################################### # 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 52285 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name pre-miR-20a _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 1H-13C HSQC/HMQC' . . . 52285 1 2 '2D 1H-1H NOESY' . . . 52285 1 3 '2D 1H-15N HSQC' . . . 52285 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 1 $software_1 . . 52285 1 2 $software_2 . . 52285 1 3 $software_3 . . 52285 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 G H3' H 1 4.8142 0.0000 . 1 . . . . . 1200 G H3' . 52285 1 2 . 1 . 1 1 1 G H2' H 1 5.0335 0.0000 . 1 . . . . . 1200 G H2' . 52285 1 3 . 1 . 1 1 1 G H1' H 1 5.9112 0.0000 . 1 . . . . . 1200 G H1' . 52285 1 4 . 1 . 1 1 1 G C8 C 13 139.3139 0.0000 . 1 . . . . . 1200 G C8 . 52285 1 5 . 1 . 1 1 1 G H8 H 1 8.2366 0.0000 . 1 . . . . . 1200 G H8 . 52285 1 6 . 1 . 1 2 2 G H3' H 1 4.7720 0.0000 . 1 . . . . . 481 G H3' . 52285 1 7 . 1 . 1 2 2 G H2' H 1 4.6367 0.0000 . 1 . . . . . 481 G H2' . 52285 1 8 . 1 . 1 2 2 G H1' H 1 5.9992 0.0000 . 1 . . . . . 481 G H1' . 52285 1 9 . 1 . 1 2 2 G C8 C 13 136.8049 0.0000 . 1 . . . . . 481 G C8 . 52285 1 10 . 1 . 1 2 2 G H8 H 1 7.6114 0.0000 . 1 . . . . . 481 G H8 . 52285 1 11 . 1 . 1 3 3 U H3' H 1 4.5406 0.0000 . 1 . . . . . 482 U H3' . 52285 1 12 . 1 . 1 3 3 U H2' H 1 4.3468 0.0000 . 1 . . . . . 482 U H2' . 52285 1 13 . 1 . 1 3 3 U H1' H 1 5.5711 0.0000 . 1 . . . . . 482 U H1' . 52285 1 14 . 1 . 1 3 3 U H5 H 1 5.5778 0.0000 . 1 . . . . . 482 U H5 . 52285 1 15 . 1 . 1 3 3 U H6 H 1 7.8174 0.0000 . 1 . . . . . 482 U H6 . 52285 1 16 . 1 . 1 4 4 A H3' H 1 4.6489 0.0000 . 1 . . . . . 483 A H3' . 52285 1 17 . 1 . 1 4 4 A H2' H 1 4.5866 0.0000 . 1 . . . . . 483 A H2' . 52285 1 18 . 1 . 1 4 4 A C1' C 13 92.1449 0.0000 . 1 . . . . . 483 A C1' . 52285 1 19 . 1 . 1 4 4 A H1' H 1 6.0790 0.0000 . 1 . . . . . 483 A H1' . 52285 1 20 . 1 . 1 4 4 A C8 C 13 140.5692 0.0000 . 1 . . . . . 483 A C8 . 52285 1 21 . 1 . 1 4 4 A H8 H 1 8.3799 0.0000 . 1 . . . . . 483 A H8 . 52285 1 22 . 1 . 1 4 4 A H2 H 1 7.0690 0.0000 . 1 . . . . . 483 A H2 . 52285 1 23 . 1 . 1 4 4 A N1 N 15 221.9660 0.0000 . 1 . . . . . 483 A N1 . 52285 1 24 . 1 . 1 5 5 G H3' H 1 4.1834 0.0000 . 1 . . . . . 484 G H3' . 52285 1 25 . 1 . 1 5 5 G H2' H 1 4.3857 0.0000 . 1 . . . . . 484 G H2' . 52285 1 26 . 1 . 1 5 5 G C1' C 13 90.5319 0.0000 . 1 . . . . . 484 G C1' . 52285 1 27 . 1 . 1 5 5 G H1' H 1 5.5218 0.0000 . 1 . . . . . 484 G H1' . 52285 1 28 . 1 . 1 5 5 G C8 C 13 136.1830 0.0000 . 1 . . . . . 484 G C8 . 52285 1 29 . 1 . 1 5 5 G H8 H 1 7.2555 0.0000 . 1 . . . . . 484 G H8 . 52285 1 30 . 1 . 1 6 6 C H3' H 1 4.4577 0.0000 . 1 . . . . . 485 C H3' . 52285 1 31 . 1 . 1 6 6 C H2' H 1 4.4577 0.0000 . 1 . . . . . 485 C H2' . 52285 1 32 . 1 . 1 6 6 C H1' H 1 5.6016 0.0000 . 1 . . . . . 485 C H1' . 52285 1 33 . 1 . 1 6 6 C H5 H 1 5.3499 0.0000 . 1 . . . . . 485 C H5 . 52285 1 34 . 1 . 1 6 6 C H6 H 1 7.8154 0.0000 . 1 . . . . . 485 C H6 . 52285 1 35 . 1 . 1 7 7 A H3' H 1 4.5515 0.0000 . 1 . . . . . 486 A H3' . 52285 1 36 . 1 . 1 7 7 A H2' H 1 4.6284 0.0000 . 1 . . . . . 486 A H2' . 52285 1 37 . 1 . 1 7 7 A C1' C 13 90.5517 0.0000 . 1 . . . . . 486 A C1' . 52285 1 38 . 1 . 1 7 7 A H1' H 1 5.9934 0.0000 . 1 . . . . . 486 A H1' . 52285 1 39 . 1 . 1 7 7 A H8 H 1 7.7616 0.0000 . 1 . . . . . 486 A H8 . 52285 1 40 . 1 . 1 7 7 A C2 C 13 153.0841 0.0000 . 1 . . . . . 486 A C2 . 52285 1 41 . 1 . 1 7 7 A H2 H 1 7.2134 0.0000 . 1 . . . . . 486 A H2 . 52285 1 42 . 1 . 1 7 7 A N1 N 15 223.9801 0.0000 . 1 . . . . . 486 A N1 . 52285 1 43 . 1 . 1 8 8 C H3' H 1 4.4546 0.0000 . 1 . . . . . 487 C H3' . 52285 1 44 . 1 . 1 8 8 C H2' H 1 4.4548 0.0000 . 1 . . . . . 487 C H2' . 52285 1 45 . 1 . 1 8 8 C H1' H 1 5.4730 0.0000 . 1 . . . . . 487 C H1' . 52285 1 46 . 1 . 1 8 8 C H5 H 1 5.1473 0.0000 . 1 . . . . . 487 C H5 . 52285 1 47 . 1 . 1 8 8 C H6 H 1 7.5441 0.0000 . 1 . . . . . 487 C H6 . 52285 1 48 . 1 . 1 9 9 U H3' H 1 4.4227 0.0000 . 1 . . . . . 488 U H3' . 52285 1 49 . 1 . 1 9 9 U H2' H 1 4.5770 0.0000 . 1 . . . . . 488 U H2' . 52285 1 50 . 1 . 1 9 9 U H1' H 1 5.7826 0.0000 . 1 . . . . . 488 U H1' . 52285 1 51 . 1 . 1 9 9 U N3 N 15 161.5045 0.0000 . 1 . . . . . 488 U N3 . 52285 1 52 . 1 . 1 9 9 U H5 H 1 5.3675 0.0000 . 1 . . . . . 488 U H5 . 52285 1 53 . 1 . 1 9 9 U H6 H 1 7.7649 0.0000 . 1 . . . . . 488 U H6 . 52285 1 54 . 1 . 1 10 10 A H3' H 1 4.5829 0.0000 . 1 . . . . . 489 A H3' . 52285 1 55 . 1 . 1 10 10 A H2' H 1 4.6346 0.0000 . 1 . . . . . 489 A H2' . 52285 1 56 . 1 . 1 10 10 A H1' H 1 5.7134 0.0000 . 1 . . . . . 489 A H1' . 52285 1 57 . 1 . 1 10 10 A H8 H 1 8.0189 0.0000 . 1 . . . . . 489 A H8 . 52285 1 58 . 1 . 1 10 10 A C2 C 13 154.0062 0.0000 . 1 . . . . . 489 A C2 . 52285 1 59 . 1 . 1 10 10 A H2 H 1 7.2005 0.0000 . 1 . . . . . 489 A H2 . 52285 1 60 . 1 . 1 10 10 A N1 N 15 224.8568 0.0000 . 1 . . . . . 489 A N1 . 52285 1 61 . 1 . 1 11 11 A H3' H 1 4.7108 0.0000 . 1 . . . . . 490 A H3' . 52285 1 62 . 1 . 1 11 11 A H2' H 1 4.5580 0.0000 . 1 . . . . . 490 A H2' . 52285 1 63 . 1 . 1 11 11 A C1' C 13 93.0418 0.0000 . 1 . . . . . 490 A C1' . 52285 1 64 . 1 . 1 11 11 A H1' H 1 5.5116 0.0000 . 1 . . . . . 490 A H1' . 52285 1 65 . 1 . 1 11 11 A C8 C 13 139.6228 0.0000 . 1 . . . . . 490 A C8 . 52285 1 66 . 1 . 1 11 11 A H8 H 1 8.0833 0.0000 . 1 . . . . . 490 A H8 . 52285 1 67 . 1 . 1 11 11 A C2 C 13 152.7587 0.0000 . 1 . . . . . 490 A C2 . 52285 1 68 . 1 . 1 11 11 A H2 H 1 7.0664 0.0000 . 1 . . . . . 490 A H2 . 52285 1 69 . 1 . 1 11 11 A N1 N 15 221.9428 0.0000 . 1 . . . . . 490 A N1 . 52285 1 70 . 1 . 1 12 12 A H3' H 1 4.5583 0.0000 . 1 . . . . . 491 A H3' . 52285 1 71 . 1 . 1 12 12 A H2' H 1 4.5703 0.0000 . 1 . . . . . 491 A H2' . 52285 1 72 . 1 . 1 12 12 A C1' C 13 92.7399 0.0000 . 1 . . . . . 491 A C1' . 52285 1 73 . 1 . 1 12 12 A H1' H 1 5.8386 0.0000 . 1 . . . . . 491 A H1' . 52285 1 74 . 1 . 1 12 12 A C8 C 13 139.6080 0.0000 . 1 . . . . . 491 A C8 . 52285 1 75 . 1 . 1 12 12 A H8 H 1 7.7811 0.0000 . 1 . . . . . 491 A H8 . 52285 1 76 . 1 . 1 12 12 A C2 C 13 153.3598 0.0000 . 1 . . . . . 491 A C2 . 52285 1 77 . 1 . 1 12 12 A H2 H 1 7.5449 0.0000 . 1 . . . . . 491 A H2 . 52285 1 78 . 1 . 1 12 12 A N1 N 15 221.2372 0.0000 . 1 . . . . . 491 A N1 . 52285 1 79 . 1 . 1 13 13 G H3' H 1 4.4222 0.0000 . 1 . . . . . 492 G H3' . 52285 1 80 . 1 . 1 13 13 G H2' H 1 4.4986 0.0000 . 1 . . . . . 492 G H2' . 52285 1 81 . 1 . 1 13 13 G C1' C 13 92.7462 0.0000 . 1 . . . . . 492 G C1' . 52285 1 82 . 1 . 1 13 13 G H1' H 1 5.6048 0.0000 . 1 . . . . . 492 G H1' . 52285 1 83 . 1 . 1 13 13 G C8 C 13 135.8767 0.0000 . 1 . . . . . 492 G C8 . 52285 1 84 . 1 . 1 13 13 G H8 H 1 7.1581 0.0000 . 1 . . . . . 492 G H8 . 52285 1 85 . 1 . 1 14 14 U H3' H 1 4.5690 0.0000 . 1 . . . . . 493 U H3' . 52285 1 86 . 1 . 1 14 14 U H2' H 1 4.6338 0.0000 . 1 . . . . . 493 U H2' . 52285 1 87 . 1 . 1 14 14 U H1' H 1 5.5840 0.0000 . 1 . . . . . 493 U H1' . 52285 1 88 . 1 . 1 14 14 U N3 N 15 161.6940 0.0000 . 1 . . . . . 493 U N3 . 52285 1 89 . 1 . 1 14 14 U H5 H 1 5.0585 0.0000 . 1 . . . . . 493 U H5 . 52285 1 90 . 1 . 1 14 14 U H6 H 1 7.6954 0.0000 . 1 . . . . . 493 U H6 . 52285 1 91 . 1 . 1 15 15 G H3' H 1 4.6302 0.0000 . 1 . . . . . 494 G H3' . 52285 1 92 . 1 . 1 15 15 G H2' H 1 4.5678 0.0000 . 1 . . . . . 494 G H2' . 52285 1 93 . 1 . 1 15 15 G C1' C 13 90.2488 0.0000 . 1 . . . . . 494 G C1' . 52285 1 94 . 1 . 1 15 15 G H1' H 1 5.8589 0.0000 . 1 . . . . . 494 G H1' . 52285 1 95 . 1 . 1 15 15 G C8 C 13 136.1644 0.0000 . 1 . . . . . 494 G C8 . 52285 1 96 . 1 . 1 15 15 G H8 H 1 7.7295 0.0000 . 1 . . . . . 494 G H8 . 52285 1 97 . 1 . 1 16 16 C H3' H 1 4.4856 0.0000 . 1 . . . . . 495 C H3' . 52285 1 98 . 1 . 1 16 16 C H2' H 1 4.4685 0.0000 . 1 . . . . . 495 C H2' . 52285 1 99 . 1 . 1 16 16 C H1' H 1 5.5250 0.0000 . 1 . . . . . 495 C H1' . 52285 1 100 . 1 . 1 16 16 C H5 H 1 5.2716 0.0000 . 1 . . . . . 495 C H5 . 52285 1 101 . 1 . 1 16 16 C H6 H 1 7.6911 0.0000 . 1 . . . . . 495 C H6 . 52285 1 102 . 1 . 1 17 17 U H3' H 1 4.5409 0.0000 . 1 . . . . . 496 U H3' . 52285 1 103 . 1 . 1 17 17 U H2' H 1 4.6541 0.0000 . 1 . . . . . 496 U H2' . 52285 1 104 . 1 . 1 17 17 U H1' H 1 5.5933 0.0000 . 1 . . . . . 496 U H1' . 52285 1 105 . 1 . 1 17 17 U N3 N 15 161.5045 0.0000 . 1 . . . . . 496 U N3 . 52285 1 106 . 1 . 1 17 17 U H5 H 1 5.4362 0.0000 . 1 . . . . . 496 U H5 . 52285 1 107 . 1 . 1 17 17 U H6 H 1 7.8033 0.0000 . 1 . . . . . 496 U H6 . 52285 1 108 . 1 . 1 18 18 U H3' H 1 4.7305 0.0000 . 1 . . . . . 497 U H3' . 52285 1 109 . 1 . 1 18 18 U H2' H 1 4.3324 0.0000 . 1 . . . . . 497 U H2' . 52285 1 110 . 1 . 1 18 18 U H1' H 1 5.4929 0.0000 . 1 . . . . . 497 U H1' . 52285 1 111 . 1 . 1 18 18 U H5 H 1 5.8932 0.0000 . 1 . . . . . 497 U H5 . 52285 1 112 . 1 . 1 18 18 U H6 H 1 7.9971 0.0000 . 1 . . . . . 497 U H6 . 52285 1 113 . 1 . 1 19 19 A H3' H 1 4.7690 0.0000 . 1 . . . . . 498 A H3' . 52285 1 114 . 1 . 1 19 19 A H2' H 1 4.5439 0.0000 . 1 . . . . . 498 A H2' . 52285 1 115 . 1 . 1 19 19 A C1' C 13 91.1991 0.0000 . 1 . . . . . 498 A C1' . 52285 1 116 . 1 . 1 19 19 A H1' H 1 5.9326 0.0000 . 1 . . . . . 498 A H1' . 52285 1 117 . 1 . 1 19 19 A C8 C 13 140.8928 0.0000 . 1 . . . . . 498 A C8 . 52285 1 118 . 1 . 1 19 19 A H8 H 1 8.4496 0.0000 . 1 . . . . . 498 A H8 . 52285 1 119 . 1 . 1 19 19 A H2 H 1 7.2397 0.0000 . 1 . . . . . 498 A H2 . 52285 1 120 . 1 . 1 19 19 A N1 N 15 222.5891 0.0000 . 1 . . . . . 498 A N1 . 52285 1 121 . 1 . 1 20 20 U H3' H 1 4.4482 0.0000 . 1 . . . . . 499 U H3' . 52285 1 122 . 1 . 1 20 20 U H2' H 1 4.4425 0.0000 . 1 . . . . . 499 U H2' . 52285 1 123 . 1 . 1 20 20 U H1' H 1 5.4967 0.0000 . 1 . . . . . 499 U H1' . 52285 1 124 . 1 . 1 20 20 U N3 N 15 160.9919 0.0000 . 1 . . . . . 499 U N3 . 52285 1 125 . 1 . 1 20 20 U H5 H 1 5.1414 0.0000 . 1 . . . . . 499 U H5 . 52285 1 126 . 1 . 1 20 20 U H6 H 1 7.6828 0.0000 . 1 . . . . . 499 U H6 . 52285 1 127 . 1 . 1 21 21 A H3' H 1 4.7557 0.0000 . 1 . . . . . 500 A H3' . 52285 1 128 . 1 . 1 21 21 A H2' H 1 4.6644 0.0000 . 1 . . . . . 500 A H2' . 52285 1 129 . 1 . 1 21 21 A C1' C 13 92.1787 0.0000 . 1 . . . . . 500 A C1' . 52285 1 130 . 1 . 1 21 21 A H1' H 1 6.1157 0.0000 . 1 . . . . . 500 A H1' . 52285 1 131 . 1 . 1 21 21 A C8 C 13 139.9328 0.0000 . 1 . . . . . 500 A C8 . 52285 1 132 . 1 . 1 21 21 A H8 H 1 8.1529 0.0000 . 1 . . . . . 500 A H8 . 52285 1 133 . 1 . 1 21 21 A C2 C 13 152.4120 0.0000 . 1 . . . . . 500 A C2 . 52285 1 134 . 1 . 1 21 21 A H2 H 1 6.7344 0.0000 . 1 . . . . . 500 A H2 . 52285 1 135 . 1 . 1 21 21 A N1 N 15 221.2901 0.0000 . 1 . . . . . 500 A N1 . 52285 1 136 . 1 . 1 22 22 G H3' H 1 4.1762 0.0000 . 1 . . . . . 501 G H3' . 52285 1 137 . 1 . 1 22 22 G H2' H 1 4.4073 0.0000 . 1 . . . . . 501 G H2' . 52285 1 138 . 1 . 1 22 22 G H1' H 1 5.5820 0.0000 . 1 . . . . . 501 G H1' . 52285 1 139 . 1 . 1 22 22 G C8 C 13 136.4855 0.0000 . 1 . . . . . 501 G C8 . 52285 1 140 . 1 . 1 22 22 G H8 H 1 6.9997 0.0000 . 1 . . . . . 501 G H8 . 52285 1 141 . 1 . 1 23 23 U H3' H 1 4.4563 0.0000 . 1 . . . . . 502 U H3' . 52285 1 142 . 1 . 1 23 23 U H2' H 1 4.5867 0.0000 . 1 . . . . . 502 U H2' . 52285 1 143 . 1 . 1 23 23 U H1' H 1 5.5327 0.0000 . 1 . . . . . 502 U H1' . 52285 1 144 . 1 . 1 23 23 U N3 N 15 162.2783 0.0000 . 1 . . . . . 502 U N3 . 52285 1 145 . 1 . 1 23 23 U H5 H 1 5.1379 0.0000 . 1 . . . . . 502 U H5 . 52285 1 146 . 1 . 1 23 23 U H6 H 1 7.6579 0.0000 . 1 . . . . . 502 U H6 . 52285 1 147 . 1 . 1 24 24 G H3' H 1 4.6507 0.0000 . 1 . . . . . 503 G H3' . 52285 1 148 . 1 . 1 24 24 G H2' H 1 4.5767 0.0000 . 1 . . . . . 503 G H2' . 52285 1 149 . 1 . 1 24 24 G C1' C 13 90.5696 0.0000 . 1 . . . . . 503 G C1' . 52285 1 150 . 1 . 1 24 24 G H1' H 1 5.8419 0.0000 . 1 . . . . . 503 G H1' . 52285 1 151 . 1 . 1 24 24 G C8 C 13 136.1552 0.0000 . 1 . . . . . 503 G C8 . 52285 1 152 . 1 . 1 24 24 G H8 H 1 7.7338 0.0000 . 1 . . . . . 503 G H8 . 52285 1 153 . 1 . 1 25 25 C H3' H 1 4.4854 0.0000 . 1 . . . . . 504 C H3' . 52285 1 154 . 1 . 1 25 25 C H2' H 1 4.5738 0.0000 . 1 . . . . . 504 C H2' . 52285 1 155 . 1 . 1 25 25 C H1' H 1 5.5367 0.0000 . 1 . . . . . 504 C H1' . 52285 1 156 . 1 . 1 25 25 C H5 H 1 5.2792 0.0000 . 1 . . . . . 504 C H5 . 52285 1 157 . 1 . 1 25 25 C H6 H 1 7.6835 0.0000 . 1 . . . . . 504 C H6 . 52285 1 158 . 1 . 1 26 26 A H3' H 1 4.7522 0.0000 . 1 . . . . . 505 A H3' . 52285 1 159 . 1 . 1 26 26 A H2' H 1 4.5762 0.0000 . 1 . . . . . 505 A H2' . 52285 1 160 . 1 . 1 26 26 A C1' C 13 92.4377 0.0000 . 1 . . . . . 505 A C1' . 52285 1 161 . 1 . 1 26 26 A H1' H 1 5.9708 0.0000 . 1 . . . . . 505 A H1' . 52285 1 162 . 1 . 1 26 26 A C8 C 13 140.8710 0.0000 . 1 . . . . . 505 A C8 . 52285 1 163 . 1 . 1 26 26 A H8 H 1 8.0342 0.0000 . 1 . . . . . 505 A H8 . 52285 1 164 . 1 . 1 26 26 A C2 C 13 153.0118 0.0000 . 1 . . . . . 505 A C2 . 52285 1 165 . 1 . 1 26 26 A H2 H 1 7.1223 0.0000 . 1 . . . . . 505 A H2 . 52285 1 166 . 1 . 1 26 26 A N1 N 15 222.3591 0.0000 . 1 . . . . . 505 A N1 . 52285 1 167 . 1 . 1 27 27 G H3' H 1 4.3907 0.0000 . 1 . . . . . 506 G H3' . 52285 1 168 . 1 . 1 27 27 G H2' H 1 4.3987 0.0000 . 1 . . . . . 506 G H2' . 52285 1 169 . 1 . 1 27 27 G C1' C 13 92.7336 0.0000 . 1 . . . . . 506 G C1' . 52285 1 170 . 1 . 1 27 27 G H1' H 1 5.7856 0.0000 . 1 . . . . . 506 G H1' . 52285 1 171 . 1 . 1 27 27 G C8 C 13 137.7703 0.0000 . 1 . . . . . 506 G C8 . 52285 1 172 . 1 . 1 27 27 G H8 H 1 7.6371 0.0000 . 1 . . . . . 506 G H8 . 52285 1 173 . 1 . 1 28 28 G H3' H 1 4.6225 0.0000 . 1 . . . . . 507 G H3' . 52285 1 174 . 1 . 1 28 28 G H2' H 1 4.6288 0.0000 . 1 . . . . . 507 G H2' . 52285 1 175 . 1 . 1 28 28 G C1' C 13 91.4975 0.0000 . 1 . . . . . 507 G C1' . 52285 1 176 . 1 . 1 28 28 G H1' H 1 5.9203 0.0000 . 1 . . . . . 507 G H1' . 52285 1 177 . 1 . 1 28 28 G C8 C 13 138.5493 0.0000 . 1 . . . . . 507 G C8 . 52285 1 178 . 1 . 1 28 28 G H8 H 1 7.8549 0.0000 . 1 . . . . . 507 G H8 . 52285 1 179 . 1 . 1 29 29 U H3' H 1 4.6201 0.0000 . 1 . . . . . 508 U H3' . 52285 1 180 . 1 . 1 29 29 U H2' H 1 4.5183 0.0000 . 1 . . . . . 508 U H2' . 52285 1 181 . 1 . 1 29 29 U H1' H 1 5.7715 0.0000 . 1 . . . . . 508 U H1' . 52285 1 182 . 1 . 1 29 29 U N3 N 15 160.9039 0.0000 . 1 . . . . . 508 U N3 . 52285 1 183 . 1 . 1 29 29 U H5 H 1 5.4196 0.0000 . 1 . . . . . 508 U H5 . 52285 1 184 . 1 . 1 29 29 U H6 H 1 7.9064 0.0000 . 1 . . . . . 508 U H6 . 52285 1 185 . 1 . 1 30 30 A H3' H 1 4.6378 0.0000 . 1 . . . . . 509 A H3' . 52285 1 186 . 1 . 1 30 30 A H2' H 1 4.7291 0.0000 . 1 . . . . . 509 A H2' . 52285 1 187 . 1 . 1 30 30 A C1' C 13 92.4243 0.0000 . 1 . . . . . 509 A C1' . 52285 1 188 . 1 . 1 30 30 A H1' H 1 6.1230 0.0000 . 1 . . . . . 509 A H1' . 52285 1 189 . 1 . 1 30 30 A C8 C 13 140.2265 0.0000 . 1 . . . . . 509 A C8 . 52285 1 190 . 1 . 1 30 30 A H8 H 1 8.2115 0.0000 . 1 . . . . . 509 A H8 . 52285 1 191 . 1 . 1 30 30 A C2 C 13 152.7387 0.0000 . 1 . . . . . 509 A C2 . 52285 1 192 . 1 . 1 30 30 A H2 H 1 7.0380 0.0000 . 1 . . . . . 509 A H2 . 52285 1 193 . 1 . 1 30 30 A N1 N 15 221.3139 0.0000 . 1 . . . . . 509 A N1 . 52285 1 194 . 1 . 1 31 31 G H3' H 1 4.4813 0.0000 . 1 . . . . . 510 G H3' . 52285 1 195 . 1 . 1 31 31 G H2' H 1 4.5372 0.0000 . 1 . . . . . 510 G H2' . 52285 1 196 . 1 . 1 31 31 G C1' C 13 92.7462 0.0000 . 1 . . . . . 510 G C1' . 52285 1 197 . 1 . 1 31 31 G H1' H 1 5.6208 0.0000 . 1 . . . . . 510 G H1' . 52285 1 198 . 1 . 1 31 31 G C8 C 13 135.8767 0.0000 . 1 . . . . . 510 G C8 . 52285 1 199 . 1 . 1 31 31 G H8 H 1 7.1134 0.0000 . 1 . . . . . 510 G H8 . 52285 1 200 . 1 . 1 32 32 U H3' H 1 4.4832 0.0000 . 1 . . . . . 511 U H3' . 52285 1 201 . 1 . 1 32 32 U H2' H 1 4.4764 0.0000 . 1 . . . . . 511 U H2' . 52285 1 202 . 1 . 1 32 32 U H1' H 1 5.5486 0.0000 . 1 . . . . . 511 U H1' . 52285 1 203 . 1 . 1 32 32 U H5 H 1 5.2158 0.0000 . 1 . . . . . 511 U H5 . 52285 1 204 . 1 . 1 32 32 U H6 H 1 7.3592 0.0000 . 1 . . . . . 511 U H6 . 52285 1 205 . 1 . 1 33 33 G H3' H 1 4.7248 0.0000 . 1 . . . . . 512 G H3' . 52285 1 206 . 1 . 1 33 33 G H2' H 1 4.6194 0.0000 . 1 . . . . . 512 G H2' . 52285 1 207 . 1 . 1 33 33 G H1' H 1 5.7069 0.0000 . 1 . . . . . 512 G H1' . 52285 1 208 . 1 . 1 33 33 G C8 C 13 138.6501 0.0000 . 1 . . . . . 512 G C8 . 52285 1 209 . 1 . 1 33 33 G H8 H 1 7.9664 0.0000 . 1 . . . . . 512 G H8 . 52285 1 210 . 1 . 1 34 34 U H3' H 1 4.7265 0.0000 . 1 . . . . . 513 U H3' . 52285 1 211 . 1 . 1 34 34 U H2' H 1 4.6234 0.0000 . 1 . . . . . 513 U H2' . 52285 1 212 . 1 . 1 34 34 U H1' H 1 5.4552 0.0000 . 1 . . . . . 513 U H1' . 52285 1 213 . 1 . 1 34 34 U H5 H 1 5.5324 0.0000 . 1 . . . . . 513 U H5 . 52285 1 214 . 1 . 1 34 34 U H6 H 1 7.5716 0.0000 . 1 . . . . . 513 U H6 . 52285 1 215 . 1 . 1 35 35 U H3' H 1 4.4404 0.0000 . 1 . . . . . 514 U H3' . 52285 1 216 . 1 . 1 35 35 U H2' H 1 4.1840 0.0000 . 1 . . . . . 514 U H2' . 52285 1 217 . 1 . 1 35 35 U H1' H 1 5.8944 0.0000 . 1 . . . . . 514 U H1' . 52285 1 218 . 1 . 1 35 35 U H5 H 1 5.8587 0.0000 . 1 . . . . . 514 U H5 . 52285 1 219 . 1 . 1 35 35 U H6 H 1 7.8181 0.0000 . 1 . . . . . 514 U H6 . 52285 1 220 . 1 . 1 36 36 U H3' H 1 4.3512 0.0000 . 1 . . . . . 515 U H3' . 52285 1 221 . 1 . 1 36 36 U H2' H 1 4.2009 0.0000 . 1 . . . . . 515 U H2' . 52285 1 222 . 1 . 1 36 36 U H1' H 1 5.7955 0.0000 . 1 . . . . . 515 U H1' . 52285 1 223 . 1 . 1 36 36 U H5 H 1 5.8989 0.0000 . 1 . . . . . 515 U H5 . 52285 1 224 . 1 . 1 36 36 U H6 H 1 7.7716 0.0000 . 1 . . . . . 515 U H6 . 52285 1 225 . 1 . 1 37 37 A H3' H 1 4.8628 0.0000 . 1 . . . . . 516 A H3' . 52285 1 226 . 1 . 1 37 37 A H2' H 1 4.7812 0.0000 . 1 . . . . . 516 A H2' . 52285 1 227 . 1 . 1 37 37 A H1' H 1 6.0061 0.0000 . 1 . . . . . 516 A H1' . 52285 1 228 . 1 . 1 37 37 A C8 C 13 142.2988 0.0000 . 1 . . . . . 516 A C8 . 52285 1 229 . 1 . 1 37 37 A H8 H 1 8.3442 0.0000 . 1 . . . . . 516 A H8 . 52285 1 230 . 1 . 1 37 37 A C2 C 13 155.2589 0.0000 . 1 . . . . . 516 A C2 . 52285 1 231 . 1 . 1 37 37 A H2 H 1 8.1726 0.0000 . 1 . . . . . 516 A H2 . 52285 1 232 . 1 . 1 37 37 A N1 N 15 226.4726 0.0000 . 1 . . . . . 516 A N1 . 52285 1 233 . 1 . 1 38 38 G H3' H 1 4.9055 0.0000 . 1 . . . . . 517 G H3' . 52285 1 234 . 1 . 1 38 38 G H2' H 1 4.8622 0.0000 . 1 . . . . . 517 G H2' . 52285 1 235 . 1 . 1 38 38 G H1' H 1 5.8984 0.0000 . 1 . . . . . 517 G H1' . 52285 1 236 . 1 . 1 38 38 G C8 C 13 140.0939 0.0000 . 1 . . . . . 517 G C8 . 52285 1 237 . 1 . 1 38 38 G H8 H 1 7.9930 0.0000 . 1 . . . . . 517 G H8 . 52285 1 238 . 1 . 1 39 39 U H3' H 1 4.6215 0.0000 . 1 . . . . . 518 U H3' . 52285 1 239 . 1 . 1 39 39 U H2' H 1 4.4668 0.0000 . 1 . . . . . 518 U H2' . 52285 1 240 . 1 . 1 39 39 U H1' H 1 5.9290 0.0000 . 1 . . . . . 518 U H1' . 52285 1 241 . 1 . 1 39 39 U H5 H 1 5.8491 0.0000 . 1 . . . . . 518 U H5 . 52285 1 242 . 1 . 1 39 39 U H6 H 1 7.8294 0.0000 . 1 . . . . . 518 U H6 . 52285 1 243 . 1 . 1 40 40 U H3' H 1 4.7770 0.0000 . 1 . . . . . 519 U H3' . 52285 1 244 . 1 . 1 40 40 U H2' H 1 4.4695 0.0000 . 1 . . . . . 519 U H2' . 52285 1 245 . 1 . 1 40 40 U H1' H 1 5.9522 0.0000 . 1 . . . . . 519 U H1' . 52285 1 246 . 1 . 1 40 40 U H5 H 1 5.8832 0.0000 . 1 . . . . . 519 U H5 . 52285 1 247 . 1 . 1 40 40 U H6 H 1 7.8468 0.0000 . 1 . . . . . 519 U H6 . 52285 1 248 . 1 . 1 41 41 A H3' H 1 4.6253 0.0000 . 1 . . . . . 520 A H3' . 52285 1 249 . 1 . 1 41 41 A H2' H 1 4.9692 0.0000 . 1 . . . . . 520 A H2' . 52285 1 250 . 1 . 1 41 41 A C1' C 13 91.9591 0.0000 . 1 . . . . . 520 A C1' . 52285 1 251 . 1 . 1 41 41 A H1' H 1 6.0806 0.0000 . 1 . . . . . 520 A H1' . 52285 1 252 . 1 . 1 41 41 A C8 C 13 141.5155 0.0000 . 1 . . . . . 520 A C8 . 52285 1 253 . 1 . 1 41 41 A H8 H 1 8.3224 0.0000 . 1 . . . . . 520 A H8 . 52285 1 254 . 1 . 1 41 41 A C2 C 13 154.9225 0.0000 . 1 . . . . . 520 A C2 . 52285 1 255 . 1 . 1 41 41 A H2 H 1 8.1379 0.0000 . 1 . . . . . 520 A H2 . 52285 1 256 . 1 . 1 41 41 A N1 N 15 226.2199 0.0000 . 1 . . . . . 520 A N1 . 52285 1 257 . 1 . 1 42 42 U H3' H 1 4.5020 0.0000 . 1 . . . . . 521 U H3' . 52285 1 258 . 1 . 1 42 42 U H2' H 1 4.4197 0.0000 . 1 . . . . . 521 U H2' . 52285 1 259 . 1 . 1 42 42 U H1' H 1 5.3518 0.0000 . 1 . . . . . 521 U H1' . 52285 1 260 . 1 . 1 42 42 U H5 H 1 5.6592 0.0000 . 1 . . . . . 521 U H5 . 52285 1 261 . 1 . 1 42 42 U H6 H 1 7.7156 0.0000 . 1 . . . . . 521 U H6 . 52285 1 262 . 1 . 1 43 43 C H3' H 1 4.5137 0.0000 . 1 . . . . . 522 C H3' . 52285 1 263 . 1 . 1 43 43 C H2' H 1 4.4257 0.0000 . 1 . . . . . 522 C H2' . 52285 1 264 . 1 . 1 43 43 C H1' H 1 5.6411 0.0000 . 1 . . . . . 522 C H1' . 52285 1 265 . 1 . 1 43 43 C H5 H 1 5.8467 0.0000 . 1 . . . . . 522 C H5 . 52285 1 266 . 1 . 1 43 43 C H6 H 1 8.0126 0.0000 . 1 . . . . . 522 C H6 . 52285 1 267 . 1 . 1 44 44 U H3' H 1 4.7063 0.0000 . 1 . . . . . 523 U H3' . 52285 1 268 . 1 . 1 44 44 U H2' H 1 4.5785 0.0000 . 1 . . . . . 523 U H2' . 52285 1 269 . 1 . 1 44 44 U H1' H 1 5.6234 0.0000 . 1 . . . . . 523 U H1' . 52285 1 270 . 1 . 1 44 44 U N3 N 15 161.0945 0.0000 . 1 . . . . . 523 U N3 . 52285 1 271 . 1 . 1 44 44 U H5 H 1 5.5598 0.0000 . 1 . . . . . 523 U H5 . 52285 1 272 . 1 . 1 44 44 U H6 H 1 7.9311 0.0000 . 1 . . . . . 523 U H6 . 52285 1 273 . 1 . 1 45 45 A H3' H 1 4.6196 0.0000 . 1 . . . . . 524 A H3' . 52285 1 274 . 1 . 1 45 45 A H2' H 1 4.4688 0.0000 . 1 . . . . . 524 A H2' . 52285 1 275 . 1 . 1 45 45 A C1' C 13 93.0625 0.0000 . 1 . . . . . 524 A C1' . 52285 1 276 . 1 . 1 45 45 A H1' H 1 6.0374 0.0000 . 1 . . . . . 524 A H1' . 52285 1 277 . 1 . 1 45 45 A C8 C 13 140.6100 0.0000 . 1 . . . . . 524 A C8 . 52285 1 278 . 1 . 1 45 45 A H8 H 1 8.2056 0.0000 . 1 . . . . . 524 A H8 . 52285 1 279 . 1 . 1 45 45 A C2 C 13 153.0118 0.0000 . 1 . . . . . 524 A C2 . 52285 1 280 . 1 . 1 45 45 A H2 H 1 7.1179 0.0000 . 1 . . . . . 524 A H2 . 52285 1 281 . 1 . 1 45 45 A N1 N 15 221.9584 0.0000 . 1 . . . . . 524 A N1 . 52285 1 282 . 1 . 1 46 46 C H3' H 1 4.4624 0.0000 . 1 . . . . . 525 C H3' . 52285 1 283 . 1 . 1 46 46 C H2' H 1 4.2878 0.0000 . 1 . . . . . 525 C H2' . 52285 1 284 . 1 . 1 46 46 C H1' H 1 5.2678 0.0000 . 1 . . . . . 525 C H1' . 52285 1 285 . 1 . 1 46 46 C H5 H 1 5.3210 0.0000 . 1 . . . . . 525 C H5 . 52285 1 286 . 1 . 1 46 46 C H6 H 1 7.4207 0.0000 . 1 . . . . . 525 C H6 . 52285 1 287 . 1 . 1 47 47 U H3' H 1 4.5439 0.0000 . 1 . . . . . 526 U H3' . 52285 1 288 . 1 . 1 47 47 U H2' H 1 4.6554 0.0000 . 1 . . . . . 526 U H2' . 52285 1 289 . 1 . 1 47 47 U H1' H 1 5.5871 0.0000 . 1 . . . . . 526 U H1' . 52285 1 290 . 1 . 1 47 47 U N3 N 15 161.2650 0.0000 . 1 . . . . . 526 U N3 . 52285 1 291 . 1 . 1 47 47 U H5 H 1 5.4988 0.0000 . 1 . . . . . 526 U H5 . 52285 1 292 . 1 . 1 47 47 U H6 H 1 7.9327 0.0000 . 1 . . . . . 526 U H6 . 52285 1 293 . 1 . 1 48 48 G H3' H 1 4.6560 0.0000 . 1 . . . . . 527 G H3' . 52285 1 294 . 1 . 1 48 48 G H2' H 1 4.5435 0.0000 . 1 . . . . . 527 G H2' . 52285 1 295 . 1 . 1 48 48 G C1' C 13 92.7336 0.0000 . 1 . . . . . 527 G C1' . 52285 1 296 . 1 . 1 48 48 G H1' H 1 5.7877 0.0000 . 1 . . . . . 527 G H1' . 52285 1 297 . 1 . 1 48 48 G C8 C 13 136.4821 0.0000 . 1 . . . . . 527 G C8 . 52285 1 298 . 1 . 1 48 48 G H8 H 1 7.7985 0.0000 . 1 . . . . . 527 G H8 . 52285 1 299 . 1 . 1 49 49 C H3' H 1 4.5645 0.0000 . 1 . . . . . 528 C H3' . 52285 1 300 . 1 . 1 49 49 C H2' H 1 4.4781 0.0000 . 1 . . . . . 528 C H2' . 52285 1 301 . 1 . 1 49 49 C H1' H 1 5.5009 0.0000 . 1 . . . . . 528 C H1' . 52285 1 302 . 1 . 1 49 49 C H5 H 1 5.2783 0.0000 . 1 . . . . . 528 C H5 . 52285 1 303 . 1 . 1 49 49 C H6 H 1 7.7329 0.0000 . 1 . . . . . 528 C H6 . 52285 1 304 . 1 . 1 50 50 A H3' H 1 4.5686 0.0000 . 1 . . . . . 529 A H3' . 52285 1 305 . 1 . 1 50 50 A H2' H 1 4.6231 0.0000 . 1 . . . . . 529 A H2' . 52285 1 306 . 1 . 1 50 50 A C1' C 13 93.0569 0.0000 . 1 . . . . . 529 A C1' . 52285 1 307 . 1 . 1 50 50 A H1' H 1 5.9834 0.0000 . 1 . . . . . 529 A H1' . 52285 1 308 . 1 . 1 50 50 A C8 C 13 139.2994 0.0000 . 1 . . . . . 529 A C8 . 52285 1 309 . 1 . 1 50 50 A H8 H 1 7.9452 0.0000 . 1 . . . . . 529 A H8 . 52285 1 310 . 1 . 1 50 50 A C2 C 13 153.0524 0.0000 . 1 . . . . . 529 A C2 . 52285 1 311 . 1 . 1 50 50 A H2 H 1 7.4211 0.0000 . 1 . . . . . 529 A H2 . 52285 1 312 . 1 . 1 50 50 A N1 N 15 221.9744 0.0000 . 1 . . . . . 529 A N1 . 52285 1 313 . 1 . 1 51 51 U H3' H 1 4.5879 0.0000 . 1 . . . . . 530 U H3' . 52285 1 314 . 1 . 1 51 51 U H2' H 1 4.0900 0.0000 . 1 . . . . . 530 U H2' . 52285 1 315 . 1 . 1 51 51 U H1' H 1 5.3110 0.0000 . 1 . . . . . 530 U H1' . 52285 1 316 . 1 . 1 51 51 U H5 H 1 5.4097 0.0000 . 1 . . . . . 530 U H5 . 52285 1 317 . 1 . 1 51 51 U H6 H 1 7.6104 0.0000 . 1 . . . . . 530 U H6 . 52285 1 318 . 1 . 1 52 52 U H3' H 1 4.5842 0.0000 . 1 . . . . . 531 U H3' . 52285 1 319 . 1 . 1 52 52 U H2' H 1 4.5884 0.0000 . 1 . . . . . 531 U H2' . 52285 1 320 . 1 . 1 52 52 U H1' H 1 5.6201 0.0000 . 1 . . . . . 531 U H1' . 52285 1 321 . 1 . 1 52 52 U N3 N 15 161.5317 0.0000 . 1 . . . . . 531 U N3 . 52285 1 322 . 1 . 1 52 52 U H5 H 1 5.5950 0.0000 . 1 . . . . . 531 U H5 . 52285 1 323 . 1 . 1 52 52 U H6 H 1 8.0625 0.0000 . 1 . . . . . 531 U H6 . 52285 1 324 . 1 . 1 53 53 A H3' H 1 4.5898 0.0000 . 1 . . . . . 532 A H3' . 52285 1 325 . 1 . 1 53 53 A H2' H 1 4.4551 0.0000 . 1 . . . . . 532 A H2' . 52285 1 326 . 1 . 1 53 53 A C1' C 13 93.0569 0.0000 . 1 . . . . . 532 A C1' . 52285 1 327 . 1 . 1 53 53 A H1' H 1 6.0522 0.0000 . 1 . . . . . 532 A H1' . 52285 1 328 . 1 . 1 53 53 A C8 C 13 139.3127 0.0000 . 1 . . . . . 532 A C8 . 52285 1 329 . 1 . 1 53 53 A H8 H 1 8.2400 0.0000 . 1 . . . . . 532 A H8 . 52285 1 330 . 1 . 1 53 53 A C2 C 13 153.9652 0.0000 . 1 . . . . . 532 A C2 . 52285 1 331 . 1 . 1 53 53 A H2 H 1 7.1493 0.0000 . 1 . . . . . 532 A H2 . 52285 1 332 . 1 . 1 53 53 A N1 N 15 222.2813 0.0000 . 1 . . . . . 532 A N1 . 52285 1 333 . 1 . 1 54 54 U H3' H 1 4.4925 0.0000 . 1 . . . . . 533 U H3' . 52285 1 334 . 1 . 1 54 54 U H2' H 1 4.4925 0.0000 . 1 . . . . . 533 U H2' . 52285 1 335 . 1 . 1 54 54 U H1' H 1 5.5851 0.0000 . 1 . . . . . 533 U H1' . 52285 1 336 . 1 . 1 54 54 U N3 N 15 161.8201 0.0000 . 1 . . . . . 533 U N3 . 52285 1 337 . 1 . 1 54 54 U H5 H 1 5.1261 0.0000 . 1 . . . . . 533 U H5 . 52285 1 338 . 1 . 1 54 54 U H6 H 1 7.6292 0.0000 . 1 . . . . . 533 U H6 . 52285 1 339 . 1 . 1 55 55 G H3' H 1 4.7754 0.0000 . 1 . . . . . 534 G H3' . 52285 1 340 . 1 . 1 55 55 G H2' H 1 4.4235 0.0000 . 1 . . . . . 534 G H2' . 52285 1 341 . 1 . 1 55 55 G C1' C 13 91.4881 0.0000 . 1 . . . . . 534 G C1' . 52285 1 342 . 1 . 1 55 55 G H1' H 1 5.7591 0.0000 . 1 . . . . . 534 G H1' . 52285 1 343 . 1 . 1 55 55 G C8 C 13 137.1391 0.0000 . 1 . . . . . 534 G C8 . 52285 1 344 . 1 . 1 55 55 G H8 H 1 7.6214 0.0000 . 1 . . . . . 534 G H8 . 52285 1 345 . 1 . 1 56 56 A H3' H 1 4.7167 0.0000 . 1 . . . . . 535 A H3' . 52285 1 346 . 1 . 1 56 56 A H2' H 1 4.5503 0.0000 . 1 . . . . . 535 A H2' . 52285 1 347 . 1 . 1 56 56 A C1' C 13 93.0230 0.0000 . 1 . . . . . 535 A C1' . 52285 1 348 . 1 . 1 56 56 A H1' H 1 5.8865 0.0000 . 1 . . . . . 535 A H1' . 52285 1 349 . 1 . 1 56 56 A C8 C 13 139.3020 0.0000 . 1 . . . . . 535 A C8 . 52285 1 350 . 1 . 1 56 56 A H8 H 1 7.7121 0.0000 . 1 . . . . . 535 A H8 . 52285 1 351 . 1 . 1 56 56 A C2 C 13 153.3565 0.0000 . 1 . . . . . 535 A C2 . 52285 1 352 . 1 . 1 56 56 A H2 H 1 7.5293 0.0000 . 1 . . . . . 535 A H2 . 52285 1 353 . 1 . 1 56 56 A N1 N 15 222.6488 0.0000 . 1 . . . . . 535 A N1 . 52285 1 354 . 1 . 1 57 57 G H3' H 1 4.5060 0.0000 . 1 . . . . . 536 G H3' . 52285 1 355 . 1 . 1 57 57 G H2' H 1 4.5060 0.0000 . 1 . . . . . 536 G H2' . 52285 1 356 . 1 . 1 57 57 G C1' C 13 90.5507 0.0000 . 1 . . . . . 536 G C1' . 52285 1 357 . 1 . 1 57 57 G H1' H 1 5.6795 0.0000 . 1 . . . . . 536 G H1' . 52285 1 358 . 1 . 1 57 57 G H8 H 1 7.2115 0.0000 . 1 . . . . . 536 G H8 . 52285 1 359 . 1 . 1 58 58 C H3' H 1 4.4867 0.0000 . 1 . . . . . 537 C H3' . 52285 1 360 . 1 . 1 58 58 C H2' H 1 4.4867 0.0000 . 1 . . . . . 537 C H2' . 52285 1 361 . 1 . 1 58 58 C H1' H 1 5.5476 0.0000 . 1 . . . . . 537 C H1' . 52285 1 362 . 1 . 1 58 58 C H5 H 1 5.2259 0.0000 . 1 . . . . . 537 C H5 . 52285 1 363 . 1 . 1 58 58 C H6 H 1 7.6741 0.0000 . 1 . . . . . 537 C H6 . 52285 1 364 . 1 . 1 59 59 A H3' H 1 4.6375 0.0000 . 1 . . . . . 538 A H3' . 52285 1 365 . 1 . 1 59 59 A H2' H 1 4.5665 0.0000 . 1 . . . . . 538 A H2' . 52285 1 366 . 1 . 1 59 59 A C1' C 13 90.5517 0.0000 . 1 . . . . . 538 A C1' . 52285 1 367 . 1 . 1 59 59 A H1' H 1 5.9968 0.0000 . 1 . . . . . 538 A H1' . 52285 1 368 . 1 . 1 59 59 A C8 C 13 140.5528 0.0000 . 1 . . . . . 538 A C8 . 52285 1 369 . 1 . 1 59 59 A H8 H 1 8.0890 0.0000 . 1 . . . . . 538 A H8 . 52285 1 370 . 1 . 1 59 59 A C2 C 13 153.3598 0.0000 . 1 . . . . . 538 A C2 . 52285 1 371 . 1 . 1 59 59 A H2 H 1 7.4624 0.0000 . 1 . . . . . 538 A H2 . 52285 1 372 . 1 . 1 59 59 A N1 N 15 222.5007 0.0000 . 1 . . . . . 538 A N1 . 52285 1 373 . 1 . 1 60 60 C H3' H 1 4.2686 0.0000 . 1 . . . . . 539 C H3' . 52285 1 374 . 1 . 1 60 60 C H2' H 1 4.1379 0.0000 . 1 . . . . . 539 C H2' . 52285 1 375 . 1 . 1 60 60 C H1' H 1 5.4461 0.0000 . 1 . . . . . 539 C H1' . 52285 1 376 . 1 . 1 60 60 C H5 H 1 5.2608 0.0000 . 1 . . . . . 539 C H5 . 52285 1 377 . 1 . 1 60 60 C H6 H 1 7.5782 0.0000 . 1 . . . . . 539 C H6 . 52285 1 378 . 1 . 1 61 61 U H3' H 1 4.4741 0.0000 . 1 . . . . . 540 U H3' . 52285 1 379 . 1 . 1 61 61 U H2' H 1 4.3999 0.0000 . 1 . . . . . 540 U H2' . 52285 1 380 . 1 . 1 61 61 U H1' H 1 5.6131 0.0000 . 1 . . . . . 540 U H1' . 52285 1 381 . 1 . 1 61 61 U N3 N 15 161.5260 0.0000 . 1 . . . . . 540 U N3 . 52285 1 382 . 1 . 1 61 61 U H5 H 1 5.3597 0.0000 . 1 . . . . . 540 U H5 . 52285 1 383 . 1 . 1 61 61 U H6 H 1 7.8827 0.0000 . 1 . . . . . 540 U H6 . 52285 1 384 . 1 . 1 62 62 U H3' H 1 4.4640 0.0000 . 1 . . . . . 541 U H3' . 52285 1 385 . 1 . 1 62 62 U H2' H 1 4.3820 0.0000 . 1 . . . . . 541 U H2' . 52285 1 386 . 1 . 1 62 62 U H1' H 1 5.7865 0.0000 . 1 . . . . . 541 U H1' . 52285 1 387 . 1 . 1 62 62 U N3 N 15 161.5636 0.0000 . 1 . . . . . 541 U N3 . 52285 1 388 . 1 . 1 62 62 U H5 H 1 5.5983 0.0000 . 1 . . . . . 541 U H5 . 52285 1 389 . 1 . 1 62 62 U H6 H 1 7.8667 0.0000 . 1 . . . . . 541 U H6 . 52285 1 390 . 1 . 1 63 63 A H3' H 1 4.5875 0.0000 . 1 . . . . . 542 A H3' . 52285 1 391 . 1 . 1 63 63 A H2' H 1 4.7020 0.0000 . 1 . . . . . 542 A H2' . 52285 1 392 . 1 . 1 63 63 A C1' C 13 90.5507 0.0000 . 1 . . . . . 542 A C1' . 52285 1 393 . 1 . 1 63 63 A H1' H 1 5.6790 0.0000 . 1 . . . . . 542 A H1' . 52285 1 394 . 1 . 1 63 63 A C8 C 13 140.5528 0.0000 . 1 . . . . . 542 A C8 . 52285 1 395 . 1 . 1 63 63 A H8 H 1 8.1080 0.0000 . 1 . . . . . 542 A H8 . 52285 1 396 . 1 . 1 63 63 A C2 C 13 154.0243 0.0000 . 1 . . . . . 542 A C2 . 52285 1 397 . 1 . 1 63 63 A H2 H 1 7.1991 0.0000 . 1 . . . . . 542 A H2 . 52285 1 398 . 1 . 1 63 63 A N1 N 15 224.8810 0.0000 . 1 . . . . . 542 A N1 . 52285 1 399 . 1 . 1 64 64 A H3' H 1 4.5696 0.0000 . 1 . . . . . 543 A H3' . 52285 1 400 . 1 . 1 64 64 A H2' H 1 4.6037 0.0000 . 1 . . . . . 543 A H2' . 52285 1 401 . 1 . 1 64 64 A C1' C 13 93.3564 0.0000 . 1 . . . . . 543 A C1' . 52285 1 402 . 1 . 1 64 64 A H1' H 1 5.7079 0.0000 . 1 . . . . . 543 A H1' . 52285 1 403 . 1 . 1 64 64 A C8 C 13 140.8710 0.0000 . 1 . . . . . 543 A C8 . 52285 1 404 . 1 . 1 64 64 A H8 H 1 8.0406 0.0000 . 1 . . . . . 543 A H8 . 52285 1 405 . 1 . 1 64 64 A C2 C 13 154.4391 0.0000 . 1 . . . . . 543 A C2 . 52285 1 406 . 1 . 1 64 64 A H2 H 1 7.6314 0.0000 . 1 . . . . . 543 A H2 . 52285 1 407 . 1 . 1 64 64 A N1 N 15 225.5408 0.0000 . 1 . . . . . 543 A N1 . 52285 1 408 . 1 . 1 65 65 A H3' H 1 4.5988 0.0000 . 1 . . . . . 544 A H3' . 52285 1 409 . 1 . 1 65 65 A H2' H 1 4.6105 0.0000 . 1 . . . . . 544 A H2' . 52285 1 410 . 1 . 1 65 65 A C1' C 13 92.7399 0.0000 . 1 . . . . . 544 A C1' . 52285 1 411 . 1 . 1 65 65 A H1' H 1 5.8421 0.0000 . 1 . . . . . 544 A H1' . 52285 1 412 . 1 . 1 65 65 A C8 C 13 140.8792 0.0000 . 1 . . . . . 544 A C8 . 52285 1 413 . 1 . 1 65 65 A H8 H 1 8.2019 0.0000 . 1 . . . . . 544 A H8 . 52285 1 414 . 1 . 1 65 65 A C2 C 13 153.3598 0.0000 . 1 . . . . . 544 A C2 . 52285 1 415 . 1 . 1 65 65 A H2 H 1 7.5283 0.0000 . 1 . . . . . 544 A H2 . 52285 1 416 . 1 . 1 65 65 A N1 N 15 222.5718 0.0000 . 1 . . . . . 544 A N1 . 52285 1 417 . 1 . 1 66 66 G H3' H 1 4.4458 0.0000 . 1 . . . . . 545 G H3' . 52285 1 418 . 1 . 1 66 66 G H2' H 1 4.3993 0.0000 . 1 . . . . . 545 G H2' . 52285 1 419 . 1 . 1 66 66 G C1' C 13 90.5507 0.0000 . 1 . . . . . 545 G C1' . 52285 1 420 . 1 . 1 66 66 G H1' H 1 5.6356 0.0000 . 1 . . . . . 545 G H1' . 52285 1 421 . 1 . 1 66 66 G C8 C 13 136.5079 0.0000 . 1 . . . . . 545 G C8 . 52285 1 422 . 1 . 1 66 66 G H8 H 1 7.3436 0.0000 . 1 . . . . . 545 G H8 . 52285 1 423 . 1 . 1 67 67 U H3' H 1 4.5549 0.0000 . 1 . . . . . 546 U H3' . 52285 1 424 . 1 . 1 67 67 U H2' H 1 4.2815 0.0000 . 1 . . . . . 546 U H2' . 52285 1 425 . 1 . 1 67 67 U H1' H 1 5.6250 0.0000 . 1 . . . . . 546 U H1' . 52285 1 426 . 1 . 1 67 67 U N3 N 15 161.4729 0.0000 . 1 . . . . . 546 U N3 . 52285 1 427 . 1 . 1 67 67 U H5 H 1 5.1288 0.0000 . 1 . . . . . 546 U H5 . 52285 1 428 . 1 . 1 67 67 U H6 H 1 7.7491 0.0000 . 1 . . . . . 546 U H6 . 52285 1 429 . 1 . 1 68 68 A H3' H 1 4.5320 0.0000 . 1 . . . . . 547 A H3' . 52285 1 430 . 1 . 1 68 68 A H2' H 1 4.6435 0.0000 . 1 . . . . . 547 A H2' . 52285 1 431 . 1 . 1 68 68 A C1' C 13 93.0739 0.0000 . 1 . . . . . 547 A C1' . 52285 1 432 . 1 . 1 68 68 A H1' H 1 6.1845 0.0000 . 1 . . . . . 547 A H1' . 52285 1 433 . 1 . 1 68 68 A C8 C 13 140.5692 0.0000 . 1 . . . . . 547 A C8 . 52285 1 434 . 1 . 1 68 68 A H8 H 1 8.3762 0.0000 . 1 . . . . . 547 A H8 . 52285 1 435 . 1 . 1 68 68 A H2 H 1 7.7597 0.0000 . 1 . . . . . 547 A H2 . 52285 1 436 . 1 . 1 69 69 C H3' H 1 4.5195 0.0000 . 1 . . . . . 548 C H3' . 52285 1 437 . 1 . 1 69 69 C H2' H 1 4.2683 0.0000 . 1 . . . . . 548 C H2' . 52285 1 438 . 1 . 1 69 69 C H1' H 1 5.4612 0.0000 . 1 . . . . . 548 C H1' . 52285 1 439 . 1 . 1 69 69 C H5 H 1 5.3858 0.0000 . 1 . . . . . 548 C H5 . 52285 1 440 . 1 . 1 69 69 C H6 H 1 7.6144 0.0000 . 1 . . . . . 548 C H6 . 52285 1 441 . 1 . 1 70 70 U H3' H 1 4.6207 0.0000 . 1 . . . . . 549 U H3' . 52285 1 442 . 1 . 1 70 70 U H2' H 1 4.6207 0.0000 . 1 . . . . . 549 U H2' . 52285 1 443 . 1 . 1 70 70 U H1' H 1 5.6803 0.0000 . 1 . . . . . 549 U H1' . 52285 1 444 . 1 . 1 70 70 U N3 N 15 162.1851 0.0000 . 1 . . . . . 549 U N3 . 52285 1 445 . 1 . 1 70 70 U H5 H 1 5.4554 0.0000 . 1 . . . . . 549 U H5 . 52285 1 446 . 1 . 1 70 70 U H6 H 1 7.9296 0.0000 . 1 . . . . . 549 U H6 . 52285 1 447 . 1 . 1 71 71 G H3' H 1 4.3388 0.0000 . 1 . . . . . 550 G H3' . 52285 1 448 . 1 . 1 71 71 G H2' H 1 4.5528 0.0000 . 1 . . . . . 550 G H2' . 52285 1 449 . 1 . 1 71 71 G C1' C 13 93.3722 0.0000 . 1 . . . . . 550 G C1' . 52285 1 450 . 1 . 1 71 71 G H1' H 1 5.9043 0.0000 . 1 . . . . . 550 G H1' . 52285 1 451 . 1 . 1 71 71 G C8 C 13 137.1174 0.0000 . 1 . . . . . 550 G C8 . 52285 1 452 . 1 . 1 71 71 G H8 H 1 7.8285 0.0000 . 1 . . . . . 550 G H8 . 52285 1 453 . 1 . 1 72 72 C H3' H 1 4.4631 0.0000 . 1 . . . . . 551 C H3' . 52285 1 454 . 1 . 1 72 72 C H2' H 1 4.2356 0.0000 . 1 . . . . . 551 C H2' . 52285 1 455 . 1 . 1 72 72 C H1' H 1 5.4431 0.0000 . 1 . . . . . 551 C H1' . 52285 1 456 . 1 . 1 72 72 C H5 H 1 5.5440 0.0000 . 1 . . . . . 551 C H5 . 52285 1 457 . 1 . 1 72 72 C H6 H 1 7.7913 0.0000 . 1 . . . . . 551 C H6 . 52285 1 458 . 1 . 1 73 73 C H3' H 1 4.2609 0.0000 . 1 . . . . . 1201 C H3' . 52285 1 459 . 1 . 1 73 73 C H2' H 1 4.0953 0.0000 . 1 . . . . . 1201 C H2' . 52285 1 460 . 1 . 1 73 73 C H1' H 1 5.8508 0.0000 . 1 . . . . . 1201 C H1' . 52285 1 461 . 1 . 1 73 73 C H5 H 1 5.5614 0.0000 . 1 . . . . . 1201 C H5 . 52285 1 462 . 1 . 1 73 73 C H6 H 1 7.7573 0.0000 . 1 . . . . . 1201 C H6 . 52285 1 stop_ save_