################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30805 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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 NOESY' . . . 30805 1 2 '2D NOESY' . . . 30805 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 DT H1' H 1 5.798 0.004 . 1 . . 15 . A 4 DT H1' . 30805 1 2 . 1 . 1 1 1 DT H2' H 1 1.630 0.003 . 1 . . 17 . A 4 DT H2' . 30805 1 3 . 1 . 1 1 1 DT H2'' H 1 2.057 0.002 . 1 . . 16 . A 4 DT H2'' . 30805 1 4 . 1 . 1 1 1 DT H3' H 1 4.465 . . 1 . . 53 . A 4 DT H3' . 30805 1 5 . 1 . 1 1 1 DT H4' H 1 3.833 . . 1 . . 539 . A 4 DT H4' . 30805 1 6 . 1 . 1 1 1 DT H5' H 1 3.480 0.0 . 1 . . 398 . A 4 DT H5' . 30805 1 7 . 1 . 1 1 1 DT H6 H 1 7.181 0.002 . 1 . . 18 . A 4 DT H6 . 30805 1 8 . 1 . 1 1 1 DT H71 H 1 1.565 0.003 . 1 . . 19 . A 4 DT H71 . 30805 1 9 . 1 . 1 1 1 DT H72 H 1 1.565 0.003 . 1 . . 19 . A 4 DT H72 . 30805 1 10 . 1 . 1 1 1 DT H73 H 1 1.565 0.003 . 1 . . 19 . A 4 DT H73 . 30805 1 11 . 1 . 1 2 2 DG H1' H 1 5.652 0.001 . 1 . . 21 . A 5 DG H1' . 30805 1 12 . 1 . 1 2 2 DG H2' H 1 2.326 0.003 . 1 . . 23 . A 5 DG H2' . 30805 1 13 . 1 . 1 2 2 DG H2'' H 1 2.326 0.003 . 1 . . 22 . A 5 DG H2'' . 30805 1 14 . 1 . 1 2 2 DG H3' H 1 4.757 0.001 . 1 . . 54 . A 5 DG H3' . 30805 1 15 . 1 . 1 2 2 DG H4' H 1 4.032 0.001 . 1 . . 524 . A 5 DG H4' . 30805 1 16 . 1 . 1 2 2 DG H5' H 1 3.671 . . 2 . . 540 . A 5 DG H5' . 30805 1 17 . 1 . 1 2 2 DG H5'' H 1 3.795 . . 2 . . 541 . A 5 DG H5'' . 30805 1 18 . 1 . 1 2 2 DG H8 H 1 7.568 0.001 . 1 . . 20 . A 5 DG H8 . 30805 1 19 . 1 . 1 3 3 DA H1' H 1 6.069 0.004 . 1 . . 33 . A 6 DA H1' . 30805 1 20 . 1 . 1 3 3 DA H2 H 1 7.841 0.002 . 1 . . 376 . A 6 DA H2 . 30805 1 21 . 1 . 1 3 3 DA H2' H 1 2.868 0.004 . 1 . . 35 . A 6 DA H2' . 30805 1 22 . 1 . 1 3 3 DA H2'' H 1 2.782 0.002 . 1 . . 34 . A 6 DA H2'' . 30805 1 23 . 1 . 1 3 3 DA H3' H 1 4.986 . . 1 . . 55 . A 6 DA H3' . 30805 1 24 . 1 . 1 3 3 DA H4' H 1 4.400 . . 1 . . 544 . A 6 DA H4' . 30805 1 25 . 1 . 1 3 3 DA H5' H 1 4.098 . . 2 . . 542 . A 6 DA H5' . 30805 1 26 . 1 . 1 3 3 DA H5'' H 1 4.063 . . 2 . . 543 . A 6 DA H5'' . 30805 1 27 . 1 . 1 3 3 DA H8 H 1 8.036 0.002 . 1 . . 24 . A 6 DA H8 . 30805 1 28 . 1 . 1 4 4 DG H1 H 1 11.510 0.003 . 1 . . 87 . A 7 DG H1 . 30805 1 29 . 1 . 1 4 4 DG H1' H 1 6.039 0.001 . 1 . . 31 . A 7 DG H1' . 30805 1 30 . 1 . 1 4 4 DG H2' H 1 2.731 0.003 . 1 . . 29 . A 7 DG H2' . 30805 1 31 . 1 . 1 4 4 DG H2'' H 1 2.987 0.002 . 1 . . 28 . A 7 DG H2'' . 30805 1 32 . 1 . 1 4 4 DG H3' H 1 5.029 0.001 . 1 . . 56 . A 7 DG H3' . 30805 1 33 . 1 . 1 4 4 DG H4' H 1 4.517 . . 1 . . 547 . A 7 DG H4' . 30805 1 34 . 1 . 1 4 4 DG H5' H 1 4.188 . . 2 . . 545 . A 7 DG H5' . 30805 1 35 . 1 . 1 4 4 DG H5'' H 1 4.219 . . 2 . . 546 . A 7 DG H5'' . 30805 1 36 . 1 . 1 4 4 DG H8 H 1 8.042 0.001 . 1 . . 32 . A 7 DG H8 . 30805 1 37 . 1 . 1 5 5 DG H1 H 1 11.018 0.002 . 1 . . 86 . A 8 DG H1 . 30805 1 38 . 1 . 1 5 5 DG H1' H 1 6.093 0.0 . 1 . . 76 . A 8 DG H1' . 30805 1 39 . 1 . 1 5 5 DG H2' H 1 2.611 . . 1 . . 75 . A 8 DG H2' . 30805 1 40 . 1 . 1 5 5 DG H2'' H 1 2.862 0.003 . 1 . . 74 . A 8 DG H2'' . 30805 1 41 . 1 . 1 5 5 DG H3' H 1 5.022 0.002 . 1 . . 78 . A 8 DG H3' . 30805 1 42 . 1 . 1 5 5 DG H4' H 1 4.532 . . 1 . . 549 . A 8 DG H4' . 30805 1 43 . 1 . 1 5 5 DG H5' H 1 4.300 . . 2 . . 550 . A 8 DG H5' . 30805 1 44 . 1 . 1 5 5 DG H5'' H 1 4.211 . . 2 . . 551 . A 8 DG H5'' . 30805 1 45 . 1 . 1 5 5 DG H8 H 1 7.714 0.002 . 1 . . 30 . A 8 DG H8 . 30805 1 46 . 1 . 1 6 6 DG H1 H 1 10.662 0.002 . 1 . . 89 . A 9 DG H1 . 30805 1 47 . 1 . 1 6 6 DG H1' H 1 6.203 0.001 . 1 . . 71 . A 9 DG H1' . 30805 1 48 . 1 . 1 6 6 DG H2' H 1 2.577 0.003 . 1 . . 73 . A 9 DG H2' . 30805 1 49 . 1 . 1 6 6 DG H2'' H 1 2.500 0.003 . 1 . . 72 . A 9 DG H2'' . 30805 1 50 . 1 . 1 6 6 DG H3' H 1 5.106 0.001 . 1 . . 77 . A 9 DG H3' . 30805 1 51 . 1 . 1 6 6 DG H4' H 1 4.536 . . 1 . . 552 . A 9 DG H4' . 30805 1 52 . 1 . 1 6 6 DG H5' H 1 4.319 . . 2 . . 553 . A 9 DG H5' . 30805 1 53 . 1 . 1 6 6 DG H5'' H 1 4.282 . . 2 . . 554 . A 9 DG H5'' . 30805 1 54 . 1 . 1 6 6 DG H8 H 1 7.582 0.002 . 1 . . 70 . A 9 DG H8 . 30805 1 55 . 1 . 1 7 7 DT H1' H 1 6.519 . . 1 . . 191 . A 10 DT H1' . 30805 1 56 . 1 . 1 7 7 DT H2' H 1 2.464 . . 1 . . 557 . A 10 DT H2' . 30805 1 57 . 1 . 1 7 7 DT H2'' H 1 2.655 . . 1 . . 558 . A 10 DT H2'' . 30805 1 58 . 1 . 1 7 7 DT H3' H 1 5.068 . . 1 . . 566 . A 10 DT H3' . 30805 1 59 . 1 . 1 7 7 DT H4' H 1 4.557 . . 1 . . 564 . A 10 DT H4' . 30805 1 60 . 1 . 1 7 7 DT H5' H 1 4.225 . . 2 . . 562 . A 10 DT H5' . 30805 1 61 . 1 . 1 7 7 DT H5'' H 1 4.324 . . 2 . . 563 . A 10 DT H5'' . 30805 1 62 . 1 . 1 7 7 DT H6 H 1 7.864 0.002 . 1 . . 175 . A 10 DT H6 . 30805 1 63 . 1 . 1 7 7 DT H71 H 1 2.001 . . 1 . . 567 . A 10 DT H71 . 30805 1 64 . 1 . 1 7 7 DT H72 H 1 2.001 . . 1 . . 567 . A 10 DT H72 . 30805 1 65 . 1 . 1 7 7 DT H73 H 1 2.001 . . 1 . . 567 . A 10 DT H73 . 30805 1 66 . 1 . 1 8 8 DG H1 H 1 11.189 0.002 . 1 . . 99 . A 11 DG H1 . 30805 1 67 . 1 . 1 8 8 DG H1' H 1 5.581 0.003 . 1 . . 59 . A 11 DG H1' . 30805 1 68 . 1 . 1 8 8 DG H2' H 1 2.186 0.001 . 1 . . 62 . A 11 DG H2' . 30805 1 69 . 1 . 1 8 8 DG H2'' H 1 2.720 0.002 . 1 . . 61 . A 11 DG H2'' . 30805 1 70 . 1 . 1 8 8 DG H3' H 1 4.997 0.003 . 1 . . 568 . A 11 DG H3' . 30805 1 71 . 1 . 1 8 8 DG H4' H 1 4.293 . . 1 . . 394 . A 11 DG H4' . 30805 1 72 . 1 . 1 8 8 DG H8 H 1 7.700 0.002 . 1 . . 60 . A 11 DG H8 . 30805 1 73 . 1 . 1 8 8 DG H21 H 1 9.242 . . 1 . . 393 . A 11 DG H21 . 30805 1 74 . 1 . 1 9 9 DG H1 H 1 11.107 0.004 . 1 . . 93 . A 12 DG H1 . 30805 1 75 . 1 . 1 9 9 DG H1' H 1 6.002 0.003 . 1 . . 58 . A 12 DG H1' . 30805 1 76 . 1 . 1 9 9 DG H2' H 1 2.532 0.002 . 1 . . 96 . A 12 DG H2' . 30805 1 77 . 1 . 1 9 9 DG H2'' H 1 2.747 0.004 . 1 . . 95 . A 12 DG H2'' . 30805 1 78 . 1 . 1 9 9 DG H3' H 1 5.018 0.001 . 1 . . 572 . A 12 DG H3' . 30805 1 79 . 1 . 1 9 9 DG H4' H 1 4.398 . . 1 . . 569 . A 12 DG H4' . 30805 1 80 . 1 . 1 9 9 DG H5' H 1 4.220 . . 2 . . 570 . A 12 DG H5' . 30805 1 81 . 1 . 1 9 9 DG H5'' H 1 4.128 . . 2 . . 571 . A 12 DG H5'' . 30805 1 82 . 1 . 1 9 9 DG H8 H 1 7.745 0.001 . 1 . . 57 . A 12 DG H8 . 30805 1 83 . 1 . 1 9 9 DG H21 H 1 9.088 0.003 . 1 . . 391 . A 12 DG H21 . 30805 1 84 . 1 . 1 9 9 DG H22 H 1 6.209 0.005 . 1 . . 392 . A 12 DG H22 . 30805 1 85 . 1 . 1 10 10 DG H1 H 1 10.826 0.005 . 1 . . 92 . A 13 DG H1 . 30805 1 86 . 1 . 1 10 10 DG H1' H 1 6.232 0.003 . 1 . . 196 . A 13 DG H1' . 30805 1 87 . 1 . 1 10 10 DG H2' H 1 2.722 0.002 . 1 . . 198 . A 13 DG H2' . 30805 1 88 . 1 . 1 10 10 DG H2'' H 1 2.575 0.002 . 1 . . 197 . A 13 DG H2'' . 30805 1 89 . 1 . 1 10 10 DG H3' H 1 5.034 . . 1 . . 573 . A 13 DG H3' . 30805 1 90 . 1 . 1 10 10 DG H4' H 1 4.454 . . 1 . . 574 . A 13 DG H4' . 30805 1 91 . 1 . 1 10 10 DG H5' H 1 4.256 . . 2 . . 575 . A 13 DG H5' . 30805 1 92 . 1 . 1 10 10 DG H5'' H 1 4.233 . . 2 . . 576 . A 13 DG H5'' . 30805 1 93 . 1 . 1 10 10 DG H8 H 1 7.715 0.001 . 1 . . 97 . A 13 DG H8 . 30805 1 94 . 1 . 1 11 11 DT H1' H 1 6.264 0.001 . 1 . . 80 . A 14 DT H1' . 30805 1 95 . 1 . 1 11 11 DT H2' H 1 2.225 0.003 . 1 . . 79 . A 14 DT H2' . 30805 1 96 . 1 . 1 11 11 DT H2'' H 1 2.472 0.001 . 1 . . 81 . A 14 DT H2'' . 30805 1 97 . 1 . 1 11 11 DT H3' H 1 4.735 . . 1 . . 581 . A 14 DT H3' . 30805 1 98 . 1 . 1 11 11 DT H4' H 1 3.950 . . 1 . . 578 . A 14 DT H4' . 30805 1 99 . 1 . 1 11 11 DT H5' H 1 3.781 . . 2 . . 579 . A 14 DT H5' . 30805 1 100 . 1 . 1 11 11 DT H5'' H 1 3.815 . . 2 . . 580 . A 14 DT H5'' . 30805 1 101 . 1 . 1 11 11 DT H6 H 1 7.678 0.0 . 1 . . 25 . A 14 DT H6 . 30805 1 102 . 1 . 1 11 11 DT H71 H 1 1.954 0.001 . 1 . . 26 . A 14 DT H71 . 30805 1 103 . 1 . 1 11 11 DT H72 H 1 1.954 0.001 . 1 . . 26 . A 14 DT H72 . 30805 1 104 . 1 . 1 11 11 DT H73 H 1 1.954 0.001 . 1 . . 26 . A 14 DT H73 . 30805 1 105 . 1 . 1 12 12 DA H1' H 1 6.659 0.003 . 1 . . 2 . A 15 DA H1' . 30805 1 106 . 1 . 1 12 12 DA H2 H 1 8.349 0.002 . 1 . . 5 . A 15 DA H2 . 30805 1 107 . 1 . 1 12 12 DA H2' H 1 3.074 0.004 . 1 . . 3 . A 15 DA H2' . 30805 1 108 . 1 . 1 12 12 DA H2'' H 1 2.946 0.002 . 1 . . 4 . A 15 DA H2'' . 30805 1 109 . 1 . 1 12 12 DA H3' H 1 5.181 . . 1 . . 582 . A 15 DA H3' . 30805 1 110 . 1 . 1 12 12 DA H4' H 1 4.593 . . 1 . . 204 . A 15 DA H4' . 30805 1 111 . 1 . 1 12 12 DA H5' H 1 4.199 . . 2 . . 583 . A 15 DA H5' . 30805 1 112 . 1 . 1 12 12 DA H5'' H 1 4.295 . . 2 . . 584 . A 15 DA H5'' . 30805 1 113 . 1 . 1 12 12 DA H8 H 1 8.561 0.001 . 1 . . 1 . A 15 DA H8 . 30805 1 114 . 1 . 1 13 13 DG H1 H 1 11.574 0.003 . 1 . . 84 . A 16 DG H1 . 30805 1 115 . 1 . 1 13 13 DG H1' H 1 5.896 0.002 . 1 . . 49 . A 16 DG H1' . 30805 1 116 . 1 . 1 13 13 DG H2' H 1 2.472 0.003 . 1 . . 51 . A 16 DG H2' . 30805 1 117 . 1 . 1 13 13 DG H2'' H 1 2.873 0.003 . 1 . . 50 . A 16 DG H2'' . 30805 1 118 . 1 . 1 13 13 DG H3' H 1 4.994 . . 1 . . 585 . A 16 DG H3' . 30805 1 119 . 1 . 1 13 13 DG H4' H 1 4.494 0.0 . 1 . . 205 . A 16 DG H4' . 30805 1 120 . 1 . 1 13 13 DG H5' H 1 4.236 . . 2 . . 395 . A 16 DG H5' . 30805 1 121 . 1 . 1 13 13 DG H5'' H 1 4.296 . . 2 . . 396 . A 16 DG H5'' . 30805 1 122 . 1 . 1 13 13 DG H8 H 1 7.843 0.002 . 1 . . 100 . A 16 DG H8 . 30805 1 123 . 1 . 1 14 14 DG H1 H 1 11.025 0.001 . 1 . . 85 . A 17 DG H1 . 30805 1 124 . 1 . 1 14 14 DG H1' H 1 6.084 0.002 . 1 . . 69 . A 17 DG H1' . 30805 1 125 . 1 . 1 14 14 DG H2' H 1 2.575 0.002 . 1 . . 200 . A 17 DG H2' . 30805 1 126 . 1 . 1 14 14 DG H2'' H 1 2.860 0.004 . 1 . . 199 . A 17 DG H2'' . 30805 1 127 . 1 . 1 14 14 DG H3' H 1 5.014 . . 1 . . 586 . A 17 DG H3' . 30805 1 128 . 1 . 1 14 14 DG H4' H 1 4.525 . . 1 . . 587 . A 17 DG H4' . 30805 1 129 . 1 . 1 14 14 DG H5' H 1 4.221 . . 2 . . 588 . A 17 DG H5' . 30805 1 130 . 1 . 1 14 14 DG H5'' H 1 4.239 . . 2 . . 589 . A 17 DG H5'' . 30805 1 131 . 1 . 1 14 14 DG H8 H 1 7.636 0.002 . 1 . . 52 . A 17 DG H8 . 30805 1 132 . 1 . 1 14 14 DG H21 H 1 9.114 0.007 . 1 . . 389 . A 17 DG H21 . 30805 1 133 . 1 . 1 14 14 DG H22 H 1 6.672 0.004 . 1 . . 390 . A 17 DG H22 . 30805 1 134 . 1 . 1 15 15 DG H1 H 1 10.848 0.002 . 1 . . 90 . A 18 DG H1 . 30805 1 135 . 1 . 1 15 15 DG H1' H 1 6.322 0.001 . 1 . . 65 . A 18 DG H1' . 30805 1 136 . 1 . 1 15 15 DG H2' H 1 2.688 . . 1 . . 67 . A 18 DG H2' . 30805 1 137 . 1 . 1 15 15 DG H2'' H 1 2.582 . . 1 . . 66 . A 18 DG H2'' . 30805 1 138 . 1 . 1 15 15 DG H3' H 1 5.141 . . 1 . . 591 . A 18 DG H3' . 30805 1 139 . 1 . 1 15 15 DG H4' H 1 4.573 . . 1 . . 590 . A 18 DG H4' . 30805 1 140 . 1 . 1 15 15 DG H5' H 1 4.353 . . 2 . . 592 . A 18 DG H5' . 30805 1 141 . 1 . 1 15 15 DG H5'' H 1 4.526 . . 2 . . 593 . A 18 DG H5'' . 30805 1 142 . 1 . 1 15 15 DG H8 H 1 7.670 0.001 . 1 . . 68 . A 18 DG H8 . 30805 1 143 . 1 . 1 16 16 DT H1' H 1 6.532 . . 1 . . 192 . A 19 DT H1' . 30805 1 144 . 1 . 1 16 16 DT H2' H 1 2.476 . . 1 . . 555 . A 19 DT H2' . 30805 1 145 . 1 . 1 16 16 DT H2'' H 1 2.666 . . 1 . . 556 . A 19 DT H2'' . 30805 1 146 . 1 . 1 16 16 DT H3' H 1 5.087 . . 1 . . 565 . A 19 DT H3' . 30805 1 147 . 1 . 1 16 16 DT H4' H 1 4.587 . . 1 . . 559 . A 19 DT H4' . 30805 1 148 . 1 . 1 16 16 DT H5' H 1 4.260 . . 2 . . 560 . A 19 DT H5' . 30805 1 149 . 1 . 1 16 16 DT H5'' H 1 4.347 . . 2 . . 561 . A 19 DT H5'' . 30805 1 150 . 1 . 1 16 16 DT H6 H 1 7.872 0.002 . 1 . . 176 . A 19 DT H6 . 30805 1 151 . 1 . 1 17 17 DG H1 H 1 11.156 0.002 . 1 . . 94 . A 20 DG H1 . 30805 1 152 . 1 . 1 17 17 DG H1' H 1 5.818 0.002 . 1 . . 44 . A 20 DG H1' . 30805 1 153 . 1 . 1 17 17 DG H2' H 1 2.268 0.001 . 1 . . 45 . A 20 DG H2' . 30805 1 154 . 1 . 1 17 17 DG H2'' H 1 2.732 0.0 . 1 . . 46 . A 20 DG H2'' . 30805 1 155 . 1 . 1 17 17 DG H3' H 1 5.038 0.0 . 1 . . 597 . A 20 DG H3' . 30805 1 156 . 1 . 1 17 17 DG H4' H 1 4.414 . . 1 . . 596 . A 20 DG H4' . 30805 1 157 . 1 . 1 17 17 DG H5' H 1 4.263 . . 2 . . 594 . A 20 DG H5' . 30805 1 158 . 1 . 1 17 17 DG H5'' H 1 4.316 . . 2 . . 595 . A 20 DG H5'' . 30805 1 159 . 1 . 1 17 17 DG H8 H 1 7.781 0.001 . 1 . . 47 . A 20 DG H8 . 30805 1 160 . 1 . 1 18 18 DG H1 H 1 11.225 0.002 . 1 . . 88 . A 21 DG H1 . 30805 1 161 . 1 . 1 18 18 DG H1' H 1 6.018 0.003 . 1 . . 27 . A 21 DG H1' . 30805 1 162 . 1 . 1 18 18 DG H2' H 1 2.641 . . 1 . . 203 . A 21 DG H2' . 30805 1 163 . 1 . 1 18 18 DG H2'' H 1 2.731 . . 1 . . 202 . A 21 DG H2'' . 30805 1 164 . 1 . 1 18 18 DG H3' H 1 5.078 . . 1 . . 598 . A 21 DG H3' . 30805 1 165 . 1 . 1 18 18 DG H4' H 1 4.535 . . 1 . . 599 . A 21 DG H4' . 30805 1 166 . 1 . 1 18 18 DG H5' H 1 4.181 . . 2 . . 600 . A 21 DG H5' . 30805 1 167 . 1 . 1 18 18 DG H5'' H 1 4.266 . . 2 . . 601 . A 21 DG H5'' . 30805 1 168 . 1 . 1 18 18 DG H8 H 1 7.851 0.001 . 1 . . 48 . A 21 DG H8 . 30805 1 169 . 1 . 1 19 19 DG H1 H 1 10.910 0.002 . 1 . . 91 . A 22 DG H1 . 30805 1 170 . 1 . 1 19 19 DG H1' H 1 6.218 0.002 . 1 . . 7 . A 22 DG H1' . 30805 1 171 . 1 . 1 19 19 DG H2' H 1 2.556 0.003 . 1 . . 6 . A 22 DG H2' . 30805 1 172 . 1 . 1 19 19 DG H2'' H 1 2.686 0.001 . 1 . . 8 . A 22 DG H2'' . 30805 1 173 . 1 . 1 19 19 DG H3' H 1 5.026 0.002 . 1 . . 82 . A 22 DG H3' . 30805 1 174 . 1 . 1 19 19 DG H4' H 1 4.530 . . 1 . . 604 . A 22 DG H4' . 30805 1 175 . 1 . 1 19 19 DG H5' H 1 4.305 . . 2 . . 602 . A 22 DG H5' . 30805 1 176 . 1 . 1 19 19 DG H5'' H 1 4.234 . . 2 . . 603 . A 22 DG H5'' . 30805 1 177 . 1 . 1 19 19 DG H8 H 1 7.665 0.001 . 1 . . 14 . A 22 DG H8 . 30805 1 178 . 1 . 1 20 20 DT H1' H 1 5.936 0.018 . 1 . . 10 . A 23 DT H1' . 30805 1 179 . 1 . 1 20 20 DT H2' H 1 1.890 0.001 . 1 . . 11 . A 23 DT H2' . 30805 1 180 . 1 . 1 20 20 DT H2'' H 1 2.166 0.002 . 1 . . 12 . A 23 DT H2'' . 30805 1 181 . 1 . 1 20 20 DT H3' H 1 4.801 0.003 . 1 . . 83 . A 23 DT H3' . 30805 1 182 . 1 . 1 20 20 DT H4' H 1 4.232 0.002 . 1 . . 525 . A 23 DT H4' . 30805 1 183 . 1 . 1 20 20 DT H5' H 1 4.178 . . 2 . . 605 . A 23 DT H5' . 30805 1 184 . 1 . 1 20 20 DT H5'' H 1 4.107 . . 2 . . 606 . A 23 DT H5'' . 30805 1 185 . 1 . 1 20 20 DT H6 H 1 7.347 0.003 . 1 . . 9 . A 23 DT H6 . 30805 1 186 . 1 . 1 20 20 DT H71 H 1 1.780 0.002 . 1 . . 13 . A 23 DT H71 . 30805 1 187 . 1 . 1 20 20 DT H72 H 1 1.780 0.002 . 1 . . 13 . A 23 DT H72 . 30805 1 188 . 1 . 1 20 20 DT H73 H 1 1.780 0.002 . 1 . . 13 . A 23 DT H73 . 30805 1 189 . 1 . 1 21 21 DA H1' H 1 5.784 0.002 . 1 . . 37 . A 24 DA H1' . 30805 1 190 . 1 . 1 21 21 DA H2 H 1 7.554 0.002 . 1 . . 397 . A 24 DA H2 . 30805 1 191 . 1 . 1 21 21 DA H2' H 1 2.305 0.003 . 1 . . 39 . A 24 DA H2' . 30805 1 192 . 1 . 1 21 21 DA H2'' H 1 2.423 0.002 . 1 . . 38 . A 24 DA H2'' . 30805 1 193 . 1 . 1 21 21 DA H3' H 1 4.778 0.002 . 1 . . 400 . A 24 DA H3' . 30805 1 194 . 1 . 1 21 21 DA H4' H 1 4.056 0.0 . 1 . . 404 . A 24 DA H4' . 30805 1 195 . 1 . 1 21 21 DA H5' H 1 3.837 . . 2 . . 607 . A 24 DA H5' . 30805 1 196 . 1 . 1 21 21 DA H5'' H 1 3.931 . . 2 . . 608 . A 24 DA H5'' . 30805 1 197 . 1 . 1 21 21 DA H8 H 1 8.002 0.002 . 1 . . 36 . A 24 DA H8 . 30805 1 198 . 1 . 1 22 22 DA H1' H 1 5.979 0.001 . 1 . . 41 . A 25 DA H1' . 30805 1 199 . 1 . 1 22 22 DA H2' H 1 2.470 0.001 . 1 . . 43 . A 25 DA H2' . 30805 1 200 . 1 . 1 22 22 DA H2'' H 1 2.279 0.003 . 1 . . 42 . A 25 DA H2'' . 30805 1 201 . 1 . 1 22 22 DA H3' H 1 4.555 . . 1 . . 401 . A 25 DA H3' . 30805 1 202 . 1 . 1 22 22 DA H4' H 1 3.961 . . 1 . . 609 . A 25 DA H4' . 30805 1 203 . 1 . 1 22 22 DA H5' H 1 3.926 . . 2 . . 610 . A 25 DA H5' . 30805 1 204 . 1 . 1 22 22 DA H5'' H 1 3.900 . . 2 . . 611 . A 25 DA H5'' . 30805 1 205 . 1 . 1 22 22 DA H8 H 1 8.058 0.002 . 1 . . 40 . A 25 DA H8 . 30805 1 206 . 2 . 2 1 1 WAM H3 H 1 7.924 0.002 . 1 . . 189 . A 101 WAM H3 . 30805 1 207 . 2 . 2 1 1 WAM H5 H 1 7.895 0.004 . 1 . . 195 . A 101 WAM H5 . 30805 1 208 . 2 . 2 1 1 WAM H6 H 1 7.503 0.003 . 1 . . 194 . A 101 WAM H6 . 30805 1 209 . 2 . 2 1 1 WAM H7 H 1 7.650 0.001 . 1 . . 193 . A 101 WAM H7 . 30805 1 210 . 2 . 2 1 1 WAM H8 H 1 7.769 0.004 . 1 . . 188 . A 101 WAM H8 . 30805 1 211 . 2 . 2 1 1 WAM H9 H 1 6.905 0.005 . 1 . . 103 . A 101 WAM H9 . 30805 1 212 . 2 . 2 1 1 WAM H10 H 1 7.373 0.002 . 1 . . 190 . A 101 WAM H10 . 30805 1 213 . 2 . 2 1 1 WAM H12 H 1 6.691 0.004 . 1 . . 101 . A 101 WAM H12 . 30805 1 214 . 2 . 2 1 1 WAM H131 H 1 3.573 0.003 . 1 . . 102 . A 101 WAM H131 . 30805 1 215 . 2 . 2 1 1 WAM H132 H 1 3.573 0.003 . 1 . . 102 . A 101 WAM H132 . 30805 1 216 . 2 . 2 1 1 WAM H133 H 1 3.573 0.003 . 1 . . 102 . A 101 WAM H133 . 30805 1 217 . 2 . 2 1 1 WAM H15 H 1 6.448 0.003 . 1 . . 186 . A 101 WAM H15 . 30805 1 218 . 2 . 2 1 1 WAM H16 H 1 6.687 0.003 . 1 . . 187 . A 101 WAM H16 . 30805 1 219 . 2 . 2 1 1 WAM HM11 H 1 4.072 0.002 . 1 . . 104 . A 101 WAM HM11 . 30805 1 220 . 2 . 2 1 1 WAM HM12 H 1 4.072 0.002 . 1 . . 104 . A 101 WAM HM12 . 30805 1 221 . 2 . 2 1 1 WAM HM13 H 1 4.072 0.002 . 1 . . 104 . A 101 WAM HM13 . 30805 1 stop_ save_