Content for NMR-STAR saveframe, "assigned_chem_shift_list_298K"
save_assigned_chem_shift_list_298K
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_298K
_Assigned_chem_shift_list.Entry_ID 28092
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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
10 '2D 1H-15N HSQC' . . . 28092 2
11 '3D HNCACB' . . . 28092 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 . 1 . 1 1 1 MET CA C 13 55.026 0.3 . 1 . . . . . 1 M CA . 28092 2
2 . 1 . 1 1 1 MET CB C 13 32.746 0.3 . 1 . . . . . 1 M CB . 28092 2
3 . 1 . 1 2 2 ILE H H 1 8.444 0.01 . 1 . . . . . 2 I H . 28092 2
4 . 1 . 1 2 2 ILE CA C 13 60.462 0.3 . 1 . . . . . 2 I CA . 28092 2
5 . 1 . 1 2 2 ILE CB C 13 39.819 0.3 . 1 . . . . . 2 I CB . 28092 2
6 . 1 . 1 2 2 ILE N N 15 125.110 0.2 . 1 . . . . . 2 I N . 28092 2
7 . 1 . 1 3 3 LYS H H 1 8.679 0.01 . 1 . . . . . 3 K H . 28092 2
8 . 1 . 1 3 3 LYS CA C 13 54.240 0.3 . 1 . . . . . 3 K CA . 28092 2
9 . 1 . 1 3 3 LYS CB C 13 34.979 0.3 . 1 . . . . . 3 K CB . 28092 2
10 . 1 . 1 3 3 LYS N N 15 123.495 0.2 . 1 . . . . . 3 K N . 28092 2
11 . 1 . 1 4 4 CYS H H 1 9.321 0.01 . 1 . . . . . 4 C H . 28092 2
12 . 1 . 1 4 4 CYS N N 15 119.909 0.2 . 1 . . . . . 4 C N . 28092 2
13 . 1 . 1 5 5 SER CA C 13 61.387 0.3 . 1 . . . . . 5 S CA . 28092 2
14 . 1 . 1 6 6 ASP H H 1 7.158 0.01 . 1 . . . . . 6 D H . 28092 2
15 . 1 . 1 6 6 ASP CA C 13 57.338 0.3 . 1 . . . . . 6 D CA . 28092 2
16 . 1 . 1 6 6 ASP CB C 13 41.365 0.3 . 1 . . . . . 6 D CB . 28092 2
17 . 1 . 1 6 6 ASP N N 15 121.974 0.2 . 1 . . . . . 6 D N . 28092 2
18 . 1 . 1 7 7 VAL H H 1 7.411 0.01 . 1 . . . . . 7 V H . 28092 2
19 . 1 . 1 7 7 VAL CA C 13 66.753 0.3 . 1 . . . . . 7 V CA . 28092 2
20 . 1 . 1 7 7 VAL CB C 13 31.276 0.3 . 1 . . . . . 7 V CB . 28092 2
21 . 1 . 1 7 7 VAL N N 15 119.589 0.2 . 1 . . . . . 7 V N . 28092 2
22 . 1 . 1 8 8 SER H H 1 8.579 0.01 . 1 . . . . . 8 S H . 28092 2
23 . 1 . 1 8 8 SER CA C 13 62.380 0.3 . 1 . . . . . 8 S CA . 28092 2
24 . 1 . 1 8 8 SER N N 15 113.739 0.2 . 1 . . . . . 8 S N . 28092 2
25 . 1 . 1 9 9 ASN H H 1 7.759 0.01 . 1 . . . . . 9 N H . 28092 2
26 . 1 . 1 9 9 ASN HD21 H 1 7.740 0.01 . 2 . . . . . 9 N HD21 . 28092 2
27 . 1 . 1 9 9 ASN HD22 H 1 6.982 0.01 . 2 . . . . . 9 N HD22 . 28092 2
28 . 1 . 1 9 9 ASN CA C 13 56.364 0.3 . 1 . . . . . 9 N CA . 28092 2
29 . 1 . 1 9 9 ASN CB C 13 38.492 0.3 . 1 . . . . . 9 N CB . 28092 2
30 . 1 . 1 9 9 ASN N N 15 118.988 0.2 . 1 . . . . . 9 N N . 28092 2
31 . 1 . 1 9 9 ASN ND2 N 15 112.766 0.2 . 1 . . . . . 9 N ND2 . 28092 2
32 . 1 . 1 10 10 LYS H H 1 7.933 0.01 . 1 . . . . . 10 K H . 28092 2
33 . 1 . 1 10 10 LYS CA C 13 58.612 0.3 . 1 . . . . . 10 K CA . 28092 2
34 . 1 . 1 10 10 LYS CB C 13 32.318 0.3 . 1 . . . . . 10 K CB . 28092 2
35 . 1 . 1 10 10 LYS N N 15 118.737 0.2 . 1 . . . . . 10 K N . 28092 2
36 . 1 . 1 11 11 ILE H H 1 7.504 0.01 . 1 . . . . . 11 I H . 28092 2
37 . 1 . 1 11 11 ILE CA C 13 60.207 0.3 . 1 . . . . . 11 I CA . 28092 2
38 . 1 . 1 11 11 ILE CB C 13 39.437 0.3 . 1 . . . . . 11 I CB . 28092 2
39 . 1 . 1 11 11 ILE N N 15 108.643 0.2 . 1 . . . . . 11 I N . 28092 2
40 . 1 . 1 12 12 SER H H 1 7.525 0.01 . 1 . . . . . 12 S H . 28092 2
41 . 1 . 1 12 12 SER CA C 13 62.135 0.3 . 1 . . . . . 12 S CA . 28092 2
42 . 1 . 1 12 12 SER CB C 13 63.010 0.3 . 1 . . . . . 12 S CB . 28092 2
43 . 1 . 1 12 12 SER N N 15 119.480 0.2 . 1 . . . . . 12 S N . 28092 2
44 . 1 . 1 13 13 ALA H H 1 8.788 0.01 . 1 . . . . . 13 A H . 28092 2
45 . 1 . 1 13 13 ALA CA C 13 53.307 0.3 . 1 . . . . . 13 A CA . 28092 2
46 . 1 . 1 13 13 ALA CB C 13 18.282 0.3 . 1 . . . . . 13 A CB . 28092 2
47 . 1 . 1 13 13 ALA N N 15 122.241 0.2 . 1 . . . . . 13 A N . 28092 2
48 . 1 . 1 14 14 CYS H H 1 8.607 0.01 . 1 . . . . . 14 C H . 28092 2
49 . 1 . 1 14 14 CYS CA C 13 53.951 0.3 . 1 . . . . . 14 C CA . 28092 2
50 . 1 . 1 14 14 CYS CB C 13 42.913 0.3 . 1 . . . . . 14 C CB . 28092 2
51 . 1 . 1 14 14 CYS N N 15 114.845 0.2 . 1 . . . . . 14 C N . 28092 2
52 . 1 . 1 15 15 LEU H H 1 7.416 0.01 . 1 . . . . . 15 L H . 28092 2
53 . 1 . 1 15 15 LEU CA C 13 59.681 0.3 . 1 . . . . . 15 L CA . 28092 2
54 . 1 . 1 15 15 LEU CB C 13 40.834 0.3 . 1 . . . . . 15 L CB . 28092 2
55 . 1 . 1 15 15 LEU N N 15 118.776 0.2 . 1 . . . . . 15 L N . 28092 2
56 . 1 . 1 16 16 SER H H 1 8.358 0.01 . 1 . . . . . 16 S H . 28092 2
57 . 1 . 1 16 16 SER CA C 13 62.236 0.3 . 1 . . . . . 16 S CA . 28092 2
58 . 1 . 1 16 16 SER N N 15 113.442 0.2 . 1 . . . . . 16 S N . 28092 2
59 . 1 . 1 17 17 TYR H H 1 8.348 0.01 . 1 . . . . . 17 Y H . 28092 2
60 . 1 . 1 17 17 TYR CA C 13 60.968 0.3 . 1 . . . . . 17 Y CA . 28092 2
61 . 1 . 1 17 17 TYR CB C 13 37.709 0.3 . 1 . . . . . 17 Y CB . 28092 2
62 . 1 . 1 17 17 TYR N N 15 125.236 0.2 . 1 . . . . . 17 Y N . 28092 2
63 . 1 . 1 18 18 LEU H H 1 8.101 0.01 . 1 . . . . . 18 L H . 28092 2
64 . 1 . 1 18 18 LEU CA C 13 57.511 0.3 . 1 . . . . . 18 L CA . 28092 2
65 . 1 . 1 18 18 LEU CB C 13 41.917 0.3 . 1 . . . . . 18 L CB . 28092 2
66 . 1 . 1 18 18 LEU N N 15 116.898 0.2 . 1 . . . . . 18 L N . 28092 2
67 . 1 . 1 19 19 LYS H H 1 7.338 0.01 . 1 . . . . . 19 K H . 28092 2
68 . 1 . 1 19 19 LYS CA C 13 57.933 0.3 . 1 . . . . . 19 K CA . 28092 2
69 . 1 . 1 19 19 LYS CB C 13 34.836 0.3 . 1 . . . . . 19 K CB . 28092 2
70 . 1 . 1 19 19 LYS N N 15 114.548 0.2 . 1 . . . . . 19 K N . 28092 2
71 . 1 . 1 20 20 GLN H H 1 8.231 0.01 . 1 . . . . . 20 Q H . 28092 2
72 . 1 . 1 20 20 GLN HE21 H 1 7.410 0.01 . 2 . . . . . 20 Q HE21 . 28092 2
73 . 1 . 1 20 20 GLN HE22 H 1 6.848 0.01 . 2 . . . . . 20 Q HE22 . 28092 2
74 . 1 . 1 20 20 GLN CA C 13 55.764 0.3 . 1 . . . . . 20 Q CA . 28092 2
75 . 1 . 1 20 20 GLN CB C 13 31.392 0.3 . 1 . . . . . 20 Q CB . 28092 2
76 . 1 . 1 20 20 GLN N N 15 114.969 0.2 . 1 . . . . . 20 Q N . 28092 2
77 . 1 . 1 20 20 GLN NE2 N 15 111.197 0.2 . 1 . . . . . 20 Q NE2 . 28092 2
78 . 1 . 1 21 21 GLY H H 1 8.566 0.01 . 1 . . . . . 21 G H . 28092 2
79 . 1 . 1 21 21 GLY CA C 13 44.512 0.3 . 1 . . . . . 21 G CA . 28092 2
80 . 1 . 1 21 21 GLY N N 15 116.230 0.2 . 1 . . . . . 21 G N . 28092 2
81 . 1 . 1 22 22 GLY H H 1 8.174 0.01 . 1 . . . . . 22 G H . 28092 2
82 . 1 . 1 22 22 GLY CA C 13 44.383 0.3 . 1 . . . . . 22 G CA . 28092 2
83 . 1 . 1 22 22 GLY N N 15 109.445 0.2 . 1 . . . . . 22 G N . 28092 2
84 . 1 . 1 23 23 GLU H H 1 8.457 0.01 . 1 . . . . . 23 E H . 28092 2
85 . 1 . 1 23 23 GLU CA C 13 55.912 0.3 . 1 . . . . . 23 E CA . 28092 2
86 . 1 . 1 23 23 GLU CB C 13 30.212 0.3 . 1 . . . . . 23 E CB . 28092 2
87 . 1 . 1 23 23 GLU N N 15 122.293 0.2 . 1 . . . . . 23 E N . 28092 2
88 . 1 . 1 24 24 VAL H H 1 8.627 0.01 . 1 . . . . . 24 V H . 28092 2
89 . 1 . 1 24 24 VAL CA C 13 60.148 0.3 . 1 . . . . . 24 V CA . 28092 2
90 . 1 . 1 24 24 VAL CB C 13 32.185 0.3 . 1 . . . . . 24 V CB . 28092 2
91 . 1 . 1 24 24 VAL N N 15 126.201 0.2 . 1 . . . . . 24 V N . 28092 2
92 . 1 . 1 25 25 PRO CA C 13 62.741 0.3 . 1 . . . . . 25 P CA . 28092 2
93 . 1 . 1 25 25 PRO CB C 13 32.520 0.3 . 1 . . . . . 25 P CB . 28092 2
94 . 1 . 1 26 26 ALA H H 1 9.075 0.01 . 1 . . . . . 26 A H . 28092 2
95 . 1 . 1 26 26 ALA CA C 13 56.052 0.3 . 1 . . . . . 26 A CA . 28092 2
96 . 1 . 1 26 26 ALA CB C 13 17.937 0.3 . 1 . . . . . 26 A CB . 28092 2
97 . 1 . 1 26 26 ALA N N 15 128.737 0.2 . 1 . . . . . 26 A N . 28092 2
98 . 1 . 1 27 27 ASP H H 1 9.072 0.01 . 1 . . . . . 27 D H . 28092 2
99 . 1 . 1 27 27 ASP CA C 13 56.688 0.3 . 1 . . . . . 27 D CA . 28092 2
100 . 1 . 1 27 27 ASP CB C 13 39.456 0.3 . 1 . . . . . 27 D CB . 28092 2
101 . 1 . 1 27 27 ASP N N 15 114.390 0.2 . 1 . . . . . 27 D N . 28092 2
102 . 1 . 1 28 28 CYS H H 1 7.590 0.01 . 1 . . . . . 28 C H . 28092 2
103 . 1 . 1 28 28 CYS CA C 13 58.424 0.3 . 1 . . . . . 28 C CA . 28092 2
104 . 1 . 1 28 28 CYS CB C 13 37.680 0.3 . 1 . . . . . 28 C CB . 28092 2
105 . 1 . 1 28 28 CYS N N 15 118.171 0.2 . 1 . . . . . 28 C N . 28092 2
106 . 1 . 1 29 29 CYS H H 1 7.298 0.01 . 1 . . . . . 29 C H . 28092 2
107 . 1 . 1 29 29 CYS CA C 13 54.969 0.3 . 1 . . . . . 29 C CA . 28092 2
108 . 1 . 1 29 29 CYS CB C 13 32.210 0.3 . 1 . . . . . 29 C CB . 28092 2
109 . 1 . 1 29 29 CYS N N 15 116.991 0.2 . 1 . . . . . 29 C N . 28092 2
110 . 1 . 1 30 30 THR H H 1 8.810 0.01 . 1 . . . . . 30 T H . 28092 2
111 . 1 . 1 30 30 THR CA C 13 66.836 0.3 . 1 . . . . . 30 T CA . 28092 2
112 . 1 . 1 30 30 THR CB C 13 68.484 0.3 . 1 . . . . . 30 T CB . 28092 2
113 . 1 . 1 30 30 THR N N 15 118.758 0.2 . 1 . . . . . 30 T N . 28092 2
114 . 1 . 1 31 31 GLY H H 1 7.740 0.01 . 1 . . . . . 31 G H . 28092 2
115 . 1 . 1 31 31 GLY CA C 13 47.790 0.3 . 1 . . . . . 31 G CA . 28092 2
116 . 1 . 1 31 31 GLY N N 15 113.168 0.2 . 1 . . . . . 31 G N . 28092 2
117 . 1 . 1 32 32 VAL H H 1 8.540 0.01 . 1 . . . . . 32 V H . 28092 2
118 . 1 . 1 32 32 VAL CA C 13 67.050 0.3 . 1 . . . . . 32 V CA . 28092 2
119 . 1 . 1 32 32 VAL CB C 13 31.775 0.3 . 1 . . . . . 32 V CB . 28092 2
120 . 1 . 1 32 32 VAL N N 15 122.489 0.2 . 1 . . . . . 32 V N . 28092 2
121 . 1 . 1 33 33 LYS H H 1 8.404 0.01 . 1 . . . . . 33 K H . 28092 2
122 . 1 . 1 33 33 LYS CA C 13 60.266 0.3 . 1 . . . . . 33 K CA . 28092 2
123 . 1 . 1 33 33 LYS CB C 13 32.306 0.3 . 1 . . . . . 33 K CB . 28092 2
124 . 1 . 1 33 33 LYS N N 15 120.601 0.2 . 1 . . . . . 33 K N . 28092 2
125 . 1 . 1 34 34 GLY H H 1 8.251 0.01 . 1 . . . . . 34 G H . 28092 2
126 . 1 . 1 34 34 GLY CA C 13 47.125 0.3 . 1 . . . . . 34 G CA . 28092 2
127 . 1 . 1 34 34 GLY N N 15 106.930 0.2 . 1 . . . . . 34 G N . 28092 2
128 . 1 . 1 35 35 LEU H H 1 8.620 0.01 . 1 . . . . . 35 L H . 28092 2
129 . 1 . 1 35 35 LEU CA C 13 57.983 0.3 . 1 . . . . . 35 L CA . 28092 2
130 . 1 . 1 35 35 LEU CB C 13 41.858 0.3 . 1 . . . . . 35 L CB . 28092 2
131 . 1 . 1 35 35 LEU N N 15 124.515 0.2 . 1 . . . . . 35 L N . 28092 2
132 . 1 . 1 36 36 ASN H H 1 7.838 0.01 . 1 . . . . . 36 N H . 28092 2
133 . 1 . 1 36 36 ASN HD21 H 1 7.945 0.01 . 2 . . . . . 36 N HD21 . 28092 2
134 . 1 . 1 36 36 ASN HD22 H 1 6.573 0.01 . 2 . . . . . 36 N HD22 . 28092 2
135 . 1 . 1 36 36 ASN CA C 13 55.619 0.3 . 1 . . . . . 36 N CA . 28092 2
136 . 1 . 1 36 36 ASN CB C 13 39.465 0.3 . 1 . . . . . 36 N CB . 28092 2
137 . 1 . 1 36 36 ASN N N 15 117.340 0.2 . 1 . . . . . 36 N N . 28092 2
138 . 1 . 1 36 36 ASN ND2 N 15 114.307 0.2 . 1 . . . . . 36 N ND2 . 28092 2
139 . 1 . 1 37 37 ASP H H 1 8.343 0.01 . 1 . . . . . 37 D H . 28092 2
140 . 1 . 1 37 37 ASP CA C 13 56.437 0.3 . 1 . . . . . 37 D CA . 28092 2
141 . 1 . 1 37 37 ASP CB C 13 40.672 0.3 . 1 . . . . . 37 D CB . 28092 2
142 . 1 . 1 37 37 ASP N N 15 117.181 0.2 . 1 . . . . . 37 D N . 28092 2
143 . 1 . 1 38 38 ALA H H 1 7.658 0.01 . 1 . . . . . 38 A H . 28092 2
144 . 1 . 1 38 38 ALA CA C 13 53.063 0.3 . 1 . . . . . 38 A CA . 28092 2
145 . 1 . 1 38 38 ALA CB C 13 18.890 0.3 . 1 . . . . . 38 A CB . 28092 2
146 . 1 . 1 38 38 ALA N N 15 118.452 0.2 . 1 . . . . . 38 A N . 28092 2
147 . 1 . 1 39 39 ALA H H 1 7.250 0.01 . 1 . . . . . 39 A H . 28092 2
148 . 1 . 1 39 39 ALA CA C 13 50.415 0.3 . 1 . . . . . 39 A CA . 28092 2
149 . 1 . 1 39 39 ALA CB C 13 18.017 0.3 . 1 . . . . . 39 A CB . 28092 2
150 . 1 . 1 39 39 ALA N N 15 120.895 0.2 . 1 . . . . . 39 A N . 28092 2
151 . 1 . 1 40 40 LYS H H 1 9.014 0.01 . 1 . . . . . 40 K H . 28092 2
152 . 1 . 1 40 40 LYS CA C 13 57.007 0.3 . 1 . . . . . 40 K CA . 28092 2
153 . 1 . 1 40 40 LYS CB C 13 34.438 0.3 . 1 . . . . . 40 K CB . 28092 2
154 . 1 . 1 40 40 LYS N N 15 123.188 0.2 . 1 . . . . . 40 K N . 28092 2
155 . 1 . 1 41 41 THR H H 1 7.695 0.01 . 1 . . . . . 41 T H . 28092 2
156 . 1 . 1 41 41 THR CA C 13 59.243 0.3 . 1 . . . . . 41 T CA . 28092 2
157 . 1 . 1 41 41 THR CB C 13 72.207 0.3 . 1 . . . . . 41 T CB . 28092 2
158 . 1 . 1 41 41 THR N N 15 108.654 0.2 . 1 . . . . . 41 T N . 28092 2
159 . 1 . 1 42 42 THR H H 1 9.226 0.01 . 1 . . . . . 42 T H . 28092 2
160 . 1 . 1 42 42 THR CA C 13 69.271 0.3 . 1 . . . . . 42 T CA . 28092 2
161 . 1 . 1 42 42 THR CB C 13 67.024 0.3 . 1 . . . . . 42 T CB . 28092 2
162 . 1 . 1 42 42 THR N N 15 118.960 0.2 . 1 . . . . . 42 T N . 28092 2
163 . 1 . 1 43 43 PRO CA C 13 66.157 0.3 . 1 . . . . . 43 P CA . 28092 2
164 . 1 . 1 43 43 PRO CB C 13 30.897 0.3 . 1 . . . . . 43 P CB . 28092 2
165 . 1 . 1 44 44 ASP H H 1 7.212 0.01 . 1 . . . . . 44 D H . 28092 2
166 . 1 . 1 44 44 ASP CA C 13 57.631 0.3 . 1 . . . . . 44 D CA . 28092 2
167 . 1 . 1 44 44 ASP CB C 13 40.497 0.3 . 1 . . . . . 44 D CB . 28092 2
168 . 1 . 1 44 44 ASP N N 15 117.030 0.2 . 1 . . . . . 44 D N . 28092 2
169 . 1 . 1 45 45 ARG H H 1 8.432 0.01 . 1 . . . . . 45 R H . 28092 2
170 . 1 . 1 45 45 ARG HE H 1 7.597 0.01 . 1 . . . . . 45 R HE . 28092 2
171 . 1 . 1 45 45 ARG CA C 13 60.732 0.3 . 1 . . . . . 45 R CA . 28092 2
172 . 1 . 1 45 45 ARG CB C 13 31.220 0.3 . 1 . . . . . 45 R CB . 28092 2
173 . 1 . 1 45 45 ARG N N 15 121.238 0.2 . 1 . . . . . 45 R N . 28092 2
174 . 1 . 1 45 45 ARG NE N 15 84.137 0.2 . 1 . . . . . 45 R NE . 28092 2
175 . 1 . 1 46 46 GLN H H 1 8.443 0.01 . 1 . . . . . 46 Q H . 28092 2
176 . 1 . 1 46 46 GLN HE21 H 1 7.588 0.01 . 2 . . . . . 46 Q HE21 . 28092 2
177 . 1 . 1 46 46 GLN HE22 H 1 6.502 0.01 . 2 . . . . . 46 Q HE22 . 28092 2
178 . 1 . 1 46 46 GLN CA C 13 60.552 0.3 . 1 . . . . . 46 Q CA . 28092 2
179 . 1 . 1 46 46 GLN CB C 13 26.947 0.3 . 1 . . . . . 46 Q CB . 28092 2
180 . 1 . 1 46 46 GLN N N 15 118.286 0.2 . 1 . . . . . 46 Q N . 28092 2
181 . 1 . 1 46 46 GLN NE2 N 15 110.599 0.2 . 1 . . . . . 46 Q NE2 . 28092 2
182 . 1 . 1 47 47 THR H H 1 8.350 0.01 . 1 . . . . . 47 T H . 28092 2
183 . 1 . 1 47 47 THR CA C 13 66.953 0.3 . 1 . . . . . 47 T CA . 28092 2
184 . 1 . 1 47 47 THR CB C 13 68.550 0.3 . 1 . . . . . 47 T CB . 28092 2
185 . 1 . 1 47 47 THR N N 15 117.464 0.2 . 1 . . . . . 47 T N . 28092 2
186 . 1 . 1 48 48 ALA H H 1 8.603 0.01 . 1 . . . . . 48 A H . 28092 2
187 . 1 . 1 48 48 ALA CA C 13 56.565 0.3 . 1 . . . . . 48 A CA . 28092 2
188 . 1 . 1 48 48 ALA CB C 13 17.584 0.3 . 1 . . . . . 48 A CB . 28092 2
189 . 1 . 1 48 48 ALA N N 15 124.513 0.2 . 1 . . . . . 48 A N . 28092 2
190 . 1 . 1 49 49 CYS H H 1 7.941 0.01 . 1 . . . . . 49 C H . 28092 2
191 . 1 . 1 49 49 CYS CA C 13 60.398 0.3 . 1 . . . . . 49 C CA . 28092 2
192 . 1 . 1 49 49 CYS CB C 13 33.933 0.3 . 1 . . . . . 49 C CB . 28092 2
193 . 1 . 1 49 49 CYS N N 15 116.347 0.2 . 1 . . . . . 49 C N . 28092 2
194 . 1 . 1 50 50 ASN H H 1 8.311 0.01 . 1 . . . . . 50 N H . 28092 2
195 . 1 . 1 50 50 ASN HD21 H 1 7.233 0.01 . 2 . . . . . 50 N HD21 . 28092 2
196 . 1 . 1 50 50 ASN CA C 13 56.933 0.3 . 1 . . . . . 50 N CA . 28092 2
197 . 1 . 1 50 50 ASN CB C 13 39.154 0.3 . 1 . . . . . 50 N CB . 28092 2
198 . 1 . 1 50 50 ASN N N 15 120.741 0.2 . 1 . . . . . 50 N N . 28092 2
199 . 1 . 1 50 50 ASN ND2 N 15 115.979 0.2 . 1 . . . . . 50 N ND2 . 28092 2
200 . 1 . 1 51 51 CYS H H 1 9.096 0.01 . 1 . . . . . 51 C H . 28092 2
201 . 1 . 1 51 51 CYS CA C 13 57.404 0.3 . 1 . . . . . 51 C CA . 28092 2
202 . 1 . 1 51 51 CYS CB C 13 36.166 0.3 . 1 . . . . . 51 C CB . 28092 2
203 . 1 . 1 51 51 CYS N N 15 120.701 0.2 . 1 . . . . . 51 C N . 28092 2
204 . 1 . 1 52 52 LEU H H 1 8.301 0.01 . 1 . . . . . 52 L H . 28092 2
205 . 1 . 1 52 52 LEU CA C 13 58.298 0.3 . 1 . . . . . 52 L CA . 28092 2
206 . 1 . 1 52 52 LEU CB C 13 41.569 0.3 . 1 . . . . . 52 L CB . 28092 2
207 . 1 . 1 52 52 LEU N N 15 122.245 0.2 . 1 . . . . . 52 L N . 28092 2
208 . 1 . 1 53 53 LYS H H 1 8.227 0.01 . 1 . . . . . 53 K H . 28092 2
209 . 1 . 1 53 53 LYS CA C 13 61.264 0.3 . 1 . . . . . 53 K CA . 28092 2
210 . 1 . 1 53 53 LYS CB C 13 32.520 0.3 . 1 . . . . . 53 K CB . 28092 2
211 . 1 . 1 53 53 LYS N N 15 119.864 0.2 . 1 . . . . . 53 K N . 28092 2
212 . 1 . 1 54 54 THR H H 1 8.197 0.01 . 1 . . . . . 54 T H . 28092 2
213 . 1 . 1 54 54 THR CA C 13 66.854 0.3 . 1 . . . . . 54 T CA . 28092 2
214 . 1 . 1 54 54 THR CB C 13 68.697 0.3 . 1 . . . . . 54 T CB . 28092 2
215 . 1 . 1 54 54 THR N N 15 114.675 0.2 . 1 . . . . . 54 T N . 28092 2
216 . 1 . 1 55 55 THR H H 1 8.035 0.01 . 1 . . . . . 55 T H . 28092 2
217 . 1 . 1 55 55 THR CA C 13 67.389 0.3 . 1 . . . . . 55 T CA . 28092 2
218 . 1 . 1 55 55 THR CB C 13 68.591 0.3 . 1 . . . . . 55 T CB . 28092 2
219 . 1 . 1 55 55 THR N N 15 120.618 0.2 . 1 . . . . . 55 T N . 28092 2
220 . 1 . 1 56 56 PHE H H 1 8.365 0.01 . 1 . . . . . 56 F H . 28092 2
221 . 1 . 1 56 56 PHE CA C 13 60.584 0.3 . 1 . . . . . 56 F CA . 28092 2
222 . 1 . 1 56 56 PHE CB C 13 38.384 0.3 . 1 . . . . . 56 F CB . 28092 2
223 . 1 . 1 56 56 PHE N N 15 121.645 0.2 . 1 . . . . . 56 F N . 28092 2
224 . 1 . 1 57 57 LYS H H 1 8.314 0.01 . 1 . . . . . 57 K H . 28092 2
225 . 1 . 1 57 57 LYS CA C 13 58.835 0.3 . 1 . . . . . 57 K CA . 28092 2
226 . 1 . 1 57 57 LYS CB C 13 32.633 0.3 . 1 . . . . . 57 K CB . 28092 2
227 . 1 . 1 57 57 LYS N N 15 118.547 0.2 . 1 . . . . . 57 K N . 28092 2
228 . 1 . 1 58 58 SER H H 1 7.675 0.01 . 1 . . . . . 58 S H . 28092 2
229 . 1 . 1 58 58 SER CA C 13 59.615 0.3 . 1 . . . . . 58 S CA . 28092 2
230 . 1 . 1 58 58 SER CB C 13 64.189 0.3 . 1 . . . . . 58 S CB . 28092 2
231 . 1 . 1 58 58 SER N N 15 111.554 0.2 . 1 . . . . . 58 S N . 28092 2
232 . 1 . 1 59 59 ASN H H 1 7.299 0.01 . 1 . . . . . 59 N H . 28092 2
233 . 1 . 1 59 59 ASN HD21 H 1 7.363 0.01 . 2 . . . . . 59 N HD21 . 28092 2
234 . 1 . 1 59 59 ASN HD22 H 1 6.931 0.01 . 2 . . . . . 59 N HD22 . 28092 2
235 . 1 . 1 59 59 ASN CA C 13 52.664 0.3 . 1 . . . . . 59 N CA . 28092 2
236 . 1 . 1 59 59 ASN CB C 13 39.383 0.3 . 1 . . . . . 59 N CB . 28092 2
237 . 1 . 1 59 59 ASN N N 15 120.248 0.2 . 1 . . . . . 59 N N . 28092 2
238 . 1 . 1 59 59 ASN ND2 N 15 113.057 0.2 . 1 . . . . . 59 N ND2 . 28092 2
239 . 1 . 1 60 60 LYS H H 1 8.547 0.01 . 1 . . . . . 60 K H . 28092 2
240 . 1 . 1 60 60 LYS CA C 13 57.915 0.3 . 1 . . . . . 60 K CA . 28092 2
241 . 1 . 1 60 60 LYS CB C 13 31.912 0.3 . 1 . . . . . 60 K CB . 28092 2
242 . 1 . 1 60 60 LYS N N 15 123.121 0.2 . 1 . . . . . 60 K N . 28092 2
243 . 1 . 1 61 61 ASP H H 1 8.493 0.01 . 1 . . . . . 61 D H . 28092 2
244 . 1 . 1 61 61 ASP CA C 13 54.822 0.3 . 1 . . . . . 61 D CA . 28092 2
245 . 1 . 1 61 61 ASP CB C 13 40.569 0.3 . 1 . . . . . 61 D CB . 28092 2
246 . 1 . 1 61 61 ASP N N 15 117.038 0.2 . 1 . . . . . 61 D N . 28092 2
247 . 1 . 1 62 62 PHE H H 1 7.380 0.01 . 1 . . . . . 62 F H . 28092 2
248 . 1 . 1 62 62 PHE CA C 13 55.900 0.3 . 1 . . . . . 62 F CA . 28092 2
249 . 1 . 1 62 62 PHE CB C 13 38.172 0.3 . 1 . . . . . 62 F CB . 28092 2
250 . 1 . 1 62 62 PHE N N 15 118.722 0.2 . 1 . . . . . 62 F N . 28092 2
251 . 1 . 1 63 63 LYS H H 1 8.453 0.01 . 1 . . . . . 63 K H . 28092 2
252 . 1 . 1 63 63 LYS CA C 13 54.426 0.3 . 1 . . . . . 63 K CA . 28092 2
253 . 1 . 1 63 63 LYS CB C 13 32.074 0.3 . 1 . . . . . 63 K CB . 28092 2
254 . 1 . 1 63 63 LYS N N 15 122.097 0.2 . 1 . . . . . 63 K N . 28092 2
255 . 1 . 1 64 64 SER H H 1 9.075 0.01 . 1 . . . . . 64 S H . 28092 2
256 . 1 . 1 64 64 SER CA C 13 61.918 0.3 . 1 . . . . . 64 S CA . 28092 2
257 . 1 . 1 64 64 SER CB C 13 62.748 0.3 . 1 . . . . . 64 S CB . 28092 2
258 . 1 . 1 64 64 SER N N 15 121.975 0.2 . 1 . . . . . 64 S N . 28092 2
259 . 1 . 1 65 65 ASP H H 1 8.998 0.01 . 1 . . . . . 65 D H . 28092 2
260 . 1 . 1 65 65 ASP CA C 13 56.930 0.3 . 1 . . . . . 65 D CA . 28092 2
261 . 1 . 1 65 65 ASP CB C 13 39.605 0.3 . 1 . . . . . 65 D CB . 28092 2
262 . 1 . 1 65 65 ASP N N 15 120.144 0.2 . 1 . . . . . 65 D N . 28092 2
263 . 1 . 1 66 66 PHE H H 1 6.792 0.01 . 1 . . . . . 66 F H . 28092 2
264 . 1 . 1 66 66 PHE CA C 13 57.029 0.3 . 1 . . . . . 66 F CA . 28092 2
265 . 1 . 1 66 66 PHE CB C 13 36.593 0.3 . 1 . . . . . 66 F CB . 28092 2
266 . 1 . 1 66 66 PHE N N 15 118.347 0.2 . 1 . . . . . 66 F N . 28092 2
267 . 1 . 1 67 67 ALA H H 1 7.984 0.01 . 1 . . . . . 67 A H . 28092 2
268 . 1 . 1 67 67 ALA CA C 13 55.612 0.3 . 1 . . . . . 67 A CA . 28092 2
269 . 1 . 1 67 67 ALA CB C 13 18.857 0.3 . 1 . . . . . 67 A CB . 28092 2
270 . 1 . 1 67 67 ALA N N 15 123.215 0.2 . 1 . . . . . 67 A N . 28092 2
271 . 1 . 1 68 68 ALA H H 1 8.138 0.01 . 1 . . . . . 68 A H . 28092 2
272 . 1 . 1 68 68 ALA CA C 13 54.711 0.3 . 1 . . . . . 68 A CA . 28092 2
273 . 1 . 1 68 68 ALA CB C 13 18.573 0.3 . 1 . . . . . 68 A CB . 28092 2
274 . 1 . 1 68 68 ALA N N 15 116.945 0.2 . 1 . . . . . 68 A N . 28092 2
275 . 1 . 1 69 69 SER H H 1 7.531 0.01 . 1 . . . . . 69 S H . 28092 2
276 . 1 . 1 69 69 SER CA C 13 58.626 0.3 . 1 . . . . . 69 S CA . 28092 2
277 . 1 . 1 69 69 SER CB C 13 64.612 0.3 . 1 . . . . . 69 S CB . 28092 2
278 . 1 . 1 69 69 SER N N 15 108.998 0.2 . 1 . . . . . 69 S N . 28092 2
279 . 1 . 1 70 70 LEU H H 1 7.485 0.01 . 1 . . . . . 70 L H . 28092 2
280 . 1 . 1 70 70 LEU CA C 13 59.950 0.3 . 1 . . . . . 70 L CA . 28092 2
281 . 1 . 1 70 70 LEU CB C 13 39.983 0.3 . 1 . . . . . 70 L CB . 28092 2
282 . 1 . 1 70 70 LEU N N 15 122.629 0.2 . 1 . . . . . 70 L N . 28092 2
283 . 1 . 1 71 71 PRO CA C 13 67.737 0.3 . 1 . . . . . 71 P CA . 28092 2
284 . 1 . 1 71 71 PRO CB C 13 31.138 0.3 . 1 . . . . . 71 P CB . 28092 2
285 . 1 . 1 72 72 SER H H 1 7.979 0.01 . 1 . . . . . 72 S H . 28092 2
286 . 1 . 1 72 72 SER CA C 13 61.583 0.3 . 1 . . . . . 72 S CA . 28092 2
287 . 1 . 1 72 72 SER CB C 13 62.599 0.3 . 1 . . . . . 72 S CB . 28092 2
288 . 1 . 1 72 72 SER N N 15 112.459 0.2 . 1 . . . . . 72 S N . 28092 2
289 . 1 . 1 73 73 LYS H H 1 8.413 0.01 . 1 . . . . . 73 K H . 28092 2
290 . 1 . 1 73 73 LYS CA C 13 59.116 0.3 . 1 . . . . . 73 K CA . 28092 2
291 . 1 . 1 73 73 LYS CB C 13 32.537 0.3 . 1 . . . . . 73 K CB . 28092 2
292 . 1 . 1 73 73 LYS N N 15 122.978 0.2 . 1 . . . . . 73 K N . 28092 2
293 . 1 . 1 74 74 CYS H H 1 7.773 0.01 . 1 . . . . . 74 C H . 28092 2
294 . 1 . 1 74 74 CYS CA C 13 52.963 0.3 . 1 . . . . . 74 C CA . 28092 2
295 . 1 . 1 74 74 CYS CB C 13 36.180 0.3 . 1 . . . . . 74 C CB . 28092 2
296 . 1 . 1 74 74 CYS N N 15 113.871 0.2 . 1 . . . . . 74 C N . 28092 2
297 . 1 . 1 75 75 GLY H H 1 7.979 0.01 . 1 . . . . . 75 G H . 28092 2
298 . 1 . 1 75 75 GLY CA C 13 46.864 0.3 . 1 . . . . . 75 G CA . 28092 2
299 . 1 . 1 75 75 GLY N N 15 111.430 0.2 . 1 . . . . . 75 G N . 28092 2
300 . 1 . 1 76 76 VAL H H 1 8.075 0.01 . 1 . . . . . 76 V H . 28092 2
301 . 1 . 1 76 76 VAL CA C 13 60.456 0.3 . 1 . . . . . 76 V CA . 28092 2
302 . 1 . 1 76 76 VAL CB C 13 34.612 0.3 . 1 . . . . . 76 V CB . 28092 2
303 . 1 . 1 76 76 VAL N N 15 118.687 0.2 . 1 . . . . . 76 V N . 28092 2
304 . 1 . 1 77 77 ASN H H 1 8.755 0.01 . 1 . . . . . 77 N H . 28092 2
305 . 1 . 1 77 77 ASN HD21 H 1 7.475 0.01 . 2 . . . . . 77 N HD21 . 28092 2
306 . 1 . 1 77 77 ASN HD22 H 1 6.774 0.01 . 2 . . . . . 77 N HD22 . 28092 2
307 . 1 . 1 77 77 ASN CA C 13 51.992 0.3 . 1 . . . . . 77 N CA . 28092 2
308 . 1 . 1 77 77 ASN CB C 13 37.558 0.3 . 1 . . . . . 77 N CB . 28092 2
309 . 1 . 1 77 77 ASN N N 15 126.548 0.2 . 1 . . . . . 77 N N . 28092 2
310 . 1 . 1 77 77 ASN ND2 N 15 111.891 0.2 . 1 . . . . . 77 N ND2 . 28092 2
311 . 1 . 1 78 78 ILE H H 1 7.489 0.01 . 1 . . . . . 78 I H . 28092 2
312 . 1 . 1 78 78 ILE CA C 13 57.735 0.3 . 1 . . . . . 78 I CA . 28092 2
313 . 1 . 1 78 78 ILE CB C 13 38.882 0.3 . 1 . . . . . 78 I CB . 28092 2
314 . 1 . 1 78 78 ILE N N 15 124.664 0.2 . 1 . . . . . 78 I N . 28092 2
315 . 1 . 1 79 79 PRO CA C 13 64.452 0.3 . 1 . . . . . 79 P CA . 28092 2
316 . 1 . 1 79 79 PRO CB C 13 30.911 0.3 . 1 . . . . . 79 P CB . 28092 2
317 . 1 . 1 80 80 TYR H H 1 6.654 0.01 . 1 . . . . . 80 Y H . 28092 2
318 . 1 . 1 80 80 TYR CA C 13 54.469 0.3 . 1 . . . . . 80 Y CA . 28092 2
319 . 1 . 1 80 80 TYR CB C 13 40.059 0.3 . 1 . . . . . 80 Y CB . 28092 2
320 . 1 . 1 80 80 TYR N N 15 115.807 0.2 . 1 . . . . . 80 Y N . 28092 2
321 . 1 . 1 81 81 LYS H H 1 8.383 0.01 . 1 . . . . . 81 K H . 28092 2
322 . 1 . 1 81 81 LYS CA C 13 55.596 0.3 . 1 . . . . . 81 K CA . 28092 2
323 . 1 . 1 81 81 LYS CB C 13 33.180 0.3 . 1 . . . . . 81 K CB . 28092 2
324 . 1 . 1 81 81 LYS N N 15 119.498 0.2 . 1 . . . . . 81 K N . 28092 2
325 . 1 . 1 82 82 ILE H H 1 9.205 0.01 . 1 . . . . . 82 I H . 28092 2
326 . 1 . 1 82 82 ILE N N 15 129.451 0.2 . 1 . . . . . 82 I N . 28092 2
327 . 1 . 1 83 83 SER H H 1 7.436 0.01 . 1 . . . . . 83 S H . 28092 2
328 . 1 . 1 83 83 SER N N 15 118.676 0.2 . 1 . . . . . 83 S N . 28092 2
329 . 1 . 1 84 84 LEU H H 1 8.668 0.01 . 1 . . . . . 84 L H . 28092 2
330 . 1 . 1 84 84 LEU CA C 13 57.332 0.3 . 1 . . . . . 84 L CA . 28092 2
331 . 1 . 1 84 84 LEU CB C 13 41.729 0.3 . 1 . . . . . 84 L CB . 28092 2
332 . 1 . 1 84 84 LEU N N 15 123.536 0.2 . 1 . . . . . 84 L N . 28092 2
333 . 1 . 1 85 85 GLU H H 1 8.319 0.01 . 1 . . . . . 85 E H . 28092 2
334 . 1 . 1 85 85 GLU CA C 13 56.345 0.3 . 1 . . . . . 85 E CA . 28092 2
335 . 1 . 1 85 85 GLU CB C 13 29.922 0.3 . 1 . . . . . 85 E CB . 28092 2
336 . 1 . 1 85 85 GLU N N 15 115.244 0.2 . 1 . . . . . 85 E N . 28092 2
337 . 1 . 1 86 86 THR H H 1 7.192 0.01 . 1 . . . . . 86 T H . 28092 2
338 . 1 . 1 86 86 THR CA C 13 64.186 0.3 . 1 . . . . . 86 T CA . 28092 2
339 . 1 . 1 86 86 THR CB C 13 70.192 0.3 . 1 . . . . . 86 T CB . 28092 2
340 . 1 . 1 86 86 THR N N 15 118.579 0.2 . 1 . . . . . 86 T N . 28092 2
341 . 1 . 1 87 87 ASP H H 1 8.792 0.01 . 1 . . . . . 87 D H . 28092 2
342 . 1 . 1 87 87 ASP CA C 13 52.266 0.3 . 1 . . . . . 87 D CA . 28092 2
343 . 1 . 1 87 87 ASP CB C 13 39.629 0.3 . 1 . . . . . 87 D CB . 28092 2
344 . 1 . 1 87 87 ASP N N 15 125.702 0.2 . 1 . . . . . 87 D N . 28092 2
345 . 1 . 1 88 88 CYS H H 1 8.643 0.01 . 1 . . . . . 88 C H . 28092 2
346 . 1 . 1 88 88 CYS CA C 13 55.842 0.3 . 1 . . . . . 88 C CA . 28092 2
347 . 1 . 1 88 88 CYS CB C 13 36.590 0.3 . 1 . . . . . 88 C CB . 28092 2
348 . 1 . 1 88 88 CYS N N 15 126.073 0.2 . 1 . . . . . 88 C N . 28092 2
349 . 1 . 1 89 89 ASN H H 1 8.351 0.01 . 1 . . . . . 89 N H . 28092 2
350 . 1 . 1 89 89 ASN HD21 H 1 7.891 0.01 . 2 . . . . . 89 N HD21 . 28092 2
351 . 1 . 1 89 89 ASN HD22 H 1 7.003 0.01 . 2 . . . . . 89 N HD22 . 28092 2
352 . 1 . 1 89 89 ASN CA C 13 54.998 0.3 . 1 . . . . . 89 N CA . 28092 2
353 . 1 . 1 89 89 ASN CB C 13 38.075 0.3 . 1 . . . . . 89 N CB . 28092 2
354 . 1 . 1 89 89 ASN N N 15 115.189 0.2 . 1 . . . . . 89 N N . 28092 2
355 . 1 . 1 89 89 ASN ND2 N 15 114.689 0.2 . 1 . . . . . 89 N ND2 . 28092 2
356 . 1 . 1 90 90 LYS H H 1 7.239 0.01 . 1 . . . . . 90 K H . 28092 2
357 . 1 . 1 90 90 LYS CA C 13 55.422 0.3 . 1 . . . . . 90 K CA . 28092 2
358 . 1 . 1 90 90 LYS CB C 13 32.962 0.3 . 1 . . . . . 90 K CB . 28092 2
359 . 1 . 1 90 90 LYS N N 15 116.293 0.2 . 1 . . . . . 90 K N . 28092 2
360 . 1 . 1 91 91 VAL H H 1 6.941 0.01 . 1 . . . . . 91 V H . 28092 2
361 . 1 . 1 91 91 VAL CA C 13 63.427 0.3 . 1 . . . . . 91 V CA . 28092 2
362 . 1 . 1 91 91 VAL CB C 13 32.801 0.3 . 1 . . . . . 91 V CB . 28092 2
363 . 1 . 1 91 91 VAL N N 15 121.697 0.2 . 1 . . . . . 91 V N . 28092 2
364 . 1 . 1 92 92 LYS H H 1 7.996 0.01 . 1 . . . . . 92 K H . 28092 2
365 . 1 . 1 92 92 LYS CA C 13 57.400 0.3 . 1 . . . . . 92 K CA . 28092 2
366 . 1 . 1 92 92 LYS CB C 13 34.838 0.3 . 1 . . . . . 92 K CB . 28092 2
367 . 1 . 1 92 92 LYS N N 15 130.909 0.2 . 1 . . . . . 92 K N . 28092 2
stop_
save_