###################################
# 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_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 7188
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 'Wild-type Im7 in native conditions'
_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
. '2D 15N-1H HSQC' 1 $sample_1 isotropic 7188 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 1 1 MET HA H 1 3.970 0.02 . 1 . . . . 1 MET HA . 7188 1
2 . 1 1 1 1 MET C C 13 171.920 0.2 . 1 . . . . 1 MET C . 7188 1
3 . 1 1 1 1 MET CA C 13 55.000 0.2 . 1 . . . . 1 MET CA . 7188 1
4 . 1 1 1 1 MET CB C 13 33.290 0.2 . 1 . . . . 1 MET CB . 7188 1
5 . 1 1 2 2 GLU H H 1 8.660 0.02 . 1 . . . . 2 GLU HN . 7188 1
6 . 1 1 2 2 GLU HA H 1 4.240 0.02 . 1 . . . . 2 GLU HA . 7188 1
7 . 1 1 2 2 GLU C C 13 175.090 0.2 . 1 . . . . 2 GLU C . 7188 1
8 . 1 1 2 2 GLU CA C 13 55.930 0.2 . 1 . . . . 2 GLU CA . 7188 1
9 . 1 1 2 2 GLU CB C 13 30.150 0.2 . 1 . . . . 2 GLU CB . 7188 1
10 . 1 1 2 2 GLU N N 15 125.320 0.38 . 1 . . . . 2 GLU N . 7188 1
11 . 1 1 3 3 LEU H H 1 8.420 0.02 . 1 . . . . 3 LEU HN . 7188 1
12 . 1 1 3 3 LEU HA H 1 4.300 0.02 . 1 . . . . 3 LEU HA . 7188 1
13 . 1 1 3 3 LEU C C 13 177.160 0.2 . 1 . . . . 3 LEU C . 7188 1
14 . 1 1 3 3 LEU CA C 13 54.250 0.2 . 1 . . . . 3 LEU CA . 7188 1
15 . 1 1 3 3 LEU CB C 13 40.710 0.2 . 1 . . . . 3 LEU CB . 7188 1
16 . 1 1 3 3 LEU N N 15 125.480 0.38 . 1 . . . . 3 LEU N . 7188 1
17 . 1 1 4 4 LYS H H 1 7.790 0.02 . 1 . . . . 4 LYS HN . 7188 1
18 . 1 1 4 4 LYS HA H 1 4.340 0.02 . 1 . . . . 4 LYS HA . 7188 1
19 . 1 1 4 4 LYS C C 13 176.280 0.2 . 1 . . . . 4 LYS C . 7188 1
20 . 1 1 4 4 LYS CA C 13 55.490 0.2 . 1 . . . . 4 LYS CA . 7188 1
21 . 1 1 4 4 LYS CB C 13 33.430 0.2 . 1 . . . . 4 LYS CB . 7188 1
22 . 1 1 4 4 LYS N N 15 123.000 0.38 . 1 . . . . 4 LYS N . 7188 1
23 . 1 1 5 5 ASN H H 1 8.410 0.02 . 1 . . . . 5 ASN HN . 7188 1
24 . 1 1 5 5 ASN HA H 1 4.560 0.02 . 1 . . . . 5 ASN HA . 7188 1
25 . 1 1 5 5 ASN C C 13 175.100 0.2 . 1 . . . . 5 ASN C . 7188 1
26 . 1 1 5 5 ASN CA C 13 55.700 0.2 . 1 . . . . 5 ASN CA . 7188 1
27 . 1 1 5 5 ASN CB C 13 40.060 0.2 . 1 . . . . 5 ASN CB . 7188 1
28 . 1 1 5 5 ASN N N 15 115.560 0.38 . 1 . . . . 5 ASN N . 7188 1
29 . 1 1 6 6 SER H H 1 8.050 0.02 . 1 . . . . 6 SER HN . 7188 1
30 . 1 1 6 6 SER HA H 1 4.710 0.02 . 1 . . . . 6 SER HA . 7188 1
31 . 1 1 6 6 SER C C 13 174.900 0.2 . 1 . . . . 6 SER C . 7188 1
32 . 1 1 6 6 SER CA C 13 56.780 0.2 . 1 . . . . 6 SER CA . 7188 1
33 . 1 1 6 6 SER CB C 13 65.960 0.2 . 1 . . . . 6 SER CB . 7188 1
34 . 1 1 6 6 SER N N 15 112.000 0.38 . 1 . . . . 6 SER N . 7188 1
35 . 1 1 7 7 ILE H H 1 9.300 0.02 . 1 . . . . 7 ILE HN . 7188 1
36 . 1 1 7 7 ILE HA H 1 3.920 0.02 . 1 . . . . 7 ILE HA . 7188 1
37 . 1 1 7 7 ILE C C 13 175.370 0.2 . 1 . . . . 7 ILE C . 7188 1
38 . 1 1 7 7 ILE CA C 13 64.910 0.2 . 1 . . . . 7 ILE CA . 7188 1
39 . 1 1 7 7 ILE CB C 13 36.880 0.2 . 1 . . . . 7 ILE CB . 7188 1
40 . 1 1 7 7 ILE N N 15 125.770 0.38 . 1 . . . . 7 ILE N . 7188 1
41 . 1 1 8 8 SER H H 1 7.350 0.02 . 1 . . . . 8 SER HN . 7188 1
42 . 1 1 8 8 SER HA H 1 4.640 0.02 . 1 . . . . 8 SER HA . 7188 1
43 . 1 1 8 8 SER C C 13 174.220 0.2 . 1 . . . . 8 SER C . 7188 1
44 . 1 1 8 8 SER CA C 13 59.240 0.2 . 1 . . . . 8 SER CA . 7188 1
45 . 1 1 8 8 SER CB C 13 63.160 0.2 . 1 . . . . 8 SER CB . 7188 1
46 . 1 1 8 8 SER N N 15 112.180 0.38 . 1 . . . . 8 SER N . 7188 1
47 . 1 1 9 9 ASP H H 1 7.700 0.02 . 1 . . . . 9 ASP HN . 7188 1
48 . 1 1 9 9 ASP HA H 1 4.700 0.02 . 1 . . . . 9 ASP HA . 7188 1
49 . 1 1 9 9 ASP C C 13 175.970 0.2 . 1 . . . . 9 ASP C . 7188 1
50 . 1 1 9 9 ASP CA C 13 55.040 0.2 . 1 . . . . 9 ASP CA . 7188 1
51 . 1 1 9 9 ASP CB C 13 43.350 0.2 . 1 . . . . 9 ASP CB . 7188 1
52 . 1 1 9 9 ASP N N 15 117.950 0.38 . 1 . . . . 9 ASP N . 7188 1
53 . 1 1 10 10 TYR H H 1 8.130 0.02 . 1 . . . . 10 TYR HN . 7188 1
54 . 1 1 10 10 TYR HA H 1 4.960 0.02 . 1 . . . . 10 TYR HA . 7188 1
55 . 1 1 10 10 TYR C C 13 177.510 0.2 . 1 . . . . 10 TYR C . 7188 1
56 . 1 1 10 10 TYR CA C 13 58.270 0.2 . 1 . . . . 10 TYR CA . 7188 1
57 . 1 1 10 10 TYR CB C 13 40.830 0.2 . 1 . . . . 10 TYR CB . 7188 1
58 . 1 1 10 10 TYR N N 15 120.190 0.38 . 1 . . . . 10 TYR N . 7188 1
59 . 1 1 11 11 THR H H 1 8.790 0.02 . 1 . . . . 11 THR HN . 7188 1
60 . 1 1 11 11 THR HA H 1 4.970 0.02 . 1 . . . . 11 THR HA . 7188 1
61 . 1 1 11 11 THR C C 13 176.120 0.2 . 1 . . . . 11 THR C . 7188 1
62 . 1 1 11 11 THR CA C 13 60.590 0.2 . 1 . . . . 11 THR CA . 7188 1
63 . 1 1 11 11 THR CB C 13 70.920 0.2 . 1 . . . . 11 THR CB . 7188 1
64 . 1 1 11 11 THR N N 15 112.250 0.38 . 1 . . . . 11 THR N . 7188 1
65 . 1 1 12 12 GLU H H 1 9.100 0.02 . 1 . . . . 12 GLU HN . 7188 1
66 . 1 1 12 12 GLU HA H 1 4.660 0.02 . 1 . . . . 12 GLU HA . 7188 1
67 . 1 1 12 12 GLU C C 13 178.320 0.2 . 1 . . . . 12 GLU C . 7188 1
68 . 1 1 12 12 GLU CA C 13 60.720 0.2 . 1 . . . . 12 GLU CA . 7188 1
69 . 1 1 12 12 GLU CB C 13 29.240 0.2 . 1 . . . . 12 GLU CB . 7188 1
70 . 1 1 12 12 GLU N N 15 121.970 0.38 . 1 . . . . 12 GLU N . 7188 1
71 . 1 1 13 13 ALA H H 1 8.260 0.02 . 1 . . . . 13 ALA HN . 7188 1
72 . 1 1 13 13 ALA HA H 1 4.350 0.02 . 1 . . . . 13 ALA HA . 7188 1
73 . 1 1 13 13 ALA C C 13 181.810 0.2 . 1 . . . . 13 ALA C . 7188 1
74 . 1 1 13 13 ALA CA C 13 55.190 0.2 . 1 . . . . 13 ALA CA . 7188 1
75 . 1 1 13 13 ALA CB C 13 18.200 0.2 . 1 . . . . 13 ALA CB . 7188 1
76 . 1 1 13 13 ALA N N 15 118.610 0.38 . 1 . . . . 13 ALA N . 7188 1
77 . 1 1 14 14 GLU H H 1 7.950 0.02 . 1 . . . . 14 GLU HN . 7188 1
78 . 1 1 14 14 GLU HA H 1 4.050 0.02 . 1 . . . . 14 GLU HA . 7188 1
79 . 1 1 14 14 GLU C C 13 179.170 0.2 . 1 . . . . 14 GLU C . 7188 1
80 . 1 1 14 14 GLU CA C 13 58.950 0.2 . 1 . . . . 14 GLU CA . 7188 1
81 . 1 1 14 14 GLU CB C 13 31.310 0.2 . 1 . . . . 14 GLU CB . 7188 1
82 . 1 1 14 14 GLU N N 15 119.260 0.38 . 1 . . . . 14 GLU N . 7188 1
83 . 1 1 15 15 PHE H H 1 8.500 0.02 . 1 . . . . 15 PHE HN . 7188 1
84 . 1 1 15 15 PHE HA H 1 3.920 0.02 . 1 . . . . 15 PHE HA . 7188 1
85 . 1 1 15 15 PHE C C 13 177.630 0.2 . 1 . . . . 15 PHE C . 7188 1
86 . 1 1 15 15 PHE CA C 13 62.100 0.2 . 1 . . . . 15 PHE CA . 7188 1
87 . 1 1 15 15 PHE CB C 13 40.280 0.2 . 1 . . . . 15 PHE CB . 7188 1
88 . 1 1 15 15 PHE N N 15 124.200 0.38 . 1 . . . . 15 PHE N . 7188 1
89 . 1 1 16 16 VAL H H 1 8.550 0.02 . 1 . . . . 16 VAL HN . 7188 1
90 . 1 1 16 16 VAL HA H 1 3.360 0.02 . 1 . . . . 16 VAL HA . 7188 1
91 . 1 1 16 16 VAL C C 13 177.810 0.2 . 1 . . . . 16 VAL C . 7188 1
92 . 1 1 16 16 VAL CA C 13 67.750 0.2 . 1 . . . . 16 VAL CA . 7188 1
93 . 1 1 16 16 VAL CB C 13 31.310 0.2 . 1 . . . . 16 VAL CB . 7188 1
94 . 1 1 16 16 VAL N N 15 119.660 0.38 . 1 . . . . 16 VAL N . 7188 1
95 . 1 1 17 17 GLN H H 1 7.490 0.02 . 1 . . . . 17 GLN HN . 7188 1
96 . 1 1 17 17 GLN HA H 1 3.850 0.02 . 1 . . . . 17 GLN HA . 7188 1
97 . 1 1 17 17 GLN C C 13 178.430 0.2 . 1 . . . . 17 GLN C . 7188 1
98 . 1 1 17 17 GLN CA C 13 59.150 0.2 . 1 . . . . 17 GLN CA . 7188 1
99 . 1 1 17 17 GLN CB C 13 27.610 0.2 . 1 . . . . 17 GLN CB . 7188 1
100 . 1 1 17 17 GLN N N 15 117.810 0.38 . 1 . . . . 17 GLN N . 7188 1
101 . 1 1 18 18 LEU H H 1 7.520 0.02 . 1 . . . . 18 LEU HN . 7188 1
102 . 1 1 18 18 LEU HA H 1 4.000 0.02 . 1 . . . . 18 LEU HA . 7188 1
103 . 1 1 18 18 LEU C C 13 178.280 0.2 . 1 . . . . 18 LEU C . 7188 1
104 . 1 1 18 18 LEU CA C 13 58.760 0.2 . 1 . . . . 18 LEU CA . 7188 1
105 . 1 1 18 18 LEU CB C 13 40.420 0.2 . 1 . . . . 18 LEU CB . 7188 1
106 . 1 1 18 18 LEU N N 15 122.540 0.38 . 1 . . . . 18 LEU N . 7188 1
107 . 1 1 19 19 LEU H H 1 7.690 0.02 . 1 . . . . 19 LEU HN . 7188 1
108 . 1 1 19 19 LEU HA H 1 3.730 0.02 . 1 . . . . 19 LEU HA . 7188 1
109 . 1 1 19 19 LEU C C 13 180.060 0.2 . 1 . . . . 19 LEU C . 7188 1
110 . 1 1 19 19 LEU CA C 13 57.700 0.2 . 1 . . . . 19 LEU CA . 7188 1
111 . 1 1 19 19 LEU CB C 13 40.770 0.2 . 1 . . . . 19 LEU CB . 7188 1
112 . 1 1 19 19 LEU N N 15 119.100 0.38 . 1 . . . . 19 LEU N . 7188 1
113 . 1 1 20 20 LYS H H 1 8.350 0.02 . 1 . . . . 20 LYS HN . 7188 1
114 . 1 1 20 20 LYS HA H 1 3.950 0.02 . 1 . . . . 20 LYS HA . 7188 1
115 . 1 1 20 20 LYS C C 13 179.470 0.2 . 1 . . . . 20 LYS C . 7188 1
116 . 1 1 20 20 LYS CA C 13 59.320 0.2 . 1 . . . . 20 LYS CA . 7188 1
117 . 1 1 20 20 LYS CB C 13 31.600 0.2 . 1 . . . . 20 LYS CB . 7188 1
118 . 1 1 20 20 LYS N N 15 120.640 0.38 . 1 . . . . 20 LYS N . 7188 1
119 . 1 1 21 21 GLU H H 1 8.080 0.02 . 1 . . . . 21 GLU HN . 7188 1
120 . 1 1 21 21 GLU HA H 1 4.020 0.02 . 1 . . . . 21 GLU HA . 7188 1
121 . 1 1 21 21 GLU C C 13 178.970 0.2 . 1 . . . . 21 GLU C . 7188 1
122 . 1 1 21 21 GLU CA C 13 59.310 0.2 . 1 . . . . 21 GLU CA . 7188 1
123 . 1 1 21 21 GLU CB C 13 28.740 0.2 . 1 . . . . 21 GLU CB . 7188 1
124 . 1 1 21 21 GLU N N 15 123.170 0.38 . 1 . . . . 21 GLU N . 7188 1
125 . 1 1 22 22 ILE H H 1 7.950 0.02 . 1 . . . . 22 ILE HN . 7188 1
126 . 1 1 22 22 ILE HA H 1 3.270 0.02 . 1 . . . . 22 ILE HA . 7188 1
127 . 1 1 22 22 ILE C C 13 177.030 0.2 . 1 . . . . 22 ILE C . 7188 1
128 . 1 1 22 22 ILE CA C 13 66.380 0.2 . 1 . . . . 22 ILE CA . 7188 1
129 . 1 1 22 22 ILE CB C 13 37.900 0.2 . 1 . . . . 22 ILE CB . 7188 1
130 . 1 1 22 22 ILE N N 15 120.540 0.38 . 1 . . . . 22 ILE N . 7188 1
131 . 1 1 23 23 GLU H H 1 7.720 0.02 . 1 . . . . 23 GLU HN . 7188 1
132 . 1 1 23 23 GLU HA H 1 3.940 0.02 . 1 . . . . 23 GLU HA . 7188 1
133 . 1 1 23 23 GLU C C 13 179.000 0.2 . 1 . . . . 23 GLU C . 7188 1
134 . 1 1 23 23 GLU CA C 13 59.210 0.2 . 1 . . . . 23 GLU CA . 7188 1
135 . 1 1 23 23 GLU CB C 13 29.560 0.2 . 1 . . . . 23 GLU CB . 7188 1
136 . 1 1 23 23 GLU N N 15 118.650 0.38 . 1 . . . . 23 GLU N . 7188 1
137 . 1 1 24 24 LYS H H 1 7.560 0.02 . 1 . . . . 24 LYS HN . 7188 1
138 . 1 1 24 24 LYS HA H 1 3.980 0.02 . 1 . . . . 24 LYS HA . 7188 1
139 . 1 1 24 24 LYS C C 13 179.320 0.2 . 1 . . . . 24 LYS C . 7188 1
140 . 1 1 24 24 LYS CA C 13 59.090 0.2 . 1 . . . . 24 LYS CA . 7188 1
141 . 1 1 24 24 LYS CB C 13 32.470 0.2 . 1 . . . . 24 LYS CB . 7188 1
142 . 1 1 24 24 LYS N N 15 119.230 0.38 . 1 . . . . 24 LYS N . 7188 1
143 . 1 1 25 25 GLU H H 1 8.220 0.02 . 1 . . . . 25 GLU HN . 7188 1
144 . 1 1 25 25 GLU HA H 1 4.220 0.02 . 1 . . . . 25 GLU HA . 7188 1
145 . 1 1 25 25 GLU C C 13 178.090 0.2 . 1 . . . . 25 GLU C . 7188 1
146 . 1 1 25 25 GLU CA C 13 57.350 0.2 . 1 . . . . 25 GLU CA . 7188 1
147 . 1 1 25 25 GLU CB C 13 29.190 0.2 . 1 . . . . 25 GLU CB . 7188 1
148 . 1 1 25 25 GLU N N 15 119.000 0.38 . 1 . . . . 25 GLU N . 7188 1
149 . 1 1 26 26 ASN H H 1 8.410 0.02 . 1 . . . . 26 ASN HN . 7188 1
150 . 1 1 26 26 ASN HA H 1 4.540 0.02 . 1 . . . . 26 ASN HA . 7188 1
151 . 1 1 26 26 ASN C C 13 176.720 0.2 . 1 . . . . 26 ASN C . 7188 1
152 . 1 1 26 26 ASN CA C 13 55.610 0.2 . 1 . . . . 26 ASN CA . 7188 1
153 . 1 1 26 26 ASN CB C 13 39.010 0.2 . 1 . . . . 26 ASN CB . 7188 1
154 . 1 1 26 26 ASN N N 15 119.000 0.38 . 1 . . . . 26 ASN N . 7188 1
155 . 1 1 27 27 VAL H H 1 7.250 0.02 . 1 . . . . 27 VAL HN . 7188 1
156 . 1 1 27 27 VAL HA H 1 4.190 0.02 . 1 . . . . 27 VAL HA . 7188 1
157 . 1 1 27 27 VAL C C 13 176.180 0.2 . 1 . . . . 27 VAL C . 7188 1
158 . 1 1 27 27 VAL CA C 13 62.090 0.2 . 1 . . . . 27 VAL CA . 7188 1
159 . 1 1 27 27 VAL CB C 13 31.770 0.2 . 1 . . . . 27 VAL CB . 7188 1
160 . 1 1 27 27 VAL N N 15 112.670 0.38 . 1 . . . . 27 VAL N . 7188 1
161 . 1 1 28 28 ALA H H 1 7.450 0.02 . 1 . . . . 28 ALA HN . 7188 1
162 . 1 1 28 28 ALA HA H 1 4.280 0.02 . 1 . . . . 28 ALA HA . 7188 1
163 . 1 1 28 28 ALA C C 13 177.190 0.2 . 1 . . . . 28 ALA C . 7188 1
164 . 1 1 28 28 ALA CA C 13 52.480 0.2 . 1 . . . . 28 ALA CA . 7188 1
165 . 1 1 28 28 ALA CB C 13 19.900 0.2 . 1 . . . . 28 ALA CB . 7188 1
166 . 1 1 28 28 ALA N N 15 124.460 0.38 . 1 . . . . 28 ALA N . 7188 1
167 . 1 1 29 29 ALA H H 1 8.400 0.02 . 1 . . . . 29 ALA HN . 7188 1
168 . 1 1 29 29 ALA C C 13 178.010 0.2 . 1 . . . . 29 ALA C . 7188 1
169 . 1 1 29 29 ALA CA C 13 53.920 0.2 . 1 . . . . 29 ALA CA . 7188 1
170 . 1 1 29 29 ALA CB C 13 19.200 0.2 . 1 . . . . 29 ALA CB . 7188 1
171 . 1 1 29 29 ALA N N 15 121.690 0.38 . 1 . . . . 29 ALA N . 7188 1
172 . 1 1 30 30 THR H H 1 7.970 0.02 . 1 . . . . 30 THR HN . 7188 1
173 . 1 1 30 30 THR HA H 1 4.510 0.02 . 1 . . . . 30 THR HA . 7188 1
174 . 1 1 30 30 THR C C 13 174.770 0.2 . 1 . . . . 30 THR C . 7188 1
175 . 1 1 30 30 THR CA C 13 60.220 0.2 . 1 . . . . 30 THR CA . 7188 1
176 . 1 1 30 30 THR CB C 13 70.650 0.2 . 1 . . . . 30 THR CB . 7188 1
177 . 1 1 30 30 THR N N 15 109.250 0.38 . 1 . . . . 30 THR N . 7188 1
178 . 1 1 31 31 ASP H H 1 8.500 0.02 . 1 . . . . 31 ASP HN . 7188 1
179 . 1 1 31 31 ASP HA H 1 4.630 0.02 . 1 . . . . 31 ASP HA . 7188 1
180 . 1 1 31 31 ASP C C 13 175.820 0.2 . 1 . . . . 31 ASP C . 7188 1
181 . 1 1 31 31 ASP CA C 13 54.380 0.2 . 1 . . . . 31 ASP CA . 7188 1
182 . 1 1 31 31 ASP CB C 13 40.950 0.2 . 1 . . . . 31 ASP CB . 7188 1
183 . 1 1 31 31 ASP N N 15 121.630 0.38 . 1 . . . . 31 ASP N . 7188 1
184 . 1 1 32 32 ASP H H 1 8.250 0.02 . 1 . . . . 32 ASP HN . 7188 1
185 . 1 1 32 32 ASP HA H 1 4.360 0.02 . 1 . . . . 32 ASP HA . 7188 1
186 . 1 1 32 32 ASP C C 13 177.810 0.2 . 1 . . . . 32 ASP C . 7188 1
187 . 1 1 32 32 ASP CA C 13 56.750 0.2 . 1 . . . . 32 ASP CA . 7188 1
188 . 1 1 32 32 ASP CB C 13 40.510 0.2 . 1 . . . . 32 ASP CB . 7188 1
189 . 1 1 32 32 ASP N N 15 118.700 0.38 . 1 . . . . 32 ASP N . 7188 1
190 . 1 1 33 33 VAL H H 1 7.940 0.02 . 1 . . . . 33 VAL HN . 7188 1
191 . 1 1 33 33 VAL HA H 1 3.770 0.02 . 1 . . . . 33 VAL HA . 7188 1
192 . 1 1 33 33 VAL C C 13 177.640 0.2 . 1 . . . . 33 VAL C . 7188 1
193 . 1 1 33 33 VAL CA C 13 65.120 0.2 . 1 . . . . 33 VAL CA . 7188 1
194 . 1 1 33 33 VAL CB C 13 32.020 0.2 . 1 . . . . 33 VAL CB . 7188 1
195 . 1 1 33 33 VAL N N 15 119.880 0.38 . 1 . . . . 33 VAL N . 7188 1
196 . 1 1 34 34 LEU H H 1 8.570 0.02 . 1 . . . . 34 LEU HN . 7188 1
197 . 1 1 34 34 LEU HA H 1 3.780 0.02 . 1 . . . . 34 LEU HA . 7188 1
198 . 1 1 34 34 LEU C C 13 177.640 0.2 . 1 . . . . 34 LEU C . 7188 1
199 . 1 1 34 34 LEU CA C 13 58.520 0.2 . 1 . . . . 34 LEU CA . 7188 1
200 . 1 1 34 34 LEU CB C 13 41.560 0.2 . 1 . . . . 34 LEU CB . 7188 1
201 . 1 1 34 34 LEU N N 15 122.210 0.38 . 1 . . . . 34 LEU N . 7188 1
202 . 1 1 35 35 ASP H H 1 8.290 0.02 . 1 . . . . 35 ASP HN . 7188 1
203 . 1 1 35 35 ASP HA H 1 4.300 0.02 . 1 . . . . 35 ASP HA . 7188 1
204 . 1 1 35 35 ASP C C 13 179.420 0.2 . 1 . . . . 35 ASP C . 7188 1
205 . 1 1 35 35 ASP CA C 13 57.940 0.2 . 1 . . . . 35 ASP CA . 7188 1
206 . 1 1 35 35 ASP CB C 13 40.210 0.2 . 1 . . . . 35 ASP CB . 7188 1
207 . 1 1 35 35 ASP N N 15 115.700 0.38 . 1 . . . . 35 ASP N . 7188 1
208 . 1 1 36 36 VAL H H 1 7.200 0.02 . 1 . . . . 36 VAL HN . 7188 1
209 . 1 1 36 36 VAL HA H 1 3.730 0.02 . 1 . . . . 36 VAL HA . 7188 1
210 . 1 1 36 36 VAL C C 13 179.460 0.2 . 1 . . . . 36 VAL C . 7188 1
211 . 1 1 36 36 VAL CA C 13 66.040 0.2 . 1 . . . . 36 VAL CA . 7188 1
212 . 1 1 36 36 VAL CB C 13 32.150 0.2 . 1 . . . . 36 VAL CB . 7188 1
213 . 1 1 36 36 VAL N N 15 120.170 0.38 . 1 . . . . 36 VAL N . 7188 1
214 . 1 1 37 37 LEU H H 1 8.090 0.02 . 1 . . . . 37 LEU HN . 7188 1
215 . 1 1 37 37 LEU HA H 1 3.990 0.02 . 1 . . . . 37 LEU HA . 7188 1
216 . 1 1 37 37 LEU C C 13 179.570 0.2 . 1 . . . . 37 LEU C . 7188 1
217 . 1 1 37 37 LEU CA C 13 58.130 0.2 . 1 . . . . 37 LEU CA . 7188 1
218 . 1 1 37 37 LEU CB C 13 42.330 0.2 . 1 . . . . 37 LEU CB . 7188 1
219 . 1 1 37 37 LEU N N 15 120.800 0.38 . 1 . . . . 37 LEU N . 7188 1
220 . 1 1 38 38 LEU H H 1 8.980 0.02 . 1 . . . . 38 LEU HN . 7188 1
221 . 1 1 38 38 LEU HA H 1 4.020 0.02 . 1 . . . . 38 LEU HA . 7188 1
222 . 1 1 38 38 LEU C C 13 179.290 0.2 . 1 . . . . 38 LEU C . 7188 1
223 . 1 1 38 38 LEU CA C 13 57.950 0.2 . 1 . . . . 38 LEU CA . 7188 1
224 . 1 1 38 38 LEU CB C 13 41.360 0.2 . 1 . . . . 38 LEU CB . 7188 1
225 . 1 1 38 38 LEU N N 15 118.860 0.38 . 1 . . . . 38 LEU N . 7188 1
226 . 1 1 39 39 GLU H H 1 7.900 0.02 . 1 . . . . 39 GLU HN . 7188 1
227 . 1 1 39 39 GLU HA H 1 4.030 0.02 . 1 . . . . 39 GLU HA . 7188 1
228 . 1 1 39 39 GLU C C 13 178.930 0.2 . 1 . . . . 39 GLU C . 7188 1
229 . 1 1 39 39 GLU CA C 13 59.630 0.2 . 1 . . . . 39 GLU CA . 7188 1
230 . 1 1 39 39 GLU CB C 13 29.400 0.2 . 1 . . . . 39 GLU CB . 7188 1
231 . 1 1 39 39 GLU N N 15 119.750 0.38 . 1 . . . . 39 GLU N . 7188 1
232 . 1 1 40 40 HIS H H 1 7.970 0.02 . 1 . . . . 40 HIS HN . 7188 1
233 . 1 1 40 40 HIS HA H 1 4.340 0.02 . 1 . . . . 40 HIS HA . 7188 1
234 . 1 1 40 40 HIS C C 13 175.970 0.2 . 1 . . . . 40 HIS C . 7188 1
235 . 1 1 40 40 HIS CA C 13 58.910 0.2 . 1 . . . . 40 HIS CA . 7188 1
236 . 1 1 40 40 HIS CB C 13 31.420 0.2 . 1 . . . . 40 HIS CB . 7188 1
237 . 1 1 40 40 HIS N N 15 119.400 0.38 . 1 . . . . 40 HIS N . 7188 1
238 . 1 1 41 41 PHE H H 1 8.780 0.02 . 1 . . . . 41 PHE HN . 7188 1
239 . 1 1 41 41 PHE HA H 1 3.750 0.02 . 1 . . . . 41 PHE HA . 7188 1
240 . 1 1 41 41 PHE C C 13 177.970 0.2 . 1 . . . . 41 PHE C . 7188 1
241 . 1 1 41 41 PHE CA C 13 62.680 0.2 . 1 . . . . 41 PHE CA . 7188 1
242 . 1 1 41 41 PHE CB C 13 39.610 0.2 . 1 . . . . 41 PHE CB . 7188 1
243 . 1 1 41 41 PHE N N 15 118.340 0.38 . 1 . . . . 41 PHE N . 7188 1
244 . 1 1 42 42 VAL H H 1 8.390 0.02 . 1 . . . . 42 VAL HN . 7188 1
245 . 1 1 42 42 VAL HA H 1 3.310 0.02 . 1 . . . . 42 VAL HA . 7188 1
246 . 1 1 42 42 VAL C C 13 178.270 0.2 . 1 . . . . 42 VAL C . 7188 1
247 . 1 1 42 42 VAL CA C 13 67.150 0.2 . 1 . . . . 42 VAL CA . 7188 1
248 . 1 1 42 42 VAL CB C 13 32.160 0.2 . 1 . . . . 42 VAL CB . 7188 1
249 . 1 1 42 42 VAL N N 15 120.950 0.38 . 1 . . . . 42 VAL N . 7188 1
250 . 1 1 43 43 LYS H H 1 8.040 0.02 . 1 . . . . 43 LYS HN . 7188 1
251 . 1 1 43 43 LYS CA C 13 59.440 0.2 . 1 . . . . 43 LYS CA . 7188 1
252 . 1 1 43 43 LYS CB C 13 32.880 0.2 . 1 . . . . 43 LYS CB . 7188 1
253 . 1 1 43 43 LYS N N 15 120.780 0.38 . 1 . . . . 43 LYS N . 7188 1
254 . 1 1 44 44 ILE C C 13 178.150 0.2 . 1 . . . . 44 ILE C . 7188 1
255 . 1 1 44 44 ILE CA C 13 61.900 0.2 . 1 . . . . 44 ILE CA . 7188 1
256 . 1 1 44 44 ILE CB C 13 37.400 0.2 . 1 . . . . 44 ILE CB . 7188 1
257 . 1 1 45 45 THR H H 1 7.480 0.02 . 1 . . . . 45 THR HN . 7188 1
258 . 1 1 45 45 THR C C 13 176.280 0.2 . 1 . . . . 45 THR C . 7188 1
259 . 1 1 45 45 THR CA C 13 65.630 0.2 . 1 . . . . 45 THR CA . 7188 1
260 . 1 1 45 45 THR CB C 13 69.620 0.2 . 1 . . . . 45 THR CB . 7188 1
261 . 1 1 45 45 THR N N 15 109.160 0.38 . 1 . . . . 45 THR N . 7188 1
262 . 1 1 46 46 GLU H H 1 7.230 0.02 . 1 . . . . 46 GLU HN . 7188 1
263 . 1 1 46 46 GLU HA H 1 3.780 0.02 . 1 . . . . 46 GLU HA . 7188 1
264 . 1 1 46 46 GLU C C 13 173.250 0.2 . 1 . . . . 46 GLU C . 7188 1
265 . 1 1 46 46 GLU CA C 13 57.520 0.2 . 1 . . . . 46 GLU CA . 7188 1
266 . 1 1 46 46 GLU CB C 13 28.880 0.2 . 1 . . . . 46 GLU CB . 7188 1
267 . 1 1 46 46 GLU N N 15 112.440 0.38 . 1 . . . . 46 GLU N . 7188 1
268 . 1 1 47 47 HIS H H 1 7.040 0.02 . 1 . . . . 47 HIS HN . 7188 1
269 . 1 1 47 47 HIS CA C 13 55.750 0.2 . 1 . . . . 47 HIS CA . 7188 1
270 . 1 1 47 47 HIS CB C 13 32.110 0.2 . 1 . . . . 47 HIS CB . 7188 1
271 . 1 1 47 47 HIS N N 15 119.570 0.38 . 1 . . . . 47 HIS N . 7188 1
272 . 1 1 48 48 PRO HA H 1 4.070 0.02 . 1 . . . . 48 PRO HA . 7188 1
273 . 1 1 48 48 PRO C C 13 177.790 0.2 . 1 . . . . 48 PRO C . 7188 1
274 . 1 1 48 48 PRO CA C 13 64.690 0.2 . 1 . . . . 48 PRO CA . 7188 1
275 . 1 1 48 48 PRO CB C 13 32.310 0.2 . 1 . . . . 48 PRO CB . 7188 1
276 . 1 1 49 49 ASP H H 1 10.670 0.02 . 1 . . . . 49 ASP HN . 7188 1
277 . 1 1 49 49 ASP HA H 1 4.650 0.02 . 1 . . . . 49 ASP HA . 7188 1
278 . 1 1 49 49 ASP C C 13 177.520 0.2 . 1 . . . . 49 ASP C . 7188 1
279 . 1 1 49 49 ASP CA C 13 55.250 0.2 . 1 . . . . 49 ASP CA . 7188 1
280 . 1 1 49 49 ASP CB C 13 40.570 0.2 . 1 . . . . 49 ASP CB . 7188 1
281 . 1 1 49 49 ASP N N 15 121.230 0.38 . 1 . . . . 49 ASP N . 7188 1
282 . 1 1 50 50 GLY H H 1 7.930 0.02 . 1 . . . . 50 GLY HN . 7188 1
283 . 1 1 50 50 GLY HA2 H 1 3.860 0.02 . 2 . . . . 50 GLY HA2 . 7188 1
284 . 1 1 50 50 GLY C C 13 175.400 0.2 . 1 . . . . 50 GLY C . 7188 1
285 . 1 1 50 50 GLY CA C 13 47.130 0.2 . 1 . . . . 50 GLY CA . 7188 1
286 . 1 1 50 50 GLY N N 15 107.710 0.38 . 1 . . . . 50 GLY N . 7188 1
287 . 1 1 51 51 THR H H 1 9.160 0.02 . 1 . . . . 51 THR HN . 7188 1
288 . 1 1 51 51 THR HA H 1 4.630 0.02 . 1 . . . . 51 THR HA . 7188 1
289 . 1 1 51 51 THR C C 13 176.520 0.2 . 1 . . . . 51 THR C . 7188 1
290 . 1 1 51 51 THR CA C 13 64.570 0.2 . 1 . . . . 51 THR CA . 7188 1
291 . 1 1 51 51 THR CB C 13 67.960 0.2 . 1 . . . . 51 THR CB . 7188 1
292 . 1 1 51 51 THR N N 15 114.480 0.38 . 1 . . . . 51 THR N . 7188 1
293 . 1 1 52 52 ASP H H 1 8.660 0.02 . 1 . . . . 52 ASP HN . 7188 1
294 . 1 1 52 52 ASP HA H 1 4.470 0.02 . 1 . . . . 52 ASP HA . 7188 1
295 . 1 1 52 52 ASP C C 13 177.660 0.2 . 1 . . . . 52 ASP C . 7188 1
296 . 1 1 52 52 ASP CA C 13 57.720 0.2 . 1 . . . . 52 ASP CA . 7188 1
297 . 1 1 52 52 ASP CB C 13 39.210 0.2 . 1 . . . . 52 ASP CB . 7188 1
298 . 1 1 52 52 ASP N N 15 125.960 0.38 . 1 . . . . 52 ASP N . 7188 1
299 . 1 1 53 53 LEU H H 1 7.190 0.02 . 1 . . . . 53 LEU HN . 7188 1
300 . 1 1 53 53 LEU HA H 1 3.770 0.02 . 1 . . . . 53 LEU HA . 7188 1
301 . 1 1 53 53 LEU C C 13 177.360 0.2 . 1 . . . . 53 LEU C . 7188 1
302 . 1 1 53 53 LEU CA C 13 57.470 0.2 . 1 . . . . 53 LEU CA . 7188 1
303 . 1 1 53 53 LEU CB C 13 43.590 0.2 . 1 . . . . 53 LEU CB . 7188 1
304 . 1 1 53 53 LEU N N 15 115.490 0.38 . 1 . . . . 53 LEU N . 7188 1
305 . 1 1 54 54 ILE H H 1 6.910 0.02 . 1 . . . . 54 ILE HN . 7188 1
306 . 1 1 54 54 ILE HA H 1 3.350 0.02 . 1 . . . . 54 ILE HA . 7188 1
307 . 1 1 54 54 ILE C C 13 177.280 0.2 . 1 . . . . 54 ILE C . 7188 1
308 . 1 1 54 54 ILE CA C 13 62.820 0.2 . 1 . . . . 54 ILE CA . 7188 1
309 . 1 1 54 54 ILE CB C 13 39.410 0.2 . 1 . . . . 54 ILE CB . 7188 1
310 . 1 1 54 54 ILE N N 15 113.480 0.38 . 1 . . . . 54 ILE N . 7188 1
311 . 1 1 55 55 TYR H H 1 7.080 0.02 . 1 . . . . 55 TYR HN . 7188 1
312 . 1 1 55 55 TYR HA H 1 4.000 0.02 . 1 . . . . 55 TYR HA . 7188 1
313 . 1 1 55 55 TYR C C 13 175.290 0.2 . 1 . . . . 55 TYR C . 7188 1
314 . 1 1 55 55 TYR CA C 13 60.740 0.2 . 1 . . . . 55 TYR CA . 7188 1
315 . 1 1 55 55 TYR CB C 13 40.040 0.2 . 1 . . . . 55 TYR CB . 7188 1
316 . 1 1 55 55 TYR N N 15 114.440 0.38 . 1 . . . . 55 TYR N . 7188 1
317 . 1 1 56 56 TYR H H 1 8.480 0.02 . 1 . . . . 56 TYR HN . 7188 1
318 . 1 1 56 56 TYR CA C 13 55.480 0.2 . 1 . . . . 56 TYR CA . 7188 1
319 . 1 1 56 56 TYR CB C 13 39.200 0.2 . 1 . . . . 56 TYR CB . 7188 1
320 . 1 1 56 56 TYR N N 15 118.170 0.38 . 1 . . . . 56 TYR N . 7188 1
321 . 1 1 57 57 PRO HA H 1 4.200 0.02 . 1 . . . . 57 PRO HA . 7188 1
322 . 1 1 57 57 PRO C C 13 177.310 0.2 . 1 . . . . 57 PRO C . 7188 1
323 . 1 1 57 57 PRO CA C 13 63.590 0.2 . 1 . . . . 57 PRO CA . 7188 1
324 . 1 1 57 57 PRO CB C 13 32.380 0.2 . 1 . . . . 57 PRO CB . 7188 1
325 . 1 1 58 58 SER H H 1 8.510 0.02 . 1 . . . . 58 SER HN . 7188 1
326 . 1 1 58 58 SER C C 13 174.770 0.2 . 1 . . . . 58 SER C . 7188 1
327 . 1 1 58 58 SER CA C 13 57.980 0.2 . 1 . . . . 58 SER CA . 7188 1
328 . 1 1 58 58 SER CB C 13 64.340 0.2 . 1 . . . . 58 SER CB . 7188 1
329 . 1 1 58 58 SER N N 15 116.700 0.38 . 1 . . . . 58 SER N . 7188 1
330 . 1 1 59 59 ASP H H 1 8.470 0.02 . 1 . . . . 59 ASP HN . 7188 1
331 . 1 1 59 59 ASP HA H 1 4.430 0.02 . 1 . . . . 59 ASP HA . 7188 1
332 . 1 1 59 59 ASP C C 13 176.460 0.2 . 1 . . . . 59 ASP C . 7188 1
333 . 1 1 59 59 ASP CA C 13 55.330 0.2 . 1 . . . . 59 ASP CA . 7188 1
334 . 1 1 59 59 ASP CB C 13 40.570 0.2 . 1 . . . . 59 ASP CB . 7188 1
335 . 1 1 59 59 ASP N N 15 121.550 0.38 . 1 . . . . 59 ASP N . 7188 1
336 . 1 1 60 60 ASN H H 1 8.240 0.02 . 1 . . . . 60 ASN HN . 7188 1
337 . 1 1 60 60 ASN HA H 1 4.550 0.02 . 1 . . . . 60 ASN HA . 7188 1
338 . 1 1 60 60 ASN C C 13 174.140 0.2 . 1 . . . . 60 ASN C . 7188 1
339 . 1 1 60 60 ASN CA C 13 53.430 0.2 . 1 . . . . 60 ASN CA . 7188 1
340 . 1 1 60 60 ASN CB C 13 38.490 0.2 . 1 . . . . 60 ASN CB . 7188 1
341 . 1 1 60 60 ASN N N 15 115.440 0.38 . 1 . . . . 60 ASN N . 7188 1
342 . 1 1 61 61 ARG H H 1 7.520 0.02 . 1 . . . . 61 ARG HN . 7188 1
343 . 1 1 61 61 ARG C C 13 174.910 0.2 . 1 . . . . 61 ARG C . 7188 1
344 . 1 1 61 61 ARG CA C 13 54.840 0.2 . 1 . . . . 61 ARG CA . 7188 1
345 . 1 1 61 61 ARG CB C 13 31.750 0.2 . 1 . . . . 61 ARG CB . 7188 1
346 . 1 1 61 61 ARG N N 15 116.970 0.38 . 1 . . . . 61 ARG N . 7188 1
347 . 1 1 62 62 ASP H H 1 8.470 0.02 . 1 . . . . 62 ASP HN . 7188 1
348 . 1 1 62 62 ASP HA H 1 4.440 0.02 . 1 . . . . 62 ASP HA . 7188 1
349 . 1 1 62 62 ASP C C 13 175.870 0.2 . 1 . . . . 62 ASP C . 7188 1
350 . 1 1 62 62 ASP CA C 13 54.670 0.2 . 1 . . . . 62 ASP CA . 7188 1
351 . 1 1 62 62 ASP CB C 13 41.370 0.2 . 1 . . . . 62 ASP CB . 7188 1
352 . 1 1 62 62 ASP N N 15 121.110 0.38 . 1 . . . . 62 ASP N . 7188 1
353 . 1 1 63 63 ASP H H 1 8.550 0.02 . 1 . . . . 63 ASP HN . 7188 1
354 . 1 1 63 63 ASP HA H 1 4.470 0.02 . 1 . . . . 63 ASP HA . 7188 1
355 . 1 1 63 63 ASP C C 13 174.520 0.2 . 1 . . . . 63 ASP C . 7188 1
356 . 1 1 63 63 ASP CA C 13 52.760 0.2 . 1 . . . . 63 ASP CA . 7188 1
357 . 1 1 63 63 ASP CB C 13 39.200 0.2 . 1 . . . . 63 ASP CB . 7188 1
358 . 1 1 63 63 ASP N N 15 123.850 0.38 . 1 . . . . 63 ASP N . 7188 1
359 . 1 1 64 64 SER H H 1 7.880 0.02 . 1 . . . . 64 SER HN . 7188 1
360 . 1 1 64 64 SER CA C 13 56.460 0.2 . 1 . . . . 64 SER CA . 7188 1
361 . 1 1 64 64 SER CB C 13 63.690 0.2 . 1 . . . . 64 SER CB . 7188 1
362 . 1 1 64 64 SER N N 15 117.180 0.38 . 1 . . . . 64 SER N . 7188 1
363 . 1 1 65 65 PRO HA H 1 4.130 0.02 . 1 . . . . 65 PRO HA . 7188 1
364 . 1 1 65 65 PRO C C 13 177.710 0.2 . 1 . . . . 65 PRO C . 7188 1
365 . 1 1 65 65 PRO CA C 13 65.840 0.2 . 1 . . . . 65 PRO CA . 7188 1
366 . 1 1 65 65 PRO CB C 13 32.790 0.2 . 1 . . . . 65 PRO CB . 7188 1
367 . 1 1 66 66 GLU H H 1 8.940 0.02 . 1 . . . . 66 GLU HN . 7188 1
368 . 1 1 66 66 GLU HA H 1 3.710 0.02 . 1 . . . . 66 GLU HA . 7188 1
369 . 1 1 66 66 GLU C C 13 179.640 0.2 . 1 . . . . 66 GLU C . 7188 1
370 . 1 1 66 66 GLU CA C 13 61.260 0.2 . 1 . . . . 66 GLU CA . 7188 1
371 . 1 1 66 66 GLU CB C 13 28.410 0.2 . 1 . . . . 66 GLU CB . 7188 1
372 . 1 1 66 66 GLU N N 15 115.890 0.38 . 1 . . . . 66 GLU N . 7188 1
373 . 1 1 67 67 GLY H H 1 8.410 0.02 . 1 . . . . 67 GLY HN . 7188 1
374 . 1 1 67 67 GLY HA2 H 1 3.980 0.02 . 2 . . . . 67 GLY HA2 . 7188 1
375 . 1 1 67 67 GLY C C 13 176.490 0.2 . 1 . . . . 67 GLY C . 7188 1
376 . 1 1 67 67 GLY CA C 13 46.830 0.2 . 1 . . . . 67 GLY CA . 7188 1
377 . 1 1 67 67 GLY N N 15 111.840 0.38 . 1 . . . . 67 GLY N . 7188 1
378 . 1 1 68 68 ILE H H 1 8.190 0.02 . 1 . . . . 68 ILE HN . 7188 1
379 . 1 1 68 68 ILE HA H 1 3.580 0.02 . 1 . . . . 68 ILE HA . 7188 1
380 . 1 1 68 68 ILE C C 13 178.140 0.2 . 1 . . . . 68 ILE C . 7188 1
381 . 1 1 68 68 ILE CA C 13 66.110 0.2 . 1 . . . . 68 ILE CA . 7188 1
382 . 1 1 68 68 ILE CB C 13 38.010 0.2 . 1 . . . . 68 ILE CB . 7188 1
383 . 1 1 68 68 ILE N N 15 124.200 0.38 . 1 . . . . 68 ILE N . 7188 1
384 . 1 1 69 69 VAL H H 1 8.250 0.02 . 1 . . . . 69 VAL HN . 7188 1
385 . 1 1 69 69 VAL HA H 1 3.500 0.02 . 1 . . . . 69 VAL HA . 7188 1
386 . 1 1 69 69 VAL C C 13 177.000 0.2 . 1 . . . . 69 VAL C . 7188 1
387 . 1 1 69 69 VAL CA C 13 68.200 0.2 . 1 . . . . 69 VAL CA . 7188 1
388 . 1 1 69 69 VAL CB C 13 31.560 0.2 . 1 . . . . 69 VAL CB . 7188 1
389 . 1 1 69 69 VAL N N 15 118.870 0.38 . 1 . . . . 69 VAL N . 7188 1
390 . 1 1 70 70 LYS H H 1 7.910 0.02 . 1 . . . . 70 LYS HN . 7188 1
391 . 1 1 70 70 LYS HA H 1 3.950 0.02 . 1 . . . . 70 LYS HA . 7188 1
392 . 1 1 70 70 LYS C C 13 178.010 0.2 . 1 . . . . 70 LYS C . 7188 1
393 . 1 1 70 70 LYS CA C 13 60.360 0.2 . 1 . . . . 70 LYS CA . 7188 1
394 . 1 1 70 70 LYS CB C 13 32.600 0.2 . 1 . . . . 70 LYS CB . 7188 1
395 . 1 1 70 70 LYS N N 15 120.030 0.38 . 1 . . . . 70 LYS N . 7188 1
396 . 1 1 71 71 GLU H H 1 7.690 0.02 . 1 . . . . 71 GLU HN . 7188 1
397 . 1 1 71 71 GLU HA H 1 3.920 0.02 . 1 . . . . 71 GLU HA . 7188 1
398 . 1 1 71 71 GLU C C 13 179.500 0.2 . 1 . . . . 71 GLU C . 7188 1
399 . 1 1 71 71 GLU CA C 13 59.690 0.2 . 1 . . . . 71 GLU CA . 7188 1
400 . 1 1 71 71 GLU CB C 13 28.720 0.2 . 1 . . . . 71 GLU CB . 7188 1
401 . 1 1 71 71 GLU N N 15 119.040 0.38 . 1 . . . . 71 GLU N . 7188 1
402 . 1 1 72 72 ILE H H 1 8.490 0.02 . 1 . . . . 72 ILE HN . 7188 1
403 . 1 1 72 72 ILE HA H 1 3.680 0.02 . 1 . . . . 72 ILE HA . 7188 1
404 . 1 1 72 72 ILE C C 13 177.570 0.2 . 1 . . . . 72 ILE C . 7188 1
405 . 1 1 72 72 ILE CA C 13 65.700 0.2 . 1 . . . . 72 ILE CA . 7188 1
406 . 1 1 72 72 ILE CB C 13 37.990 0.2 . 1 . . . . 72 ILE CB . 7188 1
407 . 1 1 72 72 ILE N N 15 118.970 0.38 . 1 . . . . 72 ILE N . 7188 1
408 . 1 1 73 73 LYS H H 1 9.160 0.02 . 1 . . . . 73 LYS HN . 7188 1
409 . 1 1 73 73 LYS HA H 1 4.210 0.02 . 1 . . . . 73 LYS HA . 7188 1
410 . 1 1 73 73 LYS C C 13 180.270 0.2 . 1 . . . . 73 LYS C . 7188 1
411 . 1 1 73 73 LYS CA C 13 59.890 0.2 . 1 . . . . 73 LYS CA . 7188 1
412 . 1 1 73 73 LYS CB C 13 33.160 0.2 . 1 . . . . 73 LYS CB . 7188 1
413 . 1 1 73 73 LYS N N 15 119.900 0.38 . 1 . . . . 73 LYS N . 7188 1
414 . 1 1 74 74 GLU H H 1 8.490 0.02 . 1 . . . . 74 GLU HN . 7188 1
415 . 1 1 74 74 GLU HA H 1 4.020 0.02 . 1 . . . . 74 GLU HA . 7188 1
416 . 1 1 74 74 GLU C C 13 179.200 0.2 . 1 . . . . 74 GLU C . 7188 1
417 . 1 1 74 74 GLU CA C 13 59.490 0.2 . 1 . . . . 74 GLU CA . 7188 1
418 . 1 1 74 74 GLU CB C 13 29.440 0.2 . 1 . . . . 74 GLU CB . 7188 1
419 . 1 1 74 74 GLU N N 15 119.180 0.38 . 1 . . . . 74 GLU N . 7188 1
420 . 1 1 75 75 TRP H H 1 8.770 0.02 . 1 . . . . 75 TRP HN . 7188 1
421 . 1 1 75 75 TRP HA H 1 4.130 0.02 . 1 . . . . 75 TRP HA . 7188 1
422 . 1 1 75 75 TRP C C 13 179.860 0.2 . 1 . . . . 75 TRP C . 7188 1
423 . 1 1 75 75 TRP CA C 13 63.050 0.2 . 1 . . . . 75 TRP CA . 7188 1
424 . 1 1 75 75 TRP CB C 13 29.270 0.2 . 1 . . . . 75 TRP CB . 7188 1
425 . 1 1 75 75 TRP N N 15 122.590 0.38 . 1 . . . . 75 TRP N . 7188 1
426 . 1 1 76 76 ARG H H 1 9.090 0.02 . 1 . . . . 76 ARG HN . 7188 1
427 . 1 1 76 76 ARG C C 13 178.080 0.2 . 1 . . . . 76 ARG C . 7188 1
428 . 1 1 76 76 ARG CA C 13 60.820 0.2 . 1 . . . . 76 ARG CA . 7188 1
429 . 1 1 76 76 ARG CB C 13 28.500 0.2 . 1 . . . . 76 ARG CB . 7188 1
430 . 1 1 76 76 ARG N N 15 118.520 0.38 . 1 . . . . 76 ARG N . 7188 1
431 . 1 1 77 77 ALA H H 1 7.710 0.02 . 1 . . . . 77 ALA HN . 7188 1
432 . 1 1 77 77 ALA C C 13 181.410 0.2 . 1 . . . . 77 ALA C . 7188 1
433 . 1 1 77 77 ALA CA C 13 55.160 0.2 . 1 . . . . 77 ALA CA . 7188 1
434 . 1 1 77 77 ALA CB C 13 17.960 0.2 . 1 . . . . 77 ALA CB . 7188 1
435 . 1 1 77 77 ALA N N 15 120.240 0.38 . 1 . . . . 77 ALA N . 7188 1
436 . 1 1 78 78 ALA H H 1 7.880 0.02 . 1 . . . . 78 ALA HN . 7188 1
437 . 1 1 78 78 ALA C C 13 178.250 0.2 . 1 . . . . 78 ALA C . 7188 1
438 . 1 1 78 78 ALA CA C 13 54.100 0.2 . 1 . . . . 78 ALA CA . 7188 1
439 . 1 1 78 78 ALA CB C 13 18.110 0.2 . 1 . . . . 78 ALA CB . 7188 1
440 . 1 1 78 78 ALA N N 15 120.560 0.38 . 1 . . . . 78 ALA N . 7188 1
441 . 1 1 79 79 ASN H H 1 6.960 0.02 . 1 . . . . 79 ASN HN . 7188 1
442 . 1 1 79 79 ASN HA H 1 4.410 0.02 . 1 . . . . 79 ASN HA . 7188 1
443 . 1 1 79 79 ASN C C 13 174.020 0.2 . 1 . . . . 79 ASN C . 7188 1
444 . 1 1 79 79 ASN CA C 13 53.150 0.2 . 1 . . . . 79 ASN CA . 7188 1
445 . 1 1 79 79 ASN CB C 13 39.170 0.2 . 1 . . . . 79 ASN CB . 7188 1
446 . 1 1 79 79 ASN N N 15 113.400 0.38 . 1 . . . . 79 ASN N . 7188 1
447 . 1 1 80 80 GLY H H 1 7.480 0.02 . 1 . . . . 80 GLY HN . 7188 1
448 . 1 1 80 80 GLY C C 13 174.430 0.2 . 1 . . . . 80 GLY C . 7188 1
449 . 1 1 80 80 GLY CA C 13 47.110 0.2 . 1 . . . . 80 GLY CA . 7188 1
450 . 1 1 80 80 GLY N N 15 108.190 0.38 . 1 . . . . 80 GLY N . 7188 1
451 . 1 1 81 81 LYS H H 1 8.000 0.02 . 1 . . . . 81 LYS HN . 7188 1
452 . 1 1 81 81 LYS CA C 13 53.280 0.2 . 1 . . . . 81 LYS CA . 7188 1
453 . 1 1 81 81 LYS CB C 13 32.640 0.2 . 1 . . . . 81 LYS CB . 7188 1
454 . 1 1 81 81 LYS N N 15 119.240 0.38 . 1 . . . . 81 LYS N . 7188 1
455 . 1 1 82 82 PRO HA H 1 4.200 0.02 . 1 . . . . 82 PRO HA . 7188 1
456 . 1 1 82 82 PRO C C 13 176.650 0.2 . 1 . . . . 82 PRO C . 7188 1
457 . 1 1 82 82 PRO CA C 13 63.350 0.2 . 1 . . . . 82 PRO CA . 7188 1
458 . 1 1 82 82 PRO CB C 13 32.780 0.2 . 1 . . . . 82 PRO CB . 7188 1
459 . 1 1 83 83 GLY H H 1 8.320 0.02 . 1 . . . . 83 GLY HN . 7188 1
460 . 1 1 83 83 GLY HA2 H 1 3.790 0.02 . 2 . . . . 83 GLY HA2 . 7188 1
461 . 1 1 83 83 GLY C C 13 173.370 0.2 . 1 . . . . 83 GLY C . 7188 1
462 . 1 1 83 83 GLY CA C 13 43.210 0.2 . 1 . . . . 83 GLY CA . 7188 1
463 . 1 1 83 83 GLY N N 15 110.590 0.38 . 1 . . . . 83 GLY N . 7188 1
464 . 1 1 84 84 PHE H H 1 7.810 0.02 . 1 . . . . 84 PHE HN . 7188 1
465 . 1 1 84 84 PHE HA H 1 4.450 0.02 . 1 . . . . 84 PHE HA . 7188 1
466 . 1 1 84 84 PHE C C 13 176.950 0.2 . 1 . . . . 84 PHE C . 7188 1
467 . 1 1 84 84 PHE CA C 13 59.080 0.2 . 1 . . . . 84 PHE CA . 7188 1
468 . 1 1 84 84 PHE CB C 13 39.780 0.2 . 1 . . . . 84 PHE CB . 7188 1
469 . 1 1 84 84 PHE N N 15 116.270 0.38 . 1 . . . . 84 PHE N . 7188 1
470 . 1 1 85 85 LYS H H 1 8.510 0.02 . 1 . . . . 85 LYS HN . 7188 1
471 . 1 1 85 85 LYS HA H 1 4.090 0.02 . 1 . . . . 85 LYS HA . 7188 1
472 . 1 1 85 85 LYS C C 13 176.500 0.2 . 1 . . . . 85 LYS C . 7188 1
473 . 1 1 85 85 LYS CA C 13 57.230 0.2 . 1 . . . . 85 LYS CA . 7188 1
474 . 1 1 85 85 LYS CB C 13 32.710 0.2 . 1 . . . . 85 LYS CB . 7188 1
475 . 1 1 85 85 LYS N N 15 123.950 0.38 . 1 . . . . 85 LYS N . 7188 1
476 . 1 1 86 86 GLN H H 1 8.610 0.02 . 1 . . . . 86 GLN HN . 7188 1
477 . 1 1 86 86 GLN HA H 1 4.220 0.02 . 1 . . . . 86 GLN HA . 7188 1
478 . 1 1 86 86 GLN C C 13 175.260 0.2 . 1 . . . . 86 GLN C . 7188 1
479 . 1 1 86 86 GLN CA C 13 56.360 0.2 . 1 . . . . 86 GLN CA . 7188 1
480 . 1 1 86 86 GLN CB C 13 29.570 0.2 . 1 . . . . 86 GLN CB . 7188 1
481 . 1 1 86 86 GLN N N 15 125.310 0.38 . 1 . . . . 86 GLN N . 7188 1
482 . 1 1 87 87 GLY H H 1 8.010 0.02 . 1 . . . . 87 GLY HN . 7188 1
483 . 1 1 87 87 GLY CA C 13 46.160 0.2 . 1 . . . . 87 GLY CA . 7188 1
484 . 1 1 87 87 GLY N N 15 116.760 0.38 . 1 . . . . 87 GLY N . 7188 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_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 7188
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 'Im7 in 6M Urea'
_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
. '2D 15N-1H HSQC' 2 $sample_2 isotropic 7188 2
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 1 1 MET C C 13 172.419 0.2 . 1 . . . . 1 MET C . 7188 2
2 . 1 1 1 1 MET CA C 13 54.829 0.2 . 1 . . . . 1 MET CA . 7188 2
3 . 1 1 1 1 MET CB C 13 32.894 0.2 . 1 . . . . 1 MET CB . 7188 2
4 . 1 1 2 2 GLU C C 13 175.777 0.2 . 1 . . . . 2 GLU C . 7188 2
5 . 1 1 2 2 GLU CA C 13 55.912 0.2 . 1 . . . . 2 GLU CA . 7188 2
6 . 1 1 2 2 GLU CB C 13 30.371 0.2 . 1 . . . . 2 GLU CB . 7188 2
7 . 1 1 3 3 LEU C C 13 177.186 0.2 . 1 . . . . 3 LEU C . 7188 2
8 . 1 1 3 3 LEU CA C 13 54.806 0.2 . 1 . . . . 3 LEU CA . 7188 2
9 . 1 1 3 3 LEU CB C 13 42.149 0.2 . 1 . . . . 3 LEU CB . 7188 2
10 . 1 1 4 4 LYS C C 13 176.261 0.2 . 1 . . . . 4 LYS C . 7188 2
11 . 1 1 4 4 LYS CA C 13 56.074 0.2 . 1 . . . . 4 LYS CA . 7188 2
12 . 1 1 4 4 LYS CB C 13 33.076 0.2 . 1 . . . . 4 LYS CB . 7188 2
13 . 1 1 5 5 ASN C C 13 175.182 0.2 . 1 . . . . 5 ASN C . 7188 2
14 . 1 1 5 5 ASN CA C 13 53.013 0.2 . 1 . . . . 5 ASN CA . 7188 2
15 . 1 1 5 5 ASN CB C 13 38.906 0.2 . 1 . . . . 5 ASN CB . 7188 2
16 . 1 1 6 6 SER C C 13 174.467 0.2 . 1 . . . . 6 SER C . 7188 2
17 . 1 1 6 6 SER CA C 13 58.138 0.2 . 1 . . . . 6 SER CA . 7188 2
18 . 1 1 6 6 SER CB C 13 63.762 0.2 . 1 . . . . 6 SER CB . 7188 2
19 . 1 1 7 7 ILE C C 13 176.294 0.2 . 1 . . . . 7 ILE C . 7188 2
20 . 1 1 7 7 ILE CA C 13 61.161 0.2 . 1 . . . . 7 ILE CA . 7188 2
21 . 1 1 7 7 ILE CB C 13 38.682 0.2 . 1 . . . . 7 ILE CB . 7188 2
22 . 1 1 8 8 SER C C 13 174.048 0.2 . 1 . . . . 8 SER C . 7188 2
23 . 1 1 8 8 SER CA C 13 58.113 0.2 . 1 . . . . 8 SER CA . 7188 2
24 . 1 1 8 8 SER CB C 13 63.747 0.2 . 1 . . . . 8 SER CB . 7188 2
25 . 1 1 9 9 ASP C C 13 175.766 0.2 . 1 . . . . 9 ASP C . 7188 2
26 . 1 1 9 9 ASP CA C 13 54.159 0.2 . 1 . . . . 9 ASP CA . 7188 2
27 . 1 1 9 9 ASP CB C 13 41.059 0.2 . 1 . . . . 9 ASP CB . 7188 2
28 . 1 1 10 10 TYR C C 13 175.931 0.2 . 1 . . . . 10 TYR C . 7188 2
29 . 1 1 10 10 TYR CA C 13 57.831 0.2 . 1 . . . . 10 TYR CA . 7188 2
30 . 1 1 10 10 TYR CB C 13 38.740 0.2 . 1 . . . . 10 TYR CB . 7188 2
31 . 1 1 11 11 THR C C 13 174.169 0.2 . 1 . . . . 11 THR C . 7188 2
32 . 1 1 11 11 THR CA C 13 61.428 0.2 . 1 . . . . 11 THR CA . 7188 2
33 . 1 1 11 11 THR CB C 13 69.859 0.2 . 1 . . . . 11 THR CB . 7188 2
34 . 1 1 12 12 GLU C C 13 176.305 0.2 . 1 . . . . 12 GLU C . 7188 2
35 . 1 1 12 12 GLU CA C 13 56.614 0.2 . 1 . . . . 12 GLU CA . 7188 2
36 . 1 1 12 12 GLU CB C 13 29.997 0.2 . 1 . . . . 12 GLU CB . 7188 2
37 . 1 1 13 13 ALA C C 13 177.836 0.2 . 1 . . . . 13 ALA C . 7188 2
38 . 1 1 13 13 ALA CA C 13 52.744 0.2 . 1 . . . . 13 ALA CA . 7188 2
39 . 1 1 13 13 ALA CB C 13 19.052 0.2 . 1 . . . . 13 ALA CB . 7188 2
40 . 1 1 14 14 GLU C C 13 176.349 0.2 . 1 . . . . 14 GLU C . 7188 2
41 . 1 1 14 14 GLU CA C 13 56.602 0.2 . 1 . . . . 14 GLU CA . 7188 2
42 . 1 1 14 14 GLU CB C 13 30.353 0.2 . 1 . . . . 14 GLU CB . 7188 2
43 . 1 1 15 15 PHE C C 13 175.491 0.2 . 1 . . . . 15 PHE C . 7188 2
44 . 1 1 15 15 PHE CA C 13 57.796 0.2 . 1 . . . . 15 PHE CA . 7188 2
45 . 1 1 15 15 PHE CB C 13 39.323 0.2 . 1 . . . . 15 PHE CB . 7188 2
46 . 1 1 16 16 VAL CA C 13 62.318 0.2 . 1 . . . . 16 VAL CA . 7188 2
47 . 1 1 16 16 VAL CB C 13 32.762 0.2 . 1 . . . . 16 VAL CB . 7188 2
48 . 1 1 17 17 GLN C C 13 175.744 0.2 . 1 . . . . 17 GLN C . 7188 2
49 . 1 1 17 17 GLN CA C 13 55.892 0.2 . 1 . . . . 17 GLN CA . 7188 2
50 . 1 1 17 17 GLN CB C 13 29.242 0.2 . 1 . . . . 17 GLN CB . 7188 2
51 . 1 1 18 18 LEU C C 13 177.164 0.2 . 1 . . . . 18 LEU C . 7188 2
52 . 1 1 18 18 LEU CA C 13 54.969 0.2 . 1 . . . . 18 LEU CA . 7188 2
53 . 1 1 18 18 LEU CB C 13 42.072 0.2 . 1 . . . . 18 LEU CB . 7188 2
54 . 1 1 19 19 LEU CA C 13 54.897 0.2 . 1 . . . . 19 LEU CA . 7188 2
55 . 1 1 19 19 LEU CB C 13 42.071 0.2 . 1 . . . . 19 LEU CB . 7188 2
56 . 1 1 20 20 LYS CA C 13 55.989 0.2 . 1 . . . . 20 LYS CA . 7188 2
57 . 1 1 20 20 LYS CB C 13 33.017 0.2 . 1 . . . . 20 LYS CB . 7188 2
58 . 1 1 21 21 GLU C C 13 174.213 0.2 . 1 . . . . 21 GLU C . 7188 2
59 . 1 1 21 21 GLU CA C 13 56.325 0.2 . 1 . . . . 21 GLU CA . 7188 2
60 . 1 1 21 21 GLU CB C 13 30.074 0.2 . 1 . . . . 21 GLU CB . 7188 2
61 . 1 1 22 22 ILE C C 13 176.283 0.2 . 1 . . . . 22 ILE C . 7188 2
62 . 1 1 22 22 ILE CA C 13 61.200 0.2 . 1 . . . . 22 ILE CA . 7188 2
63 . 1 1 22 22 ILE CB C 13 38.487 0.2 . 1 . . . . 22 ILE CB . 7188 2
64 . 1 1 23 23 GLU CA C 13 56.448 0.2 . 1 . . . . 23 GLU CA . 7188 2
65 . 1 1 23 23 GLU CB C 13 30.078 0.2 . 1 . . . . 23 GLU CB . 7188 2
66 . 1 1 24 24 LYS CA C 13 56.242 0.2 . 1 . . . . 24 LYS CA . 7188 2
67 . 1 1 24 24 LYS CB C 13 33.117 0.2 . 1 . . . . 24 LYS CB . 7188 2
68 . 1 1 25 25 GLU C C 13 176.151 0.2 . 1 . . . . 25 GLU C . 7188 2
69 . 1 1 25 25 GLU CA C 13 56.203 0.2 . 1 . . . . 25 GLU CA . 7188 2
70 . 1 1 25 25 GLU CB C 13 30.283 0.2 . 1 . . . . 25 GLU CB . 7188 2
71 . 1 1 26 26 ASN C C 13 175.028 0.2 . 1 . . . . 26 ASN C . 7188 2
72 . 1 1 26 26 ASN CA C 13 52.966 0.2 . 1 . . . . 26 ASN CA . 7188 2
73 . 1 1 26 26 ASN CB C 13 38.699 0.2 . 1 . . . . 26 ASN CB . 7188 2
74 . 1 1 27 27 VAL C C 13 175.667 0.2 . 1 . . . . 27 VAL C . 7188 2
75 . 1 1 27 27 VAL CA C 13 61.810 0.2 . 1 . . . . 27 VAL CA . 7188 2
76 . 1 1 27 27 VAL CB C 13 32.603 0.2 . 1 . . . . 27 VAL CB . 7188 2
77 . 1 1 28 28 ALA C C 13 177.351 0.2 . 1 . . . . 28 ALA C . 7188 2
78 . 1 1 28 28 ALA CA C 13 52.083 0.2 . 1 . . . . 28 ALA CA . 7188 2
79 . 1 1 28 28 ALA CB C 13 19.080 0.2 . 1 . . . . 28 ALA CB . 7188 2
80 . 1 1 29 29 ALA C C 13 177.891 0.2 . 1 . . . . 29 ALA C . 7188 2
81 . 1 1 29 29 ALA CA C 13 52.270 0.2 . 1 . . . . 29 ALA CA . 7188 2
82 . 1 1 29 29 ALA CB C 13 19.063 0.2 . 1 . . . . 29 ALA CB . 7188 2
83 . 1 1 30 30 THR C C 13 174.313 0.2 . 1 . . . . 30 THR C . 7188 2
84 . 1 1 30 30 THR CA C 13 61.247 0.2 . 1 . . . . 30 THR CA . 7188 2
85 . 1 1 30 30 THR CB C 13 69.679 0.2 . 1 . . . . 30 THR CB . 7188 2
86 . 1 1 31 31 ASP CA C 13 54.114 0.2 . 1 . . . . 31 ASP CA . 7188 2
87 . 1 1 31 31 ASP CB C 13 40.930 0.2 . 1 . . . . 31 ASP CB . 7188 2
88 . 1 1 32 32 ASP C C 13 176.107 0.2 . 1 . . . . 32 ASP C . 7188 2
89 . 1 1 32 32 ASP CA C 13 54.230 0.2 . 1 . . . . 32 ASP CA . 7188 2
90 . 1 1 32 32 ASP CB C 13 41.074 0.2 . 1 . . . . 32 ASP CB . 7188 2
91 . 1 1 33 33 VAL C C 13 176.030 0.2 . 1 . . . . 33 VAL C . 7188 2
92 . 1 1 33 33 VAL CA C 13 62.267 0.2 . 1 . . . . 33 VAL CA . 7188 2
93 . 1 1 33 33 VAL CB C 13 32.490 0.2 . 1 . . . . 33 VAL CB . 7188 2
94 . 1 1 34 34 LEU C C 13 177.010 0.2 . 1 . . . . 34 LEU C . 7188 2
95 . 1 1 34 34 LEU CA C 13 54.825 0.2 . 1 . . . . 34 LEU CA . 7188 2
96 . 1 1 34 34 LEU CB C 13 42.123 0.2 . 1 . . . . 34 LEU CB . 7188 2
97 . 1 1 35 35 ASP C C 13 176.272 0.2 . 1 . . . . 35 ASP C . 7188 2
98 . 1 1 35 35 ASP CA C 13 54.185 0.2 . 1 . . . . 35 ASP CA . 7188 2
99 . 1 1 35 35 ASP CB C 13 40.938 0.2 . 1 . . . . 35 ASP CB . 7188 2
100 . 1 1 36 36 VAL C C 13 176.272 0.2 . 1 . . . . 36 VAL C . 7188 2
101 . 1 1 36 36 VAL CA C 13 62.231 0.2 . 1 . . . . 36 VAL CA . 7188 2
102 . 1 1 36 36 VAL CB C 13 32.505 0.2 . 1 . . . . 36 VAL CB . 7188 2
103 . 1 1 37 37 LEU CA C 13 55.033 0.2 . 1 . . . . 37 LEU CA . 7188 2
104 . 1 1 37 37 LEU CB C 13 42.029 0.2 . 1 . . . . 37 LEU CB . 7188 2
105 . 1 1 38 38 LEU C C 13 177.219 0.2 . 1 . . . . 38 LEU C . 7188 2
106 . 1 1 38 38 LEU CA C 13 54.855 0.2 . 1 . . . . 38 LEU CA . 7188 2
107 . 1 1 38 38 LEU CB C 13 42.244 0.2 . 1 . . . . 38 LEU CB . 7188 2
108 . 1 1 39 39 GLU C C 13 176.063 0.2 . 1 . . . . 39 GLU C . 7188 2
109 . 1 1 39 39 GLU CA C 13 56.282 0.2 . 1 . . . . 39 GLU CA . 7188 2
110 . 1 1 39 39 GLU CB C 13 30.315 0.2 . 1 . . . . 39 GLU CB . 7188 2
111 . 1 1 40 40 HIS C C 13 176.559 0.2 . 1 . . . . 40 HIS C . 7188 2
112 . 1 1 40 40 HIS CA C 13 55.137 0.2 . 1 . . . . 40 HIS CA . 7188 2
113 . 1 1 40 40 HIS CB C 13 39.612 0.2 . 1 . . . . 40 HIS CB . 7188 2
114 . 1 1 41 41 PHE C C 13 175.226 0.2 . 1 . . . . 41 PHE C . 7188 2
115 . 1 1 41 41 PHE CA C 13 57.429 0.2 . 1 . . . . 41 PHE CA . 7188 2
116 . 1 1 41 41 PHE CB C 13 32.886 0.2 . 1 . . . . 41 PHE CB . 7188 2
117 . 1 1 42 42 VAL C C 13 175.303 0.2 . 1 . . . . 42 VAL C . 7188 2
118 . 1 1 42 42 VAL CA C 13 61.868 0.2 . 1 . . . . 42 VAL CA . 7188 2
119 . 1 1 42 42 VAL CB C 13 33.047 0.2 . 1 . . . . 42 VAL CB . 7188 2
120 . 1 1 43 43 LYS C C 13 176.228 0.2 . 1 . . . . 43 LYS C . 7188 2
121 . 1 1 43 43 LYS CA C 13 55.972 0.2 . 1 . . . . 43 LYS CA . 7188 2
122 . 1 1 43 43 LYS CB C 13 38.532 0.2 . 1 . . . . 43 LYS CB . 7188 2
123 . 1 1 44 44 ILE C C 13 176.261 0.2 . 1 . . . . 44 ILE C . 7188 2
124 . 1 1 44 44 ILE CA C 13 60.760 0.2 . 1 . . . . 44 ILE CA . 7188 2
125 . 1 1 44 44 ILE CB C 13 69.565 0.2 . 1 . . . . 44 ILE CB . 7188 2
126 . 1 1 45 45 THR C C 13 174.114 0.2 . 1 . . . . 45 THR C . 7188 2
127 . 1 1 45 45 THR CA C 13 61.313 0.2 . 1 . . . . 45 THR CA . 7188 2
128 . 1 1 45 45 THR CB C 13 30.392 0.2 . 1 . . . . 45 THR CB . 7188 2
129 . 1 1 46 46 GLU C C 13 175.744 0.2 . 1 . . . . 46 GLU C . 7188 2
130 . 1 1 46 46 GLU CA C 13 56.321 0.2 . 1 . . . . 46 GLU CA . 7188 2
131 . 1 1 47 47 HIS CA C 13 53.478 0.2 . 1 . . . . 47 HIS CA . 7188 2
132 . 1 1 47 47 HIS CB C 13 31.943 0.2 . 1 . . . . 47 HIS CB . 7188 2
133 . 1 1 48 48 PRO C C 13 176.702 0.2 . 1 . . . . 48 PRO C . 7188 2
134 . 1 1 48 48 PRO CA C 13 63.183 0.2 . 1 . . . . 48 PRO CA . 7188 2
135 . 1 1 48 48 PRO CB C 13 29.427 0.2 . 1 . . . . 48 PRO CB . 7188 2
136 . 1 1 49 49 ASP CA C 13 54.198 0.2 . 1 . . . . 49 ASP CA . 7188 2
137 . 1 1 49 49 ASP CB C 13 41.135 0.2 . 1 . . . . 49 ASP CB . 7188 2
138 . 1 1 50 50 GLY C C 13 174.511 0.2 . 1 . . . . 50 GLY C . 7188 2
139 . 1 1 50 50 GLY CA C 13 45.351 0.2 . 1 . . . . 50 GLY CA . 7188 2
140 . 1 1 51 51 THR CA C 13 61.855 0.2 . 1 . . . . 51 THR CA . 7188 2
141 . 1 1 51 51 THR CB C 13 69.757 0.2 . 1 . . . . 51 THR CB . 7188 2
142 . 1 1 52 52 ASP C C 13 175.843 0.2 . 1 . . . . 52 ASP C . 7188 2
143 . 1 1 52 52 ASP CA C 13 54.152 0.2 . 1 . . . . 52 ASP CA . 7188 2
144 . 1 1 52 52 ASP CB C 13 40.929 0.2 . 1 . . . . 52 ASP CB . 7188 2
145 . 1 1 53 53 LEU C C 13 176.702 0.2 . 1 . . . . 53 LEU C . 7188 2
146 . 1 1 53 53 LEU CA C 13 54.963 0.2 . 1 . . . . 53 LEU CA . 7188 2
147 . 1 1 53 53 LEU CB C 13 42.099 0.2 . 1 . . . . 53 LEU CB . 7188 2
148 . 1 1 54 54 ILE C C 13 175.248 0.2 . 1 . . . . 54 ILE C . 7188 2
149 . 1 1 54 54 ILE CA C 13 60.631 0.2 . 1 . . . . 54 ILE CA . 7188 2
150 . 1 1 54 54 ILE CB C 13 38.704 0.2 . 1 . . . . 54 ILE CB . 7188 2
151 . 1 1 55 55 TYR C C 13 174.544 0.2 . 1 . . . . 55 TYR C . 7188 2
152 . 1 1 55 55 TYR CA C 13 57.183 0.2 . 1 . . . . 55 TYR CA . 7188 2
153 . 1 1 55 55 TYR CB C 13 39.022 0.2 . 1 . . . . 55 TYR CB . 7188 2
154 . 1 1 56 56 TYR CA C 13 55.517 0.2 . 1 . . . . 56 TYR CA . 7188 2
155 . 1 1 56 56 TYR CB C 13 38.793 0.2 . 1 . . . . 56 TYR CB . 7188 2
156 . 1 1 57 57 PRO C C 13 176.746 0.2 . 1 . . . . 57 PRO C . 7188 2
157 . 1 1 57 57 PRO CA C 13 62.776 0.2 . 1 . . . . 57 PRO CA . 7188 2
158 . 1 1 57 57 PRO CB C 13 32.003 0.2 . 1 . . . . 57 PRO CB . 7188 2
159 . 1 1 58 58 SER C C 13 174.280 0.2 . 1 . . . . 58 SER C . 7188 2
160 . 1 1 58 58 SER CA C 13 58.004 0.2 . 1 . . . . 58 SER CA . 7188 2
161 . 1 1 58 58 SER CB C 13 63.762 0.2 . 1 . . . . 58 SER CB . 7188 2
162 . 1 1 59 59 ASP C C 13 175.799 0.2 . 1 . . . . 59 ASP C . 7188 2
163 . 1 1 59 59 ASP CA C 13 54.004 0.2 . 1 . . . . 59 ASP CA . 7188 2
164 . 1 1 59 59 ASP CB C 13 41.066 0.2 . 1 . . . . 59 ASP CB . 7188 2
165 . 1 1 60 60 ASN C C 13 175.303 0.2 . 1 . . . . 60 ASN C . 7188 2
166 . 1 1 60 60 ASN CA C 13 53.049 0.2 . 1 . . . . 60 ASN CA . 7188 2
167 . 1 1 60 60 ASN CB C 13 38.654 0.2 . 1 . . . . 60 ASN CB . 7188 2
168 . 1 1 61 61 ARG C C 13 176.107 0.2 . 1 . . . . 61 ARG C . 7188 2
169 . 1 1 61 61 ARG CA C 13 56.198 0.2 . 1 . . . . 61 ARG CA . 7188 2
170 . 1 1 61 61 ARG CB C 13 30.661 0.2 . 1 . . . . 61 ARG CB . 7188 2
171 . 1 1 62 62 ASP CA C 13 54.212 0.2 . 1 . . . . 62 ASP CA . 7188 2
172 . 1 1 62 62 ASP CB C 13 41.066 0.2 . 1 . . . . 62 ASP CB . 7188 2
173 . 1 1 63 63 ASP C C 13 175.997 0.2 . 1 . . . . 63 ASP C . 7188 2
174 . 1 1 63 63 ASP CA C 13 53.714 0.2 . 1 . . . . 63 ASP CA . 7188 2
175 . 1 1 63 63 ASP CB C 13 40.859 0.2 . 1 . . . . 63 ASP CB . 7188 2
176 . 1 1 64 64 SER CA C 13 56.740 0.2 . 1 . . . . 64 SER CA . 7188 2
177 . 1 1 64 64 SER CB C 13 63.262 0.2 . 1 . . . . 64 SER CB . 7188 2
178 . 1 1 65 65 PRO C C 13 177.021 0.2 . 1 . . . . 65 PRO C . 7188 2
179 . 1 1 65 65 PRO CA C 13 63.319 0.2 . 1 . . . . 65 PRO CA . 7188 2
180 . 1 1 65 65 PRO CB C 13 31.903 0.2 . 1 . . . . 65 PRO CB . 7188 2
181 . 1 1 66 66 GLU C C 13 177.021 0.2 . 1 . . . . 66 GLU C . 7188 2
182 . 1 1 66 66 GLU CA C 13 56.703 0.2 . 1 . . . . 66 GLU CA . 7188 2
183 . 1 1 66 66 GLU CB C 13 30.043 0.2 . 1 . . . . 66 GLU CB . 7188 2
184 . 1 1 67 67 GLY C C 13 173.806 0.2 . 1 . . . . 67 GLY C . 7188 2
185 . 1 1 67 67 GLY CA C 13 45.059 0.2 . 1 . . . . 67 GLY CA . 7188 2
186 . 1 1 68 68 ILE C C 13 176.140 0.2 . 1 . . . . 68 ILE C . 7188 2
187 . 1 1 68 68 ILE CA C 13 60.784 0.2 . 1 . . . . 68 ILE CA . 7188 2
188 . 1 1 68 68 ILE CB C 13 38.527 0.2 . 1 . . . . 68 ILE CB . 7188 2
189 . 1 1 69 69 VAL C C 13 176.019 0.2 . 1 . . . . 69 VAL C . 7188 2
190 . 1 1 69 69 VAL CA C 13 62.181 0.2 . 1 . . . . 69 VAL CA . 7188 2
191 . 1 1 69 69 VAL CB C 13 32.805 0.2 . 1 . . . . 69 VAL CB . 7188 2
192 . 1 1 70 70 LYS CA C 13 56.076 0.2 . 1 . . . . 70 LYS CA . 7188 2
193 . 1 1 70 70 LYS CB C 13 33.085 0.2 . 1 . . . . 70 LYS CB . 7188 2
194 . 1 1 71 71 GLU C C 13 176.074 0.2 . 1 . . . . 71 GLU C . 7188 2
195 . 1 1 71 71 GLU CA C 13 56.065 0.2 . 1 . . . . 71 GLU CA . 7188 2
196 . 1 1 71 71 GLU CB C 13 29.761 0.2 . 1 . . . . 71 GLU CB . 7188 2
197 . 1 1 72 72 ILE C C 13 176.107 0.2 . 1 . . . . 72 ILE C . 7188 2
198 . 1 1 72 72 ILE CA C 13 60.858 0.2 . 1 . . . . 72 ILE CA . 7188 2
199 . 1 1 72 72 ILE CB C 13 38.290 0.2 . 1 . . . . 72 ILE CB . 7188 2
200 . 1 1 73 73 LYS CA C 13 56.074 0.2 . 1 . . . . 73 LYS CA . 7188 2
201 . 1 1 73 73 LYS CB C 13 33.094 0.2 . 1 . . . . 73 LYS CB . 7188 2
202 . 1 1 74 74 GLU C C 13 175.898 0.2 . 1 . . . . 74 GLU C . 7188 2
203 . 1 1 74 74 GLU CA C 13 56.263 0.2 . 1 . . . . 74 GLU CA . 7188 2
204 . 1 1 74 74 GLU CB C 13 30.334 0.2 . 1 . . . . 74 GLU CB . 7188 2
205 . 1 1 75 75 TRP C C 13 175.997 0.2 . 1 . . . . 75 TRP C . 7188 2
206 . 1 1 75 75 TRP CA C 13 57.680 0.2 . 1 . . . . 75 TRP CA . 7188 2
207 . 1 1 75 75 TRP CB C 13 29.430 0.2 . 1 . . . . 75 TRP CB . 7188 2
208 . 1 1 76 76 ARG C C 13 175.237 0.2 . 1 . . . . 76 ARG C . 7188 2
209 . 1 1 76 76 ARG CA C 13 55.330 0.2 . 1 . . . . 76 ARG CA . 7188 2
210 . 1 1 76 76 ARG CB C 13 31.266 0.2 . 1 . . . . 76 ARG CB . 7188 2
211 . 1 1 77 77 ALA CA C 13 52.225 0.2 . 1 . . . . 77 ALA CA . 7188 2
212 . 1 1 77 77 ALA CB C 13 18.793 0.2 . 1 . . . . 77 ALA CB . 7188 2
213 . 1 1 78 78 ALA C C 13 177.494 0.2 . 1 . . . . 78 ALA C . 7188 2
214 . 1 1 78 78 ALA CA C 13 52.518 0.2 . 1 . . . . 78 ALA CA . 7188 2
215 . 1 1 78 78 ALA CB C 13 18.866 0.2 . 1 . . . . 78 ALA CB . 7188 2
216 . 1 1 79 79 ASN C C 13 175.656 0.2 . 1 . . . . 79 ASN C . 7188 2
217 . 1 1 79 79 ASN CA C 13 52.945 0.2 . 1 . . . . 79 ASN CA . 7188 2
218 . 1 1 79 79 ASN CB C 13 38.699 0.2 . 1 . . . . 79 ASN CB . 7188 2
219 . 1 1 80 80 GLY C C 13 173.520 0.2 . 1 . . . . 80 GLY C . 7188 2
220 . 1 1 80 80 GLY CA C 13 44.943 0.2 . 1 . . . . 80 GLY CA . 7188 2
221 . 1 1 81 81 LYS CA C 13 54.396 0.2 . 1 . . . . 81 LYS CA . 7188 2
222 . 1 1 81 81 LYS CB C 13 32.688 0.2 . 1 . . . . 81 LYS CB . 7188 2
223 . 1 1 82 82 PRO CA C 13 63.136 0.2 . 1 . . . . 82 PRO CA . 7188 2
224 . 1 1 82 82 PRO CB C 13 32.028 0.2 . 1 . . . . 82 PRO CB . 7188 2
225 . 1 1 83 83 GLY C C 13 173.619 0.2 . 1 . . . . 83 GLY C . 7188 2
226 . 1 1 83 83 GLY CA C 13 44.729 0.2 . 1 . . . . 83 GLY CA . 7188 2
227 . 1 1 84 84 PHE C C 13 175.458 0.2 . 1 . . . . 84 PHE C . 7188 2
228 . 1 1 84 84 PHE CA C 13 57.534 0.2 . 1 . . . . 84 PHE CA . 7188 2
229 . 1 1 84 84 PHE CB C 13 39.707 0.2 . 1 . . . . 84 PHE CB . 7188 2
230 . 1 1 85 85 LYS C C 13 175.744 0.2 . 1 . . . . 85 LYS C . 7188 2
231 . 1 1 85 85 LYS CA C 13 56.032 0.2 . 1 . . . . 85 LYS CA . 7188 2
232 . 1 1 85 85 LYS CB C 13 33.207 0.2 . 1 . . . . 85 LYS CB . 7188 2
233 . 1 1 86 86 GLN C C 13 175.292 0.2 . 1 . . . . 86 GLN C . 7188 2
234 . 1 1 86 86 GLN CA C 13 55.924 0.2 . 1 . . . . 86 GLN CA . 7188 2
235 . 1 1 86 86 GLN CB C 13 30.140 0.2 . 1 . . . . 86 GLN CB . 7188 2
236 . 1 1 87 87 GLY CA C 13 46.345 0.2 . 1 . . . . 87 GLY CA . 7188 2
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