################################### # 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_assignments_y1fatc_dpcred298 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assignments_y1fatc_dpcred298 _Assigned_chem_shift_list.Entry_ID 16295 _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_shifts_for_reduced_FATC _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' . . . 16295 1 2 '2D 1H-13C HSQC' . . . 16295 1 5 '3D HNCA' . . . 16295 1 6 '3D HCCH-TOCSY' . . . 16295 1 7 '3D 1H-15N NOESY' . . . 16295 1 8 '3D 1H-13C NOESY' . . . 16295 1 9 '3D HACAHB-COSY' . . . 16295 1 10 '3D HNHB' . . . 16295 1 11 '{15N} SED 1H-13C HSQC' . . . 16295 1 12 "{13C'} SED 1H-13C HSQC" . . . 16295 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $NMRView . . 16295 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 1 1 ASN HA H 1 4.278 . . 1 . . . . 1 ASN HA . 16295 1 2 . 1 1 1 1 ASN HB2 H 1 2.969 . . 2 . . . . 1 ASN HB1 . 16295 1 3 . 1 1 1 1 ASN HB3 H 1 2.910 . . 2 . . . . 1 ASN HB2 . 16295 1 4 . 1 1 1 1 ASN HD21 H 1 7.807 . . 2 . . . . 1 ASN HD21 . 16295 1 5 . 1 1 1 1 ASN HD22 H 1 6.990 . . 2 . . . . 1 ASN HD22 . 16295 1 6 . 1 1 1 1 ASN CA C 13 53.007 . . 1 . . . . 1 ASN CA . 16295 1 7 . 1 1 1 1 ASN CB C 13 38.487 . . 1 . . . . 1 ASN CB . 16295 1 8 . 1 1 1 1 ASN ND2 N 15 112.745 . . 1 . . . . 1 ASN ND2 . 16295 1 9 . 1 1 2 2 GLU HA H 1 4.324 . . 1 . . . . 2 GLU HA . 16295 1 10 . 1 1 2 2 GLU HB2 H 1 2.086 . . 2 . . . . 2 GLU HB1 . 16295 1 11 . 1 1 2 2 GLU HB3 H 1 1.936 . . 2 . . . . 2 GLU HB2 . 16295 1 12 . 1 1 2 2 GLU HG2 H 1 2.287 . . 2 . . . . 2 GLU HG1 . 16295 1 13 . 1 1 2 2 GLU CA C 13 56.967 . . 1 . . . . 2 GLU CA . 16295 1 14 . 1 1 2 2 GLU CB C 13 30.210 . . 1 . . . . 2 GLU CB . 16295 1 15 . 1 1 2 2 GLU CG C 13 36.228 . . 1 . . . . 2 GLU CG . 16295 1 16 . 1 1 3 3 LEU H H 1 8.357 . . 1 . . . . 3 LEU HN . 16295 1 17 . 1 1 3 3 LEU HA H 1 4.327 . . 1 . . . . 3 LEU HA . 16295 1 18 . 1 1 3 3 LEU HB2 H 1 1.585 . . 1 . . . . 3 LEU HB1 . 16295 1 19 . 1 1 3 3 LEU HB3 H 1 1.641 . . 1 . . . . 3 LEU HB2 . 16295 1 20 . 1 1 3 3 LEU HD11 H 1 0.920 . . 2 . . . . 3 LEU HD11 . 16295 1 21 . 1 1 3 3 LEU HD12 H 1 0.920 . . 2 . . . . 3 LEU HD11 . 16295 1 22 . 1 1 3 3 LEU HD13 H 1 0.920 . . 2 . . . . 3 LEU HD11 . 16295 1 23 . 1 1 3 3 LEU HD21 H 1 0.868 . . 2 . . . . 3 LEU HD21 . 16295 1 24 . 1 1 3 3 LEU HD22 H 1 0.868 . . 2 . . . . 3 LEU HD21 . 16295 1 25 . 1 1 3 3 LEU HD23 H 1 0.868 . . 2 . . . . 3 LEU HD21 . 16295 1 26 . 1 1 3 3 LEU HG H 1 1.607 . . 1 . . . . 3 LEU HG . 16295 1 27 . 1 1 3 3 LEU CA C 13 55.052 . . 1 . . . . 3 LEU CA . 16295 1 28 . 1 1 3 3 LEU CB C 13 42.624 . . 1 . . . . 3 LEU CB . 16295 1 29 . 1 1 3 3 LEU CD1 C 13 25.158 . . 2 . . . . 3 LEU CD1 . 16295 1 30 . 1 1 3 3 LEU CD2 C 13 23.978 . . 2 . . . . 3 LEU CD2 . 16295 1 31 . 1 1 3 3 LEU CG C 13 27.163 . . 1 . . . . 3 LEU CG . 16295 1 32 . 1 1 3 3 LEU N N 15 121.833 . . 1 . . . . 3 LEU N . 16295 1 33 . 1 1 4 4 ASP H H 1 8.321 . . 1 . . . . 4 ASP HN . 16295 1 34 . 1 1 4 4 ASP HA H 1 4.669 . . 1 . . . . 4 ASP HA . 16295 1 35 . 1 1 4 4 ASP HB2 H 1 2.775 . . 2 . . . . 4 ASP HB1 . 16295 1 36 . 1 1 4 4 ASP HB3 H 1 2.589 . . 2 . . . . 4 ASP HB2 . 16295 1 37 . 1 1 4 4 ASP CA C 13 53.864 . . 1 . . . . 4 ASP CA . 16295 1 38 . 1 1 4 4 ASP CB C 13 41.252 . . 1 . . . . 4 ASP CB . 16295 1 39 . 1 1 4 4 ASP N N 15 122.569 . . 1 . . . . 4 ASP N . 16295 1 40 . 1 1 5 5 VAL H H 1 8.333 . . 1 . . . . 5 VAL HN . 16295 1 41 . 1 1 5 5 VAL HA H 1 4.171 . . 1 . . . . 5 VAL HA . 16295 1 42 . 1 1 5 5 VAL HB H 1 2.154 . . 1 . . . . 5 VAL HB . 16295 1 43 . 1 1 5 5 VAL HG11 H 1 0.980 . . 2 . . . . 5 VAL HG11 . 16295 1 44 . 1 1 5 5 VAL HG12 H 1 0.980 . . 2 . . . . 5 VAL HG11 . 16295 1 45 . 1 1 5 5 VAL HG13 H 1 0.980 . . 2 . . . . 5 VAL HG11 . 16295 1 46 . 1 1 5 5 VAL HG21 H 1 0.984 . . 2 . . . . 5 VAL HG21 . 16295 1 47 . 1 1 5 5 VAL HG22 H 1 0.984 . . 2 . . . . 5 VAL HG21 . 16295 1 48 . 1 1 5 5 VAL HG23 H 1 0.984 . . 2 . . . . 5 VAL HG21 . 16295 1 49 . 1 1 5 5 VAL CA C 13 62.935 . . 1 . . . . 5 VAL CA . 16295 1 50 . 1 1 5 5 VAL CB C 13 31.747 . . 1 . . . . 5 VAL CB . 16295 1 51 . 1 1 5 5 VAL CG1 C 13 21.614 . . 2 . . . . 5 VAL CG1 . 16295 1 52 . 1 1 5 5 VAL CG2 C 13 21.748 . . 2 . . . . 5 VAL CG2 . 16295 1 53 . 1 1 5 5 VAL N N 15 120.885 . . 1 . . . . 5 VAL N . 16295 1 54 . 1 1 6 6 PRO HA H 1 4.365 . . 1 . . . . 6 PRO HA . 16295 1 55 . 1 1 6 6 PRO HB2 H 1 2.453 . . 2 . . . . 6 PRO HB1 . 16295 1 56 . 1 1 6 6 PRO HB3 H 1 1.929 . . 2 . . . . 6 PRO HB2 . 16295 1 57 . 1 1 6 6 PRO HD2 H 1 3.905 . . 2 . . . . 6 PRO HD1 . 16295 1 58 . 1 1 6 6 PRO HD3 H 1 3.673 . . 2 . . . . 6 PRO HD2 . 16295 1 59 . 1 1 6 6 PRO HG2 H 1 2.088 . . 2 . . . . 6 PRO HG1 . 16295 1 60 . 1 1 6 6 PRO HG3 H 1 2.019 . . 2 . . . . 6 PRO HG2 . 16295 1 61 . 1 1 6 6 PRO CA C 13 64.413 . . 1 . . . . 6 PRO CA . 16295 1 62 . 1 1 6 6 PRO CB C 13 31.905 . . 1 . . . . 6 PRO CB . 16295 1 63 . 1 1 6 6 PRO CD C 13 50.505 . . 1 . . . . 6 PRO CD . 16295 1 64 . 1 1 6 6 PRO CG C 13 28.103 . . 1 . . . . 6 PRO CG . 16295 1 65 . 1 1 7 7 GLU H H 1 8.560 . . 1 . . . . 7 GLU HN . 16295 1 66 . 1 1 7 7 GLU HA H 1 4.152 . . 1 . . . . 7 GLU HA . 16295 1 67 . 1 1 7 7 GLU HB2 H 1 2.086 . . 2 . . . . 7 GLU HB1 . 16295 1 68 . 1 1 7 7 GLU HG2 H 1 2.364 . . 2 . . . . 7 GLU HG1 . 16295 1 69 . 1 1 7 7 GLU HG3 H 1 2.275 . . 2 . . . . 7 GLU HG2 . 16295 1 70 . 1 1 7 7 GLU CA C 13 58.796 . . 1 . . . . 7 GLU CA . 16295 1 71 . 1 1 7 7 GLU CB C 13 29.850 . . 1 . . . . 7 GLU CB . 16295 1 72 . 1 1 7 7 GLU CG C 13 36.413 . . 1 . . . . 7 GLU CG . 16295 1 73 . 1 1 7 7 GLU N N 15 121.123 . . 1 . . . . 7 GLU N . 16295 1 74 . 1 1 8 8 GLN H H 1 8.613 . . 1 . . . . 8 GLN HN . 16295 1 75 . 1 1 8 8 GLN HA H 1 4.163 . . 1 . . . . 8 GLN HA . 16295 1 76 . 1 1 8 8 GLN HB2 H 1 2.133 . . 2 . . . . 8 GLN HB1 . 16295 1 77 . 1 1 8 8 GLN HB3 H 1 2.088 . . 2 . . . . 8 GLN HB2 . 16295 1 78 . 1 1 8 8 GLN HE21 H 1 7.567 . . 2 . . . . 8 GLN HE21 . 16295 1 79 . 1 1 8 8 GLN HE22 H 1 6.914 . . 2 . . . . 8 GLN HE22 . 16295 1 80 . 1 1 8 8 GLN HG2 H 1 2.489 . . 2 . . . . 8 GLN HG1 . 16295 1 81 . 1 1 8 8 GLN HG3 H 1 2.426 . . 2 . . . . 8 GLN HG2 . 16295 1 82 . 1 1 8 8 GLN CA C 13 58.191 . . 1 . . . . 8 GLN CA . 16295 1 83 . 1 1 8 8 GLN CB C 13 28.660 . . 1 . . . . 8 GLN CB . 16295 1 84 . 1 1 8 8 GLN CG C 13 34.030 . . 1 . . . . 8 GLN CG . 16295 1 85 . 1 1 8 8 GLN N N 15 118.522 . . 1 . . . . 8 GLN N . 16295 1 86 . 1 1 8 8 GLN NE2 N 15 111.798 . . 1 . . . . 8 GLN NE2 . 16295 1 87 . 1 1 9 9 VAL H H 1 8.043 . . 1 . . . . 9 VAL HN . 16295 1 88 . 1 1 9 9 VAL HA H 1 3.697 . . 1 . . . . 9 VAL HA . 16295 1 89 . 1 1 9 9 VAL HB H 1 2.186 . . 1 . . . . 9 VAL HB . 16295 1 90 . 1 1 9 9 VAL HG11 H 1 0.960 . . 2 . . . . 9 VAL HG11 . 16295 1 91 . 1 1 9 9 VAL HG12 H 1 0.960 . . 2 . . . . 9 VAL HG11 . 16295 1 92 . 1 1 9 9 VAL HG13 H 1 0.960 . . 2 . . . . 9 VAL HG11 . 16295 1 93 . 1 1 9 9 VAL HG21 H 1 1.005 . . 2 . . . . 9 VAL HG21 . 16295 1 94 . 1 1 9 9 VAL HG22 H 1 1.005 . . 2 . . . . 9 VAL HG21 . 16295 1 95 . 1 1 9 9 VAL HG23 H 1 1.005 . . 2 . . . . 9 VAL HG21 . 16295 1 96 . 1 1 9 9 VAL CA C 13 65.574 . . 1 . . . . 9 VAL CA . 16295 1 97 . 1 1 9 9 VAL CB C 13 31.684 . . 1 . . . . 9 VAL CB . 16295 1 98 . 1 1 9 9 VAL CG1 C 13 21.614 . . 2 . . . . 9 VAL CG1 . 16295 1 99 . 1 1 9 9 VAL CG2 C 13 22.879 . . 2 . . . . 9 VAL CG2 . 16295 1 100 . 1 1 9 9 VAL N N 15 118.871 . . 1 . . . . 9 VAL N . 16295 1 101 . 1 1 10 10 ASP H H 1 8.047 . . 1 . . . . 10 ASP HN . 16295 1 102 . 1 1 10 10 ASP HA H 1 4.401 . . 1 . . . . 10 ASP HA . 16295 1 103 . 1 1 10 10 ASP HB2 H 1 2.704 . . 2 . . . . 10 ASP HB1 . 16295 1 104 . 1 1 10 10 ASP CA C 13 57.175 . . 1 . . . . 10 ASP CA . 16295 1 105 . 1 1 10 10 ASP CB C 13 41.230 . . 1 . . . . 10 ASP CB . 16295 1 106 . 1 1 10 10 ASP N N 15 120.618 . . 1 . . . . 10 ASP N . 16295 1 107 . 1 1 11 11 LYS H H 1 7.931 . . 1 . . . . 11 LYS HN . 16295 1 108 . 1 1 11 11 LYS HA H 1 4.036 . . 1 . . . . 11 LYS HA . 16295 1 109 . 1 1 11 11 LYS HB2 H 1 1.923 . . 2 . . . . 11 LYS HB1 . 16295 1 110 . 1 1 11 11 LYS HB3 H 1 1.880 . . 2 . . . . 11 LYS HB2 . 16295 1 111 . 1 1 11 11 LYS HD2 H 1 1.696 . . 2 . . . . 11 LYS HD1 . 16295 1 112 . 1 1 11 11 LYS HE2 H 1 2.969 . . 2 . . . . 11 LYS HE1 . 16295 1 113 . 1 1 11 11 LYS HG2 H 1 1.603 . . 2 . . . . 11 LYS HG1 . 16295 1 114 . 1 1 11 11 LYS HG3 H 1 1.465 . . 2 . . . . 11 LYS HG2 . 16295 1 115 . 1 1 11 11 LYS CA C 13 59.016 . . 1 . . . . 11 LYS CA . 16295 1 116 . 1 1 11 11 LYS CB C 13 32.400 . . 1 . . . . 11 LYS CB . 16295 1 117 . 1 1 11 11 LYS CD C 13 29.148 . . 1 . . . . 11 LYS CD . 16295 1 118 . 1 1 11 11 LYS CE C 13 42.167 . . 1 . . . . 11 LYS CE . 16295 1 119 . 1 1 11 11 LYS CG C 13 25.253 . . 1 . . . . 11 LYS CG . 16295 1 120 . 1 1 11 11 LYS N N 15 118.429 . . 1 . . . . 11 LYS N . 16295 1 121 . 1 1 12 12 LEU H H 1 7.817 . . 1 . . . . 12 LEU HN . 16295 1 122 . 1 1 12 12 LEU HA H 1 4.170 . . 1 . . . . 12 LEU HA . 16295 1 123 . 1 1 12 12 LEU HB2 H 1 1.708 . . 1 . . . . 12 LEU HB1 . 16295 1 124 . 1 1 12 12 LEU HB3 H 1 1.898 . . 1 . . . . 12 LEU HB2 . 16295 1 125 . 1 1 12 12 LEU HD11 H 1 0.903 . . 2 . . . . 12 LEU HD11 . 16295 1 126 . 1 1 12 12 LEU HD12 H 1 0.903 . . 2 . . . . 12 LEU HD11 . 16295 1 127 . 1 1 12 12 LEU HD13 H 1 0.903 . . 2 . . . . 12 LEU HD11 . 16295 1 128 . 1 1 12 12 LEU HD21 H 1 0.940 . . 2 . . . . 12 LEU HD21 . 16295 1 129 . 1 1 12 12 LEU HD22 H 1 0.940 . . 2 . . . . 12 LEU HD21 . 16295 1 130 . 1 1 12 12 LEU HD23 H 1 0.940 . . 2 . . . . 12 LEU HD21 . 16295 1 131 . 1 1 12 12 LEU HG H 1 1.784 . . 1 . . . . 12 LEU HG . 16295 1 132 . 1 1 12 12 LEU CA C 13 57.856 . . 1 . . . . 12 LEU CA . 16295 1 133 . 1 1 12 12 LEU CB C 13 41.932 . . 1 . . . . 12 LEU CB . 16295 1 134 . 1 1 12 12 LEU CD1 C 13 24.321 . . 2 . . . . 12 LEU CD1 . 16295 1 135 . 1 1 12 12 LEU CD2 C 13 25.240 . . 2 . . . . 12 LEU CD2 . 16295 1 136 . 1 1 12 12 LEU CG C 13 27.154 . . 1 . . . . 12 LEU CG . 16295 1 137 . 1 1 12 12 LEU N N 15 120.319 . . 1 . . . . 12 LEU N . 16295 1 138 . 1 1 13 13 ILE H H 1 8.193 . . 1 . . . . 13 ILE HN . 16295 1 139 . 1 1 13 13 ILE HA H 1 3.689 . . 1 . . . . 13 ILE HA . 16295 1 140 . 1 1 13 13 ILE HB H 1 2.065 . . 1 . . . . 13 ILE HB . 16295 1 141 . 1 1 13 13 ILE HD11 H 1 0.875 . . 1 . . . . 13 ILE HD11 . 16295 1 142 . 1 1 13 13 ILE HD12 H 1 0.875 . . 1 . . . . 13 ILE HD11 . 16295 1 143 . 1 1 13 13 ILE HD13 H 1 0.875 . . 1 . . . . 13 ILE HD11 . 16295 1 144 . 1 1 13 13 ILE HG12 H 1 1.754 . . 2 . . . . 13 ILE HG11 . 16295 1 145 . 1 1 13 13 ILE HG13 H 1 1.130 . . 2 . . . . 13 ILE HG12 . 16295 1 146 . 1 1 13 13 ILE HG21 H 1 0.920 . . 1 . . . . 13 ILE HG21 . 16295 1 147 . 1 1 13 13 ILE HG22 H 1 0.920 . . 1 . . . . 13 ILE HG21 . 16295 1 148 . 1 1 13 13 ILE HG23 H 1 0.920 . . 1 . . . . 13 ILE HG21 . 16295 1 149 . 1 1 13 13 ILE CA C 13 64.723 . . 1 . . . . 13 ILE CA . 16295 1 150 . 1 1 13 13 ILE CB C 13 37.690 . . 1 . . . . 13 ILE CB . 16295 1 151 . 1 1 13 13 ILE CD1 C 13 13.492 . . 1 . . . . 13 ILE CD1 . 16295 1 152 . 1 1 13 13 ILE CG1 C 13 29.156 . . 1 . . . . 13 ILE CG1 . 16295 1 153 . 1 1 13 13 ILE CG2 C 13 17.613 . . 1 . . . . 13 ILE CG2 . 16295 1 154 . 1 1 13 13 ILE N N 15 118.817 . . 1 . . . . 13 ILE N . 16295 1 155 . 1 1 14 14 GLN H H 1 8.157 . . 1 . . . . 14 GLN HN . 16295 1 156 . 1 1 14 14 GLN HA H 1 4.135 . . 1 . . . . 14 GLN HA . 16295 1 157 . 1 1 14 14 GLN HB2 H 1 2.228 . . 2 . . . . 14 GLN HB1 . 16295 1 158 . 1 1 14 14 GLN HB3 H 1 2.159 . . 2 . . . . 14 GLN HB2 . 16295 1 159 . 1 1 14 14 GLN HE21 H 1 7.580 . . 2 . . . . 14 GLN HE21 . 16295 1 160 . 1 1 14 14 GLN HE22 H 1 6.841 . . 2 . . . . 14 GLN HE22 . 16295 1 161 . 1 1 14 14 GLN HG2 H 1 2.539 . . 2 . . . . 14 GLN HG1 . 16295 1 162 . 1 1 14 14 GLN HG3 H 1 2.471 . . 2 . . . . 14 GLN HG2 . 16295 1 163 . 1 1 14 14 GLN CA C 13 58.335 . . 1 . . . . 14 GLN CA . 16295 1 164 . 1 1 14 14 GLN CB C 13 28.502 . . 1 . . . . 14 GLN CB . 16295 1 165 . 1 1 14 14 GLN CG C 13 33.900 . . 1 . . . . 14 GLN CG . 16295 1 166 . 1 1 14 14 GLN N N 15 119.424 . . 1 . . . . 14 GLN N . 16295 1 167 . 1 1 14 14 GLN NE2 N 15 112.896 . . 1 . . . . 14 GLN NE2 . 16295 1 168 . 1 1 15 15 GLN H H 1 8.036 . . 1 . . . . 15 GLN HN . 16295 1 169 . 1 1 15 15 GLN HA H 1 4.356 . . 1 . . . . 15 GLN HA . 16295 1 170 . 1 1 15 15 GLN HB2 H 1 2.249 . . 2 . . . . 15 GLN HB1 . 16295 1 171 . 1 1 15 15 GLN HB3 H 1 2.221 . . 2 . . . . 15 GLN HB2 . 16295 1 172 . 1 1 15 15 GLN HE21 H 1 7.334 . . 2 . . . . 15 GLN HE21 . 16295 1 173 . 1 1 15 15 GLN HE22 H 1 6.783 . . 2 . . . . 15 GLN HE22 . 16295 1 174 . 1 1 15 15 GLN HG2 H 1 2.494 . . 2 . . . . 15 GLN HG1 . 16295 1 175 . 1 1 15 15 GLN HG3 H 1 2.449 . . 2 . . . . 15 GLN HG2 . 16295 1 176 . 1 1 15 15 GLN CA C 13 56.905 . . 1 . . . . 15 GLN CA . 16295 1 177 . 1 1 15 15 GLN CB C 13 28.640 . . 1 . . . . 15 GLN CB . 16295 1 178 . 1 1 15 15 GLN CG C 13 34.050 . . 1 . . . . 15 GLN CG . 16295 1 179 . 1 1 15 15 GLN N N 15 118.251 . . 1 . . . . 15 GLN N . 16295 1 180 . 1 1 15 15 GLN NE2 N 15 110.651 . . 1 . . . . 15 GLN NE2 . 16295 1 181 . 1 1 16 16 ALA H H 1 8.260 . . 1 . . . . 16 ALA HN . 16295 1 182 . 1 1 16 16 ALA HA H 1 4.136 . . 1 . . . . 16 ALA HA . 16295 1 183 . 1 1 16 16 ALA HB1 H 1 1.489 . . 1 . . . . 16 ALA MB . 16295 1 184 . 1 1 16 16 ALA HB2 H 1 1.489 . . 1 . . . . 16 ALA MB . 16295 1 185 . 1 1 16 16 ALA HB3 H 1 1.489 . . 1 . . . . 16 ALA MB . 16295 1 186 . 1 1 16 16 ALA CA C 13 55.047 . . 1 . . . . 16 ALA CA . 16295 1 187 . 1 1 16 16 ALA CB C 13 18.767 . . 1 . . . . 16 ALA CB . 16295 1 188 . 1 1 16 16 ALA N N 15 122.588 . . 1 . . . . 16 ALA N . 16295 1 189 . 1 1 17 17 THR H H 1 8.266 . . 1 . . . . 17 THR HN . 16295 1 190 . 1 1 17 17 THR HA H 1 4.143 . . 1 . . . . 17 THR HA . 16295 1 191 . 1 1 17 17 THR HB H 1 4.357 . . 1 . . . . 17 THR HB . 16295 1 192 . 1 1 17 17 THR HG21 H 1 1.320 . . 1 . . . . 17 THR HG21 . 16295 1 193 . 1 1 17 17 THR HG22 H 1 1.320 . . 1 . . . . 17 THR HG21 . 16295 1 194 . 1 1 17 17 THR HG23 H 1 1.320 . . 1 . . . . 17 THR HG21 . 16295 1 195 . 1 1 17 17 THR CA C 13 65.385 . . 1 . . . . 17 THR CA . 16295 1 196 . 1 1 17 17 THR CB C 13 68.945 . . 1 . . . . 17 THR CB . 16295 1 197 . 1 1 17 17 THR CG2 C 13 21.810 . . 1 . . . . 17 THR CG2 . 16295 1 198 . 1 1 17 17 THR N N 15 112.152 . . 1 . . . . 17 THR N . 16295 1 199 . 1 1 18 18 SER H H 1 8.041 . . 1 . . . . 18 SER HN . 16295 1 200 . 1 1 18 18 SER HA H 1 4.411 . . 1 . . . . 18 SER HA . 16295 1 201 . 1 1 18 18 SER HB2 H 1 4.000 . . 1 . . . . 18 SER HB1 . 16295 1 202 . 1 1 18 18 SER HB3 H 1 4.154 . . 1 . . . . 18 SER HB2 . 16295 1 203 . 1 1 18 18 SER CA C 13 61.080 . . 1 . . . . 18 SER CA . 16295 1 204 . 1 1 18 18 SER CB C 13 63.230 . . 1 . . . . 18 SER CB . 16295 1 205 . 1 1 18 18 SER N N 15 117.812 . . 1 . . . . 18 SER N . 16295 1 206 . 1 1 19 19 ILE H H 1 8.292 . . 1 . . . . 19 ILE HN . 16295 1 207 . 1 1 19 19 ILE HA H 1 3.856 . . 1 . . . . 19 ILE HA . 16295 1 208 . 1 1 19 19 ILE HB H 1 2.176 . . 1 . . . . 19 ILE HB . 16295 1 209 . 1 1 19 19 ILE HD11 H 1 0.898 . . 1 . . . . 19 ILE HD11 . 16295 1 210 . 1 1 19 19 ILE HD12 H 1 0.898 . . 1 . . . . 19 ILE HD11 . 16295 1 211 . 1 1 19 19 ILE HD13 H 1 0.898 . . 1 . . . . 19 ILE HD11 . 16295 1 212 . 1 1 19 19 ILE HG12 H 1 1.762 . . 2 . . . . 19 ILE HG11 . 16295 1 213 . 1 1 19 19 ILE HG13 H 1 1.251 . . 2 . . . . 19 ILE HG12 . 16295 1 214 . 1 1 19 19 ILE HG21 H 1 0.971 . . 1 . . . . 19 ILE HG21 . 16295 1 215 . 1 1 19 19 ILE HG22 H 1 0.971 . . 1 . . . . 19 ILE HG21 . 16295 1 216 . 1 1 19 19 ILE HG23 H 1 0.971 . . 1 . . . . 19 ILE HG21 . 16295 1 217 . 1 1 19 19 ILE CA C 13 64.585 . . 1 . . . . 19 ILE CA . 16295 1 218 . 1 1 19 19 ILE CB C 13 37.690 . . 1 . . . . 19 ILE CB . 16295 1 219 . 1 1 19 19 ILE CD1 C 13 13.134 . . 1 . . . . 19 ILE CD1 . 16295 1 220 . 1 1 19 19 ILE CG1 C 13 29.340 . . 1 . . . . 19 ILE CG1 . 16295 1 221 . 1 1 19 19 ILE CG2 C 13 18.133 . . 1 . . . . 19 ILE CG2 . 16295 1 222 . 1 1 19 19 ILE N N 15 122.380 . . 1 . . . . 19 ILE N . 16295 1 223 . 1 1 20 20 GLU H H 1 8.636 . . 1 . . . . 20 GLU HN . 16295 1 224 . 1 1 20 20 GLU HA H 1 3.959 . . 1 . . . . 20 GLU HA . 16295 1 225 . 1 1 20 20 GLU HB2 H 1 2.209 . . 1 . . . . 20 GLU HB1 . 16295 1 226 . 1 1 20 20 GLU HB3 H 1 2.333 . . 1 . . . . 20 GLU HB2 . 16295 1 227 . 1 1 20 20 GLU HG2 H 1 2.406 . . 2 . . . . 20 GLU HG1 . 16295 1 228 . 1 1 20 20 GLU HG3 H 1 2.289 . . 2 . . . . 20 GLU HG2 . 16295 1 229 . 1 1 20 20 GLU CA C 13 60.747 . . 1 . . . . 20 GLU CA . 16295 1 230 . 1 1 20 20 GLU CB C 13 29.135 . . 1 . . . . 20 GLU CB . 16295 1 231 . 1 1 20 20 GLU CG C 13 35.582 . . 1 . . . . 20 GLU CG . 16295 1 232 . 1 1 20 20 GLU N N 15 122.425 . . 1 . . . . 20 GLU N . 16295 1 233 . 1 1 21 21 ARG H H 1 8.083 . . 1 . . . . 21 ARG HN . 16295 1 234 . 1 1 21 21 ARG HA H 1 4.084 . . 1 . . . . 21 ARG HA . 16295 1 235 . 1 1 21 21 ARG HB2 H 1 1.998 . . 2 . . . . 21 ARG HB1 . 16295 1 236 . 1 1 21 21 ARG HB3 H 1 1.950 . . 2 . . . . 21 ARG HB2 . 16295 1 237 . 1 1 21 21 ARG HD2 H 1 3.247 . . 2 . . . . 21 ARG HD1 . 16295 1 238 . 1 1 21 21 ARG HG2 H 1 1.842 . . 2 . . . . 21 ARG HG1 . 16295 1 239 . 1 1 21 21 ARG HG3 H 1 1.704 . . 2 . . . . 21 ARG HG2 . 16295 1 240 . 1 1 21 21 ARG CA C 13 59.230 . . 1 . . . . 21 ARG CA . 16295 1 241 . 1 1 21 21 ARG CB C 13 30.200 . . 1 . . . . 21 ARG CB . 16295 1 242 . 1 1 21 21 ARG CD C 13 43.433 . . 1 . . . . 21 ARG CD . 16295 1 243 . 1 1 21 21 ARG CG C 13 27.692 . . 1 . . . . 21 ARG CG . 16295 1 244 . 1 1 21 21 ARG N N 15 118.372 . . 1 . . . . 21 ARG N . 16295 1 245 . 1 1 22 22 LEU H H 1 8.091 . . 1 . . . . 22 LEU HN . 16295 1 246 . 1 1 22 22 LEU HA H 1 4.273 . . 1 . . . . 22 LEU HA . 16295 1 247 . 1 1 22 22 LEU HB2 H 1 1.813 . . 1 . . . . 22 LEU HB1 . 16295 1 248 . 1 1 22 22 LEU HB3 H 1 2.081 . . 1 . . . . 22 LEU HB2 . 16295 1 249 . 1 1 22 22 LEU HD11 H 1 1.043 . . 2 . . . . 22 LEU HD11 . 16295 1 250 . 1 1 22 22 LEU HD12 H 1 1.043 . . 2 . . . . 22 LEU HD11 . 16295 1 251 . 1 1 22 22 LEU HD13 H 1 1.043 . . 2 . . . . 22 LEU HD11 . 16295 1 252 . 1 1 22 22 LEU HD21 H 1 1.022 . . 2 . . . . 22 LEU HD21 . 16295 1 253 . 1 1 22 22 LEU HD22 H 1 1.022 . . 2 . . . . 22 LEU HD21 . 16295 1 254 . 1 1 22 22 LEU HD23 H 1 1.022 . . 2 . . . . 22 LEU HD21 . 16295 1 255 . 1 1 22 22 LEU HG H 1 1.951 . . 1 . . . . 22 LEU HG . 16295 1 256 . 1 1 22 22 LEU CA C 13 58.359 . . 1 . . . . 22 LEU CA . 16295 1 257 . 1 1 22 22 LEU CB C 13 42.540 . . 1 . . . . 22 LEU CB . 16295 1 258 . 1 1 22 22 LEU CD1 C 13 24.679 . . 2 . . . . 22 LEU CD1 . 16295 1 259 . 1 1 22 22 LEU CD2 C 13 25.717 . . 2 . . . . 22 LEU CD2 . 16295 1 260 . 1 1 22 22 LEU CG C 13 27.157 . . 1 . . . . 22 LEU CG . 16295 1 261 . 1 1 22 22 LEU N N 15 121.118 . . 1 . . . . 22 LEU N . 16295 1 262 . 1 1 23 23 CYS H H 1 8.472 . . 1 . . . . 23 CYS HN . 16295 1 263 . 1 1 23 23 CYS HA H 1 4.135 . . 1 . . . . 23 CYS HA . 16295 1 264 . 1 1 23 23 CYS HB2 H 1 3.123 . . 2 . . . . 23 CYS HB1 . 16295 1 265 . 1 1 23 23 CYS HB3 H 1 3.054 . . 2 . . . . 23 CYS HB2 . 16295 1 266 . 1 1 23 23 CYS CA C 13 64.306 . . 1 . . . . 23 CYS CA . 16295 1 267 . 1 1 23 23 CYS CB C 13 26.770 . . 1 . . . . 23 CYS CB . 16295 1 268 . 1 1 23 23 CYS N N 15 116.815 . . 1 . . . . 23 CYS N . 16295 1 269 . 1 1 24 24 GLN H H 1 8.437 . . 1 . . . . 24 GLN HN . 16295 1 270 . 1 1 24 24 GLN HA H 1 3.696 . . 1 . . . . 24 GLN HA . 16295 1 271 . 1 1 24 24 GLN HB2 H 1 2.092 . . 1 . . . . 24 GLN HB1 . 16295 1 272 . 1 1 24 24 GLN HB3 H 1 2.170 . . 1 . . . . 24 GLN HB2 . 16295 1 273 . 1 1 24 24 GLN HE21 H 1 7.500 . . 2 . . . . 24 GLN HE21 . 16295 1 274 . 1 1 24 24 GLN HE22 H 1 6.726 . . 2 . . . . 24 GLN HE22 . 16295 1 275 . 1 1 24 24 GLN HG2 H 1 2.455 . . 2 . . . . 24 GLN HG1 . 16295 1 276 . 1 1 24 24 GLN HG3 H 1 2.338 . . 2 . . . . 24 GLN HG2 . 16295 1 277 . 1 1 24 24 GLN CA C 13 59.304 . . 1 . . . . 24 GLN CA . 16295 1 278 . 1 1 24 24 GLN CB C 13 28.035 . . 1 . . . . 24 GLN CB . 16295 1 279 . 1 1 24 24 GLN CG C 13 33.733 . . 1 . . . . 24 GLN CG . 16295 1 280 . 1 1 24 24 GLN N N 15 118.866 . . 1 . . . . 24 GLN N . 16295 1 281 . 1 1 24 24 GLN NE2 N 15 110.940 . . 1 . . . . 24 GLN NE2 . 16295 1 282 . 1 1 25 25 HIS H H 1 7.975 . . 1 . . . . 25 HIS HN . 16295 1 283 . 1 1 25 25 HIS HA H 1 4.249 . . 1 . . . . 25 HIS HA . 16295 1 284 . 1 1 25 25 HIS HB2 H 1 3.022 . . 1 . . . . 25 HIS HB1 . 16295 1 285 . 1 1 25 25 HIS HB3 H 1 3.127 . . 1 . . . . 25 HIS HB2 . 16295 1 286 . 1 1 25 25 HIS CA C 13 58.905 . . 1 . . . . 25 HIS CA . 16295 1 287 . 1 1 25 25 HIS CB C 13 29.950 . . 1 . . . . 25 HIS CB . 16295 1 288 . 1 1 25 25 HIS N N 15 115.954 . . 1 . . . . 25 HIS N . 16295 1 289 . 1 1 26 26 TYR H H 1 8.046 . . 1 . . . . 26 TYR HN . 16295 1 290 . 1 1 26 26 TYR HA H 1 4.331 . . 1 . . . . 26 TYR HA . 16295 1 291 . 1 1 26 26 TYR HB2 H 1 3.098 . . 1 . . . . 26 TYR HB1 . 16295 1 292 . 1 1 26 26 TYR HB3 H 1 2.842 . . 1 . . . . 26 TYR HB2 . 16295 1 293 . 1 1 26 26 TYR HD1 H 1 7.277 . . 3 . . . . 26 TYR HD1 . 16295 1 294 . 1 1 26 26 TYR HE1 H 1 6.864 . . 3 . . . . 26 TYR HE1 . 16295 1 295 . 1 1 26 26 TYR CA C 13 61.549 . . 1 . . . . 26 TYR CA . 16295 1 296 . 1 1 26 26 TYR CB C 13 39.870 . . 1 . . . . 26 TYR CB . 16295 1 297 . 1 1 26 26 TYR CD1 C 13 133.186 . . 3 . . . . 26 TYR CD1 . 16295 1 298 . 1 1 26 26 TYR CE1 C 13 118.290 . . 3 . . . . 26 TYR CE1 . 16295 1 299 . 1 1 26 26 TYR N N 15 114.182 . . 1 . . . . 26 TYR N . 16295 1 300 . 1 1 27 27 ILE H H 1 8.137 . . 1 . . . . 27 ILE HN . 16295 1 301 . 1 1 27 27 ILE HA H 1 4.292 . . 1 . . . . 27 ILE HA . 16295 1 302 . 1 1 27 27 ILE HB H 1 2.140 . . 1 . . . . 27 ILE HB . 16295 1 303 . 1 1 27 27 ILE HD11 H 1 0.712 . . 1 . . . . 27 ILE HD11 . 16295 1 304 . 1 1 27 27 ILE HD12 H 1 0.712 . . 1 . . . . 27 ILE HD11 . 16295 1 305 . 1 1 27 27 ILE HD13 H 1 0.712 . . 1 . . . . 27 ILE HD11 . 16295 1 306 . 1 1 27 27 ILE HG12 H 1 1.558 . . 2 . . . . 27 ILE HG11 . 16295 1 307 . 1 1 27 27 ILE HG13 H 1 1.168 . . 2 . . . . 27 ILE HG12 . 16295 1 308 . 1 1 27 27 ILE HG21 H 1 0.706 . . 1 . . . . 27 ILE HG21 . 16295 1 309 . 1 1 27 27 ILE HG22 H 1 0.706 . . 1 . . . . 27 ILE HG21 . 16295 1 310 . 1 1 27 27 ILE HG23 H 1 0.706 . . 1 . . . . 27 ILE HG21 . 16295 1 311 . 1 1 27 27 ILE CA C 13 62.111 . . 1 . . . . 27 ILE CA . 16295 1 312 . 1 1 27 27 ILE CB C 13 38.875 . . 1 . . . . 27 ILE CB . 16295 1 313 . 1 1 27 27 ILE CD1 C 13 13.413 . . 1 . . . . 27 ILE CD1 . 16295 1 314 . 1 1 27 27 ILE CG1 C 13 28.080 . . 1 . . . . 27 ILE CG1 . 16295 1 315 . 1 1 27 27 ILE CG2 C 13 17.845 . . 1 . . . . 27 ILE CG2 . 16295 1 316 . 1 1 27 27 ILE N N 15 114.655 . . 1 . . . . 27 ILE N . 16295 1 317 . 1 1 28 28 GLY H H 1 7.950 . . 1 . . . . 28 GLY HN . 16295 1 318 . 1 1 28 28 GLY HA2 H 1 4.227 . . 2 . . . . 28 GLY HA1 . 16295 1 319 . 1 1 28 28 GLY HA3 H 1 3.932 . . 2 . . . . 28 GLY HA2 . 16295 1 320 . 1 1 28 28 GLY CA C 13 45.665 . . 1 . . . . 28 GLY CA . 16295 1 321 . 1 1 28 28 GLY N N 15 107.621 . . 1 . . . . 28 GLY N . 16295 1 322 . 1 1 29 29 TRP H H 1 7.521 . . 1 . . . . 29 TRP HN . 16295 1 323 . 1 1 29 29 TRP HA H 1 4.627 . . 1 . . . . 29 TRP HA . 16295 1 324 . 1 1 29 29 TRP HB2 H 1 3.262 . . 2 . . . . 29 TRP HB1 . 16295 1 325 . 1 1 29 29 TRP HD1 H 1 7.146 . . 1 . . . . 29 TRP HD1 . 16295 1 326 . 1 1 29 29 TRP HE1 H 1 10.542 . . 1 . . . . 29 TRP HE1 . 16295 1 327 . 1 1 29 29 TRP HE3 H 1 7.346 . . 1 . . . . 29 TRP HE3 . 16295 1 328 . 1 1 29 29 TRP HH2 H 1 7.055 . . 1 . . . . 29 TRP HH2 . 16295 1 329 . 1 1 29 29 TRP HZ2 H 1 7.428 . . 1 . . . . 29 TRP HZ2 . 16295 1 330 . 1 1 29 29 TRP HZ3 H 1 6.937 . . 1 . . . . 29 TRP HZ3 . 16295 1 331 . 1 1 29 29 TRP CA C 13 56.422 . . 1 . . . . 29 TRP CA . 16295 1 332 . 1 1 29 29 TRP CB C 13 30.000 . . 1 . . . . 29 TRP CB . 16295 1 333 . 1 1 29 29 TRP CD1 C 13 127.591 . . 1 . . . . 29 TRP CD1 . 16295 1 334 . 1 1 29 29 TRP CE3 C 13 120.982 . . 1 . . . . 29 TRP CE3 . 16295 1 335 . 1 1 29 29 TRP CH2 C 13 123.919 . . 1 . . . . 29 TRP CH2 . 16295 1 336 . 1 1 29 29 TRP CZ2 C 13 114.372 . . 1 . . . . 29 TRP CZ2 . 16295 1 337 . 1 1 29 29 TRP CZ3 C 13 121.227 . . 1 . . . . 29 TRP CZ3 . 16295 1 338 . 1 1 29 29 TRP N N 15 118.970 . . 1 . . . . 29 TRP N . 16295 1 339 . 1 1 29 29 TRP NE1 N 15 131.000 . . 1 . . . . 29 TRP NE1 . 16295 1 340 . 1 1 30 30 CYS H H 1 8.272 . . 1 . . . . 30 CYS HN . 16295 1 341 . 1 1 30 30 CYS HA H 1 4.434 . . 1 . . . . 30 CYS HA . 16295 1 342 . 1 1 30 30 CYS HB2 H 1 2.572 . . 1 . . . . 30 CYS HB1 . 16295 1 343 . 1 1 30 30 CYS HB3 H 1 2.805 . . 1 . . . . 30 CYS HB2 . 16295 1 344 . 1 1 30 30 CYS CA C 13 54.976 . . 1 . . . . 30 CYS CA . 16295 1 345 . 1 1 30 30 CYS CB C 13 28.271 . . 1 . . . . 30 CYS CB . 16295 1 346 . 1 1 30 30 CYS N N 15 119.989 . . 1 . . . . 30 CYS N . 16295 1 347 . 1 1 31 31 PRO HA H 1 4.146 . . 1 . . . . 31 PRO HA . 16295 1 348 . 1 1 31 31 PRO HB2 H 1 1.787 . . 2 . . . . 31 PRO HB1 . 16295 1 349 . 1 1 31 31 PRO HB3 H 1 1.317 . . 2 . . . . 31 PRO HB2 . 16295 1 350 . 1 1 31 31 PRO HD2 H 1 3.187 . . 2 . . . . 31 PRO HD1 . 16295 1 351 . 1 1 31 31 PRO HG2 H 1 1.276 . . 2 . . . . 31 PRO HG1 . 16295 1 352 . 1 1 31 31 PRO HG3 H 1 1.044 . . 2 . . . . 31 PRO HG2 . 16295 1 353 . 1 1 31 31 PRO CA C 13 63.091 . . 1 . . . . 31 PRO CA . 16295 1 354 . 1 1 31 31 PRO CB C 13 31.854 . . 1 . . . . 31 PRO CB . 16295 1 355 . 1 1 31 31 PRO CD C 13 50.317 . . 1 . . . . 31 PRO CD . 16295 1 356 . 1 1 31 31 PRO CG C 13 26.259 . . 1 . . . . 31 PRO CG . 16295 1 357 . 1 1 32 32 PHE H H 1 6.805 . . 1 . . . . 32 PHE HN . 16295 1 358 . 1 1 32 32 PHE HA H 1 4.443 . . 1 . . . . 32 PHE HA . 16295 1 359 . 1 1 32 32 PHE HB2 H 1 3.086 . . 1 . . . . 32 PHE HB1 . 16295 1 360 . 1 1 32 32 PHE HB3 H 1 2.350 . . 1 . . . . 32 PHE HB2 . 16295 1 361 . 1 1 32 32 PHE HD1 H 1 6.973 . . 3 . . . . 32 PHE HD1 . 16295 1 362 . 1 1 32 32 PHE HE1 H 1 7.131 . . 3 . . . . 32 PHE HE1 . 16295 1 363 . 1 1 32 32 PHE HZ H 1 7.074 . . 1 . . . . 32 PHE HZ . 16295 1 364 . 1 1 32 32 PHE CA C 13 57.753 . . 1 . . . . 32 PHE CA . 16295 1 365 . 1 1 32 32 PHE CB C 13 40.077 . . 1 . . . . 32 PHE CB . 16295 1 366 . 1 1 32 32 PHE CD1 C 13 131.507 . . 3 . . . . 32 PHE CD1 . 16295 1 367 . 1 1 32 32 PHE CE1 C 13 131.262 . . 3 . . . . 32 PHE CE1 . 16295 1 368 . 1 1 32 32 PHE CZ C 13 129.304 . . 1 . . . . 32 PHE CZ . 16295 1 369 . 1 1 32 32 PHE N N 15 114.799 . . 1 . . . . 32 PHE N . 16295 1 370 . 1 1 33 33 TRP H H 1 7.218 . . 1 . . . . 33 TRP HN . 16295 1 371 . 1 1 33 33 TRP HA H 1 4.461 . . 1 . . . . 33 TRP HA . 16295 1 372 . 1 1 33 33 TRP HB2 H 1 3.464 . . 1 . . . . 33 TRP HB1 . 16295 1 373 . 1 1 33 33 TRP HB3 H 1 3.193 . . 1 . . . . 33 TRP HB2 . 16295 1 374 . 1 1 33 33 TRP HD1 H 1 7.221 . . 1 . . . . 33 TRP HD1 . 16295 1 375 . 1 1 33 33 TRP HE1 H 1 10.585 . . 1 . . . . 33 TRP HE1 . 16295 1 376 . 1 1 33 33 TRP HE3 H 1 7.517 . . 1 . . . . 33 TRP HE3 . 16295 1 377 . 1 1 33 33 TRP HH2 H 1 7.070 . . 1 . . . . 33 TRP HH2 . 16295 1 378 . 1 1 33 33 TRP HZ2 H 1 7.508 . . 1 . . . . 33 TRP HZ2 . 16295 1 379 . 1 1 33 33 TRP HZ3 H 1 6.965 . . 1 . . . . 33 TRP HZ3 . 16295 1 380 . 1 1 33 33 TRP CA C 13 59.105 . . 1 . . . . 33 TRP CA . 16295 1 381 . 1 1 33 33 TRP CB C 13 29.345 . . 1 . . . . 33 TRP CB . 16295 1 382 . 1 1 33 33 TRP CD1 C 13 126.856 . . 1 . . . . 33 TRP CD1 . 16295 1 383 . 1 1 33 33 TRP CE3 C 13 121.472 . . 1 . . . . 33 TRP CE3 . 16295 1 384 . 1 1 33 33 TRP CH2 C 13 123.919 . . 1 . . . . 33 TRP CH2 . 16295 1 385 . 1 1 33 33 TRP CZ2 C 13 114.616 . . 1 . . . . 33 TRP CZ2 . 16295 1 386 . 1 1 33 33 TRP CZ3 C 13 121.227 . . 1 . . . . 33 TRP CZ3 . 16295 1 387 . 1 1 33 33 TRP N N 15 121.766 . . 1 . . . . 33 TRP N . 16295 1 388 . 1 1 33 33 TRP NE1 N 15 130.668 . . 1 . . . . 33 TRP NE1 . 16295 1 stop_ save_