################################### # 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 25953 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25953 1 2 '2D 1H-13C HSQC' . . . 25953 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 SER HA H 1 4.465 0.004 . . . . . A 535 SER HA . 25953 1 2 . 1 1 3 3 SER HB2 H 1 3.842 0.003 . . . . . A 535 SER HB2 . 25953 1 3 . 1 1 3 3 SER C C 13 174.718 0.000 . . . . . A 535 SER C . 25953 1 4 . 1 1 3 3 SER CA C 13 58.323 0.004 . . . . . A 535 SER CA . 25953 1 5 . 1 1 3 3 SER CB C 13 63.845 0.007 . . . . . A 535 SER CB . 25953 1 6 . 1 1 4 4 GLU H H 1 8.638 0.004 . . . . . A 536 GLU H . 25953 1 7 . 1 1 4 4 GLU HA H 1 4.201 0.001 . . . . . A 536 GLU HA . 25953 1 8 . 1 1 4 4 GLU HB2 H 1 1.833 0.003 . . . . . A 536 GLU HB2 . 25953 1 9 . 1 1 4 4 GLU HB3 H 1 1.872 0.003 . . . . . A 536 GLU HB3 . 25953 1 10 . 1 1 4 4 GLU HG2 H 1 2.111 0.000 . . . . . A 536 GLU HG2 . 25953 1 11 . 1 1 4 4 GLU HG3 H 1 2.023 0.000 . . . . . A 536 GLU HG3 . 25953 1 12 . 1 1 4 4 GLU C C 13 176.241 0.000 . . . . . A 536 GLU C . 25953 1 13 . 1 1 4 4 GLU CA C 13 57.077 0.000 . . . . . A 536 GLU CA . 25953 1 14 . 1 1 4 4 GLU CB C 13 29.832 0.027 . . . . . A 536 GLU CB . 25953 1 15 . 1 1 4 4 GLU CG C 13 36.054 0.016 . . . . . A 536 GLU CG . 25953 1 16 . 1 1 4 4 GLU N N 15 122.899 0.021 . . . . . A 536 GLU N . 25953 1 17 . 1 1 5 5 PHE H H 1 8.266 0.006 . . . . . A 537 PHE H . 25953 1 18 . 1 1 5 5 PHE HA H 1 4.641 0.001 . . . . . A 537 PHE HA . 25953 1 19 . 1 1 5 5 PHE HB2 H 1 2.988 0.002 . . . . . A 537 PHE HB2 . 25953 1 20 . 1 1 5 5 PHE HB3 H 1 3.178 0.002 . . . . . A 537 PHE HB3 . 25953 1 21 . 1 1 5 5 PHE HD1 H 1 7.240 0.000 . . . . . A 537 PHE HD1 . 25953 1 22 . 1 1 5 5 PHE HD2 H 1 7.240 0.000 . . . . . A 537 PHE HD2 . 25953 1 23 . 1 1 5 5 PHE C C 13 176.005 0.000 . . . . . A 537 PHE C . 25953 1 24 . 1 1 5 5 PHE CA C 13 57.804 0.052 . . . . . A 537 PHE CA . 25953 1 25 . 1 1 5 5 PHE CB C 13 39.450 0.012 . . . . . A 537 PHE CB . 25953 1 26 . 1 1 5 5 PHE N N 15 120.390 0.002 . . . . . A 537 PHE N . 25953 1 27 . 1 1 6 6 SER H H 1 8.194 0.006 . . . . . A 538 SER H . 25953 1 28 . 1 1 6 6 SER HA H 1 4.399 0.003 . . . . . A 538 SER HA . 25953 1 29 . 1 1 6 6 SER HB2 H 1 3.841 0.000 . . . . . A 538 SER HB2 . 25953 1 30 . 1 1 6 6 SER HB3 H 1 3.841 0.000 . . . . . A 538 SER HB3 . 25953 1 31 . 1 1 6 6 SER C C 13 174.167 0.000 . . . . . A 538 SER C . 25953 1 32 . 1 1 6 6 SER CA C 13 58.437 0.030 . . . . . A 538 SER CA . 25953 1 33 . 1 1 6 6 SER CB C 13 63.956 0.011 . . . . . A 538 SER CB . 25953 1 34 . 1 1 6 6 SER N N 15 117.148 0.049 . . . . . A 538 SER N . 25953 1 35 . 1 1 7 7 ASP H H 1 8.333 0.003 . . . . . A 539 ASP H . 25953 1 36 . 1 1 7 7 ASP HA H 1 4.586 0.000 . . . . . A 539 ASP HA . 25953 1 37 . 1 1 7 7 ASP HB2 H 1 2.710 0.002 . . . . . A 539 ASP HB2 . 25953 1 38 . 1 1 7 7 ASP HB3 H 1 2.715 0.000 . . . . . A 539 ASP HB3 . 25953 1 39 . 1 1 7 7 ASP C C 13 176.496 0.000 . . . . . A 539 ASP C . 25953 1 40 . 1 1 7 7 ASP CA C 13 54.471 0.025 . . . . . A 539 ASP CA . 25953 1 41 . 1 1 7 7 ASP CB C 13 41.021 0.040 . . . . . A 539 ASP CB . 25953 1 42 . 1 1 7 7 ASP N N 15 122.404 0.011 . . . . . A 539 ASP N . 25953 1 43 . 1 1 8 8 ARG H H 1 8.293 0.004 . . . . . A 540 ARG H . 25953 1 44 . 1 1 8 8 ARG HA H 1 4.363 0.000 . . . . . A 540 ARG HA . 25953 1 45 . 1 1 8 8 ARG HB2 H 1 1.762 0.002 . . . . . A 540 ARG HB2 . 25953 1 46 . 1 1 8 8 ARG HB3 H 1 1.930 0.001 . . . . . A 540 ARG HB3 . 25953 1 47 . 1 1 8 8 ARG HG2 H 1 1.641 0.000 . . . . . A 540 ARG HG2 . 25953 1 48 . 1 1 8 8 ARG HG3 H 1 1.641 0.000 . . . . . A 540 ARG HG3 . 25953 1 49 . 1 1 8 8 ARG HD2 H 1 3.174 0.000 . . . . . A 540 ARG HD2 . 25953 1 50 . 1 1 8 8 ARG HD3 H 1 3.174 0.000 . . . . . A 540 ARG HD3 . 25953 1 51 . 1 1 8 8 ARG C C 13 176.889 0.000 . . . . . A 540 ARG C . 25953 1 52 . 1 1 8 8 ARG CA C 13 56.406 0.043 . . . . . A 540 ARG CA . 25953 1 53 . 1 1 8 8 ARG CB C 13 30.365 0.044 . . . . . A 540 ARG CB . 25953 1 54 . 1 1 8 8 ARG CG C 13 27.050 0.000 . . . . . A 540 ARG CG . 25953 1 55 . 1 1 8 8 ARG CD C 13 43.328 0.000 . . . . . A 540 ARG CD . 25953 1 56 . 1 1 8 8 ARG N N 15 121.337 0.053 . . . . . A 540 ARG N . 25953 1 57 . 1 1 9 9 SER H H 1 8.369 0.005 . . . . . A 541 SER H . 25953 1 58 . 1 1 9 9 SER HA H 1 4.319 0.005 . . . . . A 541 SER HA . 25953 1 59 . 1 1 9 9 SER HB2 H 1 3.882 0.000 . . . . . A 541 SER HB2 . 25953 1 60 . 1 1 9 9 SER C C 13 175.060 0.000 . . . . . A 541 SER C . 25953 1 61 . 1 1 9 9 SER CA C 13 59.655 0.019 . . . . . A 541 SER CA . 25953 1 62 . 1 1 9 9 SER CB C 13 63.417 0.002 . . . . . A 541 SER CB . 25953 1 63 . 1 1 9 9 SER N N 15 116.606 0.030 . . . . . A 541 SER N . 25953 1 64 . 1 1 10 10 ASN H H 1 8.451 0.006 . . . . . A 542 ASN H . 25953 1 65 . 1 1 10 10 ASN HA H 1 4.700 0.002 . . . . . A 542 ASN HA . 25953 1 66 . 1 1 10 10 ASN HB2 H 1 2.828 0.000 . . . . . A 542 ASN HB2 . 25953 1 67 . 1 1 10 10 ASN HB3 H 1 2.832 0.000 . . . . . A 542 ASN HB3 . 25953 1 68 . 1 1 10 10 ASN HD21 H 1 7.688 0.000 . . . . . A 542 ASN HD21 . 25953 1 69 . 1 1 10 10 ASN HD22 H 1 6.885 0.004 . . . . . A 542 ASN HD22 . 25953 1 70 . 1 1 10 10 ASN C C 13 175.903 0.000 . . . . . A 542 ASN C . 25953 1 71 . 1 1 10 10 ASN CA C 13 53.788 0.028 . . . . . A 542 ASN CA . 25953 1 72 . 1 1 10 10 ASN CB C 13 38.728 0.019 . . . . . A 542 ASN CB . 25953 1 73 . 1 1 10 10 ASN N N 15 120.759 0.013 . . . . . A 542 ASN N . 25953 1 74 . 1 1 10 10 ASN ND2 N 15 112.914 0.019 . . . . . A 542 ASN ND2 . 25953 1 75 . 1 1 11 11 GLU H H 1 8.257 0.003 . . . . . A 543 GLU H . 25953 1 76 . 1 1 11 11 GLU HA H 1 3.991 0.004 . . . . . A 543 GLU HA . 25953 1 77 . 1 1 11 11 GLU HB2 H 1 2.026 0.000 . . . . . A 543 GLU HB2 . 25953 1 78 . 1 1 11 11 GLU HB3 H 1 2.029 0.000 . . . . . A 543 GLU HB3 . 25953 1 79 . 1 1 11 11 GLU HG2 H 1 2.220 0.000 . . . . . A 543 GLU HG2 . 25953 1 80 . 1 1 11 11 GLU HG3 H 1 2.220 0.000 . . . . . A 543 GLU HG3 . 25953 1 81 . 1 1 11 11 GLU C C 13 177.658 0.000 . . . . . A 543 GLU C . 25953 1 82 . 1 1 11 11 GLU CA C 13 58.789 0.070 . . . . . A 543 GLU CA . 25953 1 83 . 1 1 11 11 GLU CB C 13 29.754 0.049 . . . . . A 543 GLU CB . 25953 1 84 . 1 1 11 11 GLU CG C 13 36.233 0.000 . . . . . A 543 GLU CG . 25953 1 85 . 1 1 11 11 GLU N N 15 120.886 0.030 . . . . . A 543 GLU N . 25953 1 86 . 1 1 12 12 LEU H H 1 8.104 0.004 . . . . . A 544 LEU H . 25953 1 87 . 1 1 12 12 LEU HA H 1 4.087 0.002 . . . . . A 544 LEU HA . 25953 1 88 . 1 1 12 12 LEU HB2 H 1 1.738 0.001 . . . . . A 544 LEU HB2 . 25953 1 89 . 1 1 12 12 LEU HB3 H 1 1.561 0.001 . . . . . A 544 LEU HB3 . 25953 1 90 . 1 1 12 12 LEU HG H 1 1.670 0.000 . . . . . A 544 LEU HG . 25953 1 91 . 1 1 12 12 LEU HD11 H 1 0.913 0.000 . . . . . A 544 LEU HD11 . 25953 1 92 . 1 1 12 12 LEU HD12 H 1 0.913 0.000 . . . . . A 544 LEU HD12 . 25953 1 93 . 1 1 12 12 LEU HD13 H 1 0.913 0.000 . . . . . A 544 LEU HD13 . 25953 1 94 . 1 1 12 12 LEU HD21 H 1 0.854 0.000 . . . . . A 544 LEU HD21 . 25953 1 95 . 1 1 12 12 LEU HD22 H 1 0.854 0.000 . . . . . A 544 LEU HD22 . 25953 1 96 . 1 1 12 12 LEU HD23 H 1 0.854 0.000 . . . . . A 544 LEU HD23 . 25953 1 97 . 1 1 12 12 LEU C C 13 179.340 0.000 . . . . . A 544 LEU C . 25953 1 98 . 1 1 12 12 LEU CA C 13 57.198 0.034 . . . . . A 544 LEU CA . 25953 1 99 . 1 1 12 12 LEU CB C 13 41.611 0.039 . . . . . A 544 LEU CB . 25953 1 100 . 1 1 12 12 LEU CG C 13 27.135 0.000 . . . . . A 544 LEU CG . 25953 1 101 . 1 1 12 12 LEU CD1 C 13 24.746 0.040 . . . . . A 544 LEU CD1 . 25953 1 102 . 1 1 12 12 LEU CD2 C 13 23.387 0.020 . . . . . A 544 LEU CD2 . 25953 1 103 . 1 1 12 12 LEU N N 15 119.978 0.028 . . . . . A 544 LEU N . 25953 1 104 . 1 1 13 13 GLU H H 1 7.995 0.002 . . . . . A 545 GLU H . 25953 1 105 . 1 1 13 13 GLU HA H 1 4.060 0.000 . . . . . A 545 GLU HA . 25953 1 106 . 1 1 13 13 GLU HB2 H 1 2.048 0.000 . . . . . A 545 GLU HB2 . 25953 1 107 . 1 1 13 13 GLU HB3 H 1 2.059 0.000 . . . . . A 545 GLU HB3 . 25953 1 108 . 1 1 13 13 GLU HG2 H 1 2.311 0.000 . . . . . A 545 GLU HG2 . 25953 1 109 . 1 1 13 13 GLU HG3 H 1 2.300 0.000 . . . . . A 545 GLU HG3 . 25953 1 110 . 1 1 13 13 GLU C C 13 178.371 0.000 . . . . . A 545 GLU C . 25953 1 111 . 1 1 13 13 GLU CA C 13 58.243 0.007 . . . . . A 545 GLU CA . 25953 1 112 . 1 1 13 13 GLU CB C 13 29.565 0.018 . . . . . A 545 GLU CB . 25953 1 113 . 1 1 13 13 GLU CG C 13 36.372 0.000 . . . . . A 545 GLU CG . 25953 1 114 . 1 1 13 13 GLU N N 15 120.432 0.019 . . . . . A 545 GLU N . 25953 1 115 . 1 1 14 14 ILE H H 1 7.828 0.004 . . . . . A 546 ILE H . 25953 1 116 . 1 1 14 14 ILE HA H 1 3.624 0.001 . . . . . A 546 ILE HA . 25953 1 117 . 1 1 14 14 ILE HB H 1 1.796 0.011 . . . . . A 546 ILE HB . 25953 1 118 . 1 1 14 14 ILE HG12 H 1 1.236 0.001 . . . . . A 546 ILE HG12 . 25953 1 119 . 1 1 14 14 ILE HG13 H 1 0.807 0.006 . . . . . A 546 ILE HG13 . 25953 1 120 . 1 1 14 14 ILE HG21 H 1 0.715 0.001 . . . . . A 546 ILE HG21 . 25953 1 121 . 1 1 14 14 ILE HG22 H 1 0.715 0.001 . . . . . A 546 ILE HG22 . 25953 1 122 . 1 1 14 14 ILE HG23 H 1 0.715 0.001 . . . . . A 546 ILE HG23 . 25953 1 123 . 1 1 14 14 ILE HD11 H 1 0.435 0.005 . . . . . A 546 ILE HD11 . 25953 1 124 . 1 1 14 14 ILE HD12 H 1 0.435 0.005 . . . . . A 546 ILE HD12 . 25953 1 125 . 1 1 14 14 ILE HD13 H 1 0.435 0.005 . . . . . A 546 ILE HD13 . 25953 1 126 . 1 1 14 14 ILE C C 13 178.857 0.000 . . . . . A 546 ILE C . 25953 1 127 . 1 1 14 14 ILE CA C 13 63.839 0.044 . . . . . A 546 ILE CA . 25953 1 128 . 1 1 14 14 ILE CB C 13 37.654 0.028 . . . . . A 546 ILE CB . 25953 1 129 . 1 1 14 14 ILE CG1 C 13 28.018 0.071 . . . . . A 546 ILE CG1 . 25953 1 130 . 1 1 14 14 ILE CG2 C 13 17.576 0.025 . . . . . A 546 ILE CG2 . 25953 1 131 . 1 1 14 14 ILE CD1 C 13 11.646 0.007 . . . . . A 546 ILE CD1 . 25953 1 132 . 1 1 14 14 ILE N N 15 119.751 0.017 . . . . . A 546 ILE N . 25953 1 133 . 1 1 15 15 ARG H H 1 8.313 0.003 . . . . . A 547 ARG H . 25953 1 134 . 1 1 15 15 ARG HA H 1 4.357 0.000 . . . . . A 547 ARG HA . 25953 1 135 . 1 1 15 15 ARG HB2 H 1 1.779 0.000 . . . . . A 547 ARG HB2 . 25953 1 136 . 1 1 15 15 ARG HB3 H 1 1.776 0.000 . . . . . A 547 ARG HB3 . 25953 1 137 . 1 1 15 15 ARG HG2 H 1 1.624 0.000 . . . . . A 547 ARG HG2 . 25953 1 138 . 1 1 15 15 ARG HG3 H 1 1.675 0.000 . . . . . A 547 ARG HG3 . 25953 1 139 . 1 1 15 15 ARG HD2 H 1 3.171 0.000 . . . . . A 547 ARG HD2 . 25953 1 140 . 1 1 15 15 ARG HD3 H 1 3.111 0.000 . . . . . A 547 ARG HD3 . 25953 1 141 . 1 1 15 15 ARG C C 13 176.842 0.000 . . . . . A 547 ARG C . 25953 1 142 . 1 1 15 15 ARG CA C 13 57.875 0.062 . . . . . A 547 ARG CA . 25953 1 143 . 1 1 15 15 ARG CB C 13 30.460 0.048 . . . . . A 547 ARG CB . 25953 1 144 . 1 1 15 15 ARG CG C 13 28.141 0.000 . . . . . A 547 ARG CG . 25953 1 145 . 1 1 15 15 ARG CD C 13 43.338 0.009 . . . . . A 547 ARG CD . 25953 1 146 . 1 1 15 15 ARG N N 15 120.304 0.049 . . . . . A 547 ARG N . 25953 1 147 . 1 1 16 16 GLY H H 1 7.823 0.007 . . . . . A 548 GLY H . 25953 1 148 . 1 1 16 16 GLY HA2 H 1 3.887 0.000 . . . . . A 548 GLY HA2 . 25953 1 149 . 1 1 16 16 GLY HA3 H 1 4.116 0.001 . . . . . A 548 GLY HA3 . 25953 1 150 . 1 1 16 16 GLY C C 13 175.105 0.000 . . . . . A 548 GLY C . 25953 1 151 . 1 1 16 16 GLY CA C 13 45.460 0.017 . . . . . A 548 GLY CA . 25953 1 152 . 1 1 16 16 GLY N N 15 104.777 0.063 . . . . . A 548 GLY N . 25953 1 153 . 1 1 17 17 LYS H H 1 7.257 0.004 . . . . . A 549 LYS H . 25953 1 154 . 1 1 17 17 LYS HA H 1 4.377 0.006 . . . . . A 549 LYS HA . 25953 1 155 . 1 1 17 17 LYS HB2 H 1 1.808 0.000 . . . . . A 549 LYS HB2 . 25953 1 156 . 1 1 17 17 LYS HB3 H 1 1.808 0.000 . . . . . A 549 LYS HB3 . 25953 1 157 . 1 1 17 17 LYS HG2 H 1 1.730 0.000 . . . . . A 549 LYS HG2 . 25953 1 158 . 1 1 17 17 LYS HG3 H 1 1.592 0.000 . . . . . A 549 LYS HG3 . 25953 1 159 . 1 1 17 17 LYS HE2 H 1 3.039 0.000 . . . . . A 549 LYS HE2 . 25953 1 160 . 1 1 17 17 LYS HE3 H 1 2.936 0.000 . . . . . A 549 LYS HE3 . 25953 1 161 . 1 1 17 17 LYS C C 13 175.156 0.000 . . . . . A 549 LYS C . 25953 1 162 . 1 1 17 17 LYS CA C 13 57.373 0.049 . . . . . A 549 LYS CA . 25953 1 163 . 1 1 17 17 LYS CB C 13 32.147 0.008 . . . . . A 549 LYS CB . 25953 1 164 . 1 1 17 17 LYS CG C 13 25.321 0.032 . . . . . A 549 LYS CG . 25953 1 165 . 1 1 17 17 LYS CD C 13 28.694 0.000 . . . . . A 549 LYS CD . 25953 1 166 . 1 1 17 17 LYS CE C 13 42.335 0.043 . . . . . A 549 LYS CE . 25953 1 167 . 1 1 17 17 LYS N N 15 122.134 0.015 . . . . . A 549 LYS N . 25953 1 168 . 1 1 18 18 TYR H H 1 8.108 0.008 . . . . . A 550 TYR H . 25953 1 169 . 1 1 18 18 TYR HA H 1 5.758 0.001 . . . . . A 550 TYR HA . 25953 1 170 . 1 1 18 18 TYR HB2 H 1 3.091 0.000 . . . . . A 550 TYR HB2 . 25953 1 171 . 1 1 18 18 TYR HB3 H 1 3.091 0.000 . . . . . A 550 TYR HB3 . 25953 1 172 . 1 1 18 18 TYR HD1 H 1 7.028 0.000 . . . . . A 550 TYR HD1 . 25953 1 173 . 1 1 18 18 TYR HD2 H 1 7.028 0.000 . . . . . A 550 TYR HD2 . 25953 1 174 . 1 1 18 18 TYR HE1 H 1 6.798 0.000 . . . . . A 550 TYR HE1 . 25953 1 175 . 1 1 18 18 TYR HE2 H 1 6.798 0.000 . . . . . A 550 TYR HE2 . 25953 1 176 . 1 1 18 18 TYR C C 13 174.650 0.000 . . . . . A 550 TYR C . 25953 1 177 . 1 1 18 18 TYR CA C 13 56.030 0.078 . . . . . A 550 TYR CA . 25953 1 178 . 1 1 18 18 TYR CB C 13 42.227 0.017 . . . . . A 550 TYR CB . 25953 1 179 . 1 1 18 18 TYR CD2 C 13 133.423 0.000 . . . . . A 550 TYR CD2 . 25953 1 180 . 1 1 18 18 TYR CE2 C 13 118.222 0.000 . . . . . A 550 TYR CE2 . 25953 1 181 . 1 1 18 18 TYR N N 15 117.482 0.049 . . . . . A 550 TYR N . 25953 1 182 . 1 1 19 19 VAL H H 1 8.549 0.003 . . . . . A 551 VAL H . 25953 1 183 . 1 1 19 19 VAL HA H 1 4.459 0.005 . . . . . A 551 VAL HA . 25953 1 184 . 1 1 19 19 VAL HB H 1 2.150 0.000 . . . . . A 551 VAL HB . 25953 1 185 . 1 1 19 19 VAL HG11 H 1 1.102 0.000 . . . . . A 551 VAL HG11 . 25953 1 186 . 1 1 19 19 VAL HG12 H 1 1.102 0.000 . . . . . A 551 VAL HG12 . 25953 1 187 . 1 1 19 19 VAL HG13 H 1 1.102 0.000 . . . . . A 551 VAL HG13 . 25953 1 188 . 1 1 19 19 VAL HG21 H 1 1.060 0.000 . . . . . A 551 VAL HG21 . 25953 1 189 . 1 1 19 19 VAL HG22 H 1 1.060 0.000 . . . . . A 551 VAL HG22 . 25953 1 190 . 1 1 19 19 VAL HG23 H 1 1.060 0.000 . . . . . A 551 VAL HG23 . 25953 1 191 . 1 1 19 19 VAL C C 13 174.974 0.000 . . . . . A 551 VAL C . 25953 1 192 . 1 1 19 19 VAL CA C 13 60.038 0.063 . . . . . A 551 VAL CA . 25953 1 193 . 1 1 19 19 VAL CB C 13 36.793 0.020 . . . . . A 551 VAL CB . 25953 1 194 . 1 1 19 19 VAL CG1 C 13 21.877 0.001 . . . . . A 551 VAL CG1 . 25953 1 195 . 1 1 19 19 VAL CG2 C 13 22.775 0.017 . . . . . A 551 VAL CG2 . 25953 1 196 . 1 1 19 19 VAL N N 15 117.964 0.108 . . . . . A 551 VAL N . 25953 1 197 . 1 1 20 20 VAL H H 1 8.642 0.007 . . . . . A 552 VAL H . 25953 1 198 . 1 1 20 20 VAL HA H 1 4.159 0.000 . . . . . A 552 VAL HA . 25953 1 199 . 1 1 20 20 VAL HB H 1 1.872 0.001 . . . . . A 552 VAL HB . 25953 1 200 . 1 1 20 20 VAL HG11 H 1 1.010 0.000 . . . . . A 552 VAL HG11 . 25953 1 201 . 1 1 20 20 VAL HG12 H 1 1.010 0.000 . . . . . A 552 VAL HG12 . 25953 1 202 . 1 1 20 20 VAL HG13 H 1 1.010 0.000 . . . . . A 552 VAL HG13 . 25953 1 203 . 1 1 20 20 VAL HG21 H 1 1.044 0.000 . . . . . A 552 VAL HG21 . 25953 1 204 . 1 1 20 20 VAL HG22 H 1 1.044 0.000 . . . . . A 552 VAL HG22 . 25953 1 205 . 1 1 20 20 VAL HG23 H 1 1.044 0.000 . . . . . A 552 VAL HG23 . 25953 1 206 . 1 1 20 20 VAL C C 13 175.545 0.000 . . . . . A 552 VAL C . 25953 1 207 . 1 1 20 20 VAL CA C 13 63.152 0.039 . . . . . A 552 VAL CA . 25953 1 208 . 1 1 20 20 VAL CB C 13 31.958 0.036 . . . . . A 552 VAL CB . 25953 1 209 . 1 1 20 20 VAL CG1 C 13 21.150 0.006 . . . . . A 552 VAL CG1 . 25953 1 210 . 1 1 20 20 VAL CG2 C 13 22.369 0.045 . . . . . A 552 VAL CG2 . 25953 1 211 . 1 1 20 20 VAL N N 15 126.679 0.028 . . . . . A 552 VAL N . 25953 1 212 . 1 1 21 21 VAL H H 1 8.341 0.003 . . . . . A 553 VAL H . 25953 1 213 . 1 1 21 21 VAL HA H 1 2.459 0.000 . . . . . A 553 VAL HA . 25953 1 214 . 1 1 21 21 VAL HB H 1 1.463 0.000 . . . . . A 553 VAL HB . 25953 1 215 . 1 1 21 21 VAL HG11 H 1 -0.362 0.000 . . . . . A 553 VAL HG11 . 25953 1 216 . 1 1 21 21 VAL HG12 H 1 -0.362 0.000 . . . . . A 553 VAL HG12 . 25953 1 217 . 1 1 21 21 VAL HG13 H 1 -0.362 0.000 . . . . . A 553 VAL HG13 . 25953 1 218 . 1 1 21 21 VAL HG21 H 1 0.317 0.000 . . . . . A 553 VAL HG21 . 25953 1 219 . 1 1 21 21 VAL HG22 H 1 0.317 0.000 . . . . . A 553 VAL HG22 . 25953 1 220 . 1 1 21 21 VAL HG23 H 1 0.317 0.000 . . . . . A 553 VAL HG23 . 25953 1 221 . 1 1 21 21 VAL CA C 13 61.168 0.000 . . . . . A 553 VAL CA . 25953 1 222 . 1 1 21 21 VAL CB C 13 31.384 0.000 . . . . . A 553 VAL CB . 25953 1 223 . 1 1 21 21 VAL CG1 C 13 20.461 0.000 . . . . . A 553 VAL CG1 . 25953 1 224 . 1 1 21 21 VAL CG2 C 13 20.151 0.000 . . . . . A 553 VAL CG2 . 25953 1 225 . 1 1 21 21 VAL N N 15 129.744 0.027 . . . . . A 553 VAL N . 25953 1 226 . 1 1 22 22 PRO HA H 1 4.388 0.004 . . . . . A 554 PRO HA . 25953 1 227 . 1 1 22 22 PRO HB2 H 1 1.887 0.002 . . . . . A 554 PRO HB2 . 25953 1 228 . 1 1 22 22 PRO HB3 H 1 2.282 0.002 . . . . . A 554 PRO HB3 . 25953 1 229 . 1 1 22 22 PRO HG2 H 1 1.889 0.000 . . . . . A 554 PRO HG2 . 25953 1 230 . 1 1 22 22 PRO HG3 H 1 1.889 0.000 . . . . . A 554 PRO HG3 . 25953 1 231 . 1 1 22 22 PRO HD2 H 1 2.797 0.005 . . . . . A 554 PRO HD2 . 25953 1 232 . 1 1 22 22 PRO HD3 H 1 3.276 0.006 . . . . . A 554 PRO HD3 . 25953 1 233 . 1 1 22 22 PRO C C 13 178.374 0.000 . . . . . A 554 PRO C . 25953 1 234 . 1 1 22 22 PRO CA C 13 62.576 0.042 . . . . . A 554 PRO CA . 25953 1 235 . 1 1 22 22 PRO CB C 13 32.755 0.028 . . . . . A 554 PRO CB . 25953 1 236 . 1 1 22 22 PRO CG C 13 27.055 0.041 . . . . . A 554 PRO CG . 25953 1 237 . 1 1 22 22 PRO CD C 13 51.907 0.022 . . . . . A 554 PRO CD . 25953 1 238 . 1 1 23 23 GLU H H 1 8.904 0.006 . . . . . A 555 GLU H . 25953 1 239 . 1 1 23 23 GLU HA H 1 4.054 0.001 . . . . . A 555 GLU HA . 25953 1 240 . 1 1 23 23 GLU HB2 H 1 2.076 0.000 . . . . . A 555 GLU HB2 . 25953 1 241 . 1 1 23 23 GLU HB3 H 1 2.076 0.000 . . . . . A 555 GLU HB3 . 25953 1 242 . 1 1 23 23 GLU HG2 H 1 2.314 0.000 . . . . . A 555 GLU HG2 . 25953 1 243 . 1 1 23 23 GLU HG3 H 1 2.302 0.000 . . . . . A 555 GLU HG3 . 25953 1 244 . 1 1 23 23 GLU C C 13 176.757 0.000 . . . . . A 555 GLU C . 25953 1 245 . 1 1 23 23 GLU CA C 13 58.501 0.044 . . . . . A 555 GLU CA . 25953 1 246 . 1 1 23 23 GLU CB C 13 29.413 0.015 . . . . . A 555 GLU CB . 25953 1 247 . 1 1 23 23 GLU CG C 13 36.155 0.000 . . . . . A 555 GLU CG . 25953 1 248 . 1 1 23 23 GLU N N 15 122.440 0.034 . . . . . A 555 GLU N . 25953 1 249 . 1 1 24 24 THR H H 1 7.160 0.002 . . . . . A 556 THR H . 25953 1 250 . 1 1 24 24 THR HA H 1 4.152 0.003 . . . . . A 556 THR HA . 25953 1 251 . 1 1 24 24 THR HB H 1 4.486 0.000 . . . . . A 556 THR HB . 25953 1 252 . 1 1 24 24 THR HG21 H 1 1.252 0.001 . . . . . A 556 THR HG21 . 25953 1 253 . 1 1 24 24 THR HG22 H 1 1.252 0.001 . . . . . A 556 THR HG22 . 25953 1 254 . 1 1 24 24 THR HG23 H 1 1.252 0.001 . . . . . A 556 THR HG23 . 25953 1 255 . 1 1 24 24 THR C C 13 175.161 0.000 . . . . . A 556 THR C . 25953 1 256 . 1 1 24 24 THR CA C 13 61.379 0.033 . . . . . A 556 THR CA . 25953 1 257 . 1 1 24 24 THR CB C 13 68.976 0.045 . . . . . A 556 THR CB . 25953 1 258 . 1 1 24 24 THR CG2 C 13 22.136 0.006 . . . . . A 556 THR CG2 . 25953 1 259 . 1 1 24 24 THR N N 15 104.703 0.035 . . . . . A 556 THR N . 25953 1 260 . 1 1 25 25 SER H H 1 7.405 0.003 . . . . . A 557 SER H . 25953 1 261 . 1 1 25 25 SER HA H 1 4.529 0.002 . . . . . A 557 SER HA . 25953 1 262 . 1 1 25 25 SER HB2 H 1 3.823 0.001 . . . . . A 557 SER HB2 . 25953 1 263 . 1 1 25 25 SER HB3 H 1 3.824 0.000 . . . . . A 557 SER HB3 . 25953 1 264 . 1 1 25 25 SER C C 13 175.325 0.000 . . . . . A 557 SER C . 25953 1 265 . 1 1 25 25 SER CA C 13 58.036 0.082 . . . . . A 557 SER CA . 25953 1 266 . 1 1 25 25 SER CB C 13 63.214 0.033 . . . . . A 557 SER CB . 25953 1 267 . 1 1 25 25 SER N N 15 116.705 0.018 . . . . . A 557 SER N . 25953 1 268 . 1 1 26 26 GLN H H 1 8.915 0.009 . . . . . A 558 GLN H . 25953 1 269 . 1 1 26 26 GLN HA H 1 4.169 0.001 . . . . . A 558 GLN HA . 25953 1 270 . 1 1 26 26 GLN HB2 H 1 2.067 0.000 . . . . . A 558 GLN HB2 . 25953 1 271 . 1 1 26 26 GLN HB3 H 1 2.082 0.000 . . . . . A 558 GLN HB3 . 25953 1 272 . 1 1 26 26 GLN HG2 H 1 2.407 0.000 . . . . . A 558 GLN HG2 . 25953 1 273 . 1 1 26 26 GLN HG3 H 1 2.400 0.000 . . . . . A 558 GLN HG3 . 25953 1 274 . 1 1 26 26 GLN HE21 H 1 6.837 0.001 . . . . . A 558 GLN HE21 . 25953 1 275 . 1 1 26 26 GLN HE22 H 1 7.517 0.001 . . . . . A 558 GLN HE22 . 25953 1 276 . 1 1 26 26 GLN C C 13 176.491 0.000 . . . . . A 558 GLN C . 25953 1 277 . 1 1 26 26 GLN CA C 13 57.594 0.008 . . . . . A 558 GLN CA . 25953 1 278 . 1 1 26 26 GLN CB C 13 28.773 0.024 . . . . . A 558 GLN CB . 25953 1 279 . 1 1 26 26 GLN CG C 13 34.009 0.000 . . . . . A 558 GLN CG . 25953 1 280 . 1 1 26 26 GLN N N 15 127.356 0.023 . . . . . A 558 GLN N . 25953 1 281 . 1 1 26 26 GLN NE2 N 15 112.733 0.018 . . . . . A 558 GLN NE2 . 25953 1 282 . 1 1 27 27 ASP H H 1 8.275 0.003 . . . . . A 559 ASP H . 25953 1 283 . 1 1 27 27 ASP HA H 1 4.485 0.001 . . . . . A 559 ASP HA . 25953 1 284 . 1 1 27 27 ASP HB2 H 1 2.627 0.002 . . . . . A 559 ASP HB2 . 25953 1 285 . 1 1 27 27 ASP HB3 H 1 2.803 0.000 . . . . . A 559 ASP HB3 . 25953 1 286 . 1 1 27 27 ASP C C 13 175.554 0.000 . . . . . A 559 ASP C . 25953 1 287 . 1 1 27 27 ASP CA C 13 53.203 0.037 . . . . . A 559 ASP CA . 25953 1 288 . 1 1 27 27 ASP CB C 13 40.526 0.007 . . . . . A 559 ASP CB . 25953 1 289 . 1 1 27 27 ASP N N 15 116.840 0.034 . . . . . A 559 ASP N . 25953 1 290 . 1 1 28 28 MET H H 1 7.935 0.003 . . . . . A 560 MET H . 25953 1 291 . 1 1 28 28 MET HA H 1 3.899 0.008 . . . . . A 560 MET HA . 25953 1 292 . 1 1 28 28 MET HB2 H 1 1.787 0.002 . . . . . A 560 MET HB2 . 25953 1 293 . 1 1 28 28 MET HB3 H 1 2.332 0.003 . . . . . A 560 MET HB3 . 25953 1 294 . 1 1 28 28 MET HG2 H 1 2.062 0.000 . . . . . A 560 MET HG2 . 25953 1 295 . 1 1 28 28 MET HG3 H 1 2.123 0.000 . . . . . A 560 MET HG3 . 25953 1 296 . 1 1 28 28 MET HE1 H 1 1.074 0.000 . . . . . A 560 MET HE1 . 25953 1 297 . 1 1 28 28 MET HE2 H 1 1.074 0.000 . . . . . A 560 MET HE2 . 25953 1 298 . 1 1 28 28 MET HE3 H 1 1.074 0.000 . . . . . A 560 MET HE3 . 25953 1 299 . 1 1 28 28 MET C C 13 175.044 0.000 . . . . . A 560 MET C . 25953 1 300 . 1 1 28 28 MET CA C 13 56.400 0.041 . . . . . A 560 MET CA . 25953 1 301 . 1 1 28 28 MET CB C 13 30.933 0.040 . . . . . A 560 MET CB . 25953 1 302 . 1 1 28 28 MET CG C 13 32.096 0.000 . . . . . A 560 MET CG . 25953 1 303 . 1 1 28 28 MET CE C 13 16.567 0.000 . . . . . A 560 MET CE . 25953 1 304 . 1 1 28 28 MET N N 15 112.866 0.050 . . . . . A 560 MET N . 25953 1 305 . 1 1 29 29 ALA H H 1 7.910 0.002 . . . . . A 561 ALA H . 25953 1 306 . 1 1 29 29 ALA HA H 1 5.911 0.001 . . . . . A 561 ALA HA . 25953 1 307 . 1 1 29 29 ALA HB1 H 1 1.137 0.003 . . . . . A 561 ALA HB1 . 25953 1 308 . 1 1 29 29 ALA HB2 H 1 1.137 0.003 . . . . . A 561 ALA HB2 . 25953 1 309 . 1 1 29 29 ALA HB3 H 1 1.137 0.003 . . . . . A 561 ALA HB3 . 25953 1 310 . 1 1 29 29 ALA C C 13 176.577 0.000 . . . . . A 561 ALA C . 25953 1 311 . 1 1 29 29 ALA CA C 13 50.977 0.074 . . . . . A 561 ALA CA . 25953 1 312 . 1 1 29 29 ALA CB C 13 23.287 0.028 . . . . . A 561 ALA CB . 25953 1 313 . 1 1 29 29 ALA N N 15 122.207 0.019 . . . . . A 561 ALA N . 25953 1 314 . 1 1 30 30 PHE H H 1 8.075 0.002 . . . . . A 562 PHE H . 25953 1 315 . 1 1 30 30 PHE HA H 1 4.636 0.002 . . . . . A 562 PHE HA . 25953 1 316 . 1 1 30 30 PHE HB2 H 1 2.761 0.002 . . . . . A 562 PHE HB2 . 25953 1 317 . 1 1 30 30 PHE HB3 H 1 2.233 0.000 . . . . . A 562 PHE HB3 . 25953 1 318 . 1 1 30 30 PHE C C 13 170.988 0.000 . . . . . A 562 PHE C . 25953 1 319 . 1 1 30 30 PHE CA C 13 56.230 0.100 . . . . . A 562 PHE CA . 25953 1 320 . 1 1 30 30 PHE CB C 13 41.046 0.013 . . . . . A 562 PHE CB . 25953 1 321 . 1 1 30 30 PHE N N 15 117.027 0.014 . . . . . A 562 PHE N . 25953 1 322 . 1 1 31 31 LYS H H 1 8.392 0.004 . . . . . A 563 LYS H . 25953 1 323 . 1 1 31 31 LYS HA H 1 4.500 0.002 . . . . . A 563 LYS HA . 25953 1 324 . 1 1 31 31 LYS HB2 H 1 1.415 0.001 . . . . . A 563 LYS HB2 . 25953 1 325 . 1 1 31 31 LYS HB3 H 1 1.420 0.000 . . . . . A 563 LYS HB3 . 25953 1 326 . 1 1 31 31 LYS HG2 H 1 0.958 0.000 . . . . . A 563 LYS HG2 . 25953 1 327 . 1 1 31 31 LYS HG3 H 1 0.960 0.000 . . . . . A 563 LYS HG3 . 25953 1 328 . 1 1 31 31 LYS HD2 H 1 1.504 0.000 . . . . . A 563 LYS HD2 . 25953 1 329 . 1 1 31 31 LYS HD3 H 1 1.501 0.000 . . . . . A 563 LYS HD3 . 25953 1 330 . 1 1 31 31 LYS HE2 H 1 2.850 0.000 . . . . . A 563 LYS HE2 . 25953 1 331 . 1 1 31 31 LYS HE3 H 1 2.849 0.000 . . . . . A 563 LYS HE3 . 25953 1 332 . 1 1 31 31 LYS C C 13 176.093 0.000 . . . . . A 563 LYS C . 25953 1 333 . 1 1 31 31 LYS CA C 13 53.802 0.076 . . . . . A 563 LYS CA . 25953 1 334 . 1 1 31 31 LYS CB C 13 33.679 0.018 . . . . . A 563 LYS CB . 25953 1 335 . 1 1 31 31 LYS CG C 13 24.366 0.000 . . . . . A 563 LYS CG . 25953 1 336 . 1 1 31 31 LYS CD C 13 29.224 0.000 . . . . . A 563 LYS CD . 25953 1 337 . 1 1 31 31 LYS CE C 13 41.649 0.000 . . . . . A 563 LYS CE . 25953 1 338 . 1 1 31 31 LYS N N 15 120.420 0.028 . . . . . A 563 LYS N . 25953 1 339 . 1 1 32 32 CY2 H H 1 8.456 0.004 . . . . . A 564 CY2 H . 25953 1 340 . 1 1 32 32 CY2 HA H 1 4.639 0.000 . . . . . A 564 CY2 HA . 25953 1 341 . 1 1 32 32 CY2 HB2 H 1 3.448 0.000 . . . . . A 564 CY2 HB2 . 25953 1 342 . 1 1 32 32 CY2 HB3 H 1 2.257 0.000 . . . . . A 564 CY2 HB3 . 25953 1 343 . 1 1 32 32 CY2 C C 13 175.820 0.000 . . . . . A 564 CY2 C . 25953 1 344 . 1 1 32 32 CY2 CA C 13 57.545 0.055 . . . . . A 564 CY2 CA . 25953 1 345 . 1 1 32 32 CY2 CB C 13 30.650 0.041 . . . . . A 564 CY2 CB . 25953 1 346 . 1 1 32 32 CY2 N N 15 132.535 0.021 . . . . . A 564 CY2 N . 25953 1 347 . 1 1 33 33 PRO HA H 1 4.380 0.003 . . . . . A 565 PRO HA . 25953 1 348 . 1 1 33 33 PRO HB2 H 1 2.446 0.005 . . . . . A 565 PRO HB2 . 25953 1 349 . 1 1 33 33 PRO HB3 H 1 1.939 0.005 . . . . . A 565 PRO HB3 . 25953 1 350 . 1 1 33 33 PRO HG2 H 1 1.420 0.000 . . . . . A 565 PRO HG2 . 25953 1 351 . 1 1 33 33 PRO HG3 H 1 1.771 0.000 . . . . . A 565 PRO HG3 . 25953 1 352 . 1 1 33 33 PRO HD2 H 1 3.711 0.000 . . . . . A 565 PRO HD2 . 25953 1 353 . 1 1 33 33 PRO HD3 H 1 4.453 0.000 . . . . . A 565 PRO HD3 . 25953 1 354 . 1 1 33 33 PRO C C 13 177.300 0.000 . . . . . A 565 PRO C . 25953 1 355 . 1 1 33 33 PRO CA C 13 64.393 0.014 . . . . . A 565 PRO CA . 25953 1 356 . 1 1 33 33 PRO CB C 13 33.005 0.025 . . . . . A 565 PRO CB . 25953 1 357 . 1 1 33 33 PRO CG C 13 27.715 0.000 . . . . . A 565 PRO CG . 25953 1 358 . 1 1 33 33 PRO CD C 13 52.309 0.029 . . . . . A 565 PRO CD . 25953 1 359 . 1 1 34 34 ILE H H 1 8.528 0.003 . . . . . A 566 ILE H . 25953 1 360 . 1 1 34 34 ILE HA H 1 4.131 0.001 . . . . . A 566 ILE HA . 25953 1 361 . 1 1 34 34 ILE HB H 1 2.014 0.005 . . . . . A 566 ILE HB . 25953 1 362 . 1 1 34 34 ILE HG12 H 1 1.421 0.000 . . . . . A 566 ILE HG12 . 25953 1 363 . 1 1 34 34 ILE HG13 H 1 1.883 0.000 . . . . . A 566 ILE HG13 . 25953 1 364 . 1 1 34 34 ILE HG21 H 1 1.040 0.000 . . . . . A 566 ILE HG21 . 25953 1 365 . 1 1 34 34 ILE HG22 H 1 1.040 0.000 . . . . . A 566 ILE HG22 . 25953 1 366 . 1 1 34 34 ILE HG23 H 1 1.040 0.000 . . . . . A 566 ILE HG23 . 25953 1 367 . 1 1 34 34 ILE HD11 H 1 0.956 0.000 . . . . . A 566 ILE HD11 . 25953 1 368 . 1 1 34 34 ILE HD12 H 1 0.956 0.000 . . . . . A 566 ILE HD12 . 25953 1 369 . 1 1 34 34 ILE HD13 H 1 0.956 0.000 . . . . . A 566 ILE HD13 . 25953 1 370 . 1 1 34 34 ILE C C 13 176.361 0.000 . . . . . A 566 ILE C . 25953 1 371 . 1 1 34 34 ILE CA C 13 63.699 0.074 . . . . . A 566 ILE CA . 25953 1 372 . 1 1 34 34 ILE CB C 13 38.797 0.023 . . . . . A 566 ILE CB . 25953 1 373 . 1 1 34 34 ILE CG1 C 13 28.706 0.048 . . . . . A 566 ILE CG1 . 25953 1 374 . 1 1 34 34 ILE CG2 C 13 16.753 0.026 . . . . . A 566 ILE CG2 . 25953 1 375 . 1 1 34 34 ILE CD1 C 13 13.290 0.082 . . . . . A 566 ILE CD1 . 25953 1 376 . 1 1 34 34 ILE N N 15 118.529 0.021 . . . . . A 566 ILE N . 25953 1 377 . 1 1 35 35 CY2 H H 1 7.770 0.003 . . . . . A 567 CY2 H . 25953 1 378 . 1 1 35 35 CY2 HA H 1 4.932 0.000 . . . . . A 567 CY2 HA . 25953 1 379 . 1 1 35 35 CY2 HB2 H 1 3.316 0.000 . . . . . A 567 CY2 HB2 . 25953 1 380 . 1 1 35 35 CY2 HB3 H 1 3.055 0.003 . . . . . A 567 CY2 HB3 . 25953 1 381 . 1 1 35 35 CY2 C C 13 176.175 0.000 . . . . . A 567 CY2 C . 25953 1 382 . 1 1 35 35 CY2 CA C 13 58.801 0.049 . . . . . A 567 CY2 CA . 25953 1 383 . 1 1 35 35 CY2 CB C 13 31.243 0.011 . . . . . A 567 CY2 CB . 25953 1 384 . 1 1 35 35 CY2 N N 15 116.646 0.023 . . . . . A 567 CY2 N . 25953 1 385 . 1 1 36 36 LYS H H 1 8.038 0.002 . . . . . A 568 LYS H . 25953 1 386 . 1 1 36 36 LYS HA H 1 4.015 0.001 . . . . . A 568 LYS HA . 25953 1 387 . 1 1 36 36 LYS HB2 H 1 2.268 0.007 . . . . . A 568 LYS HB2 . 25953 1 388 . 1 1 36 36 LYS HB3 H 1 2.004 0.003 . . . . . A 568 LYS HB3 . 25953 1 389 . 1 1 36 36 LYS HG2 H 1 1.254 0.000 . . . . . A 568 LYS HG2 . 25953 1 390 . 1 1 36 36 LYS HG3 H 1 1.328 0.000 . . . . . A 568 LYS HG3 . 25953 1 391 . 1 1 36 36 LYS HD2 H 1 1.541 0.000 . . . . . A 568 LYS HD2 . 25953 1 392 . 1 1 36 36 LYS HD3 H 1 1.617 0.000 . . . . . A 568 LYS HD3 . 25953 1 393 . 1 1 36 36 LYS HE2 H 1 2.987 0.000 . . . . . A 568 LYS HE2 . 25953 1 394 . 1 1 36 36 LYS HE3 H 1 2.987 0.000 . . . . . A 568 LYS HE3 . 25953 1 395 . 1 1 36 36 LYS C C 13 175.290 0.000 . . . . . A 568 LYS C . 25953 1 396 . 1 1 36 36 LYS CA C 13 57.874 0.000 . . . . . A 568 LYS CA . 25953 1 397 . 1 1 36 36 LYS CB C 13 28.635 0.039 . . . . . A 568 LYS CB . 25953 1 398 . 1 1 36 36 LYS CG C 13 25.170 0.000 . . . . . A 568 LYS CG . 25953 1 399 . 1 1 36 36 LYS CE C 13 42.556 0.000 . . . . . A 568 LYS CE . 25953 1 400 . 1 1 36 36 LYS N N 15 116.867 0.017 . . . . . A 568 LYS N . 25953 1 401 . 1 1 37 37 GLU H H 1 8.380 0.003 . . . . . A 569 GLU H . 25953 1 402 . 1 1 37 37 GLU HA H 1 4.472 0.003 . . . . . A 569 GLU HA . 25953 1 403 . 1 1 37 37 GLU HB2 H 1 2.112 0.000 . . . . . A 569 GLU HB2 . 25953 1 404 . 1 1 37 37 GLU HB3 H 1 2.107 0.000 . . . . . A 569 GLU HB3 . 25953 1 405 . 1 1 37 37 GLU HG2 H 1 2.292 0.000 . . . . . A 569 GLU HG2 . 25953 1 406 . 1 1 37 37 GLU HG3 H 1 2.292 0.000 . . . . . A 569 GLU HG3 . 25953 1 407 . 1 1 37 37 GLU C C 13 175.851 0.000 . . . . . A 569 GLU C . 25953 1 408 . 1 1 37 37 GLU CA C 13 56.201 0.058 . . . . . A 569 GLU CA . 25953 1 409 . 1 1 37 37 GLU CB C 13 31.343 0.024 . . . . . A 569 GLU CB . 25953 1 410 . 1 1 37 37 GLU CG C 13 36.543 0.018 . . . . . A 569 GLU CG . 25953 1 411 . 1 1 37 37 GLU N N 15 120.683 0.034 . . . . . A 569 GLU N . 25953 1 412 . 1 1 38 38 THR H H 1 8.565 0.008 . . . . . A 570 THR H . 25953 1 413 . 1 1 38 38 THR HA H 1 4.378 0.002 . . . . . A 570 THR HA . 25953 1 414 . 1 1 38 38 THR HB H 1 3.833 0.003 . . . . . A 570 THR HB . 25953 1 415 . 1 1 38 38 THR HG21 H 1 0.896 0.000 . . . . . A 570 THR HG21 . 25953 1 416 . 1 1 38 38 THR HG22 H 1 0.896 0.000 . . . . . A 570 THR HG22 . 25953 1 417 . 1 1 38 38 THR HG23 H 1 0.896 0.000 . . . . . A 570 THR HG23 . 25953 1 418 . 1 1 38 38 THR C C 13 174.070 0.000 . . . . . A 570 THR C . 25953 1 419 . 1 1 38 38 THR CA C 13 63.174 0.064 . . . . . A 570 THR CA . 25953 1 420 . 1 1 38 38 THR CB C 13 69.853 0.060 . . . . . A 570 THR CB . 25953 1 421 . 1 1 38 38 THR CG2 C 13 21.882 0.036 . . . . . A 570 THR CG2 . 25953 1 422 . 1 1 38 38 THR N N 15 118.082 0.019 . . . . . A 570 THR N . 25953 1 423 . 1 1 39 39 VAL H H 1 8.740 0.003 . . . . . A 571 VAL H . 25953 1 424 . 1 1 39 39 VAL HA H 1 3.871 0.002 . . . . . A 571 VAL HA . 25953 1 425 . 1 1 39 39 VAL HB H 1 0.097 0.002 . . . . . A 571 VAL HB . 25953 1 426 . 1 1 39 39 VAL HG11 H 1 0.020 0.000 . . . . . A 571 VAL HG11 . 25953 1 427 . 1 1 39 39 VAL HG12 H 1 0.020 0.000 . . . . . A 571 VAL HG12 . 25953 1 428 . 1 1 39 39 VAL HG13 H 1 0.020 0.000 . . . . . A 571 VAL HG13 . 25953 1 429 . 1 1 39 39 VAL HG21 H 1 0.708 0.000 . . . . . A 571 VAL HG21 . 25953 1 430 . 1 1 39 39 VAL HG22 H 1 0.708 0.000 . . . . . A 571 VAL HG22 . 25953 1 431 . 1 1 39 39 VAL HG23 H 1 0.708 0.000 . . . . . A 571 VAL HG23 . 25953 1 432 . 1 1 39 39 VAL C C 13 174.198 0.000 . . . . . A 571 VAL C . 25953 1 433 . 1 1 39 39 VAL CA C 13 62.070 0.074 . . . . . A 571 VAL CA . 25953 1 434 . 1 1 39 39 VAL CB C 13 31.930 0.063 . . . . . A 571 VAL CB . 25953 1 435 . 1 1 39 39 VAL CG1 C 13 21.652 0.000 . . . . . A 571 VAL CG1 . 25953 1 436 . 1 1 39 39 VAL CG2 C 13 20.357 0.000 . . . . . A 571 VAL CG2 . 25953 1 437 . 1 1 39 39 VAL N N 15 132.533 0.025 . . . . . A 571 VAL N . 25953 1 438 . 1 1 40 40 THR H H 1 8.089 0.007 . . . . . A 572 THR H . 25953 1 439 . 1 1 40 40 THR HA H 1 5.243 0.002 . . . . . A 572 THR HA . 25953 1 440 . 1 1 40 40 THR HB H 1 4.223 0.005 . . . . . A 572 THR HB . 25953 1 441 . 1 1 40 40 THR HG21 H 1 1.287 0.001 . . . . . A 572 THR HG21 . 25953 1 442 . 1 1 40 40 THR HG22 H 1 1.287 0.001 . . . . . A 572 THR HG22 . 25953 1 443 . 1 1 40 40 THR HG23 H 1 1.287 0.001 . . . . . A 572 THR HG23 . 25953 1 444 . 1 1 40 40 THR C C 13 175.803 0.000 . . . . . A 572 THR C . 25953 1 445 . 1 1 40 40 THR CA C 13 60.095 0.030 . . . . . A 572 THR CA . 25953 1 446 . 1 1 40 40 THR CB C 13 70.889 0.021 . . . . . A 572 THR CB . 25953 1 447 . 1 1 40 40 THR CG2 C 13 22.089 0.013 . . . . . A 572 THR CG2 . 25953 1 448 . 1 1 40 40 THR N N 15 116.229 0.019 . . . . . A 572 THR N . 25953 1 449 . 1 1 41 41 GLY H H 1 8.871 0.004 . . . . . A 573 GLY H . 25953 1 450 . 1 1 41 41 GLY HA2 H 1 3.552 0.000 . . . . . A 573 GLY HA2 . 25953 1 451 . 1 1 41 41 GLY HA3 H 1 4.660 0.001 . . . . . A 573 GLY HA3 . 25953 1 452 . 1 1 41 41 GLY C C 13 172.769 0.000 . . . . . A 573 GLY C . 25953 1 453 . 1 1 41 41 GLY CA C 13 46.434 0.042 . . . . . A 573 GLY CA . 25953 1 454 . 1 1 41 41 GLY N N 15 110.544 0.017 . . . . . A 573 GLY N . 25953 1 455 . 1 1 42 42 VAL H H 1 9.473 0.004 . . . . . A 574 VAL H . 25953 1 456 . 1 1 42 42 VAL HA H 1 4.827 0.000 . . . . . A 574 VAL HA . 25953 1 457 . 1 1 42 42 VAL HB H 1 2.112 0.000 . . . . . A 574 VAL HB . 25953 1 458 . 1 1 42 42 VAL HG11 H 1 1.013 0.000 . . . . . A 574 VAL HG11 . 25953 1 459 . 1 1 42 42 VAL HG12 H 1 1.013 0.000 . . . . . A 574 VAL HG12 . 25953 1 460 . 1 1 42 42 VAL HG13 H 1 1.013 0.000 . . . . . A 574 VAL HG13 . 25953 1 461 . 1 1 42 42 VAL HG21 H 1 1.039 0.000 . . . . . A 574 VAL HG21 . 25953 1 462 . 1 1 42 42 VAL HG22 H 1 1.039 0.000 . . . . . A 574 VAL HG22 . 25953 1 463 . 1 1 42 42 VAL HG23 H 1 1.039 0.000 . . . . . A 574 VAL HG23 . 25953 1 464 . 1 1 42 42 VAL C C 13 173.472 0.000 . . . . . A 574 VAL C . 25953 1 465 . 1 1 42 42 VAL CA C 13 60.001 0.000 . . . . . A 574 VAL CA . 25953 1 466 . 1 1 42 42 VAL CB C 13 35.639 0.012 . . . . . A 574 VAL CB . 25953 1 467 . 1 1 42 42 VAL CG1 C 13 20.214 0.002 . . . . . A 574 VAL CG1 . 25953 1 468 . 1 1 42 42 VAL CG2 C 13 21.514 0.011 . . . . . A 574 VAL CG2 . 25953 1 469 . 1 1 42 42 VAL N N 15 120.833 0.013 . . . . . A 574 VAL N . 25953 1 470 . 1 1 43 43 TYR H H 1 8.410 0.005 . . . . . A 575 TYR H . 25953 1 471 . 1 1 43 43 TYR HA H 1 3.561 0.001 . . . . . A 575 TYR HA . 25953 1 472 . 1 1 43 43 TYR HB2 H 1 0.778 0.006 . . . . . A 575 TYR HB2 . 25953 1 473 . 1 1 43 43 TYR HB3 H 1 2.099 0.002 . . . . . A 575 TYR HB3 . 25953 1 474 . 1 1 43 43 TYR HD1 H 1 5.689 0.000 . . . . . A 575 TYR HD1 . 25953 1 475 . 1 1 43 43 TYR HD2 H 1 5.689 0.000 . . . . . A 575 TYR HD2 . 25953 1 476 . 1 1 43 43 TYR HE1 H 1 6.370 0.000 . . . . . A 575 TYR HE1 . 25953 1 477 . 1 1 43 43 TYR HE2 H 1 6.370 0.000 . . . . . A 575 TYR HE2 . 25953 1 478 . 1 1 43 43 TYR C C 13 174.622 0.000 . . . . . A 575 TYR C . 25953 1 479 . 1 1 43 43 TYR CA C 13 58.232 0.081 . . . . . A 575 TYR CA . 25953 1 480 . 1 1 43 43 TYR CB C 13 37.264 0.032 . . . . . A 575 TYR CB . 25953 1 481 . 1 1 43 43 TYR CD2 C 13 132.286 0.000 . . . . . A 575 TYR CD2 . 25953 1 482 . 1 1 43 43 TYR CE2 C 13 117.486 0.000 . . . . . A 575 TYR CE2 . 25953 1 483 . 1 1 43 43 TYR N N 15 126.796 0.033 . . . . . A 575 TYR N . 25953 1 484 . 1 1 44 44 ASP H H 1 8.228 0.003 . . . . . A 576 ASP H . 25953 1 485 . 1 1 44 44 ASP HA H 1 4.430 0.001 . . . . . A 576 ASP HA . 25953 1 486 . 1 1 44 44 ASP HB2 H 1 2.750 0.000 . . . . . A 576 ASP HB2 . 25953 1 487 . 1 1 44 44 ASP HB3 H 1 2.017 0.000 . . . . . A 576 ASP HB3 . 25953 1 488 . 1 1 44 44 ASP C C 13 174.399 0.000 . . . . . A 576 ASP C . 25953 1 489 . 1 1 44 44 ASP CA C 13 52.509 0.019 . . . . . A 576 ASP CA . 25953 1 490 . 1 1 44 44 ASP CB C 13 42.012 0.051 . . . . . A 576 ASP CB . 25953 1 491 . 1 1 44 44 ASP N N 15 130.548 0.014 . . . . . A 576 ASP N . 25953 1 492 . 1 1 45 45 GLU H H 1 8.480 0.003 . . . . . A 577 GLU H . 25953 1 493 . 1 1 45 45 GLU HA H 1 3.579 0.002 . . . . . A 577 GLU HA . 25953 1 494 . 1 1 45 45 GLU HB2 H 1 1.964 0.000 . . . . . A 577 GLU HB2 . 25953 1 495 . 1 1 45 45 GLU HB3 H 1 1.973 0.000 . . . . . A 577 GLU HB3 . 25953 1 496 . 1 1 45 45 GLU HG2 H 1 2.299 0.000 . . . . . A 577 GLU HG2 . 25953 1 497 . 1 1 45 45 GLU HG3 H 1 2.300 0.000 . . . . . A 577 GLU HG3 . 25953 1 498 . 1 1 45 45 GLU C C 13 178.103 0.000 . . . . . A 577 GLU C . 25953 1 499 . 1 1 45 45 GLU CA C 13 58.707 0.051 . . . . . A 577 GLU CA . 25953 1 500 . 1 1 45 45 GLU CB C 13 29.510 0.028 . . . . . A 577 GLU CB . 25953 1 501 . 1 1 45 45 GLU CG C 13 36.193 0.000 . . . . . A 577 GLU CG . 25953 1 502 . 1 1 45 45 GLU N N 15 125.178 0.020 . . . . . A 577 GLU N . 25953 1 503 . 1 1 46 46 GLU H H 1 8.126 0.006 . . . . . A 578 GLU H . 25953 1 504 . 1 1 46 46 GLU HA H 1 3.969 0.000 . . . . . A 578 GLU HA . 25953 1 505 . 1 1 46 46 GLU HB2 H 1 2.007 0.001 . . . . . A 578 GLU HB2 . 25953 1 506 . 1 1 46 46 GLU HB3 H 1 2.014 0.000 . . . . . A 578 GLU HB3 . 25953 1 507 . 1 1 46 46 GLU HG2 H 1 2.155 0.000 . . . . . A 578 GLU HG2 . 25953 1 508 . 1 1 46 46 GLU HG3 H 1 2.155 0.000 . . . . . A 578 GLU HG3 . 25953 1 509 . 1 1 46 46 GLU C C 13 177.632 0.000 . . . . . A 578 GLU C . 25953 1 510 . 1 1 46 46 GLU CA C 13 59.039 0.026 . . . . . A 578 GLU CA . 25953 1 511 . 1 1 46 46 GLU CB C 13 29.386 0.003 . . . . . A 578 GLU CB . 25953 1 512 . 1 1 46 46 GLU CG C 13 36.478 0.000 . . . . . A 578 GLU CG . 25953 1 513 . 1 1 46 46 GLU N N 15 117.933 0.042 . . . . . A 578 GLU N . 25953 1 514 . 1 1 47 47 SER H H 1 7.510 0.003 . . . . . A 579 SER H . 25953 1 515 . 1 1 47 47 SER HA H 1 4.343 0.000 . . . . . A 579 SER HA . 25953 1 516 . 1 1 47 47 SER HB2 H 1 3.790 0.001 . . . . . A 579 SER HB2 . 25953 1 517 . 1 1 47 47 SER HB3 H 1 3.670 0.001 . . . . . A 579 SER HB3 . 25953 1 518 . 1 1 47 47 SER C C 13 176.070 0.000 . . . . . A 579 SER C . 25953 1 519 . 1 1 47 47 SER CA C 13 58.557 0.016 . . . . . A 579 SER CA . 25953 1 520 . 1 1 47 47 SER CB C 13 64.809 0.013 . . . . . A 579 SER CB . 25953 1 521 . 1 1 47 47 SER N N 15 111.483 0.032 . . . . . A 579 SER N . 25953 1 522 . 1 1 48 48 GLY H H 1 8.196 0.002 . . . . . A 580 GLY H . 25953 1 523 . 1 1 48 48 GLY HA2 H 1 3.557 0.000 . . . . . A 580 GLY HA2 . 25953 1 524 . 1 1 48 48 GLY HA3 H 1 3.900 0.000 . . . . . A 580 GLY HA3 . 25953 1 525 . 1 1 48 48 GLY C C 13 173.600 0.000 . . . . . A 580 GLY C . 25953 1 526 . 1 1 48 48 GLY CA C 13 46.106 0.031 . . . . . A 580 GLY CA . 25953 1 527 . 1 1 48 48 GLY N N 15 113.307 0.012 . . . . . A 580 GLY N . 25953 1 528 . 1 1 49 49 GLU H H 1 6.994 0.003 . . . . . A 581 GLU H . 25953 1 529 . 1 1 49 49 GLU HA H 1 4.705 0.000 . . . . . A 581 GLU HA . 25953 1 530 . 1 1 49 49 GLU HB2 H 1 1.962 0.000 . . . . . A 581 GLU HB2 . 25953 1 531 . 1 1 49 49 GLU HB3 H 1 1.530 0.004 . . . . . A 581 GLU HB3 . 25953 1 532 . 1 1 49 49 GLU HG2 H 1 2.067 0.000 . . . . . A 581 GLU HG2 . 25953 1 533 . 1 1 49 49 GLU HG3 H 1 2.068 0.000 . . . . . A 581 GLU HG3 . 25953 1 534 . 1 1 49 49 GLU C C 13 174.750 0.000 . . . . . A 581 GLU C . 25953 1 535 . 1 1 49 49 GLU CA C 13 53.869 0.062 . . . . . A 581 GLU CA . 25953 1 536 . 1 1 49 49 GLU CB C 13 32.610 0.029 . . . . . A 581 GLU CB . 25953 1 537 . 1 1 49 49 GLU CG C 13 34.928 0.000 . . . . . A 581 GLU CG . 25953 1 538 . 1 1 49 49 GLU N N 15 116.623 0.019 . . . . . A 581 GLU N . 25953 1 539 . 1 1 50 50 TRP H H 1 8.841 0.007 . . . . . A 582 TRP H . 25953 1 540 . 1 1 50 50 TRP HA H 1 4.801 0.000 . . . . . A 582 TRP HA . 25953 1 541 . 1 1 50 50 TRP HB2 H 1 3.026 0.003 . . . . . A 582 TRP HB2 . 25953 1 542 . 1 1 50 50 TRP HB3 H 1 2.750 0.001 . . . . . A 582 TRP HB3 . 25953 1 543 . 1 1 50 50 TRP HD1 H 1 7.339 0.000 . . . . . A 582 TRP HD1 . 25953 1 544 . 1 1 50 50 TRP HE1 H 1 10.053 0.000 . . . . . A 582 TRP HE1 . 25953 1 545 . 1 1 50 50 TRP HZ2 H 1 7.242 0.000 . . . . . A 582 TRP HZ2 . 25953 1 546 . 1 1 50 50 TRP C C 13 176.750 0.000 . . . . . A 582 TRP C . 25953 1 547 . 1 1 50 50 TRP CA C 13 57.033 0.039 . . . . . A 582 TRP CA . 25953 1 548 . 1 1 50 50 TRP CB C 13 28.857 0.030 . . . . . A 582 TRP CB . 25953 1 549 . 1 1 50 50 TRP CD1 C 13 127.236 0.000 . . . . . A 582 TRP CD1 . 25953 1 550 . 1 1 50 50 TRP CZ2 C 13 114.335 0.000 . . . . . A 582 TRP CZ2 . 25953 1 551 . 1 1 50 50 TRP N N 15 122.364 0.012 . . . . . A 582 TRP N . 25953 1 552 . 1 1 50 50 TRP NE1 N 15 129.258 0.000 . . . . . A 582 TRP NE1 . 25953 1 553 . 1 1 51 51 VAL H H 1 9.440 0.003 . . . . . A 583 VAL H . 25953 1 554 . 1 1 51 51 VAL HA H 1 5.116 0.000 . . . . . A 583 VAL HA . 25953 1 555 . 1 1 51 51 VAL HB H 1 1.995 0.000 . . . . . A 583 VAL HB . 25953 1 556 . 1 1 51 51 VAL HG11 H 1 0.688 0.000 . . . . . A 583 VAL HG11 . 25953 1 557 . 1 1 51 51 VAL HG12 H 1 0.688 0.000 . . . . . A 583 VAL HG12 . 25953 1 558 . 1 1 51 51 VAL HG13 H 1 0.688 0.000 . . . . . A 583 VAL HG13 . 25953 1 559 . 1 1 51 51 VAL HG21 H 1 0.725 0.000 . . . . . A 583 VAL HG21 . 25953 1 560 . 1 1 51 51 VAL HG22 H 1 0.725 0.000 . . . . . A 583 VAL HG22 . 25953 1 561 . 1 1 51 51 VAL HG23 H 1 0.725 0.000 . . . . . A 583 VAL HG23 . 25953 1 562 . 1 1 51 51 VAL C C 13 175.063 0.000 . . . . . A 583 VAL C . 25953 1 563 . 1 1 51 51 VAL CA C 13 59.398 0.040 . . . . . A 583 VAL CA . 25953 1 564 . 1 1 51 51 VAL CB C 13 36.769 0.007 . . . . . A 583 VAL CB . 25953 1 565 . 1 1 51 51 VAL CG1 C 13 18.803 0.000 . . . . . A 583 VAL CG1 . 25953 1 566 . 1 1 51 51 VAL CG2 C 13 21.898 0.000 . . . . . A 583 VAL CG2 . 25953 1 567 . 1 1 51 51 VAL N N 15 115.147 0.022 . . . . . A 583 VAL N . 25953 1 568 . 1 1 52 52 TRP H H 1 9.295 0.003 . . . . . A 584 TRP H . 25953 1 569 . 1 1 52 52 TRP HA H 1 5.250 0.003 . . . . . A 584 TRP HA . 25953 1 570 . 1 1 52 52 TRP HB2 H 1 3.635 0.000 . . . . . A 584 TRP HB2 . 25953 1 571 . 1 1 52 52 TRP HB3 H 1 3.244 0.000 . . . . . A 584 TRP HB3 . 25953 1 572 . 1 1 52 52 TRP HD1 H 1 6.727 0.000 . . . . . A 584 TRP HD1 . 25953 1 573 . 1 1 52 52 TRP HE1 H 1 9.356 0.000 . . . . . A 584 TRP HE1 . 25953 1 574 . 1 1 52 52 TRP HZ2 H 1 6.870 0.000 . . . . . A 584 TRP HZ2 . 25953 1 575 . 1 1 52 52 TRP HH2 H 1 6.726 0.000 . . . . . A 584 TRP HH2 . 25953 1 576 . 1 1 52 52 TRP C C 13 176.436 0.000 . . . . . A 584 TRP C . 25953 1 577 . 1 1 52 52 TRP CA C 13 54.401 0.076 . . . . . A 584 TRP CA . 25953 1 578 . 1 1 52 52 TRP CB C 13 28.443 0.027 . . . . . A 584 TRP CB . 25953 1 579 . 1 1 52 52 TRP CD1 C 13 123.252 0.000 . . . . . A 584 TRP CD1 . 25953 1 580 . 1 1 52 52 TRP CZ2 C 13 113.010 0.000 . . . . . A 584 TRP CZ2 . 25953 1 581 . 1 1 52 52 TRP CH2 C 13 123.961 0.000 . . . . . A 584 TRP CH2 . 25953 1 582 . 1 1 52 52 TRP N N 15 123.710 0.019 . . . . . A 584 TRP N . 25953 1 583 . 1 1 52 52 TRP NE1 N 15 127.084 0.000 . . . . . A 584 TRP NE1 . 25953 1 584 . 1 1 53 53 LYS H H 1 8.689 0.003 . . . . . A 585 LYS H . 25953 1 585 . 1 1 53 53 LYS HA H 1 4.563 0.002 . . . . . A 585 LYS HA . 25953 1 586 . 1 1 53 53 LYS HB2 H 1 2.072 0.003 . . . . . A 585 LYS HB2 . 25953 1 587 . 1 1 53 53 LYS HB3 H 1 1.886 0.001 . . . . . A 585 LYS HB3 . 25953 1 588 . 1 1 53 53 LYS HG2 H 1 1.357 0.000 . . . . . A 585 LYS HG2 . 25953 1 589 . 1 1 53 53 LYS HG3 H 1 1.584 0.000 . . . . . A 585 LYS HG3 . 25953 1 590 . 1 1 53 53 LYS HD2 H 1 1.655 0.000 . . . . . A 585 LYS HD2 . 25953 1 591 . 1 1 53 53 LYS HD3 H 1 1.692 0.000 . . . . . A 585 LYS HD3 . 25953 1 592 . 1 1 53 53 LYS HE2 H 1 2.774 0.000 . . . . . A 585 LYS HE2 . 25953 1 593 . 1 1 53 53 LYS HE3 H 1 2.776 0.000 . . . . . A 585 LYS HE3 . 25953 1 594 . 1 1 53 53 LYS C C 13 178.886 0.000 . . . . . A 585 LYS C . 25953 1 595 . 1 1 53 53 LYS CA C 13 56.313 0.064 . . . . . A 585 LYS CA . 25953 1 596 . 1 1 53 53 LYS CB C 13 33.433 0.048 . . . . . A 585 LYS CB . 25953 1 597 . 1 1 53 53 LYS CG C 13 26.389 0.047 . . . . . A 585 LYS CG . 25953 1 598 . 1 1 53 53 LYS CD C 13 29.210 0.000 . . . . . A 585 LYS CD . 25953 1 599 . 1 1 53 53 LYS CE C 13 42.056 0.000 . . . . . A 585 LYS CE . 25953 1 600 . 1 1 53 53 LYS N N 15 122.031 0.034 . . . . . A 585 LYS N . 25953 1 601 . 1 1 54 54 ASN H H 1 8.830 0.004 . . . . . A 586 ASN H . 25953 1 602 . 1 1 54 54 ASN HA H 1 4.903 0.000 . . . . . A 586 ASN HA . 25953 1 603 . 1 1 54 54 ASN HB2 H 1 3.340 0.002 . . . . . A 586 ASN HB2 . 25953 1 604 . 1 1 54 54 ASN HB3 H 1 2.775 0.005 . . . . . A 586 ASN HB3 . 25953 1 605 . 1 1 54 54 ASN HD21 H 1 7.564 0.000 . . . . . A 586 ASN HD21 . 25953 1 606 . 1 1 54 54 ASN HD22 H 1 7.329 0.000 . . . . . A 586 ASN HD22 . 25953 1 607 . 1 1 54 54 ASN C C 13 176.043 0.000 . . . . . A 586 ASN C . 25953 1 608 . 1 1 54 54 ASN CA C 13 54.702 0.018 . . . . . A 586 ASN CA . 25953 1 609 . 1 1 54 54 ASN CB C 13 37.052 0.043 . . . . . A 586 ASN CB . 25953 1 610 . 1 1 54 54 ASN N N 15 123.634 0.043 . . . . . A 586 ASN N . 25953 1 611 . 1 1 54 54 ASN ND2 N 15 108.969 0.001 . . . . . A 586 ASN ND2 . 25953 1 612 . 1 1 55 55 THR H H 1 8.179 0.004 . . . . . A 587 THR H . 25953 1 613 . 1 1 55 55 THR HA H 1 5.482 0.002 . . . . . A 587 THR HA . 25953 1 614 . 1 1 55 55 THR HB H 1 3.931 0.002 . . . . . A 587 THR HB . 25953 1 615 . 1 1 55 55 THR HG21 H 1 1.137 0.001 . . . . . A 587 THR HG21 . 25953 1 616 . 1 1 55 55 THR HG22 H 1 1.137 0.001 . . . . . A 587 THR HG22 . 25953 1 617 . 1 1 55 55 THR HG23 H 1 1.137 0.001 . . . . . A 587 THR HG23 . 25953 1 618 . 1 1 55 55 THR C C 13 171.882 0.000 . . . . . A 587 THR C . 25953 1 619 . 1 1 55 55 THR CA C 13 63.252 0.030 . . . . . A 587 THR CA . 25953 1 620 . 1 1 55 55 THR CB C 13 73.106 0.020 . . . . . A 587 THR CB . 25953 1 621 . 1 1 55 55 THR CG2 C 13 22.595 0.016 . . . . . A 587 THR CG2 . 25953 1 622 . 1 1 55 55 THR N N 15 114.536 0.022 . . . . . A 587 THR N . 25953 1 623 . 1 1 56 56 ILE H H 1 8.984 0.002 . . . . . A 588 ILE H . 25953 1 624 . 1 1 56 56 ILE HA H 1 4.431 0.002 . . . . . A 588 ILE HA . 25953 1 625 . 1 1 56 56 ILE HB H 1 1.566 0.002 . . . . . A 588 ILE HB . 25953 1 626 . 1 1 56 56 ILE HG12 H 1 0.766 0.000 . . . . . A 588 ILE HG12 . 25953 1 627 . 1 1 56 56 ILE HG13 H 1 1.311 0.000 . . . . . A 588 ILE HG13 . 25953 1 628 . 1 1 56 56 ILE HG21 H 1 0.738 0.001 . . . . . A 588 ILE HG21 . 25953 1 629 . 1 1 56 56 ILE HG22 H 1 0.738 0.001 . . . . . A 588 ILE HG22 . 25953 1 630 . 1 1 56 56 ILE HG23 H 1 0.738 0.001 . . . . . A 588 ILE HG23 . 25953 1 631 . 1 1 56 56 ILE HD11 H 1 0.468 0.001 . . . . . A 588 ILE HD11 . 25953 1 632 . 1 1 56 56 ILE HD12 H 1 0.468 0.001 . . . . . A 588 ILE HD12 . 25953 1 633 . 1 1 56 56 ILE HD13 H 1 0.468 0.001 . . . . . A 588 ILE HD13 . 25953 1 634 . 1 1 56 56 ILE C C 13 171.550 0.000 . . . . . A 588 ILE C . 25953 1 635 . 1 1 56 56 ILE CA C 13 58.960 0.042 . . . . . A 588 ILE CA . 25953 1 636 . 1 1 56 56 ILE CB C 13 43.352 0.009 . . . . . A 588 ILE CB . 25953 1 637 . 1 1 56 56 ILE CG1 C 13 27.199 0.039 . . . . . A 588 ILE CG1 . 25953 1 638 . 1 1 56 56 ILE CG2 C 13 17.210 0.026 . . . . . A 588 ILE CG2 . 25953 1 639 . 1 1 56 56 ILE CD1 C 13 14.577 0.060 . . . . . A 588 ILE CD1 . 25953 1 640 . 1 1 56 56 ILE N N 15 120.751 0.015 . . . . . A 588 ILE N . 25953 1 641 . 1 1 57 57 GLU H H 1 8.337 0.004 . . . . . A 589 GLU H . 25953 1 642 . 1 1 57 57 GLU HA H 1 4.811 0.003 . . . . . A 589 GLU HA . 25953 1 643 . 1 1 57 57 GLU HB2 H 1 1.953 0.000 . . . . . A 589 GLU HB2 . 25953 1 644 . 1 1 57 57 GLU HB3 H 1 1.686 0.000 . . . . . A 589 GLU HB3 . 25953 1 645 . 1 1 57 57 GLU HG2 H 1 1.472 0.000 . . . . . A 589 GLU HG2 . 25953 1 646 . 1 1 57 57 GLU HG3 H 1 1.668 0.000 . . . . . A 589 GLU HG3 . 25953 1 647 . 1 1 57 57 GLU C C 13 175.587 0.000 . . . . . A 589 GLU C . 25953 1 648 . 1 1 57 57 GLU CA C 13 54.161 0.041 . . . . . A 589 GLU CA . 25953 1 649 . 1 1 57 57 GLU CB C 13 31.623 0.036 . . . . . A 589 GLU CB . 25953 1 650 . 1 1 57 57 GLU CG C 13 35.295 0.000 . . . . . A 589 GLU CG . 25953 1 651 . 1 1 57 57 GLU N N 15 125.535 0.023 . . . . . A 589 GLU N . 25953 1 652 . 1 1 58 58 VAL H H 1 9.013 0.002 . . . . . A 590 VAL H . 25953 1 653 . 1 1 58 58 VAL HA H 1 3.987 0.000 . . . . . A 590 VAL HA . 25953 1 654 . 1 1 58 58 VAL HB H 1 1.737 0.000 . . . . . A 590 VAL HB . 25953 1 655 . 1 1 58 58 VAL HG11 H 1 0.079 0.000 . . . . . A 590 VAL HG11 . 25953 1 656 . 1 1 58 58 VAL HG12 H 1 0.079 0.000 . . . . . A 590 VAL HG12 . 25953 1 657 . 1 1 58 58 VAL HG13 H 1 0.079 0.000 . . . . . A 590 VAL HG13 . 25953 1 658 . 1 1 58 58 VAL HG21 H 1 0.686 0.000 . . . . . A 590 VAL HG21 . 25953 1 659 . 1 1 58 58 VAL HG22 H 1 0.686 0.000 . . . . . A 590 VAL HG22 . 25953 1 660 . 1 1 58 58 VAL HG23 H 1 0.686 0.000 . . . . . A 590 VAL HG23 . 25953 1 661 . 1 1 58 58 VAL C C 13 176.078 0.000 . . . . . A 590 VAL C . 25953 1 662 . 1 1 58 58 VAL CA C 13 61.574 0.035 . . . . . A 590 VAL CA . 25953 1 663 . 1 1 58 58 VAL CB C 13 33.828 0.018 . . . . . A 590 VAL CB . 25953 1 664 . 1 1 58 58 VAL CG1 C 13 19.655 0.000 . . . . . A 590 VAL CG1 . 25953 1 665 . 1 1 58 58 VAL CG2 C 13 20.501 0.000 . . . . . A 590 VAL CG2 . 25953 1 666 . 1 1 58 58 VAL N N 15 126.684 0.031 . . . . . A 590 VAL N . 25953 1 667 . 1 1 59 59 ASN H H 1 9.347 0.002 . . . . . A 591 ASN H . 25953 1 668 . 1 1 59 59 ASN HA H 1 4.303 0.003 . . . . . A 591 ASN HA . 25953 1 669 . 1 1 59 59 ASN HB2 H 1 3.048 0.003 . . . . . A 591 ASN HB2 . 25953 1 670 . 1 1 59 59 ASN HB3 H 1 2.699 0.003 . . . . . A 591 ASN HB3 . 25953 1 671 . 1 1 59 59 ASN HD21 H 1 6.894 0.000 . . . . . A 591 ASN HD21 . 25953 1 672 . 1 1 59 59 ASN HD22 H 1 7.542 0.000 . . . . . A 591 ASN HD22 . 25953 1 673 . 1 1 59 59 ASN C C 13 175.223 0.000 . . . . . A 591 ASN C . 25953 1 674 . 1 1 59 59 ASN CA C 13 54.048 0.022 . . . . . A 591 ASN CA . 25953 1 675 . 1 1 59 59 ASN CB C 13 37.769 0.027 . . . . . A 591 ASN CB . 25953 1 676 . 1 1 59 59 ASN N N 15 127.075 0.006 . . . . . A 591 ASN N . 25953 1 677 . 1 1 59 59 ASN ND2 N 15 112.654 0.002 . . . . . A 591 ASN ND2 . 25953 1 678 . 1 1 60 60 GLY H H 1 8.990 0.002 . . . . . A 592 GLY H . 25953 1 679 . 1 1 60 60 GLY HA2 H 1 3.978 0.000 . . . . . A 592 GLY HA2 . 25953 1 680 . 1 1 60 60 GLY HA3 H 1 3.492 0.000 . . . . . A 592 GLY HA3 . 25953 1 681 . 1 1 60 60 GLY C C 13 172.842 0.000 . . . . . A 592 GLY C . 25953 1 682 . 1 1 60 60 GLY CA C 13 45.281 0.011 . . . . . A 592 GLY CA . 25953 1 683 . 1 1 60 60 GLY N N 15 104.628 0.024 . . . . . A 592 GLY N . 25953 1 684 . 1 1 61 61 LYS H H 1 7.485 0.003 . . . . . A 593 LYS H . 25953 1 685 . 1 1 61 61 LYS HA H 1 4.187 0.003 . . . . . A 593 LYS HA . 25953 1 686 . 1 1 61 61 LYS HB2 H 1 1.674 0.004 . . . . . A 593 LYS HB2 . 25953 1 687 . 1 1 61 61 LYS HB3 H 1 1.450 0.001 . . . . . A 593 LYS HB3 . 25953 1 688 . 1 1 61 61 LYS HG2 H 1 1.290 0.000 . . . . . A 593 LYS HG2 . 25953 1 689 . 1 1 61 61 LYS HG3 H 1 1.178 0.000 . . . . . A 593 LYS HG3 . 25953 1 690 . 1 1 61 61 LYS HE2 H 1 2.983 0.000 . . . . . A 593 LYS HE2 . 25953 1 691 . 1 1 61 61 LYS HE3 H 1 2.983 0.000 . . . . . A 593 LYS HE3 . 25953 1 692 . 1 1 61 61 LYS C C 13 173.344 0.000 . . . . . A 593 LYS C . 25953 1 693 . 1 1 61 61 LYS CA C 13 54.139 0.034 . . . . . A 593 LYS CA . 25953 1 694 . 1 1 61 61 LYS CB C 13 34.946 0.034 . . . . . A 593 LYS CB . 25953 1 695 . 1 1 61 61 LYS CG C 13 24.657 0.050 . . . . . A 593 LYS CG . 25953 1 696 . 1 1 61 61 LYS CD C 13 28.846 0.000 . . . . . A 593 LYS CD . 25953 1 697 . 1 1 61 61 LYS CE C 13 42.146 0.000 . . . . . A 593 LYS CE . 25953 1 698 . 1 1 61 61 LYS N N 15 120.387 0.013 . . . . . A 593 LYS N . 25953 1 699 . 1 1 62 62 TYR H H 1 7.092 0.004 . . . . . A 594 TYR H . 25953 1 700 . 1 1 62 62 TYR HA H 1 4.831 0.000 . . . . . A 594 TYR HA . 25953 1 701 . 1 1 62 62 TYR HB2 H 1 0.978 0.001 . . . . . A 594 TYR HB2 . 25953 1 702 . 1 1 62 62 TYR HB3 H 1 0.980 0.000 . . . . . A 594 TYR HB3 . 25953 1 703 . 1 1 62 62 TYR HD1 H 1 6.560 0.000 . . . . . A 594 TYR HD1 . 25953 1 704 . 1 1 62 62 TYR HD2 H 1 6.560 0.000 . . . . . A 594 TYR HD2 . 25953 1 705 . 1 1 62 62 TYR HE1 H 1 6.747 0.000 . . . . . A 594 TYR HE1 . 25953 1 706 . 1 1 62 62 TYR HE2 H 1 6.747 0.000 . . . . . A 594 TYR HE2 . 25953 1 707 . 1 1 62 62 TYR C C 13 173.851 0.000 . . . . . A 594 TYR C . 25953 1 708 . 1 1 62 62 TYR CA C 13 56.928 0.046 . . . . . A 594 TYR CA . 25953 1 709 . 1 1 62 62 TYR CB C 13 37.574 0.026 . . . . . A 594 TYR CB . 25953 1 710 . 1 1 62 62 TYR CD1 C 13 132.274 0.000 . . . . . A 594 TYR CD1 . 25953 1 711 . 1 1 62 62 TYR CE1 C 13 117.565 0.000 . . . . . A 594 TYR CE1 . 25953 1 712 . 1 1 62 62 TYR N N 15 119.730 0.020 . . . . . A 594 TYR N . 25953 1 713 . 1 1 63 63 PHE H H 1 8.459 0.003 . . . . . A 595 PHE H . 25953 1 714 . 1 1 63 63 PHE HA H 1 5.038 0.000 . . . . . A 595 PHE HA . 25953 1 715 . 1 1 63 63 PHE HB2 H 1 2.556 0.002 . . . . . A 595 PHE HB2 . 25953 1 716 . 1 1 63 63 PHE HB3 H 1 3.314 0.001 . . . . . A 595 PHE HB3 . 25953 1 717 . 1 1 63 63 PHE HD1 H 1 7.057 0.000 . . . . . A 595 PHE HD1 . 25953 1 718 . 1 1 63 63 PHE HD2 H 1 7.057 0.000 . . . . . A 595 PHE HD2 . 25953 1 719 . 1 1 63 63 PHE C C 13 177.013 0.000 . . . . . A 595 PHE C . 25953 1 720 . 1 1 63 63 PHE CA C 13 55.528 0.092 . . . . . A 595 PHE CA . 25953 1 721 . 1 1 63 63 PHE CB C 13 45.398 0.029 . . . . . A 595 PHE CB . 25953 1 722 . 1 1 63 63 PHE N N 15 116.435 0.012 . . . . . A 595 PHE N . 25953 1 723 . 1 1 64 64 HE1 H H 1 9.113 0.001 . . . . . A 596 HE1 H . 25953 1 724 . 1 1 64 64 HE1 HA H 1 6.064 0.001 . . . . . A 596 HE1 HA . 25953 1 725 . 1 1 64 64 HE1 HB2 H 1 3.713 0.000 . . . . . A 596 HE1 HB2 . 25953 1 726 . 1 1 64 64 HE1 HB3 H 1 3.457 0.002 . . . . . A 596 HE1 HB3 . 25953 1 727 . 1 1 64 64 HE1 HD2 H 1 7.619 0.000 . . . . . A 596 HE1 HD2 . 25953 1 728 . 1 1 64 64 HE1 HE1 H 1 7.373 0.009 . . . . . A 596 HE1 HE1 . 25953 1 729 . 1 1 64 64 HE1 CA C 13 58.668 0.041 . . . . . A 596 HE1 CA . 25953 1 730 . 1 1 64 64 HE1 CB C 13 32.486 0.031 . . . . . A 596 HE1 CB . 25953 1 731 . 1 1 64 64 HE1 CD2 C 13 118.940 0.000 . . . . . A 596 HE1 CD2 . 25953 1 732 . 1 1 64 64 HE1 CE1 C 13 137.120 0.044 . . . . . A 596 HE1 CE1 . 25953 1 733 . 1 1 64 64 HE1 N N 15 118.187 0.020 . . . . . A 596 HE1 N . 25953 1 734 . 1 1 65 65 SER H H 1 8.110 0.006 . . . . . A 597 SER H . 25953 1 735 . 1 1 65 65 SER HA H 1 4.798 0.000 . . . . . A 597 SER HA . 25953 1 736 . 1 1 65 65 SER HB2 H 1 3.583 0.000 . . . . . A 597 SER HB2 . 25953 1 737 . 1 1 65 65 SER HB3 H 1 3.585 0.000 . . . . . A 597 SER HB3 . 25953 1 738 . 1 1 65 65 SER C C 13 179.336 0.000 . . . . . A 597 SER C . 25953 1 739 . 1 1 65 65 SER CA C 13 60.633 0.067 . . . . . A 597 SER CA . 25953 1 740 . 1 1 65 65 SER CB C 13 62.965 0.021 . . . . . A 597 SER CB . 25953 1 741 . 1 1 65 65 SER N N 15 118.403 0.046 . . . . . A 597 SER N . 25953 1 742 . 1 1 66 66 THR H H 1 9.120 0.008 . . . . . A 598 THR H . 25953 1 743 . 1 1 66 66 THR HA H 1 3.991 0.000 . . . . . A 598 THR HA . 25953 1 744 . 1 1 66 66 THR HB H 1 4.336 0.000 . . . . . A 598 THR HB . 25953 1 745 . 1 1 66 66 THR HG21 H 1 1.384 0.000 . . . . . A 598 THR HG21 . 25953 1 746 . 1 1 66 66 THR HG22 H 1 1.384 0.000 . . . . . A 598 THR HG22 . 25953 1 747 . 1 1 66 66 THR HG23 H 1 1.384 0.000 . . . . . A 598 THR HG23 . 25953 1 748 . 1 1 66 66 THR C C 13 178.244 0.000 . . . . . A 598 THR C . 25953 1 749 . 1 1 66 66 THR CA C 13 64.766 0.058 . . . . . A 598 THR CA . 25953 1 750 . 1 1 66 66 THR CB C 13 67.467 0.017 . . . . . A 598 THR CB . 25953 1 751 . 1 1 66 66 THR CG2 C 13 23.356 0.009 . . . . . A 598 THR CG2 . 25953 1 752 . 1 1 66 66 THR N N 15 111.927 0.017 . . . . . A 598 THR N . 25953 1 753 . 1 1 67 67 CY2 H H 1 6.935 0.004 . . . . . A 599 CY2 H . 25953 1 754 . 1 1 67 67 CY2 HA H 1 4.055 0.003 . . . . . A 599 CY2 HA . 25953 1 755 . 1 1 67 67 CY2 HB2 H 1 3.105 0.001 . . . . . A 599 CY2 HB2 . 25953 1 756 . 1 1 67 67 CY2 HB3 H 1 2.936 0.004 . . . . . A 599 CY2 HB3 . 25953 1 757 . 1 1 67 67 CY2 C C 13 177.266 0.000 . . . . . A 599 CY2 C . 25953 1 758 . 1 1 67 67 CY2 CA C 13 63.602 0.086 . . . . . A 599 CY2 CA . 25953 1 759 . 1 1 67 67 CY2 CB C 13 30.014 0.021 . . . . . A 599 CY2 CB . 25953 1 760 . 1 1 67 67 CY2 N N 15 117.596 0.029 . . . . . A 599 CY2 N . 25953 1 761 . 1 1 68 68 TYR H H 1 8.396 0.003 . . . . . A 600 TYR H . 25953 1 762 . 1 1 68 68 TYR HA H 1 3.597 0.004 . . . . . A 600 TYR HA . 25953 1 763 . 1 1 68 68 TYR HB2 H 1 2.753 0.002 . . . . . A 600 TYR HB2 . 25953 1 764 . 1 1 68 68 TYR HB3 H 1 2.689 0.001 . . . . . A 600 TYR HB3 . 25953 1 765 . 1 1 68 68 TYR HD1 H 1 5.889 0.000 . . . . . A 600 TYR HD1 . 25953 1 766 . 1 1 68 68 TYR HD2 H 1 5.889 0.000 . . . . . A 600 TYR HD2 . 25953 1 767 . 1 1 68 68 TYR HE1 H 1 6.231 0.000 . . . . . A 600 TYR HE1 . 25953 1 768 . 1 1 68 68 TYR HE2 H 1 6.231 0.000 . . . . . A 600 TYR HE2 . 25953 1 769 . 1 1 68 68 TYR C C 13 177.533 0.000 . . . . . A 600 TYR C . 25953 1 770 . 1 1 68 68 TYR CA C 13 62.134 0.095 . . . . . A 600 TYR CA . 25953 1 771 . 1 1 68 68 TYR CB C 13 39.421 0.019 . . . . . A 600 TYR CB . 25953 1 772 . 1 1 68 68 TYR CD2 C 13 132.480 0.000 . . . . . A 600 TYR CD2 . 25953 1 773 . 1 1 68 68 TYR CE2 C 13 117.798 0.000 . . . . . A 600 TYR CE2 . 25953 1 774 . 1 1 68 68 TYR N N 15 119.532 0.016 . . . . . A 600 TYR N . 25953 1 775 . 1 1 69 69 HIE H H 1 8.417 0.003 . . . . . A 601 HIE H . 25953 1 776 . 1 1 69 69 HIE HA H 1 4.126 0.001 . . . . . A 601 HIE HA . 25953 1 777 . 1 1 69 69 HIE HB2 H 1 3.264 0.000 . . . . . A 601 HIE HB2 . 25953 1 778 . 1 1 69 69 HIE HB3 H 1 3.113 0.001 . . . . . A 601 HIE HB3 . 25953 1 779 . 1 1 69 69 HIE CA C 13 60.119 0.004 . . . . . A 601 HIE CA . 25953 1 780 . 1 1 69 69 HIE CB C 13 29.903 0.030 . . . . . A 601 HIE CB . 25953 1 781 . 1 1 69 69 HIE N N 15 117.457 0.016 . . . . . A 601 HIE N . 25953 1 782 . 1 1 70 70 GLU H H 1 8.094 0.002 . . . . . A 602 GLU H . 25953 1 783 . 1 1 70 70 GLU HA H 1 4.081 0.000 . . . . . A 602 GLU HA . 25953 1 784 . 1 1 70 70 GLU HB2 H 1 2.098 0.001 . . . . . A 602 GLU HB2 . 25953 1 785 . 1 1 70 70 GLU HB3 H 1 2.070 0.000 . . . . . A 602 GLU HB3 . 25953 1 786 . 1 1 70 70 GLU C C 13 177.912 0.000 . . . . . A 602 GLU C . 25953 1 787 . 1 1 70 70 GLU CA C 13 58.160 0.004 . . . . . A 602 GLU CA . 25953 1 788 . 1 1 70 70 GLU CB C 13 29.733 0.010 . . . . . A 602 GLU CB . 25953 1 789 . 1 1 70 70 GLU CG C 13 36.351 0.000 . . . . . A 602 GLU CG . 25953 1 790 . 1 1 70 70 GLU N N 15 118.228 0.026 . . . . . A 602 GLU N . 25953 1 791 . 1 1 71 71 THR H H 1 7.578 0.004 . . . . . A 603 THR H . 25953 1 792 . 1 1 71 71 THR HA H 1 4.265 0.000 . . . . . A 603 THR HA . 25953 1 793 . 1 1 71 71 THR HB H 1 4.149 0.000 . . . . . A 603 THR HB . 25953 1 794 . 1 1 71 71 THR HG21 H 1 1.197 0.000 . . . . . A 603 THR HG21 . 25953 1 795 . 1 1 71 71 THR HG22 H 1 1.197 0.000 . . . . . A 603 THR HG22 . 25953 1 796 . 1 1 71 71 THR HG23 H 1 1.197 0.000 . . . . . A 603 THR HG23 . 25953 1 797 . 1 1 71 71 THR C C 13 175.279 0.000 . . . . . A 603 THR C . 25953 1 798 . 1 1 71 71 THR CA C 13 63.116 0.051 . . . . . A 603 THR CA . 25953 1 799 . 1 1 71 71 THR CB C 13 69.801 0.026 . . . . . A 603 THR CB . 25953 1 800 . 1 1 71 71 THR CG2 C 13 21.488 0.000 . . . . . A 603 THR CG2 . 25953 1 801 . 1 1 71 71 THR N N 15 111.252 0.026 . . . . . A 603 THR N . 25953 1 802 . 1 1 72 72 SER H H 1 7.849 0.002 . . . . . A 604 SER H . 25953 1 803 . 1 1 72 72 SER HA H 1 4.221 0.002 . . . . . A 604 SER HA . 25953 1 804 . 1 1 72 72 SER HB2 H 1 3.572 0.000 . . . . . A 604 SER HB2 . 25953 1 805 . 1 1 72 72 SER HB3 H 1 3.630 0.004 . . . . . A 604 SER HB3 . 25953 1 806 . 1 1 72 72 SER C C 13 174.838 0.000 . . . . . A 604 SER C . 25953 1 807 . 1 1 72 72 SER CA C 13 59.105 0.012 . . . . . A 604 SER CA . 25953 1 808 . 1 1 72 72 SER CB C 13 63.387 0.017 . . . . . A 604 SER CB . 25953 1 809 . 1 1 72 72 SER N N 15 117.291 0.013 . . . . . A 604 SER N . 25953 1 810 . 1 1 73 73 GLN H H 1 7.971 0.002 . . . . . A 605 GLN H . 25953 1 811 . 1 1 73 73 GLN HE21 H 1 7.353 0.000 . . . . . A 605 GLN HE21 . 25953 1 812 . 1 1 73 73 GLN HE22 H 1 6.733 0.000 . . . . . A 605 GLN HE22 . 25953 1 813 . 1 1 73 73 GLN C C 13 175.801 0.000 . . . . . A 605 GLN C . 25953 1 814 . 1 1 73 73 GLN CA C 13 56.080 0.000 . . . . . A 605 GLN CA . 25953 1 815 . 1 1 73 73 GLN CB C 13 28.926 0.000 . . . . . A 605 GLN CB . 25953 1 816 . 1 1 73 73 GLN CG C 13 33.595 0.000 . . . . . A 605 GLN CG . 25953 1 817 . 1 1 73 73 GLN N N 15 120.747 0.006 . . . . . A 605 GLN N . 25953 1 818 . 1 1 73 73 GLN NE2 N 15 112.613 0.001 . . . . . A 605 GLN NE2 . 25953 1 819 . 1 1 74 74 ASN HD21 H 1 7.580 0.000 . . . . . A 606 ASN HD21 . 25953 1 820 . 1 1 74 74 ASN HD22 H 1 6.895 0.000 . . . . . A 606 ASN HD22 . 25953 1 821 . 1 1 74 74 ASN ND2 N 15 113.026 0.000 . . . . . A 606 ASN ND2 . 25953 1 822 . 1 1 76 76 SER H H 1 8.001 0.004 . . . . . A 608 SER H . 25953 1 823 . 1 1 76 76 SER CA C 13 60.256 0.000 . . . . . A 608 SER CA . 25953 1 824 . 1 1 76 76 SER CB C 13 64.802 0.000 . . . . . A 608 SER CB . 25953 1 825 . 1 1 76 76 SER N N 15 123.149 0.088 . . . . . A 608 SER N . 25953 1 stop_ save_