###################################
# 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_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 19686
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_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 HSQC' . . . 19686 1
2 '3D HNCACB' . . . 19686 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 ALA CA C 13 53.068 0.2 . 1 . . . . 80 ALA CA . 19686 1
2 . 1 1 2 2 ALA CB C 13 19.908 0.2 . 1 . . . . 80 ALA CB . 19686 1
3 . 1 1 3 3 MET H H 1 8.524 0.02 . 1 . . . . 81 MET HN . 19686 1
4 . 1 1 3 3 MET CA C 13 55.789 0.2 . 1 . . . . 81 MET CA . 19686 1
5 . 1 1 3 3 MET CB C 13 33.37 0.2 . 1 . . . . 81 MET CB . 19686 1
6 . 1 1 3 3 MET N N 15 119.473 0.2 . 1 . . . . 81 MET N . 19686 1
7 . 1 1 4 4 GLY H H 1 8.207 0.02 . 1 . . . . 82 GLY HN . 19686 1
8 . 1 1 4 4 GLY CA C 13 44.894 0.2 . 1 . . . . 82 GLY CA . 19686 1
9 . 1 1 4 4 GLY N N 15 110.106 0.2 . 1 . . . . 82 GLY N . 19686 1
10 . 1 1 5 5 PRO CA C 13 63.594 0.2 . 1 . . . . 83 PRO CA . 19686 1
11 . 1 1 5 5 PRO CB C 13 32.747 0.2 . 1 . . . . 83 PRO CB . 19686 1
12 . 1 1 6 6 VAL H H 1 8.246 0.02 . 1 . . . . 84 VAL HN . 19686 1
13 . 1 1 6 6 VAL CA C 13 62.686 0.2 . 1 . . . . 84 VAL CA . 19686 1
14 . 1 1 6 6 VAL CB C 13 33.461 0.2 . 1 . . . . 84 VAL CB . 19686 1
15 . 1 1 6 6 VAL N N 15 120.452 0.2 . 1 . . . . 84 VAL N . 19686 1
16 . 1 1 7 7 ALA H H 1 8.484 0.02 . 1 . . . . 85 ALA HN . 19686 1
17 . 1 1 7 7 ALA CA C 13 50.784 0.2 . 1 . . . . 85 ALA CA . 19686 1
18 . 1 1 7 7 ALA CB C 13 18.864 0.2 . 1 . . . . 85 ALA CB . 19686 1
19 . 1 1 7 7 ALA N N 15 129.346 0.2 . 1 . . . . 85 ALA N . 19686 1
20 . 1 1 8 8 PRO CA C 13 63.806 0.2 . 1 . . . . 86 PRO CA . 19686 1
21 . 1 1 8 8 PRO CB C 13 32.479 0.2 . 1 . . . . 86 PRO CB . 19686 1
22 . 1 1 9 9 ASN H H 1 8.481 0.02 . 1 . . . . 87 ASN HN . 19686 1
23 . 1 1 9 9 ASN CA C 13 53.843 0.2 . 1 . . . . 87 ASN CA . 19686 1
24 . 1 1 9 9 ASN CB C 13 39.273 0.2 . 1 . . . . 87 ASN CB . 19686 1
25 . 1 1 9 9 ASN N N 15 117.723 0.2 . 1 . . . . 87 ASN N . 19686 1
26 . 1 1 10 10 ASP H H 1 8.244 0.02 . 1 . . . . 88 ASP HN . 19686 1
27 . 1 1 10 10 ASP CA C 13 54.904 0.2 . 1 . . . . 88 ASP CA . 19686 1
28 . 1 1 10 10 ASP CB C 13 41.646 0.2 . 1 . . . . 88 ASP CB . 19686 1
29 . 1 1 10 10 ASP N N 15 120.458 0.2 . 1 . . . . 88 ASP N . 19686 1
30 . 1 1 11 11 ARG H H 1 8.295 0.02 . 1 . . . . 89 ARG HN . 19686 1
31 . 1 1 11 11 ARG CA C 13 56.663 0.2 . 1 . . . . 89 ARG CA . 19686 1
32 . 1 1 11 11 ARG CB C 13 30.923 0.2 . 1 . . . . 89 ARG CB . 19686 1
33 . 1 1 11 11 ARG N N 15 120.939 0.2 . 1 . . . . 89 ARG N . 19686 1
34 . 1 1 12 12 SER H H 1 8.438 0.02 . 1 . . . . 90 SER HN . 19686 1
35 . 1 1 12 12 SER CA C 13 59.416 0.2 . 1 . . . . 90 SER CA . 19686 1
36 . 1 1 12 12 SER CB C 13 64.211 0.2 . 1 . . . . 90 SER CB . 19686 1
37 . 1 1 12 12 SER N N 15 116.519 0.2 . 1 . . . . 90 SER N . 19686 1
38 . 1 1 13 13 THR H H 1 8.194 0.02 . 1 . . . . 91 THR HN . 19686 1
39 . 1 1 13 13 THR CA C 13 62.213 0.2 . 1 . . . . 91 THR CA . 19686 1
40 . 1 1 13 13 THR CB C 13 69.952 0.2 . 1 . . . . 91 THR CB . 19686 1
41 . 1 1 13 13 THR N N 15 114.993 0.2 . 1 . . . . 91 THR N . 19686 1
42 . 1 1 15 15 SER CA C 13 58.842 0.2 . 1 . . . . 93 SER CA . 19686 1
43 . 1 1 15 15 SER CB C 13 64.475 0.2 . 1 . . . . 93 SER CB . 19686 1
44 . 1 1 16 16 SER H H 1 8.32 0.02 . 1 . . . . 94 SER HN . 19686 1
45 . 1 1 16 16 SER CA C 13 58.886 0.2 . 1 . . . . 94 SER CA . 19686 1
46 . 1 1 16 16 SER CB C 13 64.306 0.2 . 1 . . . . 94 SER CB . 19686 1
47 . 1 1 16 16 SER N N 15 117.755 0.2 . 1 . . . . 94 SER N . 19686 1
48 . 1 1 17 17 SER H H 1 8.431 0.02 . 1 . . . . 95 SER HN . 19686 1
49 . 1 1 17 17 SER CA C 13 58.972 0.2 . 1 . . . . 95 SER CA . 19686 1
50 . 1 1 17 17 SER CB C 13 64.253 0.2 . 1 . . . . 95 SER CB . 19686 1
51 . 1 1 17 17 SER N N 15 117.66 0.2 . 1 . . . . 95 SER N . 19686 1
52 . 1 1 18 18 THR H H 1 8.249 0.02 . 1 . . . . 96 THR HN . 19686 1
53 . 1 1 18 18 THR CA C 13 62.464 0.2 . 1 . . . . 96 THR CA . 19686 1
54 . 1 1 18 18 THR CB C 13 69.87 0.2 . 1 . . . . 96 THR CB . 19686 1
55 . 1 1 18 18 THR N N 15 114.692 0.2 . 1 . . . . 96 THR N . 19686 1
56 . 1 1 19 19 ASP H H 1 8.286 0.02 . 1 . . . . 97 ASP HN . 19686 1
57 . 1 1 19 19 ASP CA C 13 54.978 0.2 . 1 . . . . 97 ASP CA . 19686 1
58 . 1 1 19 19 ASP CB C 13 41.959 0.2 . 1 . . . . 97 ASP CB . 19686 1
59 . 1 1 19 19 ASP N N 15 122.185 0.2 . 1 . . . . 97 ASP N . 19686 1
60 . 1 1 20 20 GLY H H 1 8.13 0.02 . 1 . . . . 98 GLY HN . 19686 1
61 . 1 1 20 20 GLY CA C 13 45.518 0.2 . 1 . . . . 98 GLY CA . 19686 1
62 . 1 1 20 20 GLY N N 15 108.637 0.2 . 1 . . . . 98 GLY N . 19686 1
63 . 1 1 21 21 PRO CA C 13 63.882 0.2 . 1 . . . . 99 PRO CA . 19686 1
64 . 1 1 21 21 PRO CB C 13 32.723 0.2 . 1 . . . . 99 PRO CB . 19686 1
65 . 1 1 22 22 ARG H H 1 8.293 0.02 . 1 . . . . 100 ARG HN . 19686 1
66 . 1 1 22 22 ARG CA C 13 55.793 0.2 . 1 . . . . 100 ARG CA . 19686 1
67 . 1 1 22 22 ARG CB C 13 32.877 0.2 . 1 . . . . 100 ARG CB . 19686 1
68 . 1 1 22 22 ARG N N 15 117.992 0.2 . 1 . . . . 100 ARG N . 19686 1
69 . 1 1 23 23 ARG H H 1 8.204 0.02 . 1 . . . . 101 ARG HN . 19686 1
70 . 1 1 23 23 ARG CA C 13 55.633 0.2 . 1 . . . . 101 ARG CA . 19686 1
71 . 1 1 23 23 ARG CB C 13 32.811 0.2 . 1 . . . . 101 ARG CB . 19686 1
72 . 1 1 23 23 ARG N N 15 123.794 0.2 . 1 . . . . 101 ARG N . 19686 1
73 . 1 1 24 24 LEU H H 1 9.705 0.02 . 1 . . . . 102 LEU HN . 19686 1
74 . 1 1 24 24 LEU CA C 13 53.934 0.2 . 1 . . . . 102 LEU CA . 19686 1
75 . 1 1 24 24 LEU CB C 13 44.776 0.2 . 1 . . . . 102 LEU CB . 19686 1
76 . 1 1 24 24 LEU N N 15 127.34 0.2 . 1 . . . . 102 LEU N . 19686 1
77 . 1 1 25 25 HIS H H 1 9.222 0.02 . 1 . . . . 103 HIS HN . 19686 1
78 . 1 1 25 25 HIS CA C 13 55.282 0.2 . 1 . . . . 103 HIS CA . 19686 1
79 . 1 1 25 25 HIS CB C 13 35.267 0.2 . 1 . . . . 103 HIS CB . 19686 1
80 . 1 1 25 25 HIS N N 15 123.852 0.2 . 1 . . . . 103 HIS N . 19686 1
81 . 1 1 26 26 VAL H H 1 8.344 0.02 . 1 . . . . 104 VAL HN . 19686 1
82 . 1 1 26 26 VAL CA C 13 60.091 0.2 . 1 . . . . 104 VAL CA . 19686 1
83 . 1 1 26 26 VAL CB C 13 33.576 0.2 . 1 . . . . 104 VAL CB . 19686 1
84 . 1 1 26 26 VAL N N 15 126.612 0.2 . 1 . . . . 104 VAL N . 19686 1
85 . 1 1 27 27 SER H H 1 9.038 0.02 . 1 . . . . 105 SER HN . 19686 1
86 . 1 1 27 27 SER CA C 13 56.27 0.2 . 1 . . . . 105 SER CA . 19686 1
87 . 1 1 27 27 SER CB C 13 65.229 0.2 . 1 . . . . 105 SER CB . 19686 1
88 . 1 1 27 27 SER N N 15 117.825 0.2 . 1 . . . . 105 SER N . 19686 1
89 . 1 1 28 28 ASN H H 1 7.603 0.02 . 1 . . . . 106 ASN HN . 19686 1
90 . 1 1 28 28 ASN CA C 13 54.768 0.2 . 1 . . . . 106 ASN CA . 19686 1
91 . 1 1 28 28 ASN CB C 13 38.311 0.2 . 1 . . . . 106 ASN CB . 19686 1
92 . 1 1 28 28 ASN N N 15 119.365 0.2 . 1 . . . . 106 ASN N . 19686 1
93 . 1 1 29 29 ILE H H 1 7.236 0.02 . 1 . . . . 107 ILE HN . 19686 1
94 . 1 1 29 29 ILE CA C 13 59.839 0.2 . 1 . . . . 107 ILE CA . 19686 1
95 . 1 1 29 29 ILE CB C 13 36.993 0.2 . 1 . . . . 107 ILE CB . 19686 1
96 . 1 1 29 29 ILE N N 15 107.026 0.2 . 1 . . . . 107 ILE N . 19686 1
97 . 1 1 30 30 PRO CA C 13 63.808 0.2 . 1 . . . . 108 PRO CA . 19686 1
98 . 1 1 30 30 PRO CB C 13 32.832 0.2 . 1 . . . . 108 PRO CB . 19686 1
99 . 1 1 31 31 PHE H H 1 9.253 0.02 . 1 . . . . 109 PHE HN . 19686 1
100 . 1 1 31 31 PHE CA C 13 57.785 0.2 . 1 . . . . 109 PHE CA . 19686 1
101 . 1 1 31 31 PHE CB C 13 37.677 0.2 . 1 . . . . 109 PHE CB . 19686 1
102 . 1 1 31 31 PHE N N 15 128.361 0.2 . 1 . . . . 109 PHE N . 19686 1
103 . 1 1 32 32 LYS H H 1 8.456 0.02 . 1 . . . . 110 LYS HN . 19686 1
104 . 1 1 32 32 LYS CA C 13 57.717 0.2 . 1 . . . . 110 LYS CA . 19686 1
105 . 1 1 32 32 LYS CB C 13 32.865 0.2 . 1 . . . . 110 LYS CB . 19686 1
106 . 1 1 32 32 LYS N N 15 112.319 0.2 . 1 . . . . 110 LYS N . 19686 1
107 . 1 1 33 33 TYR H H 1 7.706 0.02 . 1 . . . . 111 TYR HN . 19686 1
108 . 1 1 33 33 TYR CA C 13 58.87 0.2 . 1 . . . . 111 TYR CA . 19686 1
109 . 1 1 33 33 TYR CB C 13 37.749 0.2 . 1 . . . . 111 TYR CB . 19686 1
110 . 1 1 33 33 TYR N N 15 120.059 0.2 . 1 . . . . 111 TYR N . 19686 1
111 . 1 1 34 34 ARG H H 1 9.904 0.02 . 1 . . . . 112 ARG HN . 19686 1
112 . 1 1 34 34 ARG CA C 13 52.887 0.2 . 1 . . . . 112 ARG CA . 19686 1
113 . 1 1 34 34 ARG CB C 13 33.743 0.2 . 1 . . . . 112 ARG CB . 19686 1
114 . 1 1 34 34 ARG N N 15 124.024 0.2 . 1 . . . . 112 ARG N . 19686 1
115 . 1 1 35 35 GLU H H 1 10.48 0.02 . 1 . . . . 113 GLU HN . 19686 1
116 . 1 1 35 35 GLU CA C 13 63.93 0.2 . 1 . . . . 113 GLU CA . 19686 1
117 . 1 1 35 35 GLU CB C 13 26.805 0.2 . 1 . . . . 113 GLU CB . 19686 1
118 . 1 1 35 35 GLU N N 15 122.605 0.2 . 1 . . . . 113 GLU N . 19686 1
119 . 1 1 36 36 PRO CA C 13 66.512 0.2 . 1 . . . . 114 PRO CA . 19686 1
120 . 1 1 36 36 PRO CB C 13 31.675 0.2 . 1 . . . . 114 PRO CB . 19686 1
121 . 1 1 37 37 ASP H H 1 7.321 0.02 . 1 . . . . 115 ASP HN . 19686 1
122 . 1 1 37 37 ASP CA C 13 57.166 0.2 . 1 . . . . 115 ASP CA . 19686 1
123 . 1 1 37 37 ASP CB C 13 41.07 0.2 . 1 . . . . 115 ASP CB . 19686 1
124 . 1 1 37 37 ASP N N 15 115.036 0.2 . 1 . . . . 115 ASP N . 19686 1
125 . 1 1 38 38 LEU H H 1 7.363 0.02 . 1 . . . . 116 LEU HN . 19686 1
126 . 1 1 38 38 LEU CA C 13 57.535 0.2 . 1 . . . . 116 LEU CA . 19686 1
127 . 1 1 38 38 LEU CB C 13 43.18 0.2 . 1 . . . . 116 LEU CB . 19686 1
128 . 1 1 38 38 LEU N N 15 118.68 0.2 . 1 . . . . 116 LEU N . 19686 1
129 . 1 1 39 39 THR H H 1 8.581 0.02 . 1 . . . . 117 THR HN . 19686 1
130 . 1 1 39 39 THR CA C 13 68.673 0.2 . 1 . . . . 117 THR CA . 19686 1
131 . 1 1 39 39 THR N N 15 116.623 0.2 . 1 . . . . 117 THR N . 19686 1
132 . 1 1 40 40 ALA H H 1 7.707 0.02 . 1 . . . . 118 ALA HN . 19686 1
133 . 1 1 40 40 ALA CA C 13 55.455 0.2 . 1 . . . . 118 ALA CA . 19686 1
134 . 1 1 40 40 ALA CB C 13 18.633 0.2 . 1 . . . . 118 ALA CB . 19686 1
135 . 1 1 40 40 ALA N N 15 120.127 0.2 . 1 . . . . 118 ALA N . 19686 1
136 . 1 1 41 41 MET H H 1 7.202 0.02 . 1 . . . . 119 MET HN . 19686 1
137 . 1 1 41 41 MET CA C 13 59.221 0.2 . 1 . . . . 119 MET CA . 19686 1
138 . 1 1 41 41 MET CB C 13 33.297 0.2 . 1 . . . . 119 MET CB . 19686 1
139 . 1 1 41 41 MET N N 15 115.125 0.2 . 1 . . . . 119 MET N . 19686 1
140 . 1 1 42 42 PHE H H 1 7.944 0.02 . 1 . . . . 120 PHE HN . 19686 1
141 . 1 1 42 42 PHE CA C 13 63.13 0.2 . 1 . . . . 120 PHE CA . 19686 1
142 . 1 1 42 42 PHE CB C 13 39.93 0.2 . 1 . . . . 120 PHE CB . 19686 1
143 . 1 1 42 42 PHE N N 15 114.414 0.2 . 1 . . . . 120 PHE N . 19686 1
144 . 1 1 43 43 GLU H H 1 8.828 0.02 . 1 . . . . 121 GLU HN . 19686 1
145 . 1 1 43 43 GLU CA C 13 58.627 0.2 . 1 . . . . 121 GLU CA . 19686 1
146 . 1 1 43 43 GLU CB C 13 29.565 0.2 . 1 . . . . 121 GLU CB . 19686 1
147 . 1 1 43 43 GLU N N 15 120.497 0.2 . 1 . . . . 121 GLU N . 19686 1
148 . 1 1 44 44 LYS H H 1 7.091 0.02 . 1 . . . . 122 LYS HN . 19686 1
149 . 1 1 44 44 LYS CA C 13 59.001 0.2 . 1 . . . . 122 LYS CA . 19686 1
150 . 1 1 44 44 LYS CB C 13 33.1 0.2 . 1 . . . . 122 LYS CB . 19686 1
151 . 1 1 44 44 LYS N N 15 116.784 0.2 . 1 . . . . 122 LYS N . 19686 1
152 . 1 1 45 45 VAL H H 1 7.973 0.02 . 1 . . . . 123 VAL HN . 19686 1
153 . 1 1 45 45 VAL CA C 13 64.748 0.2 . 1 . . . . 123 VAL CA . 19686 1
154 . 1 1 45 45 VAL CB C 13 32.967 0.2 . 1 . . . . 123 VAL CB . 19686 1
155 . 1 1 45 45 VAL N N 15 117.826 0.2 . 1 . . . . 123 VAL N . 19686 1
156 . 1 1 46 46 GLY H H 1 7.867 0.02 . 1 . . . . 124 GLY HN . 19686 1
157 . 1 1 46 46 GLY CA C 13 46.203 0.2 . 1 . . . . 124 GLY CA . 19686 1
158 . 1 1 46 46 GLY N N 15 106.431 0.2 . 1 . . . . 124 GLY N . 19686 1
159 . 1 1 47 47 PRO CA C 13 63.93 0.2 . 1 . . . . 125 PRO CA . 19686 1
160 . 1 1 47 47 PRO CB C 13 32.413 0.2 . 1 . . . . 125 PRO CB . 19686 1
161 . 1 1 48 48 VAL H H 1 9.019 0.02 . 1 . . . . 126 VAL HN . 19686 1
162 . 1 1 48 48 VAL CA C 13 62.285 0.2 . 1 . . . . 126 VAL CA . 19686 1
163 . 1 1 48 48 VAL CB C 13 35.426 0.2 . 1 . . . . 126 VAL CB . 19686 1
164 . 1 1 48 48 VAL N N 15 124.806 0.2 . 1 . . . . 126 VAL N . 19686 1
165 . 1 1 49 49 VAL H H 1 8.938 0.02 . 1 . . . . 127 VAL HN . 19686 1
166 . 1 1 49 49 VAL CA C 13 63.07 0.2 . 1 . . . . 127 VAL CA . 19686 1
167 . 1 1 49 49 VAL CB C 13 33.787 0.2 . 1 . . . . 127 VAL CB . 19686 1
168 . 1 1 49 49 VAL N N 15 122.857 0.2 . 1 . . . . 127 VAL N . 19686 1
169 . 1 1 50 50 ASP H H 1 7.558 0.02 . 1 . . . . 128 ASP HN . 19686 1
170 . 1 1 50 50 ASP CA C 13 55.203 0.2 . 1 . . . . 128 ASP CA . 19686 1
171 . 1 1 50 50 ASP CB C 13 45.281 0.2 . 1 . . . . 128 ASP CB . 19686 1
172 . 1 1 50 50 ASP N N 15 116.938 0.2 . 1 . . . . 128 ASP N . 19686 1
173 . 1 1 51 51 VAL H H 1 8.069 0.02 . 1 . . . . 129 VAL HN . 19686 1
174 . 1 1 51 51 VAL CA C 13 61.316 0.2 . 1 . . . . 129 VAL CA . 19686 1
175 . 1 1 51 51 VAL CB C 13 36.133 0.2 . 1 . . . . 129 VAL CB . 19686 1
176 . 1 1 51 51 VAL N N 15 118.631 0.2 . 1 . . . . 129 VAL N . 19686 1
177 . 1 1 52 52 GLU H H 1 8.962 0.02 . 1 . . . . 130 GLU HN . 19686 1
178 . 1 1 52 52 GLU CA C 13 56.365 0.2 . 1 . . . . 130 GLU CA . 19686 1
179 . 1 1 52 52 GLU CB C 13 35.004 0.2 . 1 . . . . 130 GLU CB . 19686 1
180 . 1 1 52 52 GLU N N 15 125.677 0.2 . 1 . . . . 130 GLU N . 19686 1
181 . 1 1 53 53 ILE CA C 13 60.107 0.2 . 1 . . . . 131 ILE CA . 19686 1
182 . 1 1 53 53 ILE CB C 13 38.789 0.2 . 1 . . . . 131 ILE CB . 19686 1
183 . 1 1 54 54 ILE H H 1 7.283 0.02 . 1 . . . . 132 ILE HN . 19686 1
184 . 1 1 54 54 ILE CA C 13 58.271 0.2 . 1 . . . . 132 ILE CA . 19686 1
185 . 1 1 54 54 ILE CB C 13 34.272 0.2 . 1 . . . . 132 ILE CB . 19686 1
186 . 1 1 54 54 ILE N N 15 125.36 0.2 . 1 . . . . 132 ILE N . 19686 1
187 . 1 1 55 55 PHE H H 1 8.63 0.02 . 1 . . . . 133 PHE HN . 19686 1
188 . 1 1 55 55 PHE CA C 13 56.737 0.2 . 1 . . . . 133 PHE CA . 19686 1
189 . 1 1 55 55 PHE CB C 13 43.692 0.2 . 1 . . . . 133 PHE CB . 19686 1
190 . 1 1 55 55 PHE N N 15 124.94 0.2 . 1 . . . . 133 PHE N . 19686 1
191 . 1 1 56 56 ASN H H 1 8.592 0.02 . 1 . . . . 134 ASN HN . 19686 1
192 . 1 1 56 56 ASN CA C 13 52.444 0.2 . 1 . . . . 134 ASN CA . 19686 1
193 . 1 1 56 56 ASN CB C 13 39.664 0.2 . 1 . . . . 134 ASN CB . 19686 1
194 . 1 1 56 56 ASN N N 15 115.335 0.2 . 1 . . . . 134 ASN N . 19686 1
195 . 1 1 57 57 GLU H H 1 9.408 0.02 . 1 . . . . 135 GLU HN . 19686 1
196 . 1 1 57 57 GLU CA C 13 59.763 0.2 . 1 . . . . 135 GLU CA . 19686 1
197 . 1 1 57 57 GLU CB C 13 29.047 0.2 . 1 . . . . 135 GLU CB . 19686 1
198 . 1 1 57 57 GLU N N 15 118.687 0.2 . 1 . . . . 135 GLU N . 19686 1
199 . 1 1 58 58 ARG H H 1 7.756 0.02 . 1 . . . . 136 ARG HN . 19686 1
200 . 1 1 58 58 ARG CA C 13 56.724 0.2 . 1 . . . . 136 ARG CA . 19686 1
201 . 1 1 58 58 ARG CB C 13 31.652 0.2 . 1 . . . . 136 ARG CB . 19686 1
202 . 1 1 58 58 ARG N N 15 116.972 0.2 . 1 . . . . 136 ARG N . 19686 1
203 . 1 1 59 59 GLY H H 1 7.826 0.02 . 1 . . . . 137 GLY HN . 19686 1
204 . 1 1 59 59 GLY CA C 13 43.638 0.2 . 1 . . . . 137 GLY CA . 19686 1
205 . 1 1 59 59 GLY N N 15 106.231 0.2 . 1 . . . . 137 GLY N . 19686 1
206 . 1 1 60 60 SER H H 1 7.979 0.02 . 1 . . . . 138 SER HN . 19686 1
207 . 1 1 60 60 SER CA C 13 58.66 0.2 . 1 . . . . 138 SER CA . 19686 1
208 . 1 1 60 60 SER CB C 13 64.255 0.2 . 1 . . . . 138 SER CB . 19686 1
209 . 1 1 60 60 SER N N 15 114.717 0.2 . 1 . . . . 138 SER N . 19686 1
210 . 1 1 61 61 LYS H H 1 9.43 0.02 . 1 . . . . 139 LYS HN . 19686 1
211 . 1 1 61 61 LYS CA C 13 57.943 0.2 . 1 . . . . 139 LYS CA . 19686 1
212 . 1 1 61 61 LYS CB C 13 31.207 0.2 . 1 . . . . 139 LYS CB . 19686 1
213 . 1 1 61 61 LYS N N 15 123.764 0.2 . 1 . . . . 139 LYS N . 19686 1
214 . 1 1 62 62 GLY H H 1 9.606 0.02 . 1 . . . . 140 GLY HN . 19686 1
215 . 1 1 62 62 GLY CA C 13 46.648 0.2 . 1 . . . . 140 GLY CA . 19686 1
216 . 1 1 62 62 GLY N N 15 106.93 0.2 . 1 . . . . 140 GLY N . 19686 1
217 . 1 1 63 63 PHE H H 1 7.391 0.02 . 1 . . . . 141 PHE HN . 19686 1
218 . 1 1 63 63 PHE CA C 13 55.484 0.2 . 1 . . . . 141 PHE CA . 19686 1
219 . 1 1 63 63 PHE CB C 13 42.438 0.2 . 1 . . . . 141 PHE CB . 19686 1
220 . 1 1 63 63 PHE N N 15 112.987 0.2 . 1 . . . . 141 PHE N . 19686 1
221 . 1 1 64 64 GLY H H 1 8.781 0.02 . 1 . . . . 142 GLY HN . 19686 1
222 . 1 1 64 64 GLY CA C 13 45.899 0.2 . 1 . . . . 142 GLY CA . 19686 1
223 . 1 1 64 64 GLY N N 15 105.063 0.2 . 1 . . . . 142 GLY N . 19686 1
224 . 1 1 65 65 PHE H H 1 9.082 0.02 . 1 . . . . 143 PHE HN . 19686 1
225 . 1 1 65 65 PHE CA C 13 56.594 0.2 . 1 . . . . 143 PHE CA . 19686 1
226 . 1 1 65 65 PHE CB C 13 44.022 0.2 . 1 . . . . 143 PHE CB . 19686 1
227 . 1 1 65 65 PHE N N 15 116.126 0.2 . 1 . . . . 143 PHE N . 19686 1
228 . 1 1 66 66 VAL H H 1 8.733 0.02 . 1 . . . . 144 VAL HN . 19686 1
229 . 1 1 66 66 VAL CA C 13 60.564 0.2 . 1 . . . . 144 VAL CA . 19686 1
230 . 1 1 66 66 VAL CB C 13 37.112 0.2 . 1 . . . . 144 VAL CB . 19686 1
231 . 1 1 66 66 VAL N N 15 118.003 0.2 . 1 . . . . 144 VAL N . 19686 1
232 . 1 1 67 67 THR H H 1 9.317 0.02 . 1 . . . . 145 THR HN . 19686 1
233 . 1 1 67 67 THR CA C 13 62.24 0.2 . 1 . . . . 145 THR CA . 19686 1
234 . 1 1 67 67 THR CB C 13 69.392 0.2 . 1 . . . . 145 THR CB . 19686 1
235 . 1 1 67 67 THR N N 15 123.73 0.2 . 1 . . . . 145 THR N . 19686 1
236 . 1 1 68 68 MET H H 1 8.795 0.02 . 1 . . . . 146 MET HN . 19686 1
237 . 1 1 68 68 MET CA C 13 53.604 0.2 . 1 . . . . 146 MET CA . 19686 1
238 . 1 1 68 68 MET CB C 13 31.432 0.2 . 1 . . . . 146 MET CB . 19686 1
239 . 1 1 68 68 MET N N 15 126.109 0.2 . 1 . . . . 146 MET N . 19686 1
240 . 1 1 69 69 GLN H H 1 8.353 0.02 . 1 . . . . 147 GLN HN . 19686 1
241 . 1 1 69 69 GLN CA C 13 59.832 0.2 . 1 . . . . 147 GLN CA . 19686 1
242 . 1 1 69 69 GLN CB C 13 30.584 0.2 . 1 . . . . 147 GLN CB . 19686 1
243 . 1 1 69 69 GLN N N 15 120.648 0.2 . 1 . . . . 147 GLN N . 19686 1
244 . 1 1 70 70 ASN H H 1 9.106 0.02 . 1 . . . . 148 ASN HN . 19686 1
245 . 1 1 70 70 ASN CA C 13 50.186 0.2 . 1 . . . . 148 ASN CA . 19686 1
246 . 1 1 70 70 ASN CB C 13 40.192 0.2 . 1 . . . . 148 ASN CB . 19686 1
247 . 1 1 70 70 ASN N N 15 114.753 0.2 . 1 . . . . 148 ASN N . 19686 1
248 . 1 1 71 71 PRO CA C 13 66.143 0.2 . 1 . . . . 149 PRO CA . 19686 1
249 . 1 1 71 71 PRO CB C 13 32.287 0.2 . 1 . . . . 149 PRO CB . 19686 1
250 . 1 1 72 72 ASP H H 1 8.653 0.02 . 1 . . . . 150 ASP HN . 19686 1
251 . 1 1 72 72 ASP CA C 13 57.512 0.2 . 1 . . . . 150 ASP CA . 19686 1
252 . 1 1 72 72 ASP CB C 13 40.248 0.2 . 1 . . . . 150 ASP CB . 19686 1
253 . 1 1 72 72 ASP N N 15 117.41 0.2 . 1 . . . . 150 ASP N . 19686 1
254 . 1 1 73 73 ASP H H 1 7.6 0.02 . 1 . . . . 151 ASP HN . 19686 1
255 . 1 1 73 73 ASP CA C 13 57.032 0.2 . 1 . . . . 151 ASP CA . 19686 1
256 . 1 1 73 73 ASP CB C 13 40.427 0.2 . 1 . . . . 151 ASP CB . 19686 1
257 . 1 1 73 73 ASP N N 15 119.776 0.2 . 1 . . . . 151 ASP N . 19686 1
258 . 1 1 74 74 ALA H H 1 7.68 0.02 . 1 . . . . 152 ALA HN . 19686 1
259 . 1 1 74 74 ALA CA C 13 56.397 0.2 . 1 . . . . 152 ALA CA . 19686 1
260 . 1 1 74 74 ALA CB C 13 18.042 0.2 . 1 . . . . 152 ALA CB . 19686 1
261 . 1 1 74 74 ALA N N 15 122.543 0.2 . 1 . . . . 152 ALA N . 19686 1
262 . 1 1 75 75 ASP H H 1 7.87 0.02 . 1 . . . . 153 ASP HN . 19686 1
263 . 1 1 75 75 ASP CA C 13 58.456 0.2 . 1 . . . . 153 ASP CA . 19686 1
264 . 1 1 75 75 ASP CB C 13 41.312 0.2 . 1 . . . . 153 ASP CB . 19686 1
265 . 1 1 75 75 ASP N N 15 118.043 0.2 . 1 . . . . 153 ASP N . 19686 1
266 . 1 1 76 76 ARG H H 1 8.019 0.02 . 1 . . . . 154 ARG HN . 19686 1
267 . 1 1 76 76 ARG CA C 13 59.972 0.2 . 1 . . . . 154 ARG CA . 19686 1
268 . 1 1 76 76 ARG CB C 13 30.877 0.2 . 1 . . . . 154 ARG CB . 19686 1
269 . 1 1 76 76 ARG N N 15 120.197 0.2 . 1 . . . . 154 ARG N . 19686 1
270 . 1 1 77 77 ALA H H 1 8.88 0.02 . 1 . . . . 155 ALA HN . 19686 1
271 . 1 1 77 77 ALA CA C 13 55.514 0.2 . 1 . . . . 155 ALA CA . 19686 1
272 . 1 1 77 77 ALA CB C 13 18.882 0.2 . 1 . . . . 155 ALA CB . 19686 1
273 . 1 1 77 77 ALA N N 15 121.247 0.2 . 1 . . . . 155 ALA N . 19686 1
274 . 1 1 78 78 ARG H H 1 8.162 0.02 . 1 . . . . 156 ARG HN . 19686 1
275 . 1 1 78 78 ARG CA C 13 61.251 0.2 . 1 . . . . 156 ARG CA . 19686 1
276 . 1 1 78 78 ARG CB C 13 30.52 0.2 . 1 . . . . 156 ARG CB . 19686 1
277 . 1 1 78 78 ARG N N 15 117.137 0.2 . 1 . . . . 156 ARG N . 19686 1
278 . 1 1 79 79 ALA H H 1 7.57 0.02 . 1 . . . . 157 ALA HN . 19686 1
279 . 1 1 79 79 ALA CA C 13 55.237 0.2 . 1 . . . . 157 ALA CA . 19686 1
280 . 1 1 79 79 ALA CB C 13 18.78 0.2 . 1 . . . . 157 ALA CB . 19686 1
281 . 1 1 79 79 ALA N N 15 119.304 0.2 . 1 . . . . 157 ALA N . 19686 1
282 . 1 1 80 80 GLU H H 1 8.335 0.02 . 1 . . . . 158 GLU HN . 19686 1
283 . 1 1 80 80 GLU CA C 13 58.801 0.2 . 1 . . . . 158 GLU CA . 19686 1
284 . 1 1 80 80 GLU CB C 13 30.273 0.2 . 1 . . . . 158 GLU CB . 19686 1
285 . 1 1 80 80 GLU N N 15 116.302 0.2 . 1 . . . . 158 GLU N . 19686 1
286 . 1 1 81 81 PHE H H 1 7.974 0.02 . 1 . . . . 159 PHE HN . 19686 1
287 . 1 1 81 81 PHE CA C 13 57.363 0.2 . 1 . . . . 159 PHE CA . 19686 1
288 . 1 1 81 81 PHE CB C 13 41.388 0.2 . 1 . . . . 159 PHE CB . 19686 1
289 . 1 1 81 81 PHE N N 15 111.235 0.2 . 1 . . . . 159 PHE N . 19686 1
290 . 1 1 82 82 ASN H H 1 8.264 0.02 . 1 . . . . 160 ASN HN . 19686 1
291 . 1 1 82 82 ASN CA C 13 57.39 0.2 . 1 . . . . 160 ASN CA . 19686 1
292 . 1 1 82 82 ASN CB C 13 39.37 0.2 . 1 . . . . 160 ASN CB . 19686 1
293 . 1 1 82 82 ASN N N 15 118.34 0.2 . 1 . . . . 160 ASN N . 19686 1
294 . 1 1 83 83 GLY H H 1 9.164 0.02 . 1 . . . . 161 GLY HN . 19686 1
295 . 1 1 83 83 GLY CA C 13 46.234 0.2 . 1 . . . . 161 GLY CA . 19686 1
296 . 1 1 83 83 GLY N N 15 116.269 0.2 . 1 . . . . 161 GLY N . 19686 1
297 . 1 1 84 84 THR H H 1 7.723 0.02 . 1 . . . . 162 THR HN . 19686 1
298 . 1 1 84 84 THR CA C 13 62.569 0.2 . 1 . . . . 162 THR CA . 19686 1
299 . 1 1 84 84 THR CB C 13 70.985 0.2 . 1 . . . . 162 THR CB . 19686 1
300 . 1 1 84 84 THR N N 15 114.05 0.2 . 1 . . . . 162 THR N . 19686 1
301 . 1 1 85 85 THR H H 1 8.336 0.02 . 1 . . . . 163 THR HN . 19686 1
302 . 1 1 85 85 THR CA C 13 62.454 0.2 . 1 . . . . 163 THR CA . 19686 1
303 . 1 1 85 85 THR CB C 13 69.803 0.2 . 1 . . . . 163 THR CB . 19686 1
304 . 1 1 85 85 THR N N 15 116.302 0.2 . 1 . . . . 163 THR N . 19686 1
305 . 1 1 86 86 ILE H H 1 9.014 0.02 . 1 . . . . 164 ILE HN . 19686 1
306 . 1 1 86 86 ILE CA C 13 60.611 0.2 . 1 . . . . 164 ILE CA . 19686 1
307 . 1 1 86 86 ILE CB C 13 40.594 0.2 . 1 . . . . 164 ILE CB . 19686 1
308 . 1 1 86 86 ILE N N 15 127.045 0.2 . 1 . . . . 164 ILE N . 19686 1
309 . 1 1 87 87 GLU H H 1 9.338 0.02 . 1 . . . . 165 GLU HN . 19686 1
310 . 1 1 87 87 GLU CA C 13 57.314 0.2 . 1 . . . . 165 GLU CA . 19686 1
311 . 1 1 87 87 GLU CB C 13 27.665 0.2 . 1 . . . . 165 GLU CB . 19686 1
312 . 1 1 87 87 GLU N N 15 125.395 0.2 . 1 . . . . 165 GLU N . 19686 1
313 . 1 1 88 88 GLY H H 1 8.22 0.02 . 1 . . . . 166 GLY HN . 19686 1
314 . 1 1 88 88 GLY CA C 13 45.876 0.2 . 1 . . . . 166 GLY CA . 19686 1
315 . 1 1 88 88 GLY N N 15 102.088 0.2 . 1 . . . . 166 GLY N . 19686 1
316 . 1 1 89 89 ARG H H 1 7.884 0.02 . 1 . . . . 167 ARG HN . 19686 1
317 . 1 1 89 89 ARG CA C 13 55.486 0.2 . 1 . . . . 167 ARG CA . 19686 1
318 . 1 1 89 89 ARG CB C 13 32.279 0.2 . 1 . . . . 167 ARG CB . 19686 1
319 . 1 1 89 89 ARG N N 15 120.364 0.2 . 1 . . . . 167 ARG N . 19686 1
320 . 1 1 90 90 ARG H H 1 8.48 0.02 . 1 . . . . 168 ARG HN . 19686 1
321 . 1 1 90 90 ARG CA C 13 56.388 0.2 . 1 . . . . 168 ARG CA . 19686 1
322 . 1 1 90 90 ARG CB C 13 30.065 0.2 . 1 . . . . 168 ARG CB . 19686 1
323 . 1 1 90 90 ARG N N 15 123.299 0.2 . 1 . . . . 168 ARG N . 19686 1
324 . 1 1 91 91 VAL H H 1 9.05 0.02 . 1 . . . . 169 VAL HN . 19686 1
325 . 1 1 91 91 VAL CA C 13 62.365 0.2 . 1 . . . . 169 VAL CA . 19686 1
326 . 1 1 91 91 VAL CB C 13 33.566 0.2 . 1 . . . . 169 VAL CB . 19686 1
327 . 1 1 91 91 VAL N N 15 129.824 0.2 . 1 . . . . 169 VAL N . 19686 1
328 . 1 1 92 92 GLU H H 1 7.919 0.02 . 1 . . . . 170 GLU HN . 19686 1
329 . 1 1 92 92 GLU CA C 13 54.32 0.2 . 1 . . . . 170 GLU CA . 19686 1
330 . 1 1 92 92 GLU CB C 13 32.883 0.2 . 1 . . . . 170 GLU CB . 19686 1
331 . 1 1 92 92 GLU N N 15 122.842 0.2 . 1 . . . . 170 GLU N . 19686 1
332 . 1 1 93 93 VAL H H 1 8.895 0.02 . 1 . . . . 171 VAL HN . 19686 1
333 . 1 1 93 93 VAL CA C 13 61.657 0.2 . 1 . . . . 171 VAL CA . 19686 1
334 . 1 1 93 93 VAL CB C 13 34.496 0.2 . 1 . . . . 171 VAL CB . 19686 1
335 . 1 1 93 93 VAL N N 15 122.811 0.2 . 1 . . . . 171 VAL N . 19686 1
336 . 1 1 94 94 ASN H H 1 9.477 0.02 . 1 . . . . 172 ASN HN . 19686 1
337 . 1 1 94 94 ASN CA C 13 51.825 0.2 . 1 . . . . 172 ASN CA . 19686 1
338 . 1 1 94 94 ASN CB C 13 44.974 0.2 . 1 . . . . 172 ASN CB . 19686 1
339 . 1 1 94 94 ASN N N 15 124.677 0.2 . 1 . . . . 172 ASN N . 19686 1
340 . 1 1 95 95 LEU H H 1 9.06 0.02 . 1 . . . . 173 LEU HN . 19686 1
341 . 1 1 95 95 LEU CA C 13 56.982 0.2 . 1 . . . . 173 LEU CA . 19686 1
342 . 1 1 95 95 LEU CB C 13 41.881 0.2 . 1 . . . . 173 LEU CB . 19686 1
343 . 1 1 95 95 LEU N N 15 120.318 0.2 . 1 . . . . 173 LEU N . 19686 1
344 . 1 1 96 96 ALA H H 1 8.617 0.02 . 1 . . . . 174 ALA HN . 19686 1
345 . 1 1 96 96 ALA CA C 13 52.409 0.2 . 1 . . . . 174 ALA CA . 19686 1
346 . 1 1 96 96 ALA CB C 13 19.916 0.2 . 1 . . . . 174 ALA CB . 19686 1
347 . 1 1 96 96 ALA N N 15 125.272 0.2 . 1 . . . . 174 ALA N . 19686 1
348 . 1 1 97 97 THR H H 1 8.639 0.02 . 1 . . . . 175 THR HN . 19686 1
349 . 1 1 97 97 THR CA C 13 61.347 0.2 . 1 . . . . 175 THR CA . 19686 1
350 . 1 1 97 97 THR CB C 13 70.326 0.2 . 1 . . . . 175 THR CB . 19686 1
351 . 1 1 97 97 THR N N 15 116.483 0.2 . 1 . . . . 175 THR N . 19686 1
352 . 1 1 98 98 GLN H H 1 8.765 0.02 . 1 . . . . 176 GLN HN . 19686 1
353 . 1 1 98 98 GLN CA C 13 56.645 0.2 . 1 . . . . 176 GLN CA . 19686 1
354 . 1 1 98 98 GLN CB C 13 29.913 0.2 . 1 . . . . 176 GLN CB . 19686 1
355 . 1 1 98 98 GLN N N 15 123.968 0.2 . 1 . . . . 176 GLN N . 19686 1
356 . 1 1 99 99 ARG H H 1 8.028 0.02 . 1 . . . . 177 ARG HN . 19686 1
357 . 1 1 99 99 ARG CA C 13 58.029 0.2 . 1 . . . . 177 ARG CA . 19686 1
358 . 1 1 99 99 ARG CB C 13 31.809 0.2 . 1 . . . . 177 ARG CB . 19686 1
359 . 1 1 99 99 ARG N N 15 128.024 0.2 . 1 . . . . 177 ARG N . 19686 1
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