13 63.223 0.200 . 1 . . . . 675 THR CA . 16773 1 1086 . 1 1 100 100 THR CB C 13 71.635 0.200 . 1 . . . . 675 THR CB . 16773 1 1087 . 1 1 100 100 THR CG2 C 13 22.454 0.200 . 1 . . . . 675 THR CG2 . 16773 1 1088 . 1 1 100 100 THR N N 15 119.487 0.200 . 1 . . . . 675 THR N . 16773 1 1089 . 1 1 101 101 PRO HA H 1 4.817 0.015 . 1 . . . . 676 PRO HA . 16773 1 1090 . 1 1 101 101 PRO HB2 H 1 2.250 0.015 . 2 . . . . 676 PRO HB2 . 16773 1 1091 . 1 1 101 101 PRO HB3 H 1 1.838 0.020 . 2 . . . . 676 PRO HB3 . 16773 1 1092 . 1 1 101 101 PRO HD2 H 1 4.180 0.020 . 2 . . . . 676 PRO HD2 . 16773 1 1093 . 1 1 101 101 PRO HD3 H 1 3.871 0.015 . 2 . . . . 676 PRO HD3 . 16773 1 1094 . 1 1 101 101 PRO HG2 H 1 2.213 0.020 . 2 . . . . 676 PRO HG2 . 16773 1 1095 . 1 1 101 101 PRO HG3 H 1 2.023 0.015 . 2 . . . . 676 PRO HG3 . 16773 1 1096 . 1 1 101 101 PRO C C 13 178.424 0.200 . 1 . . . . 676 PRO C . 16773 1 1097 . 1 1 101 101 PRO CA C 13 63.663 0.200 . 1 . . . . 676 PRO CA . 16773 1 1098 . 1 1 101 101 PRO CB C 13 32.689 0.177 . 1 . . . . 676 PRO CB . 16773 1 1099 . 1 1 101 101 PRO CD C 13 52.221 0.200 . 1 . . . . 676 PRO CD . 16773 1 1100 . 1 1 101 101 PRO CG C 13 28.278 0.200 . 1 . . . . 676 PRO CG . 16773 1 1101 . 1 1 102 102 TYR H H 1 8.839 0.020 . 1 . . . . 677 TYR H . 16773 1 1102 . 1 1 102 102 TYR HA H 1 4.391 0.020 . 1 . . . . 677 TYR HA . 16773 1 1103 . 1 1 102 102 TYR HB2 H 1 2.894 0.020 . 2 . . . . 677 TYR HB2 . 16773 1 1104 . 1 1 102 102 TYR HB3 H 1 2.819 0.020 . 2 . . . . 677 TYR HB3 . 16773 1 1105 . 1 1 102 102 TYR HD1 H 1 7.393 0.001 . 1 . . . . 677 TYR HD1 . 16773 1 1106 . 1 1 102 102 TYR HD2 H 1 7.393 0.001 . 1 . . . . 677 TYR HD2 . 16773 1 1107 . 1 1 102 102 TYR HE1 H 1 6.674 0.001 . 1 . . . . 677 TYR HE1 . 16773 1 1108 . 1 1 102 102 TYR HE2 H 1 6.674 0.001 . 1 . . . . 677 TYR HE2 . 16773 1 1109 . 1 1 102 102 TYR C C 13 176.836 0.200 . 1 . . . . 677 TYR C . 16773 1 1110 . 1 1 102 102 TYR CA C 13 60.310 0.200 . 1 . . . . 677 TYR CA . 16773 1 1111 . 1 1 102 102 TYR CB C 13 41.220 0.200 . 1 . . . . 677 TYR CB . 16773 1 1112 . 1 1 102 102 TYR CD1 C 13 133.342 0.200 . 1 . . . . 677 TYR CD1 . 16773 1 1113 . 1 1 102 102 TYR CE1 C 13 118.329 0.200 . 1 . . . . 677 TYR CE1 . 16773 1 1114 . 1 1 102 102 TYR N N 15 122.625 0.200 . 1 . . . . 677 TYR N . 16773 1 1115 . 1 1 103 103 ASN H H 1 9.717 0.020 . 1 . . . . 678 ASN H . 16773 1 1116 . 1 1 103 103 ASN HA H 1 5.102 0.020 . 1 . . . . 678 ASN HA . 16773 1 1117 . 1 1 103 103 ASN HB2 H 1 3.216 0.020 . 2 . . . . 678 ASN HB2 . 16773 1 1118 . 1 1 103 103 ASN HB3 H 1 3.060 0.020 . 2 . . . . 678 ASN HB3 . 16773 1 1119 . 1 1 103 103 ASN HD21 H 1 8.063 0.020 . 2 . . . . 678 ASN HD21 . 16773 1 1120 . 1 1 103 103 ASN HD22 H 1 6.992 0.020 . 2 . . . . 678 ASN HD22 . 16773 1 1121 . 1 1 103 103 ASN C C 13 176.271 0.200 . 1 . . . . 678 ASN C . 16773 1 1122 . 1 1 103 103 ASN CA C 13 53.225 0.200 . 1 . . . . 678 ASN CA . 16773 1 1123 . 1 1 103 103 ASN CB C 13 37.795 0.200 . 1 . . . . 678 ASN CB . 16773 1 1124 . 1 1 103 103 ASN N N 15 119.899 0.200 . 1 . . . . 678 ASN N . 16773 1 1125 . 1 1 103 103 ASN ND2 N 15 114.993 0.200 . 1 . . . . 678 ASN ND2 . 16773 1 1126 . 1 1 104 104 ASN H H 1 7.866 0.020 . 1 . . . . 679 ASN H . 16773 1 1127 . 1 1 104 104 ASN HA H 1 4.851 0.016 . 1 . . . . 679 ASN HA . 16773 1 1128 . 1 1 104 104 ASN HB2 H 1 3.351 0.020 . 2 . . . . 679 ASN HB2 . 16773 1 1129 . 1 1 104 104 ASN HB3 H 1 3.038 0.015 . 2 . . . . 679 ASN HB3 . 16773 1 1130 . 1 1 104 104 ASN HD21 H 1 7.334 0.020 . 2 . . . . 679 ASN HD21 . 16773 1 1131 . 1 1 104 104 ASN HD22 H 1 6.912 0.020 . 2 . . . . 679 ASN HD22 . 16773 1 1132 . 1 1 104 104 ASN C C 13 176.659 0.200 . 1 . . . . 679 ASN C . 16773 1 1133 . 1 1 104 104 ASN CA C 13 52.357 0.200 . 1 . . . . 679 ASN CA . 16773 1 1134 . 1 1 104 104 ASN CB C 13 39.296 0.200 . 1 . . . . 679 ASN CB . 16773 1 1135 . 1 1 104 104 ASN N N 15 117.836 0.200 . 1 . . . . 679 ASN N . 16773 1 1136 . 1 1 104 104 ASN ND2 N 15 110.494 0.200 . 1 . . . . 679 ASN ND2 . 16773 1 1137 . 1 1 105 105 GLU H H 1 8.969 0.020 . 1 . . . . 680 GLU H . 16773 1 1138 . 1 1 105 105 GLU HA H 1 4.090 0.020 . 1 . . . . 680 GLU HA . 16773 1 1139 . 1 1 105 105 GLU HB2 H 1 2.148 0.020 . 2 . . . . 680 GLU HB2 . 16773 1 1140 . 1 1 105 105 GLU HB3 H 1 2.107 0.013 . 2 . . . . 680 GLU HB3 . 16773 1 1141 . 1 1 105 105 GLU HG2 H 1 2.404 0.020 . 2 . . . . 680 GLU HG2 . 16773 1 1142 . 1 1 105 105 GLU HG3 H 1 2.343 0.020 . 2 . . . . 680 GLU HG3 . 16773 1 1143 . 1 1 105 105 GLU C C 13 178.230 0.200 . 1 . . . . 680 GLU C . 16773 1 1144 . 1 1 105 105 GLU CA C 13 60.310 0.200 . 1 . . . . 680 GLU CA . 16773 1 1145 . 1 1 105 105 GLU CB C 13 29.918 0.034 . 1 . . . . 680 GLU CB . 16773 1 1146 . 1 1 105 105 GLU CG C 13 36.864 0.200 . 1 . . . . 680 GLU CG . 16773 1 1147 . 1 1 105 105 GLU N N 15 121.441 0.200 . 1 . . . . 680 GLU N . 16773 1 1148 . 1 1 106 106 LYS H H 1 7.562 0.020 . 1 . . . . 681 LYS H . 16773 1 1149 . 1 1 106 106 LYS HA H 1 4.283 0.020 . 1 . . . . 681 LYS HA . 16773 1 1150 . 1 1 106 106 LYS HB2 H 1 1.993 0.016 . 2 . . . . 681 LYS HB2 . 16773 1 1151 . 1 1 106 106 LYS HB3 H 1 1.654 0.020 . 2 . . . . 681 LYS HB3 . 16773 1 1152 . 1 1 106 106 LYS HD2 H 1 1.694 0.016 . 2 . . . . 681 LYS HD2 . 16773 1 1153 . 1 1 106 106 LYS HD3 H 1 1.694 0.016 . 2 . . . . 681 LYS HD3 . 16773 1 1154 . 1 1 106 106 LYS HE2 H 1 3.026 0.020 . 2 . . . . 681 LYS HE2 . 16773 1 1155 . 1 1 106 106 LYS HG2 H 1 1.460 0.016 . 2 . . . . 681 LYS HG2 . 16773 1 1156 . 1 1 106 106 LYS HG3 H 1 1.445 0.010 . 2 . . . . 681 LYS HG3 . 16773 1 1157 . 1 1 106 106 LYS C C 13 175.883 0.200 . 1 . . . . 681 LYS C . 16773 1 1158 . 1 1 106 106 LYS CA C 13 56.428 0.200 . 1 . . . . 681 LYS CA . 16773 1 1159 . 1 1 106 106 LYS CB C 13 33.012 0.200 . 1 . . . . 681 LYS CB . 16773 1 1160 . 1 1 106 106 LYS CD C 13 29.310 0.200 . 1 . . . . 681 LYS CD . 16773 1 1161 . 1 1 106 106 LYS CE C 13 42.938 0.200 . 1 . . . . 681 LYS CE . 16773 1 1162 . 1 1 106 106 LYS CG C 13 26.762 1.040 . 1 . . . . 681 LYS CG . 16773 1 1163 . 1 1 106 106 LYS N N 15 115.000 0.200 . 1 . . . . 681 LYS N . 16773 1 1164 . 1 1 107 107 ARG H H 1 7.981 0.020 . 1 . . . . 682 ARG H . 16773 1 1165 . 1 1 107 107 ARG HA H 1 4.406 0.020 . 1 . . . . 682 ARG HA . 16773 1 1166 . 1 1 107 107 ARG HB2 H 1 2.118 0.020 . 2 . . . . 682 ARG HB2 . 16773 1 1167 . 1 1 107 107 ARG HB3 H 1 1.810 0.020 . 2 . . . . 682 ARG HB3 . 16773 1 1168 . 1 1 107 107 ARG HD2 H 1 3.410 0.020 . 2 . . . . 682 ARG HD2 . 16773 1 1169 . 1 1 107 107 ARG HG2 H 1 1.884 0.020 . 2 . . . . 682 ARG HG2 . 16773 1 1170 . 1 1 107 107 ARG C C 13 176.201 0.200 . 1 . . . . 682 ARG C . 16773 1 1171 . 1 1 107 107 ARG CA C 13 56.187 0.200 . 1 . . . . 682 ARG CA . 16773 1 1172 . 1 1 107 107 ARG CB C 13 28.067 0.134 . 1 . . . . 682 ARG CB . 16773 1 1173 . 1 1 107 107 ARG CD C 13 43.853 0.200 . 1 . . . . 682 ARG CD . 16773 1 1174 . 1 1 107 107 ARG CG C 13 27.307 0.200 . 1 . . . . 682 ARG CG . 16773 1 1175 . 1 1 107 107 ARG N N 15 119.751 0.200 . 1 . . . . 682 ARG N . 16773 1 1176 . 1 1 108 108 THR H H 1 8.401 0.020 . 1 . . . . 683 THR H . 16773 1 1177 . 1 1 108 108 THR HA H 1 4.405 0.010 . 1 . . . . 683 THR HA . 16773 1 1178 . 1 1 108 108 THR HB H 1 4.123 0.009 . 1 . . . . 683 THR HB . 16773 1 1179 . 1 1 108 108 THR HG21 H 1 1.467 0.020 . 1 . . . . 683 THR QG2 . 16773 1 1180 . 1 1 108 108 THR HG22 H 1 1.467 0.020 . 1 . . . . 683 THR QG2 . 16773 1 1181 . 1 1 108 108 THR HG23 H 1 1.467 0.020 . 1 . . . . 683 THR QG2 . 16773 1 1182 . 1 1 108 108 THR CA C 13 61.928 0.200 . 1 . . . . 683 THR CA . 16773 1 1183 . 1 1 108 108 THR CB C 13 71.578 0.200 . 1 . . . . 683 THR CB . 16773 1 1184 . 1 1 108 108 THR CG2 C 13 22.130 0.200 . 1 . . . . 683 THR CG2 . 16773 1 1185 . 1 1 108 108 THR N N 15 117.330 0.200 . 1 . . . . 683 THR N . 16773 1 1186 . 1 1 109 109 PRO HA H 1 4.229 0.020 . 1 . . . . 684 PRO HA . 16773 1 1187 . 1 1 109 109 PRO HB2 H 1 2.707 0.015 . 2 . . . . 684 PRO HB2 . 16773 1 1188 . 1 1 109 109 PRO HB3 H 1 2.131 0.020 . 2 . . . . 684 PRO HB3 . 16773 1 1189 . 1 1 109 109 PRO HD2 H 1 4.410 0.016 . 2 . . . . 684 PRO HD2 . 16773 1 1190 . 1 1 109 109 PRO HD3 H 1 3.840 0.015 . 2 . . . . 684 PRO HD3 . 16773 1 1191 . 1 1 109 109 PRO HG2 H 1 2.412 0.016 . 2 . . . . 684 PRO HG2 . 16773 1 1192 . 1 1 109 109 PRO HG3 H 1 2.130 0.015 . 2 . . . . 684 PRO HG3 . 16773 1 1193 . 1 1 109 109 PRO C C 13 177.118 0.200 . 1 . . . . 684 PRO C . 16773 1 1194 . 1 1 109 109 PRO CA C 13 63.968 0.200 . 1 . . . . 684 PRO CA . 16773 1 1195 . 1 1 109 109 PRO CB C 13 33.267 0.200 . 1 . . . . 684 PRO CB . 16773 1 1196 . 1 1 109 109 PRO CD C 13 51.898 0.200 . 1 . . . . 684 PRO CD . 16773 1 1197 . 1 1 109 109 PRO CG C 13 28.278 0.200 . 1 . . . . 684 PRO CG . 16773 1 1198 . 1 1 110 110 ARG H H 1 6.582 0.020 . 1 . . . . 685 ARG H . 16773 1 1199 . 1 1 110 110 ARG HA H 1 4.474 0.014 . 1 . . . . 685 ARG HA . 16773 1 1200 . 1 1 110 110 ARG HB2 H 1 1.842 0.020 . 2 . . . . 685 ARG HB2 . 16773 1 1201 . 1 1 110 110 ARG HB3 H 1 1.578 0.020 . 2 . . . . 685 ARG HB3 . 16773 1 1202 . 1 1 110 110 ARG HD2 H 1 3.049 0.020 . 2 . . . . 685 ARG HD2 . 16773 1 1203 . 1 1 110 110 ARG HD3 H 1 3.049 0.020 . 2 . . . . 685 ARG HD3 . 16773 1 1204 . 1 1 110 110 ARG HE H 1 6.443 0.020 . 1 . . . . 685 ARG HE . 16773 1 1205 . 1 1 110 110 ARG HG2 H 1 1.843 0.020 . 2 . . . . 685 ARG HG2 . 16773 1 1206 . 1 1 110 110 ARG HG3 H 1 1.766 0.020 . 2 . . . . 685 ARG HG3 . 16773 1 1207 . 1 1 110 110 ARG C C 13 174.171 0.200 . 1 . . . . 685 ARG C . 16773 1 1208 . 1 1 110 110 ARG CA C 13 58.000 0.200 . 1 . . . . 685 ARG CA . 16773 1 1209 . 1 1 110 110 ARG CB C 13 33.124 0.200 . 1 . . . . 685 ARG CB . 16773 1 1210 . 1 1 110 110 ARG CD C 13 43.809 0.200 . 1 . . . . 685 ARG CD . 16773 1 1211 . 1 1 110 110 ARG N N 15 122.376 0.200 . 1 . . . . 685 ARG N . 16773 1 1212 . 1 1 110 110 ARG NE N 15 115.532 0.200 . 1 . . . . 685 ARG NE . 16773 1 1213 . 1 1 111 111 ALA H H 1 7.897 0.020 . 1 . . . . 686 ALA H . 16773 1 1214 . 1 1 111 111 ALA HA H 1 5.551 0.020 . 1 . . . . 686 ALA HA . 16773 1 1215 . 1 1 111 111 ALA HB1 H 1 1.627 0.020 . 1 . . . . 686 ALA QB . 16773 1 1216 . 1 1 111 111 ALA HB2 H 1 1.627 0.020 . 1 . . . . 686 ALA QB . 16773 1 1217 . 1 1 111 111 ALA HB3 H 1 1.627 0.020 . 1 . . . . 686 ALA QB . 16773 1 1218 . 1 1 111 111 ALA C C 13 177.507 0.200 . 1 . . . . 686 ALA C . 16773 1 1219 . 1 1 111 111 ALA CA C 13 51.464 0.200 . 1 . . . . 686 ALA CA . 16773 1 1220 . 1 1 111 111 ALA CB C 13 24.007 0.200 . 1 . . . . 686 ALA CB . 16773 1 1221 . 1 1 111 111 ALA N N 15 120.264 0.200 . 1 . . . . 686 ALA N . 16773 1 1222 . 1 1 112 112 THR H H 1 9.513 0.020 . 1 . . . . 687 THR H . 16773 1 1223 . 1 1 112 112 THR HA H 1 5.432 0.020 . 1 . . . . 687 THR HA . 16773 1 1224 . 1 1 112 112 THR HB H 1 3.895 0.007 . 1 . . . . 687 THR HB . 16773 1 1225 . 1 1 112 112 THR HG21 H 1 1.180 0.020 . 1 . . . . 687 THR QG2 . 16773 1 1226 . 1 1 112 112 THR HG22 H 1 1.180 0.020 . 1 . . . . 687 THR QG2 . 16773 1 1227 . 1 1 112 112 THR HG23 H 1 1.180 0.020 . 1 . . . . 687 THR QG2 . 16773 1 1228 . 1 1 112 112 THR C C 13 172.479 0.200 . 1 . . . . 687 THR C . 16773 1 1229 . 1 1 112 112 THR CA C 13 63.133 0.200 . 1 . . . . 687 THR CA . 16773 1 1230 . 1 1 112 112 THR CB C 13 73.247 0.200 . 1 . . . . 687 THR CB . 16773 1 1231 . 1 1 112 112 THR CG2 C 13 21.655 0.200 . 1 . . . . 687 THR CG2 . 16773 1 1232 . 1 1 112 112 THR N N 15 116.311 0.200 . 1 . . . . 687 THR N . 16773 1 1233 . 1 1 113 113 LEU H H 1 9.109 0.020 . 1 . . . . 688 LEU H . 16773 1 1234 . 1 1 113 113 LEU HA H 1 5.204 0.020 . 1 . . . . 688 LEU HA . 16773 1 1235 . 1 1 113 113 LEU HB2 H 1 1.989 0.020 . 2 . . . . 688 LEU HB2 . 16773 1 1236 . 1 1 113 113 LEU HB3 H 1 1.193 0.020 . 2 . . . . 688 LEU HB3 . 16773 1 1237 . 1 1 113 113 LEU HD11 H 1 0.804 0.020 . 2 . . . . 688 LEU QD1 . 16773 1 1238 . 1 1 113 113 LEU HD12 H 1 0.804 0.020 . 2 . . . . 688 LEU QD1 . 16773 1 1239 . 1 1 113 113 LEU HD13 H 1 0.804 0.020 . 2 . . . . 688 LEU QD1 . 16773 1 1240 . 1 1 113 113 LEU HD21 H 1 0.802 0.020 . 2 . . . . 688 LEU QD2 . 16773 1 1241 . 1 1 113 113 LEU HD22 H 1 0.802 0.020 . 2 . . . . 688 LEU QD2 . 16773 1 1242 . 1 1 113 113 LEU HD23 H 1 0.802 0.020 . 2 . . . . 688 LEU QD2 . 16773 1 1243 . 1 1 113 113 LEU HG H 1 1.379 0.020 . 1 . . . . 688 LEU HG . 16773 1 1244 . 1 1 113 113 LEU C C 13 175.565 0.200 . 1 . . . . 688 LEU C . 16773 1 1245 . 1 1 113 113 LEU CA C 13 54.170 0.200 . 1 . . . . 688 LEU CA . 16773 1 1246 . 1 1 113 113 LEU CB C 13 45.392 0.200 . 1 . . . . 688 LEU CB . 16773 1 1247 . 1 1 113 113 LEU CD1 C 13 26.074 0.200 . 1 . . . . 688 LEU CD1 . 16773 1 1248 . 1 1 113 113 LEU CD2 C 13 24.327 0.200 . 1 . . . . 688 LEU CD2 . 16773 1 1249 . 1 1 113 113 LEU CG C 13 28.278 0.200 . 1 . . . . 688 LEU CG . 16773 1 1250 . 1 1 113 113 LEU N N 15 129.405 0.200 . 1 . . . . 688 LEU N . 16773 1 1251 . 1 1 114 114 ILE H H 1 9.154 0.020 . 1 . . . . 689 ILE H . 16773 1 1252 . 1 1 114 114 ILE HA H 1 4.599 0.020 . 1 . . . . 689 ILE HA . 16773 1 1253 . 1 1 114 114 ILE HB H 1 1.397 0.020 . 1 . . . . 689 ILE HB . 16773 1 1254 . 1 1 114 114 ILE HD11 H 1 0.592 0.020 . 1 . . . . 689 ILE QD1 . 16773 1 1255 . 1 1 114 114 ILE HD12 H 1 0.592 0.020 . 1 . . . . 689 ILE QD1 . 16773 1 1256 . 1 1 114 114 ILE HD13 H 1 0.592 0.020 . 1 . . . . 689 ILE QD1 . 16773 1 1257 . 1 1 114 114 ILE HG12 H 1 0.502 0.020 . 2 . . . . 689 ILE HG12 . 16773 1 1258 . 1 1 114 114 ILE HG13 H 1 1.398 0.020 . 2 . . . . 689 ILE HG13 . 16773 1 1259 . 1 1 114 114 ILE HG21 H 1 -0.012 0.010 . 1 . . . . 689 ILE QG2 . 16773 1 1260 . 1 1 114 114 ILE HG22 H 1 -0.012 0.010 . 1 . . . . 689 ILE QG2 . 16773 1 1261 . 1 1 114 114 ILE HG23 H 1 -0.012 0.010 . 1 . . . . 689 ILE QG2 . 16773 1 1262 . 1 1 114 114 ILE C C 13 174.842 0.200 . 1 . . . . 689 ILE C . 16773 1 1263 . 1 1 114 114 ILE CA C 13 60.834 0.200 . 1 . . . . 689 ILE CA . 16773 1 1264 . 1 1 114 114 ILE CB C 13 40.125 0.200 . 1 . . . . 689 ILE CB . 16773 1 1265 . 1 1 114 114 ILE CD1 C 13 14.825 0.200 . 1 . . . . 689 ILE CD1 . 16773 1 1266 . 1 1 114 114 ILE CG1 C 13 28.144 0.200 . 1 . . . . 689 ILE CG1 . 16773 1 1267 . 1 1 114 114 ILE CG2 C 13 18.894 0.200 . 1 . . . . 689 ILE CG2 . 16773 1 1268 . 1 1 114 114 ILE N N 15 127.555 0.200 . 1 . . . . 689 ILE N . 16773 1 1269 . 1 1 115 115 THR H H 1 8.120 0.020 . 1 . . . . 690 THR H . 16773 1 1270 . 1 1 115 115 THR HA H 1 4.780 0.020 . 1 . . . . 690 THR HA . 16773 1 1271 . 1 1 115 115 THR HB H 1 3.888 0.020 . 1 . . . . 690 THR HB . 16773 1 1272 . 1 1 115 115 THR HG21 H 1 1.119 0.020 . 1 . . . . 690 THR QG2 . 16773 1 1273 . 1 1 115 115 THR HG22 H 1 1.119 0.020 . 1 . . . . 690 THR QG2 . 16773 1 1274 . 1 1 115 115 THR HG23 H 1 1.119 0.020 . 1 . . . . 690 THR QG2 . 16773 1 1275 . 1 1 115 115 THR C C 13 172.764 0.200 . 1 . . . . 690 THR C . 16773 1 1276 . 1 1 115 115 THR CA C 13 62.366 0.200 . 1 . . . . 690 THR CA . 16773 1 1277 . 1 1 115 115 THR CB C 13 70.341 0.200 . 1 . . . . 690 THR CB . 16773 1 1278 . 1 1 115 115 THR CG2 C 13 22.580 0.200 . 1 . . . . 690 THR CG2 . 16773 1 1279 . 1 1 115 115 THR N N 15 122.535 0.200 . 1 . . . . 690 THR N . 16773 1 1280 . 1 1 116 116 PHE H H 1 9.746 0.020 . 1 . . . . 691 PHE H . 16773 1 1281 . 1 1 116 116 PHE HA H 1 5.467 0.020 . 1 . . . . 691 PHE HA . 16773 1 1282 . 1 1 116 116 PHE HB2 H 1 2.782 0.007 . 2 . . . . 691 PHE HB2 . 16773 1 1283 . 1 1 116 116 PHE HB3 H 1 2.470 0.008 . 2 . . . . 691 PHE HB3 . 16773 1 1284 . 1 1 116 116 PHE HD1 H 1 6.588 0.020 . 1 . . . . 691 PHE HD1 . 16773 1 1285 . 1 1 116 116 PHE HD2 H 1 6.588 0.020 . 1 . . . . 691 PHE HD2 . 16773 1 1286 . 1 1 116 116 PHE HE1 H 1 6.091 0.020 . 1 . . . . 691 PHE HE1 . 16773 1 1287 . 1 1 116 116 PHE HE2 H 1 6.091 0.020 . 1 . . . . 691 PHE HE2 . 16773 1 1288 . 1 1 116 116 PHE HZ H 1 6.469 0.020 . 1 . . . . 691 PHE HZ . 16773 1 1289 . 1 1 116 116 PHE C C 13 174.842 0.200 . 1 . . . . 691 PHE C . 16773 1 1290 . 1 1 116 116 PHE CA C 13 56.417 0.200 . 1 . . . . 691 PHE CA . 16773 1 1291 . 1 1 116 116 PHE CB C 13 40.383 0.200 . 1 . . . . 691 PHE CB . 16773 1 1292 . 1 1 116 116 PHE CD1 C 13 132.565 0.200 . 1 . . . . 691 PHE CD1 . 16773 1 1293 . 1 1 116 116 PHE CE1 C 13 130.494 0.200 . 1 . . . . 691 PHE CE1 . 16773 1 1294 . 1 1 116 116 PHE CZ C 13 128.941 0.200 . 1 . . . . 691 PHE CZ . 16773 1 1295 . 1 1 116 116 PHE N N 15 126.802 0.200 . 1 . . . . 691 PHE N . 16773 1 1296 . 1 1 117 117 LEU H H 1 8.211 0.020 . 1 . . . . 692 LEU H . 16773 1 1297 . 1 1 117 117 LEU HA H 1 4.840 0.015 . 1 . . . . 692 LEU HA . 16773 1 1298 . 1 1 117 117 LEU HB2 H 1 1.464 0.020 . 2 . . . . 692 LEU HB2 . 16773 1 1299 . 1 1 117 117 LEU HB3 H 1 0.991 0.020 . 2 . . . . 692 LEU HB3 . 16773 1 1300 . 1 1 117 117 LEU HD11 H 1 0.838 0.020 . 2 . . . . 692 LEU QD1 . 16773 1 1301 . 1 1 117 117 LEU HD12 H 1 0.838 0.020 . 2 . . . . 692 LEU QD1 . 16773 1 1302 . 1 1 117 117 LEU HD13 H 1 0.838 0.020 . 2 . . . . 692 LEU QD1 . 16773 1 1303 . 1 1 117 117 LEU HD21 H 1 0.487 0.020 . 2 . . . . 692 LEU QD2 . 16773 1 1304 . 1 1 117 117 LEU HD22 H 1 0.487 0.020 . 2 . . . . 692 LEU QD2 . 16773 1 1305 . 1 1 117 117 LEU HD23 H 1 0.487 0.020 . 2 . . . . 692 LEU QD2 . 16773 1 1306 . 1 1 117 117 LEU HG H 1 1.255 0.020 . 1 . . . . 692 LEU HG . 16773 1 1307 . 1 1 117 117 LEU C C 13 176.351 0.200 . 1 . . . . 692 LEU C . 16773 1 1308 . 1 1 117 117 LEU CA C 13 52.945 0.200 . 1 . . . . 692 LEU CA . 16773 1 1309 . 1 1 117 117 LEU CB C 13 46.573 0.200 . 1 . . . . 692 LEU CB . 16773 1 1310 . 1 1 117 117 LEU CD1 C 13 25.000 0.200 . 1 . . . . 692 LEU CD1 . 16773 1 1311 . 1 1 117 117 LEU CD2 C 13 26.013 0.200 . 1 . . . . 692 LEU CD2 . 16773 1 1312 . 1 1 117 117 LEU CG C 13 27.631 0.200 . 1 . . . . 692 LEU CG . 16773 1 1313 . 1 1 117 117 LEU N N 15 121.465 0.200 . 1 . . . . 692 LEU N . 16773 1 1314 . 1 1 118 118 CYS H H 1 9.060 0.020 . 1 . . . . 693 CYS H . 16773 1 1315 . 1 1 118 118 CYS HA H 1 4.567 0.020 . 1 . . . . 693 CYS HA . 16773 1 1316 . 1 1 118 118 CYS HB2 H 1 3.331 0.020 . 2 . . . . 693 CYS HB2 . 16773 1 1317 . 1 1 118 118 CYS HB3 H 1 2.853 0.015 . 2 . . . . 693 CYS HB3 . 16773 1 1318 . 1 1 118 118 CYS C C 13 175.936 0.200 . 1 . . . . 693 CYS C . 16773 1 1319 . 1 1 118 118 CYS CA C 13 57.030 0.200 . 1 . . . . 693 CYS CA . 16773 1 1320 . 1 1 118 118 CYS CB C 13 39.370 0.200 . 1 . . . . 693 CYS CB . 16773 1 1321 . 1 1 118 118 CYS N N 15 119.385 0.200 . 1 . . . . 693 CYS N . 16773 1 1322 . 1 1 119 119 ASP H H 1 7.119 0.020 . 1 . . . . 694 ASP H . 16773 1 1323 . 1 1 119 119 ASP HA H 1 4.392 0.020 . 1 . . . . 694 ASP HA . 16773 1 1324 . 1 1 119 119 ASP HB2 H 1 2.786 0.020 . 2 . . . . 694 ASP HB2 . 16773 1 1325 . 1 1 119 119 ASP HB3 H 1 2.731 0.020 . 2 . . . . 694 ASP HB3 . 16773 1 1326 . 1 1 119 119 ASP C C 13 174.153 0.200 . 1 . . . . 694 ASP C . 16773 1 1327 . 1 1 119 119 ASP CA C 13 57.724 0.200 . 1 . . . . 694 ASP CA . 16773 1 1328 . 1 1 119 119 ASP CB C 13 40.721 0.200 . 1 . . . . 694 ASP CB . 16773 1 1329 . 1 1 119 119 ASP N N 15 127.886 0.200 . 1 . . . . 694 ASP N . 16773 1 1330 . 1 1 120 120 ARG H H 1 8.719 0.020 . 1 . . . . 695 ARG H . 16773 1 1331 . 1 1 120 120 ARG N N 15 125.505 0.200 . 1 . . . . 695 ARG N . 16773 1 1332 . 1 1 121 121 ASP H H 1 8.854 0.020 . 1 . . . . 696 ASP H . 16773 1 1333 . 1 1 121 121 ASP C C 13 175.336 0.200 . 1 . . . . 696 ASP C . 16773 1 1334 . 1 1 121 121 ASP N N 15 120.670 0.200 . 1 . . . . 696 ASP N . 16773 1 1335 . 1 1 122 122 ALA H H 1 6.772 0.020 . 1 . . . . 697 ALA H . 16773 1 1336 . 1 1 122 122 ALA C C 13 178.936 0.200 . 1 . . . . 697 ALA C . 16773 1 1337 . 1 1 122 122 ALA N N 15 134.029 0.200 . 1 . . . . 697 ALA N . 16773 1 1338 . 1 1 123 123 GLY H H 1 8.076 0.020 . 1 . . . . 698 GLY H . 16773 1 1339 . 1 1 123 123 GLY HA2 H 1 4.230 0.020 . 2 . . . . 698 GLY HA2 . 16773 1 1340 . 1 1 123 123 GLY HA3 H 1 3.889 0.020 . 2 . . . . 698 GLY HA3 . 16773 1 1341 . 1 1 123 123 GLY C C 13 176.276 0.200 . 1 . . . . 698 GLY C . 16773 1 1342 . 1 1 123 123 GLY CA C 13 45.942 0.200 . 1 . . . . 698 GLY CA . 16773 1 1343 . 1 1 123 123 GLY N N 15 106.199 0.200 . 1 . . . . 698 GLY N . 16773 1 1344 . 1 1 124 124 VAL H H 1 9.127 0.020 . 1 . . . . 699 VAL H . 16773 1 1345 . 1 1 124 124 VAL HA H 1 3.856 0.020 . 1 . . . . 699 VAL HA . 16773 1 1346 . 1 1 124 124 VAL HB H 1 2.492 0.020 . 1 . . . . 699 VAL HB . 16773 1 1347 . 1 1 124 124 VAL HG11 H 1 1.587 0.020 . 2 . . . . 699 VAL QG1 . 16773 1 1348 . 1 1 124 124 VAL HG12 H 1 1.587 0.020 . 2 . . . . 699 VAL QG1 . 16773 1 1349 . 1 1 124 124 VAL HG13 H 1 1.587 0.020 . 2 . . . . 699 VAL QG1 . 16773 1 1350 . 1 1 124 124 VAL HG21 H 1 1.429 0.020 . 2 . . . . 699 VAL QG2 . 16773 1 1351 . 1 1 124 124 VAL HG22 H 1 1.429 0.020 . 2 . . . . 699 VAL QG2 . 16773 1 1352 . 1 1 124 124 VAL HG23 H 1 1.429 0.020 . 2 . . . . 699 VAL QG2 . 16773 1 1353 . 1 1 124 124 VAL C C 13 177.297 0.200 . 1 . . . . 699 VAL C . 16773 1 1354 . 1 1 124 124 VAL CA C 13 67.934 0.200 . 1 . . . . 699 VAL CA . 16773 1 1355 . 1 1 124 124 VAL CB C 13 33.462 0.200 . 1 . . . . 699 VAL CB . 16773 1 1356 . 1 1 124 124 VAL CG1 C 13 21.757 0.200 . 1 . . . . 699 VAL CG1 . 16773 1 1357 . 1 1 124 124 VAL CG2 C 13 23.093 0.200 . 1 . . . . 699 VAL CG2 . 16773 1 1358 . 1 1 124 124 VAL N N 15 128.107 0.200 . 1 . . . . 699 VAL N . 16773 1 1359 . 1 1 125 125 GLY H H 1 7.981 0.020 . 1 . . . . 700 GLY H . 16773 1 1360 . 1 1 125 125 GLY HA2 H 1 4.923 0.020 . 2 . . . . 700 GLY HA2 . 16773 1 1361 . 1 1 125 125 GLY HA3 H 1 4.025 0.020 . 2 . . . . 700 GLY HA3 . 16773 1 1362 . 1 1 125 125 GLY C C 13 172.058 0.200 . 1 . . . . 700 GLY C . 16773 1 1363 . 1 1 125 125 GLY CA C 13 45.284 0.200 . 1 . . . . 700 GLY CA . 16773 1 1364 . 1 1 125 125 GLY N N 15 104.403 0.200 . 1 . . . . 700 GLY N . 16773 1 1365 . 1 1 126 126 PHE H H 1 7.859 0.020 . 1 . . . . 701 PHE H . 16773 1 1366 . 1 1 126 126 PHE N N 15 117.411 0.200 . 1 . . . . 701 PHE N . 16773 1 1367 . 1 1 127 127 PRO HA H 1 4.001 0.020 . 1 . . . . 702 PRO HA . 16773 1 1368 . 1 1 127 127 PRO HB2 H 1 1.595 0.020 . 2 . . . . 702 PRO HB2 . 16773 1 1369 . 1 1 127 127 PRO HB3 H 1 1.248 0.020 . 2 . . . . 702 PRO HB3 . 16773 1 1370 . 1 1 127 127 PRO HD2 H 1 2.347 0.020 . 2 . . . . 702 PRO HD2 . 16773 1 1371 . 1 1 127 127 PRO HD3 H 1 0.842 0.020 . 2 . . . . 702 PRO HD3 . 16773 1 1372 . 1 1 127 127 PRO HG2 H 1 1.338 0.020 . 2 . . . . 702 PRO HG2 . 16773 1 1373 . 1 1 127 127 PRO HG3 H 1 0.651 0.020 . 2 . . . . 702 PRO HG3 . 16773 1 1374 . 1 1 127 127 PRO C C 13 175.316 0.200 . 1 . . . . 702 PRO C . 16773 1 1375 . 1 1 127 127 PRO CA C 13 62.089 0.200 . 1 . . . . 702 PRO CA . 16773 1 1376 . 1 1 127 127 PRO CB C 13 32.280 0.200 . 1 . . . . 702 PRO CB . 16773 1 1377 . 1 1 127 127 PRO CD C 13 48.339 0.200 . 1 . . . . 702 PRO CD . 16773 1 1378 . 1 1 127 127 PRO CG C 13 26.013 0.200 . 1 . . . . 702 PRO CG . 16773 1 1379 . 1 1 128 128 GLU H H 1 9.003 0.020 . 1 . . . . 703 GLU H . 16773 1 1380 . 1 1 128 128 GLU HA H 1 4.796 0.020 . 1 . . . . 703 GLU HA . 16773 1 1381 . 1 1 128 128 GLU HB2 H 1 2.133 0.020 . 2 . . . . 703 GLU HB2 . 16773 1 1382 . 1 1 128 128 GLU HB3 H 1 1.998 0.020 . 2 . . . . 703 GLU HB3 . 16773 1 1383 . 1 1 128 128 GLU HG2 H 1 2.332 0.009 . 2 . . . . 703 GLU HG2 . 16773 1 1384 . 1 1 128 128 GLU C C 13 176.892 0.200 . 1 . . . . 703 GLU C . 16773 1 1385 . 1 1 128 128 GLU CA C 13 54.834 0.200 . 1 . . . . 703 GLU CA . 16773 1 1386 . 1 1 128 128 GLU CB C 13 33.574 0.200 . 1 . . . . 703 GLU CB . 16773 1 1387 . 1 1 128 128 GLU CG C 13 37.378 0.200 . 1 . . . . 703 GLU CG . 16773 1 1388 . 1 1 128 128 GLU N N 15 117.330 0.200 . 1 . . . . 703 GLU N . 16773 1 1389 . 1 1 129 129 TYR H H 1 9.106 0.020 . 1 . . . . 704 TYR H . 16773 1 1390 . 1 1 129 129 TYR HA H 1 3.939 0.020 . 1 . . . . 704 TYR HA . 16773 1 1391 . 1 1 129 129 TYR HB2 H 1 2.736 0.020 . 2 . . . . 704 TYR HB2 . 16773 1 1392 . 1 1 129 129 TYR HB3 H 1 2.607 0.020 . 2 . . . . 704 TYR HB3 . 16773 1 1393 . 1 1 129 129 TYR HD1 H 1 6.139 0.020 . 1 . . . . 704 TYR HD1 . 16773 1 1394 . 1 1 129 129 TYR HD2 H 1 6.139 0.020 . 1 . . . . 704 TYR HD2 . 16773 1 1395 . 1 1 129 129 TYR HE1 H 1 6.431 0.020 . 1 . . . . 704 TYR HE1 . 16773 1 1396 . 1 1 129 129 TYR HE2 H 1 6.431 0.020 . 1 . . . . 704 TYR HE2 . 16773 1 1397 . 1 1 129 129 TYR C C 13 175.015 0.200 . 1 . . . . 704 TYR C . 16773 1 1398 . 1 1 129 129 TYR CA C 13 58.901 0.200 . 1 . . . . 704 TYR CA . 16773 1 1399 . 1 1 129 129 TYR CB C 13 38.977 0.200 . 1 . . . . 704 TYR CB . 16773 1 1400 . 1 1 129 129 TYR CD1 C 13 132.824 0.200 . 1 . . . . 704 TYR CD1 . 16773 1 1401 . 1 1 129 129 TYR CE1 C 13 117.811 0.200 . 1 . . . . 704 TYR CE1 . 16773 1 1402 . 1 1 129 129 TYR N N 15 126.499 0.200 . 1 . . . . 704 TYR N . 16773 1 1403 . 1 1 130 130 GLN H H 1 7.933 0.020 . 1 . . . . 705 GLN H . 16773 1 1404 . 1 1 130 130 GLN HA H 1 4.225 0.020 . 1 . . . . 705 GLN HA . 16773 1 1405 . 1 1 130 130 GLN HB2 H 1 1.839 0.020 . 2 . . . . 705 GLN HB2 . 16773 1 1406 . 1 1 130 130 GLN HB3 H 1 1.430 0.020 . 2 . . . . 705 GLN HB3 . 16773 1 1407 . 1 1 130 130 GLN HE21 H 1 6.962 0.020 . 2 . . . . 705 GLN HE21 . 16773 1 1408 . 1 1 130 130 GLN HE22 H 1 6.663 0.020 . 2 . . . . 705 GLN HE22 . 16773 1 1409 . 1 1 130 130 GLN HG2 H 1 2.009 0.001 . 2 . . . . 705 GLN HG2 . 16773 1 1410 . 1 1 130 130 GLN HG3 H 1 1.955 0.001 . 2 . . . . 705 GLN HG3 . 16773 1 1411 . 1 1 130 130 GLN C C 13 172.742 0.200 . 1 . . . . 705 GLN C . 16773 1 1412 . 1 1 130 130 GLN CA C 13 56.428 0.200 . 1 . . . . 705 GLN CA . 16773 1 1413 . 1 1 130 130 GLN CB C 13 30.866 0.113 . 1 . . . . 705 GLN CB . 16773 1 1414 . 1 1 130 130 GLN CG C 13 34.426 0.200 . 1 . . . . 705 GLN CG . 16773 1 1415 . 1 1 130 130 GLN N N 15 127.301 0.200 . 1 . . . . 705 GLN N . 16773 1 1416 . 1 1 130 130 GLN NE2 N 15 111.420 0.200 . 1 . . . . 705 GLN NE2 . 16773 1 1417 . 1 1 131 131 GLU H H 1 6.226 0.020 . 1 . . . . 706 GLU H . 16773 1 1418 . 1 1 131 131 GLU HA H 1 3.978 0.020 . 1 . . . . 706 GLU HA . 16773 1 1419 . 1 1 131 131 GLU HB2 H 1 2.164 0.020 . 2 . . . . 706 GLU HB2 . 16773 1 1420 . 1 1 131 131 GLU HB3 H 1 1.841 0.020 . 2 . . . . 706 GLU HB3 . 16773 1 1421 . 1 1 131 131 GLU CA C 13 56.544 0.200 . 1 . . . . 706 GLU CA . 16773 1 1422 . 1 1 131 131 GLU CB C 13 30.866 0.200 . 1 . . . . 706 GLU CB . 16773 1 1423 . 1 1 131 131 GLU N N 15 110.650 0.200 . 1 . . . . 706 GLU N . 16773 1 1424 . 1 1 132 132 GLU H H 1 8.004 0.020 . 1 . . . . 707 GLU H . 16773 1 1425 . 1 1 132 132 GLU HA H 1 4.090 0.020 . 1 . . . . 707 GLU HA . 16773 1 1426 . 1 1 132 132 GLU HB2 H 1 1.736 0.020 . 2 . . . . 707 GLU HB2 . 16773 1 1427 . 1 1 132 132 GLU HB3 H 1 1.588 0.020 . 2 . . . . 707 GLU HB3 . 16773 1 1428 . 1 1 132 132 GLU HG2 H 1 1.443 0.020 . 2 . . . . 707 GLU HG2 . 16773 1 1429 . 1 1 132 132 GLU HG3 H 1 0.929 0.020 . 2 . . . . 707 GLU HG3 . 16773 1 1430 . 1 1 132 132 GLU C C 13 175.354 0.200 . 1 . . . . 707 GLU C . 16773 1 1431 . 1 1 132 132 GLU CA C 13 55.133 0.200 . 1 . . . . 707 GLU CA . 16773 1 1432 . 1 1 132 132 GLU CB C 13 30.543 0.200 . 1 . . . . 707 GLU CB . 16773 1 1433 . 1 1 132 132 GLU CG C 13 34.102 0.200 . 1 . . . . 707 GLU CG . 16773 1 1434 . 1 1 132 132 GLU N N 15 124.258 0.200 . 1 . . . . 707 GLU N . 16773 1 1435 . 1 1 133 133 ASP H H 1 8.830 0.020 . 1 . . . . 708 ASP H . 16773 1 1436 . 1 1 133 133 ASP HA H 1 4.030 0.020 . 1 . . . . 708 ASP HA . 16773 1 1437 . 1 1 133 133 ASP HB2 H 1 3.090 0.020 . 2 . . . . 708 ASP HB2 . 16773 1 1438 . 1 1 133 133 ASP HB3 H 1 2.830 0.020 . 2 . . . . 708 ASP HB3 . 16773 1 1439 . 1 1 133 133 ASP CA C 13 55.133 0.200 . 1 . . . . 708 ASP CA . 16773 1 1440 . 1 1 133 133 ASP CB C 13 44.132 0.200 . 1 . . . . 708 ASP CB . 16773 1 1441 . 1 1 133 133 ASP N N 15 125.294 0.200 . 1 . . . . 708 ASP N . 16773 1 1442 . 1 1 134 134 ASN H H 1 8.890 0.020 . 1 . . . . 709 ASN H . 16773 1 1443 . 1 1 134 134 ASN HA H 1 4.308 0.020 . 1 . . . . 709 ASN HA . 16773 1 1444 . 1 1 134 134 ASN HB2 H 1 3.041 0.020 . 2 . . . . 709 ASN HB2 . 16773 1 1445 . 1 1 134 134 ASN HB3 H 1 2.592 0.015 . 2 . . . . 709 ASN HB3 . 16773 1 1446 . 1 1 134 134 ASN HD21 H 1 6.810 0.020 . 2 . . . . 709 ASN HD21 . 16773 1 1447 . 1 1 134 134 ASN HD22 H 1 6.556 0.020 . 2 . . . . 709 ASN HD22 . 16773 1 1448 . 1 1 134 134 ASN C C 13 175.706 0.200 . 1 . . . . 709 ASN C . 16773 1 1449 . 1 1 134 134 ASN CA C 13 55.133 0.200 . 1 . . . . 709 ASN CA . 16773 1 1450 . 1 1 134 134 ASN CB C 13 37.985 0.200 . 1 . . . . 709 ASN CB . 16773 1 1451 . 1 1 134 134 ASN N N 15 124.010 0.200 . 1 . . . . 709 ASN N . 16773 1 1452 . 1 1 134 134 ASN ND2 N 15 111.193 0.200 . 1 . . . . 709 ASN ND2 . 16773 1 1453 . 1 1 135 135 SER H H 1 8.605 0.020 . 1 . . . . 710 SER H . 16773 1 1454 . 1 1 135 135 SER HA H 1 4.174 0.016 . 1 . . . . 710 SER HA . 16773 1 1455 . 1 1 135 135 SER HB2 H 1 4.230 0.015 . 2 . . . . 710 SER HB2 . 16773 1 1456 . 1 1 135 135 SER HB3 H 1 4.161 0.020 . 2 . . . . 710 SER HB3 . 16773 1 1457 . 1 1 135 135 SER C C 13 172.724 0.200 . 1 . . . . 710 SER C . 16773 1 1458 . 1 1 135 135 SER CA C 13 59.987 0.200 . 1 . . . . 710 SER CA . 16773 1 1459 . 1 1 135 135 SER CB C 13 62.575 0.200 . 1 . . . . 710 SER CB . 16773 1 1460 . 1 1 135 135 SER N N 15 109.623 0.200 . 1 . . . . 710 SER N . 16773 1 1461 . 1 1 136 136 THR H H 1 7.598 0.020 . 1 . . . . 711 THR H . 16773 1 1462 . 1 1 136 136 THR HA H 1 5.209 0.020 . 1 . . . . 711 THR HA . 16773 1 1463 . 1 1 136 136 THR HB H 1 4.043 0.020 . 1 . . . . 711 THR HB . 16773 1 1464 . 1 1 136 136 THR HG21 H 1 1.116 0.020 . 1 . . . . 711 THR QG2 . 16773 1 1465 . 1 1 136 136 THR HG22 H 1 1.116 0.020 . 1 . . . . 711 THR QG2 . 16773 1 1466 . 1 1 136 136 THR HG23 H 1 1.116 0.020 . 1 . . . . 711 THR QG2 . 16773 1 1467 . 1 1 136 136 THR C C 13 172.671 0.200 . 1 . . . . 711 THR C . 16773 1 1468 . 1 1 136 136 THR CA C 13 61.281 0.200 . 1 . . . . 711 THR CA . 16773 1 1469 . 1 1 136 136 THR CB C 13 71.959 0.200 . 1 . . . . 711 THR CB . 16773 1 1470 . 1 1 136 136 THR CG2 C 13 22.477 0.200 . 1 . . . . 711 THR CG2 . 16773 1 1471 . 1 1 136 136 THR N N 15 114.504 0.200 . 1 . . . . 711 THR N . 16773 1 1472 . 1 1 137 137 TYR H H 1 9.636 0.020 . 1 . . . . 712 TYR H . 16773 1 1473 . 1 1 137 137 TYR HA H 1 4.469 0.015 . 1 . . . . 712 TYR HA . 16773 1 1474 . 1 1 137 137 TYR HB2 H 1 3.502 0.020 . 2 . . . . 712 TYR HB2 . 16773 1 1475 . 1 1 137 137 TYR HB3 H 1 2.622 0.020 . 2 . . . . 712 TYR HB3 . 16773 1 1476 . 1 1 137 137 TYR HD1 H 1 7.436 0.001 . 1 . . . . 712 TYR HD1 . 16773 1 1477 . 1 1 137 137 TYR HD2 H 1 7.436 0.001 . 1 . . . . 712 TYR HD2 . 16773 1 1478 . 1 1 137 137 TYR HE1 H 1 6.423 0.001 . 1 . . . . 712 TYR HE1 . 16773 1 1479 . 1 1 137 137 TYR HE2 H 1 6.423 0.001 . 1 . . . . 712 TYR HE2 . 16773 1 1480 . 1 1 137 137 TYR C C 13 174.460 0.200 . 1 . . . . 712 TYR C . 16773 1 1481 . 1 1 137 137 TYR CA C 13 58.830 0.200 . 1 . . . . 712 TYR CA . 16773 1 1482 . 1 1 137 137 TYR CB C 13 39.264 0.200 . 1 . . . . 712 TYR CB . 16773 1 1483 . 1 1 137 137 TYR CD1 C 13 133.600 0.200 . 1 . . . . 712 TYR CD1 . 16773 1 1484 . 1 1 137 137 TYR CE1 C 13 118.070 0.200 . 1 . . . . 712 TYR CE1 . 16773 1 1485 . 1 1 137 137 TYR N N 15 127.148 0.200 . 1 . . . . 712 TYR N . 16773 1 1486 . 1 1 138 138 ASN H H 1 8.429 0.020 . 1 . . . . 713 ASN H . 16773 1 1487 . 1 1 138 138 ASN HA H 1 5.639 0.020 . 1 . . . . 713 ASN HA . 16773 1 1488 . 1 1 138 138 ASN HB2 H 1 2.625 0.020 . 2 . . . . 713 ASN HB2 . 16773 1 1489 . 1 1 138 138 ASN HB3 H 1 2.419 0.020 . 2 . . . . 713 ASN HB3 . 16773 1 1490 . 1 1 138 138 ASN HD21 H 1 7.336 0.020 . 2 . . . . 713 ASN HD21 . 16773 1 1491 . 1 1 138 138 ASN HD22 H 1 6.888 0.020 . 2 . . . . 713 ASN HD22 . 16773 1 1492 . 1 1 138 138 ASN C C 13 173.890 0.200 . 1 . . . . 713 ASN C . 16773 1 1493 . 1 1 138 138 ASN CA C 13 53.430 0.200 . 1 . . . . 713 ASN CA . 16773 1 1494 . 1 1 138 138 ASN CB C 13 41.872 0.200 . 1 . . . . 713 ASN CB . 16773 1 1495 . 1 1 138 138 ASN N N 15 122.468 0.200 . 1 . . . . 713 ASN N . 16773 1 1496 . 1 1 138 138 ASN ND2 N 15 113.115 0.071 . 1 . . . . 713 ASN ND2 . 16773 1 1497 . 1 1 139 139 PHE H H 1 9.048 0.020 . 1 . . . . 714 PHE H . 16773 1 1498 . 1 1 139 139 PHE HA H 1 5.186 0.020 . 1 . . . . 714 PHE HA . 16773 1 1499 . 1 1 139 139 PHE HB2 H 1 2.722 0.020 . 2 . . . . 714 PHE HB2 . 16773 1 1500 . 1 1 139 139 PHE HB3 H 1 2.645 0.020 . 2 . . . . 714 PHE HB3 . 16773 1 1501 . 1 1 139 139 PHE HD1 H 1 6.940 0.001 . 1 . . . . 714 PHE HD1 . 16773 1 1502 . 1 1 139 139 PHE HD2 H 1 6.940 0.001 . 1 . . . . 714 PHE HD2 . 16773 1 1503 . 1 1 139 139 PHE HE1 H 1 6.828 0.020 . 1 . . . . 714 PHE HE1 . 16773 1 1504 . 1 1 139 139 PHE HE2 H 1 6.828 0.020 . 1 . . . . 714 PHE HE2 . 16773 1 1505 . 1 1 139 139 PHE HZ H 1 6.893 0.020 . 1 . . . . 714 PHE HZ . 16773 1 1506 . 1 1 139 139 PHE C C 13 174.506 0.200 . 1 . . . . 714 PHE C . 16773 1 1507 . 1 1 139 139 PHE CA C 13 56.520 0.200 . 1 . . . . 714 PHE CA . 16773 1 1508 . 1 1 139 139 PHE CB C 13 43.162 0.200 . 1 . . . . 714 PHE CB . 16773 1 1509 . 1 1 139 139 PHE CD1 C 13 132.047 0.200 . 1 . . . . 714 PHE CD1 . 16773 1 1510 . 1 1 139 139 PHE CE1 C 13 130.753 0.200 . 1 . . . . 714 PHE CE1 . 16773 1 1511 . 1 1 139 139 PHE CZ C 13 128.941 0.200 . 1 . . . . 714 PHE CZ . 16773 1 1512 . 1 1 139 139 PHE N N 15 119.734 0.200 . 1 . . . . 714 PHE N . 16773 1 1513 . 1 1 140 140 ARG H H 1 9.172 0.020 . 1 . . . . 715 ARG H . 16773 1 1514 . 1 1 140 140 ARG HA H 1 5.131 0.020 . 1 . . . . 715 ARG HA . 16773 1 1515 . 1 1 140 140 ARG HB2 H 1 1.643 0.020 . 2 . . . . 715 ARG HB2 . 16773 1 1516 . 1 1 140 140 ARG HB3 H 1 1.538 0.020 . 2 . . . . 715 ARG HB3 . 16773 1 1517 . 1 1 140 140 ARG HD2 H 1 2.939 0.020 . 2 . . . . 715 ARG HD2 . 16773 1 1518 . 1 1 140 140 ARG HE H 1 7.209 0.020 . 1 . . . . 715 ARG HE . 16773 1 1519 . 1 1 140 140 ARG HG2 H 1 1.300 0.020 . 2 . . . . 715 ARG HG2 . 16773 1 1520 . 1 1 140 140 ARG C C 13 175.001 0.200 . 1 . . . . 715 ARG C . 16773 1 1521 . 1 1 140 140 ARG CA C 13 54.911 0.200 . 1 . . . . 715 ARG CA . 16773 1 1522 . 1 1 140 140 ARG CB C 13 33.903 0.200 . 1 . . . . 715 ARG CB . 16773 1 1523 . 1 1 140 140 ARG CD C 13 44.264 0.200 . 1 . . . . 715 ARG CD . 16773 1 1524 . 1 1 140 140 ARG CG C 13 27.410 0.200 . 1 . . . . 715 ARG CG . 16773 1 1525 . 1 1 140 140 ARG N N 15 123.122 0.200 . 1 . . . . 715 ARG N . 16773 1 1526 . 1 1 140 140 ARG NE N 15 117.073 0.200 . 1 . . . . 715 ARG NE . 16773 1 1527 . 1 1 141 141 TRP H H 1 8.749 0.020 . 1 . . . . 716 TRP H . 16773 1 1528 . 1 1 141 141 TRP HA H 1 4.922 0.010 . 1 . . . . 716 TRP HA . 16773 1 1529 . 1 1 141 141 TRP HB2 H 1 2.929 0.020 . 2 . . . . 716 TRP HB2 . 16773 1 1530 . 1 1 141 141 TRP HB3 H 1 2.208 0.020 . 2 . . . . 716 TRP HB3 . 16773 1 1531 . 1 1 141 141 TRP HD1 H 1 6.802 0.003 . 1 . . . . 716 TRP HD1 . 16773 1 1532 . 1 1 141 141 TRP HE1 H 1 10.859 0.020 . 1 . . . . 716 TRP HE1 . 16773 1 1533 . 1 1 141 141 TRP HE3 H 1 6.694 0.005 . 1 . . . . 716 TRP HE3 . 16773 1 1534 . 1 1 141 141 TRP HH2 H 1 5.554 0.020 . 1 . . . . 716 TRP HH2 . 16773 1 1535 . 1 1 141 141 TRP HZ2 H 1 6.876 0.020 . 1 . . . . 716 TRP HZ2 . 16773 1 1536 . 1 1 141 141 TRP HZ3 H 1 6.097 0.010 . 1 . . . . 716 TRP HZ3 . 16773 1 1537 . 1 1 141 141 TRP C C 13 175.481 0.200 . 1 . . . . 716 TRP C . 16773 1 1538 . 1 1 141 141 TRP CA C 13 55.933 0.200 . 1 . . . . 716 TRP CA . 16773 1 1539 . 1 1 141 141 TRP CB C 13 31.942 0.200 . 1 . . . . 716 TRP CB . 16773 1 1540 . 1 1 141 141 TRP CD1 C 13 123.764 0.200 . 1 . . . . 716 TRP CD1 . 16773 1 1541 . 1 1 141 141 TRP CE3 C 13 119.882 0.200 . 1 . . . . 716 TRP CE3 . 16773 1 1542 . 1 1 141 141 TRP CH2 C 13 124.800 0.200 . 1 . . . . 716 TRP CH2 . 16773 1 1543 . 1 1 141 141 TRP CZ2 C 13 114.964 0.200 . 1 . . . . 716 TRP CZ2 . 16773 1 1544 . 1 1 141 141 TRP CZ3 C 13 119.882 0.200 . 1 . . . . 716 TRP CZ3 . 16773 1 1545 . 1 1 141 141 TRP N N 15 128.581 0.200 . 1 . . . . 716 TRP N . 16773 1 1546 . 1 1 141 141 TRP NE1 N 15 130.128 0.200 . 1 . . . . 716 TRP NE1 . 16773 1 1547 . 1 1 142 142 TYR H H 1 9.248 0.020 . 1 . . . . 717 TYR H . 16773 1 1548 . 1 1 142 142 TYR HA H 1 5.339 0.020 . 1 . . . . 717 TYR HA . 16773 1 1549 . 1 1 142 142 TYR HB2 H 1 3.033 0.015 . 2 . . . . 717 TYR HB2 . 16773 1 1550 . 1 1 142 142 TYR HB3 H 1 2.956 0.015 . 2 . . . . 717 TYR HB3 . 16773 1 1551 . 1 1 142 142 TYR HD1 H 1 7.103 0.004 . 1 . . . . 717 TYR HD1 . 16773 1 1552 . 1 1 142 142 TYR HD2 H 1 7.103 0.004 . 1 . . . . 717 TYR HD2 . 16773 1 1553 . 1 1 142 142 TYR HE1 H 1 6.796 0.003 . 1 . . . . 717 TYR HE1 . 16773 1 1554 . 1 1 142 142 TYR HE2 H 1 6.796 0.003 . 1 . . . . 717 TYR HE2 . 16773 1 1555 . 1 1 142 142 TYR C C 13 176.236 0.200 . 1 . . . . 717 TYR C . 16773 1 1556 . 1 1 142 142 TYR CA C 13 59.073 0.200 . 1 . . . . 717 TYR CA . 16773 1 1557 . 1 1 142 142 TYR CB C 13 38.920 0.200 . 1 . . . . 717 TYR CB . 16773 1 1558 . 1 1 142 142 TYR CD1 C 13 133.859 0.200 . 1 . . . . 717 TYR CD1 . 16773 1 1559 . 1 1 142 142 TYR CE1 C 13 118.329 0.200 . 1 . . . . 717 TYR CE1 . 16773 1 1560 . 1 1 142 142 TYR N N 15 127.792 0.200 . 1 . . . . 717 TYR N . 16773 1 1561 . 1 1 143 143 THR H H 1 9.324 0.020 . 1 . . . . 718 THR H . 16773 1 1562 . 1 1 143 143 THR HA H 1 5.214 0.016 . 1 . . . . 718 THR HA . 16773 1 1563 . 1 1 143 143 THR HB H 1 4.747 0.016 . 1 . . . . 718 THR HB . 16773 1 1564 . 1 1 143 143 THR HG21 H 1 1.159 0.020 . 1 . . . . 718 THR QG2 . 16773 1 1565 . 1 1 143 143 THR HG22 H 1 1.159 0.020 . 1 . . . . 718 THR QG2 . 16773 1 1566 . 1 1 143 143 THR HG23 H 1 1.159 0.020 . 1 . . . . 718 THR QG2 . 16773 1 1567 . 1 1 143 143 THR C C 13 174.940 0.200 . 1 . . . . 718 THR C . 16773 1 1568 . 1 1 143 143 THR CA C 13 59.663 0.200 . 1 . . . . 718 THR CA . 16773 1 1569 . 1 1 143 143 THR CB C 13 70.659 0.200 . 1 . . . . 718 THR CB . 16773 1 1570 . 1 1 143 143 THR CG2 C 13 19.085 0.200 . 1 . . . . 718 THR CG2 . 16773 1 1571 . 1 1 143 143 THR N N 15 118.101 0.200 . 1 . . . . 718 THR N . 16773 1 1572 . 1 1 144 144 SER H H 1 9.773 0.020 . 1 . . . . 719 SER H . 16773 1 1573 . 1 1 144 144 SER HA H 1 4.553 0.015 . 1 . . . . 719 SER HA . 16773 1 1574 . 1 1 144 144 SER HB2 H 1 3.953 0.015 . 2 . . . . 719 SER HB2 . 16773 1 1575 . 1 1 144 144 SER HB3 H 1 3.739 0.015 . 2 . . . . 719 SER HB3 . 16773 1 1576 . 1 1 144 144 SER C C 13 177.402 0.200 . 1 . . . . 719 SER C . 16773 1 1577 . 1 1 144 144 SER CA C 13 62.137 0.200 . 1 . . . . 719 SER CA . 16773 1 1578 . 1 1 144 144 SER CB C 13 64.131 0.200 . 1 . . . . 719 SER CB . 16773 1 1579 . 1 1 144 144 SER N N 15 128.968 0.200 . 1 . . . . 719 SER N . 16773 1 1580 . 1 1 145 145 TYR H H 1 8.348 0.020 . 1 . . . . 720 TYR H . 16773 1 1581 . 1 1 145 145 TYR HA H 1 4.281 0.020 . 1 . . . . 720 TYR HA . 16773 1 1582 . 1 1 145 145 TYR HB2 H 1 3.230 0.020 . 2 . . . . 720 TYR HB2 . 16773 1 1583 . 1 1 145 145 TYR HB3 H 1 2.552 0.020 . 2 . . . . 720 TYR HB3 . 16773 1 1584 . 1 1 145 145 TYR HD1 H 1 7.306 0.002 . 1 . . . . 720 TYR HD1 . 16773 1 1585 . 1 1 145 145 TYR HD2 H 1 7.306 0.002 . 1 . . . . 720 TYR HD2 . 16773 1 1586 . 1 1 145 145 TYR HE1 H 1 6.799 0.016 . 1 . . . . 720 TYR HE1 . 16773 1 1587 . 1 1 145 145 TYR HE2 H 1 6.799 0.016 . 1 . . . . 720 TYR HE2 . 16773 1 1588 . 1 1 145 145 TYR C C 13 174.100 0.200 . 1 . . . . 720 TYR C . 16773 1 1589 . 1 1 145 145 TYR CA C 13 61.217 0.200 . 1 . . . . 720 TYR CA . 16773 1 1590 . 1 1 145 145 TYR CB C 13 37.625 0.200 . 1 . . . . 720 TYR CB . 16773 1 1591 . 1 1 145 145 TYR CD1 C 13 133.342 0.200 . 1 . . . . 720 TYR CD1 . 16773 1 1592 . 1 1 145 145 TYR CE1 C 13 118.329 0.200 . 1 . . . . 720 TYR CE1 . 16773 1 1593 . 1 1 145 145 TYR N N 15 119.873 0.200 . 1 . . . . 720 TYR N . 16773 1 1594 . 1 1 146 146 ALA H H 1 6.912 0.020 . 1 . . . . 721 ALA H . 16773 1 1595 . 1 1 146 146 ALA HA H 1 4.432 0.020 . 1 . . . . 721 ALA HA . 16773 1 1596 . 1 1 146 146 ALA HB1 H 1 1.101 0.020 . 1 . . . . 721 ALA QB . 16773 1 1597 . 1 1 146 146 ALA HB2 H 1 1.101 0.020 . 1 . . . . 721 ALA QB . 16773 1 1598 . 1 1 146 146 ALA HB3 H 1 1.101 0.020 . 1 . . . . 721 ALA QB . 16773 1 1599 . 1 1 146 146 ALA C C 13 174.190 0.200 . 1 . . . . 721 ALA C . 16773 1 1600 . 1 1 146 146 ALA CA C 13 50.979 0.200 . 1 . . . . 721 ALA CA . 16773 1 1601 . 1 1 146 146 ALA CB C 13 18.661 0.200 . 1 . . . . 721 ALA CB . 16773 1 1602 . 1 1 146 146 ALA N N 15 118.547 0.200 . 1 . . . . 721 ALA N . 16773 1 1603 . 1 1 147 147 CYS H H 1 7.342 0.020 . 1 . . . . 722 CYS H . 16773 1 1604 . 1 1 147 147 CYS HA H 1 5.127 0.020 . 1 . . . . 722 CYS HA . 16773 1 1605 . 1 1 147 147 CYS HB2 H 1 3.244 0.020 . 2 . . . . 722 CYS HB2 . 16773 1 1606 . 1 1 147 147 CYS HB3 H 1 3.136 0.015 . 2 . . . . 722 CYS HB3 . 16773 1 1607 . 1 1 147 147 CYS CA C 13 52.221 0.200 . 1 . . . . 722 CYS CA . 16773 1 1608 . 1 1 147 147 CYS CB C 13 41.868 0.200 . 1 . . . . 722 CYS CB . 16773 1 1609 . 1 1 147 147 CYS N N 15 117.747 0.200 . 1 . . . . 722 CYS N . 16773 1 1610 . 1 1 148 148 PRO HA H 1 4.226 0.020 . 1 . . . . 723 PRO HA . 16773 1 1611 . 1 1 148 148 PRO HB2 H 1 2.709 0.015 . 2 . . . . 723 PRO HB2 . 16773 1 1612 . 1 1 148 148 PRO HB3 H 1 1.982 0.020 . 2 . . . . 723 PRO HB3 . 16773 1 1613 . 1 1 148 148 PRO HD2 H 1 4.407 0.016 . 2 . . . . 723 PRO HD2 . 16773 1 1614 . 1 1 148 148 PRO HD3 H 1 3.835 0.020 . 2 . . . . 723 PRO HD3 . 16773 1 1615 . 1 1 148 148 PRO HG2 H 1 2.412 0.016 . 2 . . . . 723 PRO HG2 . 16773 1 1616 . 1 1 148 148 PRO HG3 H 1 2.138 0.016 . 2 . . . . 723 PRO HG3 . 16773 1 1617 . 1 1 148 148 PRO CA C 13 64.193 0.200 . 1 . . . . 723 PRO CA . 16773 1 1618 . 1 1 148 148 PRO CB C 13 32.963 0.166 . 1 . . . . 723 PRO CB . 16773 1 1619 . 1 1 148 148 PRO CD C 13 51.898 0.200 . 1 . . . . 723 PRO CD . 16773 1 1620 . 1 1 148 148 PRO CG C 13 28.278 0.200 . 1 . . . . 723 PRO CG . 16773 1 stop_ save_