################################### # 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 34228 _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 1H-1H NOESY mixing time 500 ms' . . . 34228 1 2 '2D 1H-1H NOESY mixing time 300 ms' . . . 34228 1 3 '2D 1H-1H NOESY mixing time 150 ms' . . . 34228 1 4 '2D 1H-1H NOESY mixing time 80 ms' . . . 34228 1 5 '2D 1H-13C HSQC aromatic' . . . 34228 1 6 '2D 1H-1H NOESY mixing time 300 ms' . . . 34228 1 7 '2D 1H-13C HSQC aromatic' . . . 34228 1 8 '2D DQF-COSY' . . . 34228 1 9 '2D 1H-1H TOCSY' . . . 34228 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 H1 H 1 11.622 0.002 . 1 . . 733 . A 1 G H1 . 34228 1 2 . 1 . 1 1 1 G H1' H 1 5.858 0.001 . 1 . . 631 . A 1 G H1' . 34228 1 3 . 1 . 1 1 1 G H2' H 1 4.900 0.001 . 1 . . 485 . A 1 G H2' . 34228 1 4 . 1 . 1 1 1 G H3' H 1 4.711 0.002 . 1 . . 663 . A 1 G H3' . 34228 1 5 . 1 . 1 1 1 G H4' H 1 4.479 0.002 . 1 . . 662 . A 1 G H4' . 34228 1 6 . 1 . 1 1 1 G H8 H 1 8.005 0.001 . 1 . . 484 . A 1 G H8 . 34228 1 7 . 1 . 1 1 1 G C8 C 13 137.831 . . 1 . . 703 . A 1 G C8 . 34228 1 8 . 1 . 1 2 2 DG H1 H 1 11.341 0.002 . 1 . . 732 . A 2 DG H1 . 34228 1 9 . 1 . 1 2 2 DG H1' H 1 6.242 0.003 . 1 . . 489 . A 2 DG H1' . 34228 1 10 . 1 . 1 2 2 DG H2' H 1 2.709 0.001 . 1 . . 488 . A 2 DG H2' . 34228 1 11 . 1 . 1 2 2 DG H2'' H 1 2.613 0.005 . 1 . . 487 . A 2 DG H2'' . 34228 1 12 . 1 . 1 2 2 DG H3' H 1 4.972 0.002 . 1 . . 670 . A 2 DG H3' . 34228 1 13 . 1 . 1 2 2 DG H4' H 1 4.546 0.001 . 1 . . 664 . A 2 DG H4' . 34228 1 14 . 1 . 1 2 2 DG H8 H 1 7.745 0.001 . 1 . . 486 . A 2 DG H8 . 34228 1 15 . 1 . 1 2 2 DG C8 C 13 137.978 . . 1 . . 697 . A 2 DG C8 . 34228 1 16 . 1 . 1 3 3 DG H1 H 1 11.212 0.001 . 1 . . 731 . A 3 DG H1 . 34228 1 17 . 1 . 1 3 3 DG H1' H 1 6.173 0.004 . 1 . . 491 . A 3 DG H1' . 34228 1 18 . 1 . 1 3 3 DG H2' H 1 2.696 0.005 . 1 . . 492 . A 3 DG H2' . 34228 1 19 . 1 . 1 3 3 DG H2'' H 1 2.594 0.002 . 1 . . 509 . A 3 DG H2'' . 34228 1 20 . 1 . 1 3 3 DG H3' H 1 5.008 0.002 . 1 . . 673 . A 3 DG H3' . 34228 1 21 . 1 . 1 3 3 DG H4' H 1 4.164 0.001 . 1 . . 674 . A 3 DG H4' . 34228 1 22 . 1 . 1 3 3 DG H8 H 1 7.658 0.001 . 1 . . 490 . A 3 DG H8 . 34228 1 23 . 1 . 1 3 3 DG C8 C 13 137.490 . . 1 . . 696 . A 3 DG C8 . 34228 1 24 . 1 . 1 4 4 DA H1' H 1 6.604 0.001 . 1 . . 541 . A 4 DA H1' . 34228 1 25 . 1 . 1 4 4 DA H2 H 1 8.316 0.003 . 1 . . 746 . A 4 DA H2 . 34228 1 26 . 1 . 1 4 4 DA H2' H 1 2.921 0.005 . 1 . . 543 . A 4 DA H2' . 34228 1 27 . 1 . 1 4 4 DA H2'' H 1 2.919 0.002 . 1 . . 747 . A 4 DA H2'' . 34228 1 28 . 1 . 1 4 4 DA H3' H 1 4.879 0.001 . 1 . . 718 . A 4 DA H3' . 34228 1 29 . 1 . 1 4 4 DA H4' H 1 4.631 0.002 . 1 . . 717 . A 4 DA H4' . 34228 1 30 . 1 . 1 4 4 DA H8 H 1 8.586 0.001 . 1 . . 540 . A 4 DA H8 . 34228 1 31 . 1 . 1 4 4 DA C8 C 13 142.641 . . 1 . . 689 . A 4 DA C8 . 34228 1 32 . 1 . 1 5 5 DT H1' H 1 6.575 0.002 . 1 . . 504 . A 5 DT H1' . 34228 1 33 . 1 . 1 5 5 DT H2' H 1 2.633 0.001 . 1 . . 507 . A 5 DT H2' . 34228 1 34 . 1 . 1 5 5 DT H2'' H 1 2.633 0.001 . 1 . . 508 . A 5 DT H2'' . 34228 1 35 . 1 . 1 5 5 DT H3' H 1 5.048 0.002 . 1 . . 712 . A 5 DT H3' . 34228 1 36 . 1 . 1 5 5 DT H4' H 1 4.515 0.002 . 1 . . 714 . A 5 DT H4' . 34228 1 37 . 1 . 1 5 5 DT H6 H 1 7.874 0.001 . 1 . . 505 . A 5 DT H6 . 34228 1 38 . 1 . 1 5 5 DT H71 H 1 2.056 0.001 . 1 . . 506 . A 5 DT H71 . 34228 1 39 . 1 . 1 5 5 DT H72 H 1 2.056 0.001 . 1 . . 506 . A 5 DT H72 . 34228 1 40 . 1 . 1 5 5 DT H73 H 1 2.056 0.001 . 1 . . 506 . A 5 DT H73 . 34228 1 41 . 1 . 1 5 5 DT C6 C 13 140.198 . . 1 . . 708 . A 5 DT C6 . 34228 1 42 . 1 . 1 6 6 DG H1 H 1 11.557 0.001 . 1 . . 728 . A 6 DG H1 . 34228 1 43 . 1 . 1 6 6 DG H1' H 1 6.118 0.002 . 1 . . 501 . A 6 DG H1' . 34228 1 44 . 1 . 1 6 6 DG H2' H 1 2.521 0.001 . 1 . . 502 . A 6 DG H2' . 34228 1 45 . 1 . 1 6 6 DG H2'' H 1 2.982 0.001 . 1 . . 503 . A 6 DG H2'' . 34228 1 46 . 1 . 1 6 6 DG H3' H 1 4.987 0.001 . 1 . . 677 . A 6 DG H3' . 34228 1 47 . 1 . 1 6 6 DG H4' H 1 4.441 0.003 . 1 . . 665 . A 6 DG H4' . 34228 1 48 . 1 . 1 6 6 DG H8 H 1 7.964 0.001 . 1 . . 701 . A 6 DG H8 . 34228 1 49 . 1 . 1 6 6 DG C8 C 13 138.326 . . 1 . . 702 . A 6 DG C8 . 34228 1 50 . 1 . 1 7 7 DG H1 H 1 11.408 0.002 . 1 . . 729 . A 7 DG H1 . 34228 1 51 . 1 . 1 7 7 DG H1' H 1 5.952 0.002 . 1 . . 498 . A 7 DG H1' . 34228 1 52 . 1 . 1 7 7 DG H2' H 1 2.702 0.002 . 1 . . 499 . A 7 DG H2' . 34228 1 53 . 1 . 1 7 7 DG H2'' H 1 2.753 0.002 . 1 . . 500 . A 7 DG H2'' . 34228 1 54 . 1 . 1 7 7 DG H3' H 1 5.095 0.001 . 1 . . 676 . A 7 DG H3' . 34228 1 55 . 1 . 1 7 7 DG H4' H 1 4.442 0.003 . 1 . . 675 . A 7 DG H4' . 34228 1 56 . 1 . 1 7 7 DG H8 H 1 7.770 0.001 . 1 . . 497 . A 7 DG H8 . 34228 1 57 . 1 . 1 7 7 DG C8 C 13 137.490 . . 1 . . 698 . A 7 DG C8 . 34228 1 58 . 1 . 1 8 8 DG H1 H 1 11.152 0.003 . 1 . . 730 . A 8 DG H1 . 34228 1 59 . 1 . 1 8 8 DG H1' H 1 5.880 0.003 . 1 . . 496 . A 8 DG H1' . 34228 1 60 . 1 . 1 8 8 DG H2' H 1 2.112 0.002 . 1 . . 494 . A 8 DG H2' . 34228 1 61 . 1 . 1 8 8 DG H2'' H 1 2.386 0.001 . 1 . . 495 . A 8 DG H2'' . 34228 1 62 . 1 . 1 8 8 DG H3' H 1 4.943 0.002 . 1 . . 679 . A 8 DG H3' . 34228 1 63 . 1 . 1 8 8 DG H4' H 1 4.419 0.004 . 1 . . 678 . A 8 DG H4' . 34228 1 64 . 1 . 1 8 8 DG H8 H 1 7.489 0.001 . 1 . . 493 . A 8 DG H8 . 34228 1 65 . 1 . 1 8 8 DG C8 C 13 136.725 . . 1 . . 695 . A 8 DG C8 . 34228 1 66 . 1 . 1 9 9 DA H1' H 1 6.084 0.002 . 1 . . 523 . A 9 DA H1' . 34228 1 67 . 1 . 1 9 9 DA H2 H 1 7.583 0.002 . 1 . . 744 . A 9 DA H2 . 34228 1 68 . 1 . 1 9 9 DA H2' H 1 2.697 0.005 . 1 . . 525 . A 9 DA H2' . 34228 1 69 . 1 . 1 9 9 DA H2'' H 1 2.565 0.004 . 1 . . 524 . A 9 DA H2'' . 34228 1 70 . 1 . 1 9 9 DA H3' H 1 4.966 0.003 . 1 . . 672 . A 9 DA H3' . 34228 1 71 . 1 . 1 9 9 DA H4' H 1 4.425 0.001 . 1 . . 671 . A 9 DA H4' . 34228 1 72 . 1 . 1 9 9 DA H8 H 1 8.078 0.001 . 1 . . 522 . A 9 DA H8 . 34228 1 73 . 1 . 1 9 9 DA C8 C 13 141.729 . . 1 . . 704 . A 9 DA C8 . 34228 1 74 . 1 . 1 10 10 DC H1' H 1 5.844 0.003 . 1 . . 527 . A 10 DC H1' . 34228 1 75 . 1 . 1 10 10 DC H2' H 1 2.156 0.005 . 1 . . 530 . A 10 DC H2' . 34228 1 76 . 1 . 1 10 10 DC H2'' H 1 1.773 0.003 . 1 . . 529 . A 10 DC H2'' . 34228 1 77 . 1 . 1 10 10 DC H3' H 1 4.590 0.003 . 1 . . 686 . A 10 DC H3' . 34228 1 78 . 1 . 1 10 10 DC H4' H 1 3.951 0.001 . 1 . . 685 . A 10 DC H4' . 34228 1 79 . 1 . 1 10 10 DC H5 H 1 5.917 . . 1 . . 528 . A 10 DC H5 . 34228 1 80 . 1 . 1 10 10 DC H6 H 1 7.573 0.001 . 1 . . 526 . A 10 DC H6 . 34228 1 81 . 1 . 1 10 10 DC C6 C 13 143.441 . . 1 . . 691 . A 10 DC C6 . 34228 1 82 . 1 . 1 11 11 DA H1' H 1 5.778 0.002 . 1 . . 532 . A 11 DA H1' . 34228 1 83 . 1 . 1 11 11 DA H2 H 1 7.728 0.002 . 1 . . 742 . A 11 DA H2 . 34228 1 84 . 1 . 1 11 11 DA H2' H 1 2.363 0.005 . 1 . . 533 . A 11 DA H2' . 34228 1 85 . 1 . 1 11 11 DA H2'' H 1 2.123 0.004 . 1 . . 546 . A 11 DA H2'' . 34228 1 86 . 1 . 1 11 11 DA H3' H 1 4.511 . . 1 . . 757 . A 11 DA H3' . 34228 1 87 . 1 . 1 11 11 DA H4' H 1 3.944 0.007 . 1 . . 666 . A 11 DA H4' . 34228 1 88 . 1 . 1 11 11 DA H8 H 1 7.862 0.001 . 1 . . 531 . A 11 DA H8 . 34228 1 89 . 1 . 1 11 11 DA C8 C 13 141.646 . . 1 . . 707 . A 11 DA C8 . 34228 1 90 . 1 . 1 12 12 DC H1' H 1 5.517 0.003 . 1 . . 535 . A 12 DC H1' . 34228 1 91 . 1 . 1 12 12 DC H2' H 1 1.768 0.01 . 1 . . 537 . A 12 DC H2' . 34228 1 92 . 1 . 1 12 12 DC H2'' H 1 2.021 0.006 . 1 . . 538 . A 12 DC H2'' . 34228 1 93 . 1 . 1 12 12 DC H3' H 1 4.374 0.001 . 1 . . 687 . A 12 DC H3' . 34228 1 94 . 1 . 1 12 12 DC H5 H 1 5.263 0.002 . 1 . . 536 . A 12 DC H5 . 34228 1 95 . 1 . 1 12 12 DC H6 H 1 7.089 0.001 . 1 . . 534 . A 12 DC H6 . 34228 1 96 . 1 . 1 12 12 DC C6 C 13 143.928 . . 1 . . 709 . A 12 DC C6 . 34228 1 97 . 1 . 1 13 13 DA H1' H 1 5.756 0.003 . 1 . . 539 . A 13 DA H1' . 34228 1 98 . 1 . 1 13 13 DA H2 H 1 7.786 0.002 . 1 . . 743 . A 13 DA H2 . 34228 1 99 . 1 . 1 13 13 DA H2' H 1 2.275 0.002 . 1 . . 544 . A 13 DA H2' . 34228 1 100 . 1 . 1 13 13 DA H2'' H 1 2.625 0.002 . 1 . . 545 . A 13 DA H2'' . 34228 1 101 . 1 . 1 13 13 DA H8 H 1 7.879 0.002 . 1 . . 705 . A 13 DA H8 . 34228 1 102 . 1 . 1 13 13 DA C8 C 13 141.367 . . 1 . . 706 . A 13 DA C8 . 34228 1 103 . 1 . 1 14 14 DG H1 H 1 11.401 0.004 . 1 . . 741 . A 14 DG H1 . 34228 1 104 . 1 . 1 14 14 DG H1' H 1 6.052 0.002 . 1 . . 511 . A 14 DG H1' . 34228 1 105 . 1 . 1 14 14 DG H2' H 1 3.701 0.007 . 1 . . 517 . A 14 DG H2' . 34228 1 106 . 1 . 1 14 14 DG H2'' H 1 3.114 0.001 . 1 . . 516 . A 14 DG H2'' . 34228 1 107 . 1 . 1 14 14 DG H3' H 1 4.441 0.001 . 1 . . 688 . A 14 DG H3' . 34228 1 108 . 1 . 1 14 14 DG H8 H 1 7.234 0.001 . 1 . . 510 . A 14 DG H8 . 34228 1 109 . 1 . 1 14 14 DG C8 C 13 141.318 . . 1 . . 693 . A 14 DG C8 . 34228 1 110 . 1 . 1 15 15 DG H1 H 1 11.458 0.002 . 1 . . 740 . A 15 DG H1 . 34228 1 111 . 1 . 1 15 15 DG H1' H 1 5.812 0.005 . 1 . . 513 . A 15 DG H1' . 34228 1 112 . 1 . 1 15 15 DG H2' H 1 2.922 0.004 . 1 . . 519 . A 15 DG H2' . 34228 1 113 . 1 . 1 15 15 DG H2'' H 1 2.802 0.001 . 1 . . 518 . A 15 DG H2'' . 34228 1 114 . 1 . 1 15 15 DG H3' H 1 5.037 0.001 . 1 . . 723 . A 15 DG H3' . 34228 1 115 . 1 . 1 15 15 DG H8 H 1 7.339 0.001 . 1 . . 512 . A 15 DG H8 . 34228 1 116 . 1 . 1 15 15 DG C8 C 13 140.692 . . 1 . . 692 . A 15 DG C8 . 34228 1 117 . 1 . 1 16 16 DG H1 H 1 11.036 0.004 . 1 . . 739 . A 16 DG H1 . 34228 1 118 . 1 . 1 16 16 DG H1' H 1 5.867 0.003 . 1 . . 515 . A 16 DG H1' . 34228 1 119 . 1 . 1 16 16 DG H2' H 1 2.672 0.004 . 1 . . 521 . A 16 DG H2' . 34228 1 120 . 1 . 1 16 16 DG H2'' H 1 2.361 0.003 . 1 . . 520 . A 16 DG H2'' . 34228 1 121 . 1 . 1 16 16 DG H3' H 1 5.009 0.001 . 1 . . 724 . A 16 DG H3' . 34228 1 122 . 1 . 1 16 16 DG H4' H 1 4.304 0.002 . 1 . . 660 . A 16 DG H4' . 34228 1 123 . 1 . 1 16 16 DG H8 H 1 7.547 0.002 . 1 . . 514 . A 16 DG H8 . 34228 1 124 . 1 . 1 16 16 DG C8 C 13 141.388 . . 1 . . 694 . A 16 DG C8 . 34228 1 125 . 1 . 1 17 17 DG H1' H 1 5.629 0.002 . 1 . . 636 . A 17 DG H1' . 34228 1 126 . 1 . 1 17 17 DG H2' H 1 2.299 0.001 . 2 . . 637 . A 17 DG H2' . 34228 1 127 . 1 . 1 17 17 DG H2'' H 1 2.354 0.003 . 2 . . 638 . A 17 DG H2'' . 34228 1 128 . 1 . 1 17 17 DG H8 H 1 7.766 0.001 . 1 . . 635 . A 17 DG H8 . 34228 1 129 . 1 . 1 18 18 DA H1' H 1 6.044 0.002 . 1 . . 639 . A 18 DA H1' . 34228 1 130 . 1 . 1 18 18 DA H2 H 1 7.805 0.002 . 1 . . 745 . A 18 DA H2 . 34228 1 131 . 1 . 1 18 18 DA H2' H 1 2.349 0.002 . 1 . . 640 . A 18 DA H2' . 34228 1 132 . 1 . 1 18 18 DA H2'' H 1 2.349 0.002 . 1 . . 641 . A 18 DA H2'' . 34228 1 133 . 1 . 1 18 18 DA H3' H 1 4.681 0.002 . 1 . . 716 . A 18 DA H3' . 34228 1 134 . 1 . 1 18 18 DA H8 H 1 7.875 0.001 . 1 . . 643 . A 18 DA H8 . 34228 1 135 . 1 . 1 18 18 DA C8 C 13 141.367 . . 1 . . 758 . A 18 DA C8 . 34228 1 136 . 1 . 1 19 19 DC H1' H 1 5.691 0.006 . 1 . . 737 . A 19 DC H1' . 34228 1 137 . 1 . 1 19 19 DC H2' H 1 2.114 0.011 . 2 . . 470 . A 19 DC H2' . 34228 1 138 . 1 . 1 19 19 DC H2'' H 1 2.365 0.004 . 2 . . 471 . A 19 DC H2'' . 34228 1 139 . 1 . 1 19 19 DC H3' H 1 4.584 0.006 . 1 . . 754 . A 19 DC H3' . 34228 1 140 . 1 . 1 19 19 DC H5 H 1 5.786 0.004 . 1 . . 472 . A 19 DC H5 . 34228 1 141 . 1 . 1 19 19 DC H6 H 1 7.300 0.001 . 1 . . 469 . A 19 DC H6 . 34228 1 142 . 1 . 1 19 19 DC C6 C 13 142.870 . . 1 . . 710 . A 19 DC C6 . 34228 1 143 . 1 . 1 20 20 G H1 H 1 11.604 0.001 . 1 . . 735 . A 20 G H1 . 34228 1 144 . 1 . 1 20 20 G H1' H 1 5.611 0.004 . 1 . . 473 . A 20 G H1' . 34228 1 145 . 1 . 1 20 20 G H2' H 1 4.922 0.0 . 1 . . 474 . A 20 G H2' . 34228 1 146 . 1 . 1 20 20 G H8 H 1 8.173 0.001 . 1 . . 483 . A 20 G H8 . 34228 1 147 . 1 . 1 20 20 G C8 C 13 138.882 . . 1 . . 690 . A 20 G C8 . 34228 1 148 . 1 . 1 21 21 DG H1 H 1 11.523 0.002 . 1 . . 734 . A 21 DG H1 . 34228 1 149 . 1 . 1 21 21 DG H1' H 1 6.038 0.001 . 1 . . 478 . A 21 DG H1' . 34228 1 150 . 1 . 1 21 21 DG H2' H 1 2.521 0.004 . 1 . . 477 . A 21 DG H2' . 34228 1 151 . 1 . 1 21 21 DG H2'' H 1 2.675 0.002 . 1 . . 476 . A 21 DG H2'' . 34228 1 152 . 1 . 1 21 21 DG H3' H 1 4.986 0.001 . 1 . . 681 . A 21 DG H3' . 34228 1 153 . 1 . 1 21 21 DG H4' H 1 4.450 0.001 . 1 . . 680 . A 21 DG H4' . 34228 1 154 . 1 . 1 21 21 DG H8 H 1 7.938 0.001 . 1 . . 475 . A 21 DG H8 . 34228 1 155 . 1 . 1 21 21 DG C8 C 13 138.326 . . 1 . . 700 . A 21 DG C8 . 34228 1 156 . 1 . 1 22 22 DG H1 H 1 11.519 0.005 . 1 . . 736 . A 22 DG H1 . 34228 1 157 . 1 . 1 22 22 DG H1' H 1 6.334 0.002 . 1 . . 480 . A 22 DG H1' . 34228 1 158 . 1 . 1 22 22 DG H2' H 1 2.603 0.003 . 1 . . 482 . A 22 DG H2' . 34228 1 159 . 1 . 1 22 22 DG H2'' H 1 2.454 0.0 . 1 . . 481 . A 22 DG H2'' . 34228 1 160 . 1 . 1 22 22 DG H3' H 1 4.687 0.001 . 1 . . 669 . A 22 DG H3' . 34228 1 161 . 1 . 1 22 22 DG H4' H 1 4.353 0.002 . 1 . . 668 . A 22 DG H4' . 34228 1 162 . 1 . 1 22 22 DG H8 H 1 7.906 0.001 . 1 . . 479 . A 22 DG H8 . 34228 1 163 . 1 . 1 22 22 DG C8 C 13 137.873 . . 1 . . 699 . A 22 DG C8 . 34228 1 stop_ save_