Content for NMR-STAR saveframe, "chemical_shift_set_2"
save_chemical_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_2
_Assigned_chem_shift_list.Entry_ID 6558
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 $sample_1 . 6558 2
. . 2 $sample_2 . 6558 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 GLY CA C 13 43.241 0.0 . . . . . . . . . . 6558 2
2 . 1 1 1 1 GLY HA2 H 1 3.886 0.0 . . . . . . . . . . 6558 2
3 . 1 1 2 2 SER CA C 13 58.302 0.0 . . . . . . . . . . 6558 2
4 . 1 1 2 2 SER CB C 13 64.000 0.0 . . . . . . . . . . 6558 2
5 . 1 1 2 2 SER HA H 1 4.511 0.0 . . . . . . . . . . 6558 2
6 . 1 1 2 2 SER HB2 H 1 3.864 0.0 . . . . . . . . . . 6558 2
7 . 1 1 3 3 ARG CA C 13 56.418 0.0 . . . . . . . . . . 6558 2
8 . 1 1 3 3 ARG CB C 13 30.831 0.0 . . . . . . . . . . 6558 2
9 . 1 1 3 3 ARG CD C 13 43.381 0.0 . . . . . . . . . . 6558 2
10 . 1 1 3 3 ARG CG C 13 27.149 0.0 . . . . . . . . . . 6558 2
11 . 1 1 3 3 ARG HA H 1 4.318 0.0 . . . . . . . . . . 6558 2
12 . 1 1 3 3 ARG HB2 H 1 1.841 0.0 . . . . . . . . . . 6558 2
13 . 1 1 3 3 ARG HB3 H 1 1.773 0.0 . . . . . . . . . . 6558 2
14 . 1 1 3 3 ARG HD2 H 1 3.194 0.0 . . . . . . . . . . 6558 2
15 . 1 1 3 3 ARG HG2 H 1 1.634 0.0 . . . . . . . . . . 6558 2
16 . 1 1 4 4 ARG CA C 13 56.112 0.0 . . . . . . . . . . 6558 2
17 . 1 1 4 4 ARG CB C 13 30.730 0.0 . . . . . . . . . . 6558 2
18 . 1 1 4 4 ARG CD C 13 43.381 0.0 . . . . . . . . . . 6558 2
19 . 1 1 4 4 ARG CG C 13 27.149 0.0 . . . . . . . . . . 6558 2
20 . 1 1 4 4 ARG HA H 1 4.331 0.0 . . . . . . . . . . 6558 2
21 . 1 1 4 4 ARG HB2 H 1 1.826 0.0 . . . . . . . . . . 6558 2
22 . 1 1 4 4 ARG HB3 H 1 1.749 0.0 . . . . . . . . . . 6558 2
23 . 1 1 4 4 ARG HD2 H 1 3.194 0.0 . . . . . . . . . . 6558 2
24 . 1 1 4 4 ARG HG2 H 1 1.634 0.0 . . . . . . . . . . 6558 2
25 . 1 1 5 5 ALA CA C 13 52.694 0.0 . . . . . . . . . . 6558 2
26 . 1 1 5 5 ALA CB C 13 19.230 0.0 . . . . . . . . . . 6558 2
27 . 1 1 5 5 ALA HA H 1 4.305 0.0 . . . . . . . . . . 6558 2
28 . 1 1 5 5 ALA HB1 H 1 1.378 0.0 . . . . . . . . . . 6558 2
29 . 1 1 5 5 ALA HB2 H 1 1.378 0.0 . . . . . . . . . . 6558 2
30 . 1 1 5 5 ALA HB3 H 1 1.378 0.0 . . . . . . . . . . 6558 2
31 . 1 1 6 6 SER CA C 13 58.258 0.0 . . . . . . . . . . 6558 2
32 . 1 1 6 6 SER CB C 13 63.884 0.0 . . . . . . . . . . 6558 2
33 . 1 1 6 6 SER HA H 1 4.467 0.0 . . . . . . . . . . 6558 2
34 . 1 1 6 6 SER HB2 H 1 3.875 0.0 . . . . . . . . . . 6558 2
35 . 1 1 7 7 VAL CA C 13 62.655 0.0 . . . . . . . . . . 6558 2
36 . 1 1 7 7 VAL CB C 13 32.679 0.0 . . . . . . . . . . 6558 2
37 . 1 1 7 7 VAL CG1 C 13 20.799 0.0 . . . . . . . . . . 6558 2
38 . 1 1 7 7 VAL CG2 C 13 20.420 0.0 . . . . . . . . . . 6558 2
39 . 1 1 7 7 VAL HA H 1 4.156 0.0 . . . . . . . . . . 6558 2
40 . 1 1 7 7 VAL HB H 1 2.100 0.0 . . . . . . . . . . 6558 2
41 . 1 1 7 7 VAL HG11 H 1 0.942 0.0 . . . . . . . . . . 6558 2
42 . 1 1 7 7 VAL HG12 H 1 0.942 0.0 . . . . . . . . . . 6558 2
43 . 1 1 7 7 VAL HG13 H 1 0.942 0.0 . . . . . . . . . . 6558 2
44 . 1 1 8 8 GLY CA C 13 45.270 0.0 . . . . . . . . . . 6558 2
45 . 1 1 8 8 GLY HA2 H 1 3.972 0.0 . . . . . . . . . . 6558 2
46 . 1 1 9 9 SER CA C 13 58.359 0.0 . . . . . . . . . . 6558 2
47 . 1 1 9 9 SER CB C 13 63.824 0.0 . . . . . . . . . . 6558 2
48 . 1 1 9 9 SER HA H 1 4.483 0.0 . . . . . . . . . . 6558 2
49 . 1 1 9 9 SER HB2 H 1 3.860 0.0 . . . . . . . . . . 6558 2
50 . 1 1 10 10 ALA CA C 13 52.694 0.0 . . . . . . . . . . 6558 2
51 . 1 1 10 10 ALA CB C 13 19.230 0.0 . . . . . . . . . . 6558 2
52 . 1 1 10 10 ALA HA H 1 4.305 0.0 . . . . . . . . . . 6558 2
53 . 1 1 10 10 ALA HB1 H 1 1.378 0.0 . . . . . . . . . . 6558 2
54 . 1 1 10 10 ALA HB2 H 1 1.378 0.0 . . . . . . . . . . 6558 2
55 . 1 1 10 10 ALA HB3 H 1 1.378 0.0 . . . . . . . . . . 6558 2
56 . 1 1 11 11 LYS CA C 13 56.719 0.0 . . . . . . . . . . 6558 2
57 . 1 1 11 11 LYS CB C 13 32.966 0.0 . . . . . . . . . . 6558 2
58 . 1 1 11 11 LYS CD C 13 29.150 0.0 . . . . . . . . . . 6558 2
59 . 1 1 11 11 LYS CG C 13 24.792 0.0 . . . . . . . . . . 6558 2
60 . 1 1 11 11 LYS HA H 1 4.316 0.0 . . . . . . . . . . 6558 2
61 . 1 1 11 11 LYS HB2 H 1 1.853 0.0 . . . . . . . . . . 6558 2
62 . 1 1 11 11 LYS HB3 H 1 1.774 0.0 . . . . . . . . . . 6558 2
63 . 1 1 11 11 LYS HD2 H 1 1.673 0.0 . . . . . . . . . . 6558 2
64 . 1 1 11 11 LYS HE2 H 1 2.989 0.0 . . . . . . . . . . 6558 2
65 . 1 1 11 11 LYS HG2 H 1 1.432 0.0 . . . . . . . . . . 6558 2
66 . 1 1 12 12 SER CA C 13 58.171 0.0 . . . . . . . . . . 6558 2
67 . 1 1 12 12 SER CB C 13 63.976 0.0 . . . . . . . . . . 6558 2
68 . 1 1 12 12 SER HA H 1 4.507 0.0 . . . . . . . . . . 6558 2
69 . 1 1 12 12 SER HB2 H 1 4.020 0.0 . . . . . . . . . . 6558 2
70 . 1 1 12 12 SER HB3 H 1 3.875 0.0 . . . . . . . . . . 6558 2
71 . 1 1 13 13 MET CA C 13 55.740 0.0 . . . . . . . . . . 6558 2
72 . 1 1 13 13 MET CB C 13 32.172 0.0 . . . . . . . . . . 6558 2
73 . 1 1 13 13 MET CG C 13 32.190 0.0 . . . . . . . . . . 6558 2
74 . 1 1 13 13 MET CE C 13 17.340 0.0 . . . . . . . . . . 6558 2
75 . 1 1 13 13 MET HA H 1 4.503 0.0 . . . . . . . . . . 6558 2
76 . 1 1 13 13 MET HB2 H 1 2.017 0.0 . . . . . . . . . . 6558 2
77 . 1 1 13 13 MET HB3 H 1 1.826 0.0 . . . . . . . . . . 6558 2
78 . 1 1 13 13 MET HG2 H 1 2.504 0.0 . . . . . . . . . . 6558 2
79 . 1 1 13 13 MET HG3 H 1 2.351 0.0 . . . . . . . . . . 6558 2
80 . 1 1 13 13 MET HE1 H 1 1.998 0.0 . . . . . . . . . . 6558 2
81 . 1 1 13 13 MET HE2 H 1 1.998 0.0 . . . . . . . . . . 6558 2
82 . 1 1 13 13 MET HE3 H 1 1.998 0.0 . . . . . . . . . . 6558 2
83 . 1 1 14 14 TRP CA C 13 56.648 0.0 . . . . . . . . . . 6558 2
84 . 1 1 14 14 TRP CB C 13 31.111 0.0 . . . . . . . . . . 6558 2
85 . 1 1 14 14 TRP CD1 C 13 128.477 0.0 . . . . . . . . . . 6558 2
86 . 1 1 14 14 TRP CE3 C 13 120.530 0.0 . . . . . . . . . . 6558 2
87 . 1 1 14 14 TRP CH2 C 13 124.700 0.0 . . . . . . . . . . 6558 2
88 . 1 1 14 14 TRP CZ2 C 13 114.688 0.0 . . . . . . . . . . 6558 2
89 . 1 1 14 14 TRP CZ3 C 13 123.228 0.0 . . . . . . . . . . 6558 2
90 . 1 1 14 14 TRP HA H 1 5.182 0.0 . . . . . . . . . . 6558 2
91 . 1 1 14 14 TRP HB2 H 1 3.147 0.0 . . . . . . . . . . 6558 2
92 . 1 1 14 14 TRP HB3 H 1 3.046 0.0 . . . . . . . . . . 6558 2
93 . 1 1 14 14 TRP HD1 H 1 7.318 0.0 . . . . . . . . . . 6558 2
94 . 1 1 14 14 TRP HE3 H 1 7.330 0.0 . . . . . . . . . . 6558 2
95 . 1 1 14 14 TRP HH2 H 1 7.024 0.0 . . . . . . . . . . 6558 2
96 . 1 1 14 14 TRP HZ2 H 1 7.479 0.0 . . . . . . . . . . 6558 2
97 . 1 1 14 14 TRP HZ3 H 1 6.951 0.0 . . . . . . . . . . 6558 2
98 . 1 1 15 15 THR CA C 13 59.900 0.0 . . . . . . . . . . 6558 2
99 . 1 1 15 15 THR CB C 13 72.004 0.0 . . . . . . . . . . 6558 2
100 . 1 1 15 15 THR CG2 C 13 22.225 0.0 . . . . . . . . . . 6558 2
101 . 1 1 15 15 THR HA H 1 4.792 0.0 . . . . . . . . . . 6558 2
102 . 1 1 15 15 THR HB H 1 4.189 0.0 . . . . . . . . . . 6558 2
103 . 1 1 15 15 THR HG21 H 1 1.263 0.0 . . . . . . . . . . 6558 2
104 . 1 1 15 15 THR HG22 H 1 1.263 0.0 . . . . . . . . . . 6558 2
105 . 1 1 15 15 THR HG23 H 1 1.263 0.0 . . . . . . . . . . 6558 2
106 . 1 1 16 16 GLU CA C 13 55.755 0.0 . . . . . . . . . . 6558 2
107 . 1 1 16 16 GLU CB C 13 30.877 0.0 . . . . . . . . . . 6558 2
108 . 1 1 16 16 GLU CG C 13 35.496 0.0 . . . . . . . . . . 6558 2
109 . 1 1 16 16 GLU HA H 1 4.483 0.0 . . . . . . . . . . 6558 2
110 . 1 1 16 16 GLU HB2 H 1 1.800 0.0 . . . . . . . . . . 6558 2
111 . 1 1 16 16 GLU HG2 H 1 1.970 0.0 . . . . . . . . . . 6558 2
112 . 1 1 17 17 HIS CA C 13 53.630 0.0 . . . . . . . . . . 6558 2
113 . 1 1 17 17 HIS CB C 13 32.500 0.0 . . . . . . . . . . 6558 2
114 . 1 1 17 17 HIS CD2 C 13 118.969 0.0 . . . . . . . . . . 6558 2
115 . 1 1 17 17 HIS CE1 C 13 136.664 0.0 . . . . . . . . . . 6558 2
116 . 1 1 17 17 HIS HA H 1 4.516 0.0 . . . . . . . . . . 6558 2
117 . 1 1 17 17 HIS HB2 H 1 2.588 0.0 . . . . . . . . . . 6558 2
118 . 1 1 17 17 HIS HB3 H 1 1.264 0.0 . . . . . . . . . . 6558 2
119 . 1 1 17 17 HIS HD2 H 1 6.699 0.0 . . . . . . . . . . 6558 2
120 . 1 1 17 17 HIS HE1 H 1 8.381 0.0 . . . . . . . . . . 6558 2
121 . 1 1 18 18 LYS CA C 13 54.632 0.0 . . . . . . . . . . 6558 2
122 . 1 1 18 18 LYS CB C 13 34.857 0.0 . . . . . . . . . . 6558 2
123 . 1 1 18 18 LYS CD C 13 29.112 0.0 . . . . . . . . . . 6558 2
124 . 1 1 18 18 LYS CE C 13 41.841 0.0 . . . . . . . . . . 6558 2
125 . 1 1 18 18 LYS CG C 13 24.663 0.0 . . . . . . . . . . 6558 2
126 . 1 1 18 18 LYS HA H 1 5.169 0.0 . . . . . . . . . . 6558 2
127 . 1 1 18 18 LYS HB2 H 1 1.629 0.0 . . . . . . . . . . 6558 2
128 . 1 1 18 18 LYS HD2 H 1 1.528 0.0 . . . . . . . . . . 6558 2
129 . 1 1 18 18 LYS HE2 H 1 2.870 0.0 . . . . . . . . . . 6558 2
130 . 1 1 18 18 LYS HG2 H 1 1.335 0.0 . . . . . . . . . . 6558 2
131 . 1 1 19 19 SER CA C 13 56.996 0.0 . . . . . . . . . . 6558 2
132 . 1 1 19 19 SER CB C 13 63.209 0.0 . . . . . . . . . . 6558 2
133 . 1 1 19 19 SER HB2 H 1 4.433 0.0 . . . . . . . . . . 6558 2
134 . 1 1 19 19 SER HB3 H 1 4.156 0.0 . . . . . . . . . . 6558 2
135 . 1 1 20 20 PRO CA C 13 65.676 0.0 . . . . . . . . . . 6558 2
136 . 1 1 20 20 PRO CB C 13 31.593 0.0 . . . . . . . . . . 6558 2
137 . 1 1 20 20 PRO CD C 13 50.797 0.0 . . . . . . . . . . 6558 2
138 . 1 1 20 20 PRO CG C 13 27.961 0.0 . . . . . . . . . . 6558 2
139 . 1 1 20 20 PRO HA H 1 4.308 0.0 . . . . . . . . . . 6558 2
140 . 1 1 20 20 PRO HB2 H 1 2.337 0.0 . . . . . . . . . . 6558 2
141 . 1 1 20 20 PRO HB3 H 1 1.736 0.0 . . . . . . . . . . 6558 2
142 . 1 1 20 20 PRO HD2 H 1 3.636 0.0 . . . . . . . . . . 6558 2
143 . 1 1 20 20 PRO HD3 H 1 3.558 0.0 . . . . . . . . . . 6558 2
144 . 1 1 20 20 PRO HG2 H 1 1.864 0.0 . . . . . . . . . . 6558 2
145 . 1 1 21 21 ASP CA C 13 53.293 0.0 . . . . . . . . . . 6558 2
146 . 1 1 21 21 ASP CB C 13 40.104 0.0 . . . . . . . . . . 6558 2
147 . 1 1 21 21 ASP HA H 1 4.615 0.0 . . . . . . . . . . 6558 2
148 . 1 1 21 21 ASP HB2 H 1 2.935 0.0 . . . . . . . . . . 6558 2
149 . 1 1 21 21 ASP HB3 H 1 2.707 0.0 . . . . . . . . . . 6558 2
150 . 1 1 22 22 GLY CA C 13 45.407 0.0 . . . . . . . . . . 6558 2
151 . 1 1 22 22 GLY HA2 H 1 4.315 0.0 . . . . . . . . . . 6558 2
152 . 1 1 22 22 GLY HA3 H 1 3.618 0.0 . . . . . . . . . . 6558 2
153 . 1 1 23 23 ARG CA C 13 56.476 0.0 . . . . . . . . . . 6558 2
154 . 1 1 23 23 ARG CB C 13 32.127 0.0 . . . . . . . . . . 6558 2
155 . 1 1 23 23 ARG CD C 13 43.553 0.0 . . . . . . . . . . 6558 2
156 . 1 1 23 23 ARG CG C 13 27.207 0.0 . . . . . . . . . . 6558 2
157 . 1 1 23 23 ARG HA H 1 4.498 0.0 . . . . . . . . . . 6558 2
158 . 1 1 23 23 ARG HB2 H 1 2.023 0.0 . . . . . . . . . . 6558 2
159 . 1 1 23 23 ARG HD2 H 1 2.766 0.0 . . . . . . . . . . 6558 2
160 . 1 1 23 23 ARG HG2 H 1 1.634 0.0 . . . . . . . . . . 6558 2
161 . 1 1 23 23 ARG HG3 H 1 1.590 0.0 . . . . . . . . . . 6558 2
162 . 1 1 24 24 THR CA C 13 63.192 0.0 . . . . . . . . . . 6558 2
163 . 1 1 24 24 THR CB C 13 70.256 0.0 . . . . . . . . . . 6558 2
164 . 1 1 24 24 THR CG2 C 13 21.939 0.0 . . . . . . . . . . 6558 2
165 . 1 1 24 24 THR HA H 1 4.890 0.0 . . . . . . . . . . 6558 2
166 . 1 1 24 24 THR HB H 1 3.961 0.0 . . . . . . . . . . 6558 2
167 . 1 1 24 24 THR HG21 H 1 0.871 0.0 . . . . . . . . . . 6558 2
168 . 1 1 24 24 THR HG22 H 1 0.871 0.0 . . . . . . . . . . 6558 2
169 . 1 1 24 24 THR HG23 H 1 0.871 0.0 . . . . . . . . . . 6558 2
170 . 1 1 25 25 TYR CA C 13 55.432 0.0 . . . . . . . . . . 6558 2
171 . 1 1 25 25 TYR CB C 13 39.871 0.0 . . . . . . . . . . 6558 2
172 . 1 1 25 25 TYR CD1 C 13 133.494 0.0 . . . . . . . . . . 6558 2
173 . 1 1 25 25 TYR CE1 C 13 117.412 0.0 . . . . . . . . . . 6558 2
174 . 1 1 25 25 TYR HA H 1 4.825 0.0 . . . . . . . . . . 6558 2
175 . 1 1 25 25 TYR HB2 H 1 2.389 0.0 . . . . . . . . . . 6558 2
176 . 1 1 25 25 TYR HD1 H 1 6.744 0.0 . . . . . . . . . . 6558 2
177 . 1 1 25 25 TYR HE1 H 1 6.371 0.0 . . . . . . . . . . 6558 2
178 . 1 1 26 26 TYR CA C 13 56.627 0.0 . . . . . . . . . . 6558 2
179 . 1 1 26 26 TYR CB C 13 41.053 0.0 . . . . . . . . . . 6558 2
180 . 1 1 26 26 TYR CD1 C 13 133.619 0.0 . . . . . . . . . . 6558 2
181 . 1 1 26 26 TYR CE1 C 13 117.548 0.0 . . . . . . . . . . 6558 2
182 . 1 1 26 26 TYR HA H 1 5.297 0.0 . . . . . . . . . . 6558 2
183 . 1 1 26 26 TYR HB2 H 1 2.843 0.0 . . . . . . . . . . 6558 2
184 . 1 1 26 26 TYR HB3 H 1 2.676 0.0 . . . . . . . . . . 6558 2
185 . 1 1 26 26 TYR HD1 H 1 6.783 0.0 . . . . . . . . . . 6558 2
186 . 1 1 26 26 TYR HE1 H 1 6.665 0.0 . . . . . . . . . . 6558 2
187 . 1 1 27 27 TYR CA C 13 56.153 0.0 . . . . . . . . . . 6558 2
188 . 1 1 27 27 TYR CB C 13 42.868 0.0 . . . . . . . . . . 6558 2
189 . 1 1 27 27 TYR CD1 C 13 133.322 0.0 . . . . . . . . . . 6558 2
190 . 1 1 27 27 TYR CE1 C 13 117.705 0.0 . . . . . . . . . . 6558 2
191 . 1 1 27 27 TYR HA H 1 5.588 0.0 . . . . . . . . . . 6558 2
192 . 1 1 27 27 TYR HB2 H 1 2.672 0.0 . . . . . . . . . . 6558 2
193 . 1 1 27 27 TYR HD1 H 1 6.930 0.0 . . . . . . . . . . 6558 2
194 . 1 1 27 27 TYR HE1 H 1 6.584 0.0 . . . . . . . . . . 6558 2
195 . 1 1 28 28 ASN CA C 13 51.545 0.0 . . . . . . . . . . 6558 2
196 . 1 1 28 28 ASN CB C 13 38.132 0.0 . . . . . . . . . . 6558 2
197 . 1 1 28 28 ASN HA H 1 4.398 0.0 . . . . . . . . . . 6558 2
198 . 1 1 28 28 ASN HB2 H 1 2.254 0.0 . . . . . . . . . . 6558 2
199 . 1 1 28 28 ASN HB3 H 1 0.049 0.0 . . . . . . . . . . 6558 2
200 . 1 1 29 29 THR CA C 13 64.325 0.0 . . . . . . . . . . 6558 2
201 . 1 1 29 29 THR CB C 13 68.856 0.0 . . . . . . . . . . 6558 2
202 . 1 1 29 29 THR CG2 C 13 22.283 0.0 . . . . . . . . . . 6558 2
203 . 1 1 29 29 THR HA H 1 3.708 0.0 . . . . . . . . . . 6558 2
204 . 1 1 29 29 THR HB H 1 4.275 0.0 . . . . . . . . . . 6558 2
205 . 1 1 29 29 THR HG21 H 1 1.379 0.0 . . . . . . . . . . 6558 2
206 . 1 1 29 29 THR HG22 H 1 1.379 0.0 . . . . . . . . . . 6558 2
207 . 1 1 29 29 THR HG23 H 1 1.379 0.0 . . . . . . . . . . 6558 2
208 . 1 1 30 30 GLU CA C 13 57.893 0.0 . . . . . . . . . . 6558 2
209 . 1 1 30 30 GLU CB C 13 29.632 0.0 . . . . . . . . . . 6558 2
210 . 1 1 30 30 GLU CG C 13 35.051 0.0 . . . . . . . . . . 6558 2
211 . 1 1 30 30 GLU HA H 1 4.261 0.0 . . . . . . . . . . 6558 2
212 . 1 1 30 30 GLU HB2 H 1 2.052 0.0 . . . . . . . . . . 6558 2
213 . 1 1 30 30 GLU HG2 H 1 2.246 0.0 . . . . . . . . . . 6558 2
214 . 1 1 30 30 GLU HG3 H 1 2.132 0.0 . . . . . . . . . . 6558 2
215 . 1 1 31 31 THR CA C 13 61.709 0.0 . . . . . . . . . . 6558 2
216 . 1 1 31 31 THR CB C 13 69.862 0.0 . . . . . . . . . . 6558 2
217 . 1 1 31 31 THR CG2 C 13 21.033 0.0 . . . . . . . . . . 6558 2
218 . 1 1 31 31 THR HA H 1 4.097 0.0 . . . . . . . . . . 6558 2
219 . 1 1 31 31 THR HB H 1 4.220 0.0 . . . . . . . . . . 6558 2
220 . 1 1 31 31 THR HG21 H 1 0.946 0.0 . . . . . . . . . . 6558 2
221 . 1 1 31 31 THR HG22 H 1 0.946 0.0 . . . . . . . . . . 6558 2
222 . 1 1 31 31 THR HG23 H 1 0.946 0.0 . . . . . . . . . . 6558 2
223 . 1 1 32 32 LYS CA C 13 57.358 0.0 . . . . . . . . . . 6558 2
224 . 1 1 32 32 LYS CB C 13 28.769 0.0 . . . . . . . . . . 6558 2
225 . 1 1 32 32 LYS CE C 13 42.350 0.0 . . . . . . . . . . 6558 2
226 . 1 1 32 32 LYS CG C 13 25.183 0.0 . . . . . . . . . . 6558 2
227 . 1 1 32 32 LYS HA H 1 3.614 0.0 . . . . . . . . . . 6558 2
228 . 1 1 32 32 LYS HB2 H 1 2.118 0.0 . . . . . . . . . . 6558 2
229 . 1 1 32 32 LYS HB3 H 1 2.039 0.0 . . . . . . . . . . 6558 2
230 . 1 1 32 32 LYS HD2 H 1 1.608 0.0 . . . . . . . . . . 6558 2
231 . 1 1 32 32 LYS HE2 H 1 2.984 0.0 . . . . . . . . . . 6558 2
232 . 1 1 32 32 LYS HG2 H 1 1.192 0.0 . . . . . . . . . . 6558 2
233 . 1 1 33 33 GLN CA C 13 54.834 0.0 . . . . . . . . . . 6558 2
234 . 1 1 33 33 GLN CB C 13 31.116 0.0 . . . . . . . . . . 6558 2
235 . 1 1 33 33 GLN CG C 13 33.804 0.0 . . . . . . . . . . 6558 2
236 . 1 1 33 33 GLN HA H 1 4.402 0.0 . . . . . . . . . . 6558 2
237 . 1 1 33 33 GLN HB2 H 1 2.070 0.0 . . . . . . . . . . 6558 2
238 . 1 1 33 33 GLN HB3 H 1 1.705 0.0 . . . . . . . . . . 6558 2
239 . 1 1 33 33 GLN HG2 H 1 2.348 0.0 . . . . . . . . . . 6558 2
240 . 1 1 34 34 SER CA C 13 57.031 0.0 . . . . . . . . . . 6558 2
241 . 1 1 34 34 SER CB C 13 66.158 0.0 . . . . . . . . . . 6558 2
242 . 1 1 34 34 SER HA H 1 6.055 0.0 . . . . . . . . . . 6558 2
243 . 1 1 34 34 SER HB2 H 1 3.660 0.0 . . . . . . . . . . 6558 2
244 . 1 1 34 34 SER HB3 H 1 3.660 0.0 . . . . . . . . . . 6558 2
245 . 1 1 35 35 THR CA C 13 59.664 0.0 . . . . . . . . . . 6558 2
246 . 1 1 35 35 THR CB C 13 69.862 0.0 . . . . . . . . . . 6558 2
247 . 1 1 35 35 THR CG2 C 13 20.335 0.0 . . . . . . . . . . 6558 2
248 . 1 1 35 35 THR HA H 1 4.767 0.0 . . . . . . . . . . 6558 2
249 . 1 1 35 35 THR HB H 1 4.220 0.0 . . . . . . . . . . 6558 2
250 . 1 1 35 35 THR HG21 H 1 1.089 0.0 . . . . . . . . . . 6558 2
251 . 1 1 35 35 THR HG22 H 1 1.089 0.0 . . . . . . . . . . 6558 2
252 . 1 1 35 35 THR HG23 H 1 1.089 0.0 . . . . . . . . . . 6558 2
253 . 1 1 36 36 TRP CA C 13 58.205 0.0 . . . . . . . . . . 6558 2
254 . 1 1 36 36 TRP CB C 13 30.346 0.0 . . . . . . . . . . 6558 2
255 . 1 1 36 36 TRP CD1 C 13 127.957 0.0 . . . . . . . . . . 6558 2
256 . 1 1 36 36 TRP CE3 C 13 121.722 0.0 . . . . . . . . . . 6558 2
257 . 1 1 36 36 TRP CH2 C 13 124.290 0.0 . . . . . . . . . . 6558 2
258 . 1 1 36 36 TRP CZ2 C 13 114.440 0.0 . . . . . . . . . . 6558 2
259 . 1 1 36 36 TRP CZ3 C 13 123.228 0.0 . . . . . . . . . . 6558 2
260 . 1 1 36 36 TRP HA H 1 5.034 0.0 . . . . . . . . . . 6558 2
261 . 1 1 36 36 TRP HB2 H 1 3.661 0.0 . . . . . . . . . . 6558 2
262 . 1 1 36 36 TRP HB3 H 1 3.169 0.0 . . . . . . . . . . 6558 2
263 . 1 1 36 36 TRP HD1 H 1 7.356 0.0 . . . . . . . . . . 6558 2
264 . 1 1 36 36 TRP HE3 H 1 8.007 0.0 . . . . . . . . . . 6558 2
265 . 1 1 36 36 TRP HH2 H 1 7.101 0.0 . . . . . . . . . . 6558 2
266 . 1 1 36 36 TRP HZ2 H 1 7.314 0.0 . . . . . . . . . . 6558 2
267 . 1 1 36 36 TRP HZ3 H 1 6.951 0.0 . . . . . . . . . . 6558 2
268 . 1 1 37 37 GLU CA C 13 54.715 0.0 . . . . . . . . . . 6558 2
269 . 1 1 37 37 GLU CB C 13 30.244 0.0 . . . . . . . . . . 6558 2
270 . 1 1 37 37 GLU CG C 13 34.405 0.0 . . . . . . . . . . 6558 2
271 . 1 1 37 37 GLU HA H 1 4.483 0.0 . . . . . . . . . . 6558 2
272 . 1 1 37 37 GLU HB2 H 1 1.887 0.0 . . . . . . . . . . 6558 2
273 . 1 1 37 37 GLU HB3 H 1 1.781 0.0 . . . . . . . . . . 6558 2
274 . 1 1 37 37 GLU HG2 H 1 2.280 0.0 . . . . . . . . . . 6558 2
275 . 1 1 38 38 LYS CA C 13 54.525 0.0 . . . . . . . . . . 6558 2
276 . 1 1 38 38 LYS CB C 13 32.415 0.0 . . . . . . . . . . 6558 2
277 . 1 1 38 38 LYS CD C 13 29.362 0.0 . . . . . . . . . . 6558 2
278 . 1 1 38 38 LYS CG C 13 23.986 0.0 . . . . . . . . . . 6558 2
279 . 1 1 38 38 LYS HA H 1 2.979 0.0 . . . . . . . . . . 6558 2
280 . 1 1 38 38 LYS HB2 H 1 1.390 0.0 . . . . . . . . . . 6558 2
281 . 1 1 38 38 LYS HB3 H 1 1.279 0.0 . . . . . . . . . . 6558 2
282 . 1 1 38 38 LYS HD2 H 1 1.494 0.0 . . . . . . . . . . 6558 2
283 . 1 1 38 38 LYS HE2 H 1 2.868 0.0 . . . . . . . . . . 6558 2
284 . 1 1 38 38 LYS HG2 H 1 1.023 0.0 . . . . . . . . . . 6558 2
285 . 1 1 38 38 LYS HG3 H 1 0.787 0.0 . . . . . . . . . . 6558 2
286 . 1 1 39 39 PRO CA C 13 62.576 0.0 . . . . . . . . . . 6558 2
287 . 1 1 39 39 PRO CB C 13 31.747 0.0 . . . . . . . . . . 6558 2
288 . 1 1 39 39 PRO CD C 13 50.375 0.0 . . . . . . . . . . 6558 2
289 . 1 1 39 39 PRO CG C 13 25.874 0.0 . . . . . . . . . . 6558 2
290 . 1 1 39 39 PRO HA H 1 3.955 0.0 . . . . . . . . . . 6558 2
291 . 1 1 39 39 PRO HB2 H 1 1.278 0.0 . . . . . . . . . . 6558 2
292 . 1 1 39 39 PRO HB3 H 1 1.191 0.0 . . . . . . . . . . 6558 2
293 . 1 1 39 39 PRO HD2 H 1 2.556 0.0 . . . . . . . . . . 6558 2
294 . 1 1 39 39 PRO HD3 H 1 2.278 0.0 . . . . . . . . . . 6558 2
295 . 1 1 39 39 PRO HG2 H 1 0.653 0.0 . . . . . . . . . . 6558 2
296 . 1 1 39 39 PRO HG3 H 1 0.325 0.0 . . . . . . . . . . 6558 2
297 . 1 1 40 40 ASP CA C 13 53.379 0.0 . . . . . . . . . . 6558 2
298 . 1 1 40 40 ASP CB C 13 40.365 0.0 . . . . . . . . . . 6558 2
299 . 1 1 40 40 ASP HA H 1 4.513 0.0 . . . . . . . . . . 6558 2
300 . 1 1 40 40 ASP HB2 H 1 2.692 0.0 . . . . . . . . . . 6558 2
301 . 1 1 40 40 ASP HB3 H 1 2.539 0.0 . . . . . . . . . . 6558 2
302 . 1 1 41 41 ASP CA C 13 54.357 0.0 . . . . . . . . . . 6558 2
303 . 1 1 41 41 ASP CB C 13 40.775 0.0 . . . . . . . . . . 6558 2
304 . 1 1 41 41 ASP HA H 1 4.406 0.0 . . . . . . . . . . 6558 2
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