###################################
# 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 51773
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'CTADN assignment'
_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-15N TROSY' . . . 51773 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 . . 51773 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 LEU H H 1 8.5840 0.0000 . 1 . . . . . 363 LEU HN . 51773 1
2 . 1 . 1 1 1 LEU N N 15 122.9760 0.0000 . 1 . . . . . 363 LEU N . 51773 1
3 . 1 . 1 2 2 GLY H H 1 8.4660 0.0000 . 1 . . . . . 364 GLY HN . 51773 1
4 . 1 . 1 2 2 GLY N N 15 111.2380 0.0000 . 1 . . . . . 364 GLY N . 51773 1
5 . 1 . 1 3 3 SER H H 1 8.1410 0.0000 . 1 . . . . . 365 SER HN . 51773 1
6 . 1 . 1 3 3 SER N N 15 116.4840 0.0000 . 1 . . . . . 365 SER N . 51773 1
7 . 1 . 1 4 4 GLU H H 1 8.6540 0.0000 . 1 . . . . . 366 GLU HN . 51773 1
8 . 1 . 1 4 4 GLU N N 15 123.5180 0.0000 . 1 . . . . . 366 GLU N . 51773 1
9 . 1 . 1 5 5 GLU H H 1 8.3400 0.0000 . 1 . . . . . 367 GLU HN . 51773 1
10 . 1 . 1 5 5 GLU N N 15 121.8600 0.0000 . 1 . . . . . 367 GLU N . 51773 1
11 . 1 . 1 6 6 GLU H H 1 8.3740 0.0000 . 1 . . . . . 368 GLU HN . 51773 1
12 . 1 . 1 6 6 GLU N N 15 122.7580 0.0000 . 1 . . . . . 368 GLU N . 51773 1
13 . 1 . 1 7 7 GLY H H 1 8.4240 0.0000 . 1 . . . . . 369 GLY HN . 51773 1
14 . 1 . 1 7 7 GLY N N 15 110.7800 0.0000 . 1 . . . . . 369 GLY N . 51773 1
15 . 1 . 1 8 8 ASP H H 1 8.2310 0.0000 . 1 . . . . . 370 ASP HN . 51773 1
16 . 1 . 1 8 8 ASP N N 15 121.5050 0.0000 . 1 . . . . . 370 ASP N . 51773 1
17 . 1 . 1 9 9 GLU H H 1 8.5840 0.0000 . 1 . . . . . 371 GLU HN . 51773 1
18 . 1 . 1 9 9 GLU N N 15 121.9570 0.0000 . 1 . . . . . 371 GLU N . 51773 1
19 . 1 . 1 10 10 GLU H H 1 8.3680 0.0000 . 1 . . . . . 372 GLU HN . 51773 1
20 . 1 . 1 10 10 GLU N N 15 120.9860 0.0000 . 1 . . . . . 372 GLU N . 51773 1
21 . 1 . 1 11 11 ASN H H 1 8.1760 0.0000 . 1 . . . . . 373 ASN HN . 51773 1
22 . 1 . 1 11 11 ASN N N 15 118.3810 0.0000 . 1 . . . . . 373 ASN N . 51773 1
23 . 1 . 1 18 18 LYS H H 1 7.9230 0.0000 . 1 . . . . . 380 LYS HN . 51773 1
24 . 1 . 1 18 18 LYS N N 15 118.6700 0.0000 . 1 . . . . . 380 LYS N . 51773 1
25 . 1 . 1 20 20 ASP H H 1 7.2780 0.0000 . 1 . . . . . 382 ASP HN . 51773 1
26 . 1 . 1 20 20 ASP N N 15 121.0950 0.0000 . 1 . . . . . 382 ASP N . 51773 1
27 . 1 . 1 21 21 GLN H H 1 8.0760 0.0000 . 1 . . . . . 383 GLN HN . 51773 1
28 . 1 . 1 21 21 GLN N N 15 121.3500 0.0000 . 1 . . . . . 383 GLN N . 51773 1
29 . 1 . 1 22 22 ASN H H 1 8.4870 0.0000 . 1 . . . . . 384 ASN HN . 51773 1
30 . 1 . 1 22 22 ASN N N 15 121.7420 0.0000 . 1 . . . . . 384 ASN N . 51773 1
31 . 1 . 1 24 24 ALA H H 1 8.3010 0.0000 . 1 . . . . . 386 ALA HN . 51773 1
32 . 1 . 1 24 24 ALA N N 15 125.2920 0.0000 . 1 . . . . . 386 ALA N . 51773 1
33 . 1 . 1 25 25 GLU H H 1 7.8020 0.0000 . 1 . . . . . 387 GLU HN . 51773 1
34 . 1 . 1 25 25 GLU N N 15 125.7800 0.0000 . 1 . . . . . 387 GLU N . 51773 1
stop_
save_
###################################
# 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_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 51773
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'H2A assignment'
_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
2 '2D 1H-15N TROSY' . . . 51773 2
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 . . 51773 2
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 . 2 . 2 4 4 GLY H H 1 8.5340 0.0000 . 1 . . . . . -1 GLY HN . 51773 2
2 . 2 . 2 4 4 GLY N N 15 110.4490 0.0000 . 1 . . . . . -1 GLY N . 51773 2
3 . 2 . 2 5 5 MET H H 1 8.2590 0.0000 . 1 . . . . . 0 MET HN . 51773 2
4 . 2 . 2 5 5 MET N N 15 120.9170 0.0000 . 1 . . . . . 0 MET N . 51773 2
5 . 2 . 2 6 6 SER H H 1 8.3810 0.0000 . 1 . . . . . 1 SER HN . 51773 2
6 . 2 . 2 6 6 SER N N 15 117.8680 0.0000 . 1 . . . . . 1 SER N . 51773 2
7 . 2 . 2 7 7 GLY H H 1 8.4060 0.0000 . 1 . . . . . 2 GLY HN . 51773 2
8 . 2 . 2 7 7 GLY N N 15 111.5850 0.0000 . 1 . . . . . 2 GLY N . 51773 2
9 . 2 . 2 8 8 ARG H H 1 8.1570 0.0000 . 1 . . . . . 3 ARG HN . 51773 2
10 . 2 . 2 8 8 ARG N N 15 121.1340 0.0000 . 1 . . . . . 3 ARG N . 51773 2
11 . 2 . 2 9 9 GLY H H 1 8.4180 0.0000 . 1 . . . . . 4 GLY HN . 51773 2
12 . 2 . 2 9 9 GLY N N 15 110.6020 0.0000 . 1 . . . . . 4 GLY N . 51773 2
13 . 2 . 2 10 10 LYS H H 1 8.2030 0.0000 . 1 . . . . . 5 LYS HN . 51773 2
14 . 2 . 2 10 10 LYS N N 15 121.8250 0.0000 . 1 . . . . . 5 LYS N . 51773 2
15 . 2 . 2 11 11 GLN H H 1 8.4630 0.0000 . 1 . . . . . 6 GLN HN . 51773 2
16 . 2 . 2 11 11 GLN N N 15 122.1650 0.0000 . 1 . . . . . 6 GLN N . 51773 2
17 . 2 . 2 12 12 GLY H H 1 8.4060 0.0000 . 1 . . . . . 7 GLY HN . 51773 2
18 . 2 . 2 12 12 GLY N N 15 111.0020 0.0000 . 1 . . . . . 7 GLY N . 51773 2
19 . 2 . 2 13 13 GLY H H 1 8.2590 0.0000 . 1 . . . . . 8 GLY HN . 51773 2
20 . 2 . 2 13 13 GLY N N 15 109.6520 0.0000 . 1 . . . . . 8 GLY N . 51773 2
21 . 2 . 2 14 14 LYS H H 1 8.1750 0.0000 . 1 . . . . . 9 LYS HN . 51773 2
22 . 2 . 2 14 14 LYS N N 15 121.8440 0.0000 . 1 . . . . . 9 LYS N . 51773 2
23 . 2 . 2 15 15 ALA H H 1 8.2640 0.0000 . 1 . . . . . 10 ALA HN . 51773 2
24 . 2 . 2 15 15 ALA N N 15 125.8940 0.0000 . 1 . . . . . 10 ALA N . 51773 2
25 . 2 . 2 16 16 ARG H H 1 8.2580 0.0000 . 1 . . . . . 11 ARG HN . 51773 2
26 . 2 . 2 16 16 ARG N N 15 121.5080 0.0000 . 1 . . . . . 11 ARG N . 51773 2
27 . 2 . 2 17 17 ALA H H 1 8.2290 0.0000 . 1 . . . . . 12 ALA HN . 51773 2
28 . 2 . 2 17 17 ALA N N 15 126.2090 0.0000 . 1 . . . . . 12 ALA N . 51773 2
29 . 2 . 2 18 18 LYS H H 1 8.2380 0.0000 . 1 . . . . . 13 LYS HN . 51773 2
30 . 2 . 2 18 18 LYS N N 15 121.6300 0.0000 . 1 . . . . . 13 LYS N . 51773 2
31 . 2 . 2 19 19 ALA H H 1 8.2720 0.0000 . 1 . . . . . 14 ALA HN . 51773 2
32 . 2 . 2 19 19 ALA N N 15 126.0990 0.0000 . 1 . . . . . 14 ALA N . 51773 2
33 . 2 . 2 20 20 LYS H H 1 8.3520 0.0000 . 1 . . . . . 15 LYS HN . 51773 2
34 . 2 . 2 20 20 LYS N N 15 121.8590 0.0000 . 1 . . . . . 15 LYS N . 51773 2
35 . 2 . 2 21 21 THR H H 1 8.1410 0.0000 . 1 . . . . . 16 THR HN . 51773 2
36 . 2 . 2 21 21 THR N N 15 116.1460 0.0000 . 1 . . . . . 16 THR N . 51773 2
37 . 2 . 2 22 22 ARG H H 1 8.4570 0.0000 . 1 . . . . . 17 ARG HN . 51773 2
38 . 2 . 2 22 22 ARG N N 15 124.3660 0.0000 . 1 . . . . . 17 ARG N . 51773 2
39 . 2 . 2 23 23 SER H H 1 8.4410 0.0000 . 1 . . . . . 18 SER HN . 51773 2
40 . 2 . 2 23 23 SER N N 15 117.7770 0.0000 . 1 . . . . . 18 SER N . 51773 2
41 . 2 . 2 24 24 SER H H 1 8.3800 0.0000 . 1 . . . . . 19 SER HN . 51773 2
42 . 2 . 2 24 24 SER N N 15 119.4140 0.0000 . 1 . . . . . 19 SER N . 51773 2
43 . 2 . 2 25 25 ARG H H 1 8.2920 0.0000 . 1 . . . . . 20 ARG HN . 51773 2
44 . 2 . 2 25 25 ARG N N 15 123.6640 0.0000 . 1 . . . . . 20 ARG N . 51773 2
45 . 2 . 2 27 27 GLY H H 1 7.9990 0.0000 . 1 . . . . . 22 GLY HN . 51773 2
46 . 2 . 2 27 27 GLY N N 15 108.1500 0.0000 . 1 . . . . . 22 GLY N . 51773 2
47 . 2 . 2 28 28 LEU H H 1 8.0150 0.0000 . 1 . . . . . 23 LEU HN . 51773 2
48 . 2 . 2 28 28 LEU N N 15 121.9260 0.0000 . 1 . . . . . 23 LEU N . 51773 2
49 . 2 . 2 32 32 VAL H H 1 8.2260 0.0000 . 1 . . . . . 27 VAL HN . 51773 2
50 . 2 . 2 32 32 VAL N N 15 128.6950 0.0000 . 1 . . . . . 27 VAL N . 51773 2
51 . 2 . 2 33 33 GLY H H 1 8.7680 0.0000 . 1 . . . . . 28 GLY HN . 51773 2
52 . 2 . 2 33 33 GLY N N 15 108.0330 0.0000 . 1 . . . . . 28 GLY N . 51773 2
53 . 2 . 2 34 34 ARG H H 1 7.2140 0.0000 . 1 . . . . . 29 ARG HN . 51773 2
54 . 2 . 2 34 34 ARG N N 15 122.1030 0.0000 . 1 . . . . . 29 ARG N . 51773 2
55 . 2 . 2 35 35 VAL H H 1 7.7200 0.0000 . 1 . . . . . 30 VAL HN . 51773 2
56 . 2 . 2 35 35 VAL N N 15 119.9430 0.0000 . 1 . . . . . 30 VAL N . 51773 2
57 . 2 . 2 36 36 HIS H H 1 8.7300 0.0000 . 1 . . . . . 31 HIS HN . 51773 2
58 . 2 . 2 36 36 HIS N N 15 120.7110 0.0000 . 1 . . . . . 31 HIS N . 51773 2
59 . 2 . 2 37 37 ARG H H 1 7.9740 0.0000 . 1 . . . . . 32 ARG HN . 51773 2
60 . 2 . 2 37 37 ARG N N 15 118.9910 0.0000 . 1 . . . . . 32 ARG N . 51773 2
61 . 2 . 2 38 38 LEU H H 1 8.3630 0.0000 . 1 . . . . . 33 LEU HN . 51773 2
62 . 2 . 2 38 38 LEU N N 15 120.3280 0.0000 . 1 . . . . . 33 LEU N . 51773 2
63 . 2 . 2 39 39 LEU H H 1 8.4050 0.0000 . 1 . . . . . 34 LEU HN . 51773 2
64 . 2 . 2 39 39 LEU N N 15 120.3240 0.0000 . 1 . . . . . 34 LEU N . 51773 2
65 . 2 . 2 40 40 ARG H H 1 7.9880 0.0000 . 1 . . . . . 35 ARG HN . 51773 2
66 . 2 . 2 40 40 ARG N N 15 118.6500 0.0000 . 1 . . . . . 35 ARG N . 51773 2
67 . 2 . 2 42 42 GLY H H 1 7.5870 0.0000 . 1 . . . . . 37 GLY HN . 51773 2
68 . 2 . 2 42 42 GLY N N 15 104.8660 0.0000 . 1 . . . . . 37 GLY N . 51773 2
69 . 2 . 2 43 43 ASN H H 1 7.8950 0.0000 . 1 . . . . . 38 ASN HN . 51773 2
70 . 2 . 2 43 43 ASN N N 15 116.1050 0.0000 . 1 . . . . . 38 ASN N . 51773 2
71 . 2 . 2 44 44 TYR H H 1 7.7920 0.0000 . 1 . . . . . 39 TYR HN . 51773 2
72 . 2 . 2 44 44 TYR N N 15 117.4800 0.0000 . 1 . . . . . 39 TYR N . 51773 2
73 . 2 . 2 45 45 SER H H 1 7.9910 0.0000 . 1 . . . . . 40 SER HN . 51773 2
74 . 2 . 2 45 45 SER N N 15 112.3500 0.0000 . 1 . . . . . 40 SER N . 51773 2
75 . 2 . 2 46 46 GLU H H 1 8.5040 0.0000 . 1 . . . . . 41 GLU HN . 51773 2
76 . 2 . 2 46 46 GLU N N 15 122.2150 0.0000 . 1 . . . . . 41 GLU N . 51773 2
77 . 2 . 2 47 47 ARG H H 1 8.1060 0.0000 . 1 . . . . . 42 ARG HN . 51773 2
78 . 2 . 2 47 47 ARG N N 15 116.6390 0.0000 . 1 . . . . . 42 ARG N . 51773 2
79 . 2 . 2 48 48 VAL H H 1 8.8660 0.0000 . 1 . . . . . 43 VAL HN . 51773 2
80 . 2 . 2 48 48 VAL N N 15 125.2150 0.0000 . 1 . . . . . 43 VAL N . 51773 2
81 . 2 . 2 49 49 GLY H H 1 9.1030 0.0000 . 1 . . . . . 44 GLY HN . 51773 2
82 . 2 . 2 49 49 GLY N N 15 116.7030 0.0000 . 1 . . . . . 44 GLY N . 51773 2
83 . 2 . 2 50 50 ALA H H 1 8.5110 0.0000 . 1 . . . . . 45 ALA HN . 51773 2
84 . 2 . 2 50 50 ALA N N 15 123.1600 0.0000 . 1 . . . . . 45 ALA N . 51773 2
85 . 2 . 2 51 51 GLY H H 1 8.6310 0.0000 . 1 . . . . . 46 GLY HN . 51773 2
86 . 2 . 2 51 51 GLY N N 15 105.7730 0.0000 . 1 . . . . . 46 GLY N . 51773 2
87 . 2 . 2 52 52 ALA H H 1 7.4450 0.0000 . 1 . . . . . 47 ALA HN . 51773 2
88 . 2 . 2 52 52 ALA N N 15 124.9860 0.0000 . 1 . . . . . 47 ALA N . 51773 2
89 . 2 . 2 54 54 VAL H H 1 6.2720 0.0000 . 1 . . . . . 49 VAL HN . 51773 2
90 . 2 . 2 54 54 VAL N N 15 118.8490 0.0000 . 1 . . . . . 49 VAL N . 51773 2
91 . 2 . 2 55 55 TYR H H 1 7.9120 0.0000 . 1 . . . . . 50 TYR HN . 51773 2
92 . 2 . 2 55 55 TYR N N 15 120.6740 0.0000 . 1 . . . . . 50 TYR N . 51773 2
93 . 2 . 2 56 56 LEU H H 1 8.2720 0.0000 . 1 . . . . . 51 LEU HN . 51773 2
94 . 2 . 2 56 56 LEU N N 15 116.2000 0.0000 . 1 . . . . . 51 LEU N . 51773 2
95 . 2 . 2 57 57 ALA H H 1 8.4310 0.0000 . 1 . . . . . 52 ALA HN . 51773 2
96 . 2 . 2 57 57 ALA N N 15 121.5630 0.0000 . 1 . . . . . 52 ALA N . 51773 2
97 . 2 . 2 58 58 ALA H H 1 7.7870 0.0000 . 1 . . . . . 53 ALA HN . 51773 2
98 . 2 . 2 58 58 ALA N N 15 119.2790 0.0000 . 1 . . . . . 53 ALA N . 51773 2
99 . 2 . 2 59 59 VAL H H 1 7.8940 0.0000 . 1 . . . . . 54 VAL HN . 51773 2
100 . 2 . 2 59 59 VAL N N 15 120.7040 0.0000 . 1 . . . . . 54 VAL N . 51773 2
101 . 2 . 2 60 60 LEU H H 1 8.2750 0.0000 . 1 . . . . . 55 LEU HN . 51773 2
102 . 2 . 2 60 60 LEU N N 15 118.9750 0.0000 . 1 . . . . . 55 LEU N . 51773 2
103 . 2 . 2 62 62 TYR H H 1 7.8560 0.0000 . 1 . . . . . 57 TYR HN . 51773 2
104 . 2 . 2 62 62 TYR N N 15 120.0160 0.0000 . 1 . . . . . 57 TYR N . 51773 2
105 . 2 . 2 63 63 LEU H H 1 8.0110 0.0000 . 1 . . . . . 58 LEU HN . 51773 2
106 . 2 . 2 63 63 LEU N N 15 117.8330 0.0000 . 1 . . . . . 58 LEU N . 51773 2
107 . 2 . 2 66 66 GLU H H 1 7.9580 0.0000 . 1 . . . . . 61 GLU HN . 51773 2
108 . 2 . 2 66 66 GLU N N 15 119.9470 0.0000 . 1 . . . . . 61 GLU N . 51773 2
109 . 2 . 2 67 67 ILE H H 1 7.9380 0.0000 . 1 . . . . . 62 ILE HN . 51773 2
110 . 2 . 2 67 67 ILE N N 15 117.8240 0.0000 . 1 . . . . . 62 ILE N . 51773 2
111 . 2 . 2 69 69 GLU H H 1 9.0200 0.0000 . 1 . . . . . 64 GLU HN . 51773 2
112 . 2 . 2 69 69 GLU N N 15 123.3670 0.0000 . 1 . . . . . 64 GLU N . 51773 2
113 . 2 . 2 70 70 LEU H H 1 7.6270 0.0000 . 1 . . . . . 65 LEU HN . 51773 2
114 . 2 . 2 70 70 LEU N N 15 119.8810 0.0000 . 1 . . . . . 65 LEU N . 51773 2
115 . 2 . 2 71 71 ALA H H 1 9.3510 0.0000 . 1 . . . . . 66 ALA HN . 51773 2
116 . 2 . 2 71 71 ALA N N 15 125.0510 0.0000 . 1 . . . . . 66 ALA N . 51773 2
117 . 2 . 2 72 72 GLY H H 1 8.8100 0.0000 . 1 . . . . . 67 GLY HN . 51773 2
118 . 2 . 2 72 72 GLY N N 15 105.9890 0.0000 . 1 . . . . . 67 GLY N . 51773 2
119 . 2 . 2 73 73 ASN H H 1 7.6580 0.0000 . 1 . . . . . 68 ASN HN . 51773 2
120 . 2 . 2 73 73 ASN N N 15 123.8130 0.0000 . 1 . . . . . 68 ASN N . 51773 2
121 . 2 . 2 74 74 ALA H H 1 7.4550 0.0000 . 1 . . . . . 69 ALA HN . 51773 2
122 . 2 . 2 74 74 ALA N N 15 123.6160 0.0000 . 1 . . . . . 69 ALA N . 51773 2
123 . 2 . 2 75 75 ALA H H 1 7.6850 0.0000 . 1 . . . . . 70 ALA HN . 51773 2
124 . 2 . 2 75 75 ALA N N 15 122.8050 0.0000 . 1 . . . . . 70 ALA N . 51773 2
125 . 2 . 2 76 76 ARG H H 1 7.6940 0.0000 . 1 . . . . . 71 ARG HN . 51773 2
126 . 2 . 2 76 76 ARG N N 15 119.9210 0.0000 . 1 . . . . . 71 ARG N . 51773 2
127 . 2 . 2 77 77 ASP H H 1 8.4920 0.0000 . 1 . . . . . 72 ASP HN . 51773 2
128 . 2 . 2 77 77 ASP N N 15 123.1280 0.0000 . 1 . . . . . 72 ASP N . 51773 2
129 . 2 . 2 78 78 ASN H H 1 7.3410 0.0000 . 1 . . . . . 73 ASN HN . 51773 2
130 . 2 . 2 78 78 ASN N N 15 117.5400 0.0000 . 1 . . . . . 73 ASN N . 51773 2
131 . 2 . 2 79 79 LYS H H 1 8.0950 0.0000 . 1 . . . . . 74 LYS HN . 51773 2
132 . 2 . 2 79 79 LYS N N 15 116.0220 0.0000 . 1 . . . . . 74 LYS N . 51773 2
133 . 2 . 2 80 80 LYS H H 1 8.1480 0.0000 . 1 . . . . . 75 LYS HN . 51773 2
134 . 2 . 2 80 80 LYS N N 15 117.4250 0.0000 . 1 . . . . . 75 LYS N . 51773 2
135 . 2 . 2 81 81 THR H H 1 8.4750 0.0000 . 1 . . . . . 76 THR HN . 51773 2
136 . 2 . 2 81 81 THR N N 15 110.2170 0.0000 . 1 . . . . . 76 THR N . 51773 2
137 . 2 . 2 82 82 ARG H H 1 7.0510 0.0000 . 1 . . . . . 77 ARG HN . 51773 2
138 . 2 . 2 82 82 ARG N N 15 119.8510 0.0000 . 1 . . . . . 77 ARG N . 51773 2
139 . 2 . 2 83 83 ILE H H 1 8.4790 0.0000 . 1 . . . . . 78 ILE HN . 51773 2
140 . 2 . 2 83 83 ILE N N 15 125.2840 0.0000 . 1 . . . . . 78 ILE N . 51773 2
141 . 2 . 2 84 84 ILE H H 1 8.9380 0.0000 . 1 . . . . . 79 ILE HN . 51773 2
142 . 2 . 2 84 84 ILE N N 15 125.3280 0.0000 . 1 . . . . . 79 ILE N . 51773 2
143 . 2 . 2 86 86 ARG H H 1 8.3810 0.0000 . 1 . . . . . 81 ARG HN . 51773 2
144 . 2 . 2 86 86 ARG N N 15 116.6640 0.0000 . 1 . . . . . 81 ARG N . 51773 2
145 . 2 . 2 87 87 HIS H H 1 7.3300 0.0000 . 1 . . . . . 82 HIS HN . 51773 2
146 . 2 . 2 87 87 HIS N N 15 118.3550 0.0000 . 1 . . . . . 82 HIS N . 51773 2
147 . 2 . 2 88 88 LEU H H 1 7.0790 0.0000 . 1 . . . . . 83 LEU HN . 51773 2
148 . 2 . 2 88 88 LEU N N 15 117.4750 0.0000 . 1 . . . . . 83 LEU N . 51773 2
149 . 2 . 2 90 90 LEU H H 1 8.1340 0.0000 . 1 . . . . . 85 LEU HN . 51773 2
150 . 2 . 2 90 90 LEU N N 15 120.0380 0.0000 . 1 . . . . . 85 LEU N . 51773 2
151 . 2 . 2 91 91 ALA H H 1 7.7540 0.0000 . 1 . . . . . 86 ALA HN . 51773 2
152 . 2 . 2 91 91 ALA N N 15 120.2350 0.0000 . 1 . . . . . 86 ALA N . 51773 2
153 . 2 . 2 92 92 ILE H H 1 7.5760 0.0000 . 1 . . . . . 87 ILE HN . 51773 2
154 . 2 . 2 92 92 ILE N N 15 114.1770 0.0000 . 1 . . . . . 87 ILE N . 51773 2
155 . 2 . 2 93 93 ARG H H 1 7.8260 0.0000 . 1 . . . . . 88 ARG HN . 51773 2
156 . 2 . 2 93 93 ARG N N 15 115.4320 0.0000 . 1 . . . . . 88 ARG N . 51773 2
157 . 2 . 2 94 94 ASN H H 1 7.6830 0.0000 . 1 . . . . . 89 ASN HN . 51773 2
158 . 2 . 2 94 94 ASN N N 15 113.7980 0.0000 . 1 . . . . . 89 ASN N . 51773 2
159 . 2 . 2 95 95 ASP H H 1 7.3030 0.0000 . 1 . . . . . 90 ASP HN . 51773 2
160 . 2 . 2 95 95 ASP N N 15 122.9440 0.0000 . 1 . . . . . 90 ASP N . 51773 2
161 . 2 . 2 96 96 GLU H H 1 8.8440 0.0000 . 1 . . . . . 91 GLU HN . 51773 2
162 . 2 . 2 96 96 GLU N N 15 126.8460 0.0000 . 1 . . . . . 91 GLU N . 51773 2
163 . 2 . 2 97 97 GLU H H 1 8.0970 0.0000 . 1 . . . . . 92 GLU HN . 51773 2
164 . 2 . 2 97 97 GLU N N 15 118.2150 0.0000 . 1 . . . . . 92 GLU N . 51773 2
165 . 2 . 2 98 98 LEU H H 1 9.1890 0.0000 . 1 . . . . . 93 LEU HN . 51773 2
166 . 2 . 2 98 98 LEU N N 15 121.6100 0.0000 . 1 . . . . . 93 LEU N . 51773 2
167 . 2 . 2 99 99 ASN H H 1 9.0130 0.0000 . 1 . . . . . 94 ASN HN . 51773 2
168 . 2 . 2 99 99 ASN N N 15 119.7590 0.0000 . 1 . . . . . 94 ASN N . 51773 2
169 . 2 . 2 100 100 LYS H H 1 7.5590 0.0000 . 1 . . . . . 95 LYS HN . 51773 2
170 . 2 . 2 100 100 LYS N N 15 120.1400 0.0000 . 1 . . . . . 95 LYS N . 51773 2
171 . 2 . 2 101 101 LEU H H 1 7.8590 0.0000 . 1 . . . . . 96 LEU HN . 51773 2
172 . 2 . 2 101 101 LEU N N 15 119.5820 0.0000 . 1 . . . . . 96 LEU N . 51773 2
173 . 2 . 2 102 102 LEU H H 1 8.6570 0.0000 . 1 . . . . . 97 LEU HN . 51773 2
174 . 2 . 2 102 102 LEU N N 15 116.4230 0.0000 . 1 . . . . . 97 LEU N . 51773 2
175 . 2 . 2 103 103 GLY H H 1 8.0260 0.0000 . 1 . . . . . 98 GLY HN . 51773 2
176 . 2 . 2 103 103 GLY N N 15 110.3390 0.0000 . 1 . . . . . 98 GLY N . 51773 2
177 . 2 . 2 104 104 ARG H H 1 8.1280 0.0000 . 1 . . . . . 99 ARG HN . 51773 2
178 . 2 . 2 104 104 ARG N N 15 118.9740 0.0000 . 1 . . . . . 99 ARG N . 51773 2
179 . 2 . 2 105 105 VAL H H 1 7.7820 0.0000 . 1 . . . . . 100 VAL HN . 51773 2
180 . 2 . 2 105 105 VAL N N 15 121.4780 0.0000 . 1 . . . . . 100 VAL N . 51773 2
181 . 2 . 2 106 106 THR H H 1 8.2680 0.0000 . 1 . . . . . 101 THR HN . 51773 2
182 . 2 . 2 106 106 THR N N 15 120.5200 0.0000 . 1 . . . . . 101 THR N . 51773 2
183 . 2 . 2 107 107 ILE H H 1 8.2010 0.0000 . 1 . . . . . 102 ILE HN . 51773 2
184 . 2 . 2 107 107 ILE N N 15 124.4900 0.0000 . 1 . . . . . 102 ILE N . 51773 2
185 . 2 . 2 108 108 ALA H H 1 8.2090 0.0000 . 1 . . . . . 103 ALA HN . 51773 2
186 . 2 . 2 108 108 ALA N N 15 127.8090 0.0000 . 1 . . . . . 103 ALA N . 51773 2
187 . 2 . 2 109 109 GLN H H 1 8.2710 0.0000 . 1 . . . . . 104 GLN HN . 51773 2
188 . 2 . 2 109 109 GLN N N 15 120.1140 0.0000 . 1 . . . . . 104 GLN N . 51773 2
189 . 2 . 2 110 110 GLY H H 1 8.3290 0.0000 . 1 . . . . . 105 GLY HN . 51773 2
190 . 2 . 2 110 110 GLY N N 15 110.4290 0.0000 . 1 . . . . . 105 GLY N . 51773 2
191 . 2 . 2 111 111 GLY H H 1 8.1840 0.0000 . 1 . . . . . 106 GLY HN . 51773 2
192 . 2 . 2 111 111 GLY N N 15 109.4640 0.0000 . 1 . . . . . 106 GLY N . 51773 2
193 . 2 . 2 112 112 VAL H H 1 7.9430 0.0000 . 1 . . . . . 107 VAL HN . 51773 2
194 . 2 . 2 112 112 VAL N N 15 119.6940 0.0000 . 1 . . . . . 107 VAL N . 51773 2
195 . 2 . 2 113 113 LEU H H 1 8.3240 0.0000 . 1 . . . . . 108 LEU HN . 51773 2
196 . 2 . 2 113 113 LEU N N 15 128.0330 0.0000 . 1 . . . . . 108 LEU N . 51773 2
197 . 2 . 2 115 115 ASN H H 1 8.4060 0.0000 . 1 . . . . . 110 ASN HN . 51773 2
198 . 2 . 2 115 115 ASN N N 15 119.4460 0.0000 . 1 . . . . . 110 ASN N . 51773 2
199 . 2 . 2 116 116 ILE H H 1 8.0530 0.0000 . 1 . . . . . 111 ILE HN . 51773 2
200 . 2 . 2 116 116 ILE N N 15 122.0890 0.0000 . 1 . . . . . 111 ILE N . 51773 2
201 . 2 . 2 117 117 GLN H H 1 8.3230 0.0000 . 1 . . . . . 112 GLN HN . 51773 2
202 . 2 . 2 117 117 GLN N N 15 124.7330 0.0000 . 1 . . . . . 112 GLN N . 51773 2
203 . 2 . 2 118 118 ALA H H 1 8.2030 0.0000 . 1 . . . . . 113 ALA HN . 51773 2
204 . 2 . 2 118 118 ALA N N 15 126.2450 0.0000 . 1 . . . . . 113 ALA N . 51773 2
205 . 2 . 2 119 119 VAL H H 1 8.0010 0.0000 . 1 . . . . . 114 VAL HN . 51773 2
206 . 2 . 2 119 119 VAL N N 15 120.2410 0.0000 . 1 . . . . . 114 VAL N . 51773 2
207 . 2 . 2 120 120 LEU H H 1 8.2030 0.0000 . 1 . . . . . 115 LEU HN . 51773 2
208 . 2 . 2 120 120 LEU N N 15 126.9790 0.0000 . 1 . . . . . 115 LEU N . 51773 2
209 . 2 . 2 121 121 LEU H H 1 8.1530 0.0000 . 1 . . . . . 116 LEU HN . 51773 2
210 . 2 . 2 121 121 LEU N N 15 125.6860 0.0000 . 1 . . . . . 116 LEU N . 51773 2
211 . 2 . 2 123 123 LYS H H 1 8.3360 0.0000 . 1 . . . . . 118 LYS HN . 51773 2
212 . 2 . 2 123 123 LYS N N 15 122.6840 0.0000 . 1 . . . . . 118 LYS N . 51773 2
213 . 2 . 2 124 124 LYS H H 1 8.3860 0.0000 . 1 . . . . . 119 LYS HN . 51773 2
214 . 2 . 2 124 124 LYS N N 15 124.1940 0.0000 . 1 . . . . . 119 LYS N . 51773 2
215 . 2 . 2 125 125 THR H H 1 8.1870 0.0000 . 1 . . . . . 120 THR HN . 51773 2
216 . 2 . 2 125 125 THR N N 15 117.1970 0.0000 . 1 . . . . . 120 THR N . 51773 2
217 . 2 . 2 126 126 GLU H H 1 8.4240 0.0000 . 1 . . . . . 121 GLU HN . 51773 2
218 . 2 . 2 126 126 GLU N N 15 124.5780 0.0000 . 1 . . . . . 121 GLU N . 51773 2
219 . 2 . 2 127 127 SER H H 1 8.3480 0.0000 . 1 . . . . . 122 SER HN . 51773 2
220 . 2 . 2 127 127 SER N N 15 118.1140 0.0000 . 1 . . . . . 122 SER N . 51773 2
221 . 2 . 2 130 130 LYS H H 1 8.3270 0.0000 . 1 . . . . . 125 LYS HN . 51773 2
222 . 2 . 2 130 130 LYS N N 15 124.3710 0.0000 . 1 . . . . . 125 LYS N . 51773 2
223 . 2 . 2 131 131 ALA H H 1 8.3550 0.0000 . 1 . . . . . 126 ALA HN . 51773 2
224 . 2 . 2 131 131 ALA N N 15 126.7870 0.0000 . 1 . . . . . 126 ALA N . 51773 2
225 . 2 . 2 132 132 LYS H H 1 8.3130 0.0000 . 1 . . . . . 127 LYS HN . 51773 2
226 . 2 . 2 132 132 LYS N N 15 121.9130 0.0000 . 1 . . . . . 127 LYS N . 51773 2
227 . 2 . 2 133 133 GLY H H 1 8.3790 0.0000 . 1 . . . . . 128 GLY HN . 51773 2
228 . 2 . 2 133 133 GLY N N 15 111.7880 0.0000 . 1 . . . . . 128 GLY N . 51773 2
229 . 2 . 2 134 134 LYS H H 1 7.7880 0.0000 . 1 . . . . . 129 LYS HN . 51773 2
230 . 2 . 2 134 134 LYS N N 15 126.6790 0.0000 . 1 . . . . . 129 LYS N . 51773 2
stop_
save_
###################################
# 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_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_3
_Assigned_chem_shift_list.Entry_ID 51773
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Name 'H2B assignment'
_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
2 '2D 1H-15N TROSY' . . . 51773 3
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 . . 51773 3
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 . 3 . 3 4 4 GLY H H 1 8.5340 0.0000 . 1 . . . . . -1 GLY HN . 51773 3
2 . 3 . 3 4 4 GLY N N 15 110.7280 0.0000 . 1 . . . . . -1 GLY N . 51773 3
3 . 3 . 3 5 5 MET H H 1 8.1010 0.0000 . 1 . . . . . 0 MET HN . 51773 3
4 . 3 . 3 5 5 MET N N 15 121.8800 0.0000 . 1 . . . . . 0 MET N . 51773 3
5 . 3 . 3 7 7 GLU H H 1 8.4380 0.0000 . 1 . . . . . 2 GLU HN . 51773 3
6 . 3 . 3 7 7 GLU N N 15 123.4960 0.0000 . 1 . . . . . 2 GLU N . 51773 3
7 . 3 . 3 9 9 ALA H H 1 8.3570 0.0000 . 1 . . . . . 4 ALA HN . 51773 3
8 . 3 . 3 9 9 ALA N N 15 124.8560 0.0000 . 1 . . . . . 4 ALA N . 51773 3
9 . 3 . 3 10 10 LYS H H 1 8.2810 0.0000 . 1 . . . . . 5 LYS HN . 51773 3
10 . 3 . 3 10 10 LYS N N 15 121.5860 0.0000 . 1 . . . . . 5 LYS N . 51773 3
11 . 3 . 3 11 11 SER H H 1 8.1980 0.0000 . 1 . . . . . 6 SER HN . 51773 3
12 . 3 . 3 11 11 SER N N 15 117.6960 0.0000 . 1 . . . . . 6 SER N . 51773 3
13 . 3 . 3 12 12 ALA H H 1 8.2660 0.0000 . 1 . . . . . 7 ALA HN . 51773 3
14 . 3 . 3 12 12 ALA N N 15 127.8500 0.0000 . 1 . . . . . 7 ALA N . 51773 3
15 . 3 . 3 14 14 ALA H H 1 8.3470 0.0000 . 1 . . . . . 9 ALA HN . 51773 3
16 . 3 . 3 14 14 ALA N N 15 126.5270 0.0000 . 1 . . . . . 9 ALA N . 51773 3
17 . 3 . 3 16 16 LYS H H 1 8.3870 0.0000 . 1 . . . . . 11 LYS HN . 51773 3
18 . 3 . 3 16 16 LYS N N 15 122.8350 0.0000 . 1 . . . . . 11 LYS N . 51773 3
19 . 3 . 3 17 17 LYS H H 1 8.3890 0.0000 . 1 . . . . . 12 LYS HN . 51773 3
20 . 3 . 3 17 17 LYS N N 15 124.1480 0.0000 . 1 . . . . . 12 LYS N . 51773 3
21 . 3 . 3 18 18 GLY H H 1 8.4410 0.0000 . 1 . . . . . 13 GLY HN . 51773 3
22 . 3 . 3 18 18 GLY N N 15 111.5360 0.0000 . 1 . . . . . 13 GLY N . 51773 3
23 . 3 . 3 19 19 SER H H 1 8.1460 0.0000 . 1 . . . . . 14 SER HN . 51773 3
24 . 3 . 3 19 19 SER N N 15 116.5100 0.0000 . 1 . . . . . 14 SER N . 51773 3
25 . 3 . 3 20 20 LYS H H 1 8.3740 0.0000 . 1 . . . . . 15 LYS HN . 51773 3
26 . 3 . 3 20 20 LYS N N 15 124.2260 0.0000 . 1 . . . . . 15 LYS N . 51773 3
27 . 3 . 3 21 21 LYS H H 1 8.2500 0.0000 . 1 . . . . . 16 LYS HN . 51773 3
28 . 3 . 3 21 21 LYS N N 15 123.9860 0.0000 . 1 . . . . . 16 LYS N . 51773 3
29 . 3 . 3 22 22 ALA H H 1 8.2920 0.0000 . 1 . . . . . 17 ALA HN . 51773 3
30 . 3 . 3 22 22 ALA N N 15 126.8630 0.0000 . 1 . . . . . 17 ALA N . 51773 3
31 . 3 . 3 23 23 VAL H H 1 8.1730 0.0000 . 1 . . . . . 18 VAL HN . 51773 3
32 . 3 . 3 23 23 VAL N N 15 121.1720 0.0000 . 1 . . . . . 18 VAL N . 51773 3
33 . 3 . 3 24 24 THR H H 1 8.2210 0.0000 . 1 . . . . . 19 THR HN . 51773 3
34 . 3 . 3 24 24 THR N N 15 119.8750 0.0000 . 1 . . . . . 19 THR N . 51773 3
35 . 3 . 3 25 25 LYS H H 1 8.3380 0.0000 . 1 . . . . . 20 LYS HN . 51773 3
36 . 3 . 3 25 25 LYS N N 15 125.1850 0.0000 . 1 . . . . . 20 LYS N . 51773 3
37 . 3 . 3 26 26 ALA H H 1 8.2740 0.0000 . 1 . . . . . 21 ALA HN . 51773 3
38 . 3 . 3 26 26 ALA N N 15 126.2120 0.0000 . 1 . . . . . 21 ALA N . 51773 3
39 . 3 . 3 27 27 GLN H H 1 8.3070 0.0000 . 1 . . . . . 22 GLN HN . 51773 3
40 . 3 . 3 27 27 GLN N N 15 121.0160 0.0000 . 1 . . . . . 22 GLN N . 51773 3
41 . 3 . 3 28 28 LYS H H 1 8.3480 0.0000 . 1 . . . . . 23 LYS HN . 51773 3
42 . 3 . 3 28 28 LYS N N 15 124.2310 0.0000 . 1 . . . . . 23 LYS N . 51773 3
43 . 3 . 3 29 29 LYS H H 1 8.3670 0.0000 . 1 . . . . . 24 LYS HN . 51773 3
44 . 3 . 3 29 29 LYS N N 15 124.3130 0.0000 . 1 . . . . . 24 LYS N . 51773 3
45 . 3 . 3 30 30 ASP H H 1 8.3150 0.0000 . 1 . . . . . 25 ASP HN . 51773 3
46 . 3 . 3 30 30 ASP N N 15 122.4230 0.0000 . 1 . . . . . 25 ASP N . 51773 3
47 . 3 . 3 31 31 GLY H H 1 8.3000 0.0000 . 1 . . . . . 26 GLY HN . 51773 3
48 . 3 . 3 31 31 GLY N N 15 110.3390 0.0000 . 1 . . . . . 26 GLY N . 51773 3
49 . 3 . 3 32 32 LYS H H 1 8.1420 0.0000 . 1 . . . . . 27 LYS HN . 51773 3
50 . 3 . 3 32 32 LYS N N 15 121.6100 0.0000 . 1 . . . . . 27 LYS N . 51773 3
51 . 3 . 3 33 33 LYS H H 1 8.2120 0.0000 . 1 . . . . . 28 LYS HN . 51773 3
52 . 3 . 3 33 33 LYS N N 15 123.1200 0.0000 . 1 . . . . . 28 LYS N . 51773 3
53 . 3 . 3 34 34 ARG H H 1 8.3990 0.0000 . 1 . . . . . 29 ARG HN . 51773 3
54 . 3 . 3 34 34 ARG N N 15 124.0280 0.0000 . 1 . . . . . 29 ARG N . 51773 3
55 . 3 . 3 35 35 LYS H H 1 8.2740 0.0000 . 1 . . . . . 30 LYS HN . 51773 3
56 . 3 . 3 35 35 LYS N N 15 123.6320 0.0000 . 1 . . . . . 30 LYS N . 51773 3
57 . 3 . 3 36 36 ARG H H 1 8.2850 0.0000 . 1 . . . . . 31 ARG HN . 51773 3
58 . 3 . 3 36 36 ARG N N 15 123.5650 0.0000 . 1 . . . . . 31 ARG N . 51773 3
59 . 3 . 3 37 37 SER H H 1 8.3910 0.0000 . 1 . . . . . 32 SER HN . 51773 3
60 . 3 . 3 37 37 SER N N 15 118.8970 0.0000 . 1 . . . . . 32 SER N . 51773 3
61 . 3 . 3 38 38 ARG H H 1 8.4510 0.0000 . 1 . . . . . 33 ARG HN . 51773 3
62 . 3 . 3 38 38 ARG N N 15 124.4350 0.0000 . 1 . . . . . 33 ARG N . 51773 3
63 . 3 . 3 39 39 LYS H H 1 8.3540 0.0000 . 1 . . . . . 34 LYS HN . 51773 3
64 . 3 . 3 39 39 LYS N N 15 124.4220 0.0000 . 1 . . . . . 34 LYS N . 51773 3
65 . 3 . 3 40 40 GLU H H 1 8.2060 0.0000 . 1 . . . . . 35 GLU HN . 51773 3
66 . 3 . 3 40 40 GLU N N 15 123.7040 0.0000 . 1 . . . . . 35 GLU N . 51773 3
67 . 3 . 3 41 41 SER H H 1 8.5800 0.0000 . 1 . . . . . 36 SER HN . 51773 3
68 . 3 . 3 41 41 SER N N 15 117.3500 0.0000 . 1 . . . . . 36 SER N . 51773 3
69 . 3 . 3 42 42 TYR H H 1 7.9660 0.0000 . 1 . . . . . 37 TYR HN . 51773 3
70 . 3 . 3 42 42 TYR N N 15 118.5910 0.0000 . 1 . . . . . 37 TYR N . 51773 3
71 . 3 . 3 48 48 LYS H H 1 7.4350 0.0000 . 1 . . . . . 43 LYS HN . 51773 3
72 . 3 . 3 48 48 LYS N N 15 118.3070 0.0000 . 1 . . . . . 43 LYS N . 51773 3
73 . 3 . 3 49 49 VAL H H 1 7.9340 0.0000 . 1 . . . . . 44 VAL HN . 51773 3
74 . 3 . 3 49 49 VAL N N 15 120.7230 0.0000 . 1 . . . . . 44 VAL N . 51773 3
75 . 3 . 3 50 50 LEU H H 1 8.5210 0.0000 . 1 . . . . . 45 LEU HN . 51773 3
76 . 3 . 3 50 50 LEU N N 15 122.2710 0.0000 . 1 . . . . . 45 LEU N . 51773 3
77 . 3 . 3 51 51 LYS H H 1 7.6750 0.0000 . 1 . . . . . 46 LYS HN . 51773 3
78 . 3 . 3 51 51 LYS N N 15 115.2400 0.0000 . 1 . . . . . 46 LYS N . 51773 3
79 . 3 . 3 52 52 GLN H H 1 7.2630 0.0000 . 1 . . . . . 47 GLN HN . 51773 3
80 . 3 . 3 52 52 GLN N N 15 115.7390 0.0000 . 1 . . . . . 47 GLN N . 51773 3
81 . 3 . 3 53 53 VAL H H 1 7.6550 0.0000 . 1 . . . . . 48 VAL HN . 51773 3
82 . 3 . 3 53 53 VAL N N 15 114.1700 0.0000 . 1 . . . . . 48 VAL N . 51773 3
83 . 3 . 3 54 54 HIS H H 1 8.8500 0.0000 . 1 . . . . . 49 HIS HN . 51773 3
84 . 3 . 3 54 54 HIS N N 15 119.3910 0.0000 . 1 . . . . . 49 HIS N . 51773 3
85 . 3 . 3 56 56 ASP H H 1 8.3320 0.0000 . 1 . . . . . 51 ASP HN . 51773 3
86 . 3 . 3 56 56 ASP N N 15 116.0950 0.0000 . 1 . . . . . 51 ASP N . 51773 3
87 . 3 . 3 57 57 THR H H 1 7.7990 0.0000 . 1 . . . . . 52 THR HN . 51773 3
88 . 3 . 3 57 57 THR N N 15 119.5350 0.0000 . 1 . . . . . 52 THR N . 51773 3
89 . 3 . 3 58 58 GLY H H 1 8.5220 0.0000 . 1 . . . . . 53 GLY HN . 51773 3
90 . 3 . 3 58 58 GLY N N 15 113.5960 0.0000 . 1 . . . . . 53 GLY N . 51773 3
91 . 3 . 3 59 59 ILE H H 1 8.7920 0.0000 . 1 . . . . . 54 ILE HN . 51773 3
92 . 3 . 3 59 59 ILE N N 15 118.4230 0.0000 . 1 . . . . . 54 ILE N . 51773 3
93 . 3 . 3 60 60 SER H H 1 8.9570 0.0000 . 1 . . . . . 55 SER HN . 51773 3
94 . 3 . 3 60 60 SER N N 15 125.3110 0.0000 . 1 . . . . . 55 SER N . 51773 3
95 . 3 . 3 61 61 SER H H 1 9.1160 0.0000 . 1 . . . . . 56 SER HN . 51773 3
96 . 3 . 3 61 61 SER N N 15 119.2360 0.0000 . 1 . . . . . 56 SER N . 51773 3
97 . 3 . 3 63 63 ALA H H 1 7.5720 0.0000 . 1 . . . . . 58 ALA HN . 51773 3
98 . 3 . 3 63 63 ALA N N 15 121.9730 0.0000 . 1 . . . . . 58 ALA N . 51773 3
99 . 3 . 3 64 64 MET H H 1 8.7520 0.0000 . 1 . . . . . 59 MET HN . 51773 3
100 . 3 . 3 64 64 MET N N 15 120.6360 0.0000 . 1 . . . . . 59 MET N . 51773 3
101 . 3 . 3 65 65 GLY H H 1 7.9760 0.0000 . 1 . . . . . 60 GLY HN . 51773 3
102 . 3 . 3 65 65 GLY N N 15 107.9820 0.0000 . 1 . . . . . 60 GLY N . 51773 3
103 . 3 . 3 66 66 ILE H H 1 7.2780 0.0000 . 1 . . . . . 61 ILE HN . 51773 3
104 . 3 . 3 66 66 ILE N N 15 124.3610 0.0000 . 1 . . . . . 61 ILE N . 51773 3
105 . 3 . 3 67 67 MET H H 1 7.9470 0.0000 . 1 . . . . . 62 MET HN . 51773 3
106 . 3 . 3 67 67 MET N N 15 118.7350 0.0000 . 1 . . . . . 62 MET N . 51773 3
107 . 3 . 3 68 68 ASN H H 1 8.6320 0.0000 . 1 . . . . . 63 ASN HN . 51773 3
108 . 3 . 3 68 68 ASN N N 15 118.0440 0.0000 . 1 . . . . . 63 ASN N . 51773 3
109 . 3 . 3 69 69 SER H H 1 8.0540 0.0000 . 1 . . . . . 64 SER HN . 51773 3
110 . 3 . 3 69 69 SER N N 15 119.4660 0.0000 . 1 . . . . . 64 SER N . 51773 3
111 . 3 . 3 70 70 PHE H H 1 8.4140 0.0000 . 1 . . . . . 65 PHE HN . 51773 3
112 . 3 . 3 70 70 PHE N N 15 122.8300 0.0000 . 1 . . . . . 65 PHE N . 51773 3
113 . 3 . 3 71 71 VAL H H 1 8.4310 0.0000 . 1 . . . . . 66 VAL HN . 51773 3
114 . 3 . 3 71 71 VAL N N 15 118.9870 0.0000 . 1 . . . . . 66 VAL N . 51773 3
115 . 3 . 3 72 72 ASN H H 1 8.0200 0.0000 . 1 . . . . . 67 ASN HN . 51773 3
116 . 3 . 3 72 72 ASN N N 15 115.9130 0.0000 . 1 . . . . . 67 ASN N . 51773 3
117 . 3 . 3 73 73 ASP H H 1 8.1770 0.0000 . 1 . . . . . 68 ASP HN . 51773 3
118 . 3 . 3 73 73 ASP N N 15 120.1660 0.0000 . 1 . . . . . 68 ASP N . 51773 3
119 . 3 . 3 74 74 ILE H H 1 8.3450 0.0000 . 1 . . . . . 69 ILE HN . 51773 3
120 . 3 . 3 74 74 ILE N N 15 118.7840 0.0000 . 1 . . . . . 69 ILE N . 51773 3
121 . 3 . 3 75 75 PHE H H 1 8.5390 0.0000 . 1 . . . . . 70 PHE HN . 51773 3
122 . 3 . 3 75 75 PHE N N 15 120.4250 0.0000 . 1 . . . . . 70 PHE N . 51773 3
123 . 3 . 3 76 76 GLU H H 1 8.3740 0.0000 . 1 . . . . . 71 GLU HN . 51773 3
124 . 3 . 3 76 76 GLU N N 15 118.0660 0.0000 . 1 . . . . . 71 GLU N . 51773 3
125 . 3 . 3 77 77 ARG H H 1 8.4180 0.0000 . 1 . . . . . 72 ARG HN . 51773 3
126 . 3 . 3 77 77 ARG N N 15 120.3170 0.0000 . 1 . . . . . 72 ARG N . 51773 3
127 . 3 . 3 78 78 ILE H H 1 8.2470 0.0000 . 1 . . . . . 73 ILE HN . 51773 3
128 . 3 . 3 78 78 ILE N N 15 119.5770 0.0000 . 1 . . . . . 73 ILE N . 51773 3
129 . 3 . 3 79 79 ALA H H 1 8.6780 0.0000 . 1 . . . . . 74 ALA HN . 51773 3
130 . 3 . 3 79 79 ALA N N 15 122.4580 0.0000 . 1 . . . . . 74 ALA N . 51773 3
131 . 3 . 3 80 80 GLY H H 1 8.1050 0.0000 . 1 . . . . . 75 GLY HN . 51773 3
132 . 3 . 3 80 80 GLY N N 15 104.3750 0.0000 . 1 . . . . . 75 GLY N . 51773 3
133 . 3 . 3 81 81 GLU H H 1 7.5920 0.0000 . 1 . . . . . 76 GLU HN . 51773 3
134 . 3 . 3 81 81 GLU N N 15 124.6030 0.0000 . 1 . . . . . 76 GLU N . 51773 3
135 . 3 . 3 82 82 ALA H H 1 8.7010 0.0000 . 1 . . . . . 77 ALA HN . 51773 3
136 . 3 . 3 82 82 ALA N N 15 122.2920 0.0000 . 1 . . . . . 77 ALA N . 51773 3
137 . 3 . 3 83 83 SER H H 1 8.1980 0.0000 . 1 . . . . . 78 SER HN . 51773 3
138 . 3 . 3 83 83 SER N N 15 111.4640 0.0000 . 1 . . . . . 78 SER N . 51773 3
139 . 3 . 3 84 84 ARG H H 1 7.8100 0.0000 . 1 . . . . . 79 ARG HN . 51773 3
140 . 3 . 3 84 84 ARG N N 15 123.4730 0.0000 . 1 . . . . . 79 ARG N . 51773 3
141 . 3 . 3 85 85 LEU H H 1 8.3370 0.0000 . 1 . . . . . 80 LEU HN . 51773 3
142 . 3 . 3 85 85 LEU N N 15 120.3270 0.0000 . 1 . . . . . 80 LEU N . 51773 3
143 . 3 . 3 87 87 HIS H H 1 8.0100 0.0000 . 1 . . . . . 82 HIS HN . 51773 3
144 . 3 . 3 87 87 HIS N N 15 115.4350 0.0000 . 1 . . . . . 82 HIS N . 51773 3
145 . 3 . 3 89 89 ASN H H 1 7.6110 0.0000 . 1 . . . . . 84 ASN HN . 51773 3
146 . 3 . 3 89 89 ASN N N 15 115.9690 0.0000 . 1 . . . . . 84 ASN N . 51773 3
147 . 3 . 3 91 91 ARG H H 1 8.3610 0.0000 . 1 . . . . . 86 ARG HN . 51773 3
148 . 3 . 3 91 91 ARG N N 15 118.1480 0.0000 . 1 . . . . . 86 ARG N . 51773 3
149 . 3 . 3 92 92 SER H H 1 8.4840 0.0000 . 1 . . . . . 87 SER HN . 51773 3
150 . 3 . 3 92 92 SER N N 15 118.2370 0.0000 . 1 . . . . . 87 SER N . 51773 3
151 . 3 . 3 93 93 THR H H 1 7.4930 0.0000 . 1 . . . . . 88 THR HN . 51773 3
152 . 3 . 3 93 93 THR N N 15 116.6270 0.0000 . 1 . . . . . 88 THR N . 51773 3
153 . 3 . 3 94 94 ILE H H 1 7.6710 0.0000 . 1 . . . . . 89 ILE HN . 51773 3
154 . 3 . 3 94 94 ILE N N 15 124.5240 0.0000 . 1 . . . . . 89 ILE N . 51773 3
155 . 3 . 3 95 95 THR H H 1 9.2520 0.0000 . 1 . . . . . 90 THR HN . 51773 3
156 . 3 . 3 95 95 THR N N 15 121.3840 0.0000 . 1 . . . . . 90 THR N . 51773 3
157 . 3 . 3 96 96 SER H H 1 8.9760 0.0000 . 1 . . . . . 91 SER HN . 51773 3
158 . 3 . 3 96 96 SER N N 15 117.3980 0.0000 . 1 . . . . . 91 SER N . 51773 3
159 . 3 . 3 97 97 ARG H H 1 7.7960 0.0000 . 1 . . . . . 92 ARG HN . 51773 3
160 . 3 . 3 97 97 ARG N N 15 122.7350 0.0000 . 1 . . . . . 92 ARG N . 51773 3
161 . 3 . 3 98 98 GLU H H 1 7.4030 0.0000 . 1 . . . . . 93 GLU HN . 51773 3
162 . 3 . 3 98 98 GLU N N 15 119.6910 0.0000 . 1 . . . . . 93 GLU N . 51773 3
163 . 3 . 3 99 99 ILE H H 1 7.1010 0.0000 . 1 . . . . . 94 ILE HN . 51773 3
164 . 3 . 3 99 99 ILE N N 15 116.5810 0.0000 . 1 . . . . . 94 ILE N . 51773 3
165 . 3 . 3 100 100 GLN H H 1 7.8740 0.0000 . 1 . . . . . 95 GLN HN . 51773 3
166 . 3 . 3 100 100 GLN N N 15 119.9620 0.0000 . 1 . . . . . 95 GLN N . 51773 3
167 . 3 . 3 101 101 THR H H 1 8.0790 0.0000 . 1 . . . . . 96 THR HN . 51773 3
168 . 3 . 3 101 101 THR N N 15 116.0670 0.0000 . 1 . . . . . 96 THR N . 51773 3
169 . 3 . 3 102 102 ALA H H 1 7.8540 0.0000 . 1 . . . . . 97 ALA HN . 51773 3
170 . 3 . 3 102 102 ALA N N 15 123.5030 0.0000 . 1 . . . . . 97 ALA N . 51773 3
171 . 3 . 3 103 103 VAL H H 1 8.4340 0.0000 . 1 . . . . . 98 VAL HN . 51773 3
172 . 3 . 3 103 103 VAL N N 15 118.2180 0.0000 . 1 . . . . . 98 VAL N . 51773 3
173 . 3 . 3 104 104 ARG H H 1 7.8070 0.0000 . 1 . . . . . 99 ARG HN . 51773 3
174 . 3 . 3 104 104 ARG N N 15 117.4420 0.0000 . 1 . . . . . 99 ARG N . 51773 3
175 . 3 . 3 105 105 LEU H H 1 7.7540 0.0000 . 1 . . . . . 100 LEU HN . 51773 3
176 . 3 . 3 105 105 LEU N N 15 118.2420 0.0000 . 1 . . . . . 100 LEU N . 51773 3
177 . 3 . 3 106 106 LEU H H 1 7.8510 0.0000 . 1 . . . . . 101 LEU HN . 51773 3
178 . 3 . 3 106 106 LEU N N 15 117.8220 0.0000 . 1 . . . . . 101 LEU N . 51773 3
179 . 3 . 3 107 107 LEU H H 1 8.1500 0.0000 . 1 . . . . . 102 LEU HN . 51773 3
180 . 3 . 3 107 107 LEU N N 15 120.5250 0.0000 . 1 . . . . . 102 LEU N . 51773 3
181 . 3 . 3 109 109 GLY H H 1 8.0890 0.0000 . 1 . . . . . 104 GLY HN . 51773 3
182 . 3 . 3 109 109 GLY N N 15 105.5380 0.0000 . 1 . . . . . 104 GLY N . 51773 3
183 . 3 . 3 110 110 GLU H H 1 10.2550 0.0000 . 1 . . . . . 105 GLU HN . 51773 3
184 . 3 . 3 110 110 GLU N N 15 129.5310 0.0000 . 1 . . . . . 105 GLU N . 51773 3
185 . 3 . 3 111 111 LEU H H 1 8.8930 0.0000 . 1 . . . . . 106 LEU HN . 51773 3
186 . 3 . 3 111 111 LEU N N 15 123.8130 0.0000 . 1 . . . . . 106 LEU N . 51773 3
187 . 3 . 3 112 112 ALA H H 1 7.9100 0.0000 . 1 . . . . . 107 ALA HN . 51773 3
188 . 3 . 3 112 112 ALA N N 15 119.4410 0.0000 . 1 . . . . . 107 ALA N . 51773 3
189 . 3 . 3 113 113 LYS H H 1 7.3240 0.0000 . 1 . . . . . 108 LYS HN . 51773 3
190 . 3 . 3 113 113 LYS N N 15 117.1360 0.0000 . 1 . . . . . 108 LYS N . 51773 3
191 . 3 . 3 114 114 HIS H H 1 8.0620 0.0000 . 1 . . . . . 109 HIS HN . 51773 3
192 . 3 . 3 114 114 HIS N N 15 118.0170 0.0000 . 1 . . . . . 109 HIS N . 51773 3
193 . 3 . 3 115 115 ALA H H 1 8.6270 0.0000 . 1 . . . . . 110 ALA HN . 51773 3
194 . 3 . 3 115 115 ALA N N 15 123.7680 0.0000 . 1 . . . . . 110 ALA N . 51773 3
195 . 3 . 3 116 116 VAL H H 1 8.2150 0.0000 . 1 . . . . . 111 VAL HN . 51773 3
196 . 3 . 3 116 116 VAL N N 15 117.3750 0.0000 . 1 . . . . . 111 VAL N . 51773 3
197 . 3 . 3 117 117 SER H H 1 7.4360 0.0000 . 1 . . . . . 112 SER HN . 51773 3
198 . 3 . 3 117 117 SER N N 15 117.8160 0.0000 . 1 . . . . . 112 SER N . 51773 3
199 . 3 . 3 118 118 GLU H H 1 8.0930 0.0000 . 1 . . . . . 113 GLU HN . 51773 3
200 . 3 . 3 118 118 GLU N N 15 119.8550 0.0000 . 1 . . . . . 113 GLU N . 51773 3
201 . 3 . 3 119 119 GLY H H 1 8.6220 0.0000 . 1 . . . . . 114 GLY HN . 51773 3
202 . 3 . 3 119 119 GLY N N 15 109.8530 0.0000 . 1 . . . . . 114 GLY N . 51773 3
203 . 3 . 3 120 120 THR H H 1 7.9340 0.0000 . 1 . . . . . 115 THR HN . 51773 3
204 . 3 . 3 120 120 THR N N 15 117.0200 0.0000 . 1 . . . . . 115 THR N . 51773 3
205 . 3 . 3 121 121 LYS H H 1 7.8870 0.0000 . 1 . . . . . 116 LYS HN . 51773 3
206 . 3 . 3 121 121 LYS N N 15 123.2790 0.0000 . 1 . . . . . 116 LYS N . 51773 3
207 . 3 . 3 122 122 ALA H H 1 7.6440 0.0000 . 1 . . . . . 117 ALA HN . 51773 3
208 . 3 . 3 122 122 ALA N N 15 121.9150 0.0000 . 1 . . . . . 117 ALA N . 51773 3
209 . 3 . 3 123 123 VAL H H 1 8.0520 0.0000 . 1 . . . . . 118 VAL HN . 51773 3
210 . 3 . 3 123 123 VAL N N 15 118.2260 0.0000 . 1 . . . . . 118 VAL N . 51773 3
211 . 3 . 3 125 125 LYS H H 1 7.8530 0.0000 . 1 . . . . . 120 LYS HN . 51773 3
212 . 3 . 3 125 125 LYS N N 15 121.8640 0.0000 . 1 . . . . . 120 LYS N . 51773 3
213 . 3 . 3 126 126 TYR H H 1 8.2110 0.0000 . 1 . . . . . 121 TYR HN . 51773 3
214 . 3 . 3 126 126 TYR N N 15 118.6520 0.0000 . 1 . . . . . 121 TYR N . 51773 3
215 . 3 . 3 127 127 THR H H 1 7.9650 0.0000 . 1 . . . . . 122 THR HN . 51773 3
216 . 3 . 3 127 127 THR N N 15 112.4530 0.0000 . 1 . . . . . 122 THR N . 51773 3
217 . 3 . 3 128 128 SER H H 1 7.8800 0.0000 . 1 . . . . . 123 SER HN . 51773 3
218 . 3 . 3 128 128 SER N N 15 117.7420 0.0000 . 1 . . . . . 123 SER N . 51773 3
219 . 3 . 3 129 129 ALA H H 1 7.9880 0.0000 . 1 . . . . . 124 ALA HN . 51773 3
220 . 3 . 3 129 129 ALA N N 15 126.8230 0.0000 . 1 . . . . . 124 ALA N . 51773 3
221 . 3 . 3 130 130 LYS H H 1 7.8050 0.0000 . 1 . . . . . 125 LYS HN . 51773 3
222 . 3 . 3 130 130 LYS N N 15 126.4390 0.0000 . 1 . . . . . 125 LYS N . 51773 3
stop_
save_