Content for NMR-STAR saveframe, "assigned_chem_shift_list_1_2"
save_assigned_chem_shift_list_1_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1_2
_Assigned_chem_shift_list.Entry_ID 25684
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
9 '2D 1H-13C HSQC/HMQC' 2 $wr10_43_D2O isotropic 25684 2
10 '3D 1H-13C NOESY' 2 $wr10_43_D2O isotropic 25684 2
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $CcpNmr_Analysis . . 25684 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.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 2 2 ALA HA H 1 4.423 0.001 . 1 . . 193 . . 6 ALA HA . 25684 2
2 . 1 1 2 2 ALA HB1 H 1 1.440 0.0 . 1 . . 194 . . 6 ALA HB1 . 25684 2
3 . 1 1 2 2 ALA HB2 H 1 1.440 0.0 . 1 . . 194 . . 6 ALA HB2 . 25684 2
4 . 1 1 2 2 ALA HB3 H 1 1.440 0.0 . 1 . . 194 . . 6 ALA HB3 . 25684 2
5 . 1 1 2 2 ALA CA C 13 52.208 . . 1 . . 73 . . 6 ALA CA . 25684 2
6 . 1 1 2 2 ALA CB C 13 18.684 . . 1 . . 159 . . 6 ALA CB . 25684 2
7 . 1 1 3 3 MET HA H 1 4.526 0.001 . 1 . . 195 . . 7 MET HA . 25684 2
8 . 1 1 3 3 MET HB2 H 1 2.664 0.029 . 2 . . 198 . . 7 MET HB2 . 25684 2
9 . 1 1 3 3 MET HB3 H 1 2.615 0.0 . 2 . . 361 . . 7 MET HB3 . 25684 2
10 . 1 1 3 3 MET CA C 13 55.311 . . 1 . . 72 . . 7 MET CA . 25684 2
11 . 1 1 3 3 MET CB C 13 31.742 0.007 . 1 . . 56 . . 7 MET CB . 25684 2
12 . 1 1 4 4 GLY HA2 H 1 4.041 0.034 . 1 . . 199 . . 8 GLY HA2 . 25684 2
13 . 1 1 4 4 GLY CA C 13 44.799 0.006 . 1 . . 81 . . 8 GLY CA . 25684 2
14 . 1 1 5 5 SER HA H 1 4.574 0.005 . 1 . . 200 . . 9 SER HA . 25684 2
15 . 1 1 5 5 SER HB2 H 1 3.924 0.0 . 1 . . 201 . . 9 SER HB2 . 25684 2
16 . 1 1 5 5 SER CA C 13 57.743 . . 1 . . 76 . . 9 SER CA . 25684 2
17 . 1 1 5 5 SER CB C 13 63.556 0.0 . 1 . . 106 . . 9 SER CB . 25684 2
18 . 1 1 6 6 VAL HA H 1 4.238 0.003 . 1 . . 202 . . 10 VAL HA . 25684 2
19 . 1 1 6 6 VAL HB H 1 2.178 0.0 . 1 . . 203 . . 10 VAL HB . 25684 2
20 . 1 1 6 6 VAL HG11 H 1 0.994 0.004 . 2 . . 204 . . 10 VAL HG11 . 25684 2
21 . 1 1 6 6 VAL HG12 H 1 0.994 0.004 . 2 . . 204 . . 10 VAL HG12 . 25684 2
22 . 1 1 6 6 VAL HG13 H 1 0.994 0.004 . 2 . . 204 . . 10 VAL HG13 . 25684 2
23 . 1 1 6 6 VAL HG21 H 1 0.989 . . 2 . . 379 . . 10 VAL HG21 . 25684 2
24 . 1 1 6 6 VAL HG22 H 1 0.989 . . 2 . . 379 . . 10 VAL HG22 . 25684 2
25 . 1 1 6 6 VAL HG23 H 1 0.989 . . 2 . . 379 . . 10 VAL HG23 . 25684 2
26 . 1 1 6 6 VAL CA C 13 61.968 . . 1 . . 75 . . 10 VAL CA . 25684 2
27 . 1 1 6 6 VAL CB C 13 32.414 . . 1 . . 59 . . 10 VAL CB . 25684 2
28 . 1 1 6 6 VAL CG1 C 13 20.870 . . 2 . . 162 . . 10 VAL CG1 . 25684 2
29 . 1 1 6 6 VAL CG2 C 13 19.967 . . 2 . . 161 . . 10 VAL CG2 . 25684 2
30 . 1 1 7 7 ASP HA H 1 4.704 0.0 . 1 . . 207 . . 11 ASP HA . 25684 2
31 . 1 1 7 7 ASP HB2 H 1 2.786 0.0 . 2 . . 205 . . 11 ASP HB2 . 25684 2
32 . 1 1 7 7 ASP HB3 H 1 2.678 0.0 . 2 . . 206 . . 11 ASP HB3 . 25684 2
33 . 1 1 7 7 ASP CA C 13 53.989 . . 1 . . 87 . . 11 ASP CA . 25684 2
34 . 1 1 7 7 ASP CB C 13 41.059 0.003 . 1 . . 163 . . 11 ASP CB . 25684 2
35 . 1 1 8 8 SER HA H 1 4.457 0.001 . 1 . . 208 . . 12 SER HA . 25684 2
36 . 1 1 8 8 SER HB2 H 1 3.972 0.0 . 2 . . 209 . . 12 SER HB2 . 25684 2
37 . 1 1 8 8 SER HB3 H 1 3.873 0.0 . 2 . . 210 . . 12 SER HB3 . 25684 2
38 . 1 1 8 8 SER CA C 13 58.149 0.025 . 1 . . 94 . . 12 SER CA . 25684 2
39 . 1 1 8 8 SER CB C 13 63.355 0.014 . 1 . . 93 . . 12 SER CB . 25684 2
40 . 1 1 9 9 ALA HA H 1 4.355 0.0 . 1 . . 211 . . 13 ALA HA . 25684 2
41 . 1 1 9 9 ALA HB1 H 1 1.453 0.0 . 1 . . 212 . . 13 ALA HB1 . 25684 2
42 . 1 1 9 9 ALA HB2 H 1 1.453 0.0 . 1 . . 212 . . 13 ALA HB2 . 25684 2
43 . 1 1 9 9 ALA HB3 H 1 1.453 0.0 . 1 . . 212 . . 13 ALA HB3 . 25684 2
44 . 1 1 9 9 ALA CA C 13 52.639 . . 1 . . 77 . . 13 ALA CA . 25684 2
45 . 1 1 9 9 ALA CB C 13 18.975 0.0 . 1 . . 60 . . 13 ALA CB . 25684 2
46 . 1 1 10 10 ASP HA H 1 4.627 0.001 . 1 . . 213 . . 14 ASP HA . 25684 2
47 . 1 1 10 10 ASP HB2 H 1 2.769 0.003 . 2 . . 214 . . 14 ASP HB2 . 25684 2
48 . 1 1 10 10 ASP HB3 H 1 2.680 0.002 . 2 . . 215 . . 14 ASP HB3 . 25684 2
49 . 1 1 10 10 ASP CA C 13 53.940 0.005 . 1 . . 74 . . 14 ASP CA . 25684 2
50 . 1 1 10 10 ASP CB C 13 41.019 0.001 . 1 . . 57 . . 14 ASP CB . 25684 2
51 . 1 1 11 11 ALA HA H 1 4.374 0.0 . 1 . . 217 . . 15 ALA HA . 25684 2
52 . 1 1 11 11 ALA HB1 H 1 1.468 0.003 . 1 . . 216 . . 15 ALA HB1 . 25684 2
53 . 1 1 11 11 ALA HB2 H 1 1.468 0.003 . 1 . . 216 . . 15 ALA HB2 . 25684 2
54 . 1 1 11 11 ALA HB3 H 1 1.468 0.003 . 1 . . 216 . . 15 ALA HB3 . 25684 2
55 . 1 1 11 11 ALA CA C 13 52.535 0.0 . 1 . . 88 . . 15 ALA CA . 25684 2
56 . 1 1 11 11 ALA CB C 13 19.046 . . 1 . . 103 . . 15 ALA CB . 25684 2
57 . 1 1 12 12 GLY HA2 H 1 4.049 . . 2 . . 218 . . 16 GLY HA2 . 25684 2
58 . 1 1 12 12 GLY HA3 H 1 3.999 . . 2 . . 219 . . 16 GLY HA3 . 25684 2
59 . 1 1 12 12 GLY CA C 13 44.983 0.012 . 1 . . 92 . . 16 GLY CA . 25684 2
60 . 1 1 13 13 GLY HA2 H 1 4.071 . . 2 . . 220 . . 17 GLY HA2 . 25684 2
61 . 1 1 13 13 GLY HA3 H 1 4.017 . . 2 . . 221 . . 17 GLY HA3 . 25684 2
62 . 1 1 13 13 GLY CA C 13 44.854 0.006 . 1 . . 104 . . 17 GLY CA . 25684 2
63 . 1 1 14 14 GLY HA2 H 1 4.093 . . 2 . . 222 . . 18 GLY HA2 . 25684 2
64 . 1 1 14 14 GLY HA3 H 1 4.047 . . 2 . . 223 . . 18 GLY HA3 . 25684 2
65 . 1 1 14 14 GLY CA C 13 44.799 0.012 . 1 . . 105 . . 18 GLY CA . 25684 2
66 . 1 1 15 15 SER HA H 1 4.464 0.0 . 1 . . 224 . . 19 SER HA . 25684 2
67 . 1 1 15 15 SER HB2 H 1 3.903 0.008 . 1 . . 225 . . 19 SER HB2 . 25684 2
68 . 1 1 15 15 SER CA C 13 58.159 0.0 . 1 . . 86 . . 19 SER CA . 25684 2
69 . 1 1 15 15 SER CB C 13 63.480 0.0 . 1 . . 67 . . 19 SER CB . 25684 2
70 . 1 1 16 16 GLY HA2 H 1 4.066 . . 1 . . 226 . . 20 GLY HA2 . 25684 2
71 . 1 1 16 16 GLY CA C 13 45.149 . . 1 . . 80 . . 20 GLY CA . 25684 2
72 . 1 1 17 17 TRP HB2 H 1 3.297 0.038 . 1 . . 228 . . 21 TRP HB2 . 25684 2
73 . 1 1 17 17 TRP CB C 13 29.085 0.01 . 1 . . 348 . . 21 TRP CB . 25684 2
74 . 1 1 18 18 LEU HA H 1 4.320 0.002 . 1 . . 229 . . 22 LEU HA . 25684 2
75 . 1 1 18 18 LEU HB2 H 1 1.543 0.006 . 2 . . 230 . . 22 LEU HB2 . 25684 2
76 . 1 1 18 18 LEU HB3 H 1 1.512 0.005 . 2 . . 355 . . 22 LEU HB3 . 25684 2
77 . 1 1 18 18 LEU HG H 1 1.387 0.002 . 1 . . 367 . . 22 LEU HG . 25684 2
78 . 1 1 18 18 LEU HD11 H 1 0.875 0.001 . 1 . . 365 . . 22 LEU HD11 . 25684 2
79 . 1 1 18 18 LEU HD12 H 1 0.875 0.001 . 1 . . 365 . . 22 LEU HD12 . 25684 2
80 . 1 1 18 18 LEU HD13 H 1 0.875 0.001 . 1 . . 365 . . 22 LEU HD13 . 25684 2
81 . 1 1 18 18 LEU HD21 H 1 0.793 0.002 . 1 . . 381 . . 22 LEU HD21 . 25684 2
82 . 1 1 18 18 LEU HD22 H 1 0.793 0.002 . 1 . . 381 . . 22 LEU HD22 . 25684 2
83 . 1 1 18 18 LEU HD23 H 1 0.793 0.002 . 1 . . 381 . . 22 LEU HD23 . 25684 2
84 . 1 1 18 18 LEU CA C 13 55.083 0.0 . 1 . . 368 . . 22 LEU CA . 25684 2
85 . 1 1 18 18 LEU CB C 13 41.938 0.059 . 1 . . 354 . . 22 LEU CB . 25684 2
86 . 1 1 18 18 LEU CG C 13 26.485 0.008 . 1 . . 166 . . 22 LEU CG . 25684 2
87 . 1 1 18 18 LEU CD1 C 13 24.614 . . 1 . . 366 . . 22 LEU CD1 . 25684 2
88 . 1 1 18 18 LEU CD2 C 13 23.192 0.011 . 1 . . 364 . . 22 LEU CD2 . 25684 2
89 . 1 1 19 19 THR HA H 1 3.969 . . 1 . . 233 . . 23 THR HA . 25684 2
90 . 1 1 19 19 THR HB H 1 4.211 0.001 . 1 . . 234 . . 23 THR HB . 25684 2
91 . 1 1 19 19 THR HG21 H 1 1.229 0.0 . 1 . . 232 . . 23 THR HG21 . 25684 2
92 . 1 1 19 19 THR HG22 H 1 1.229 0.0 . 1 . . 232 . . 23 THR HG22 . 25684 2
93 . 1 1 19 19 THR HG23 H 1 1.229 0.0 . 1 . . 232 . . 23 THR HG23 . 25684 2
94 . 1 1 19 19 THR CA C 13 63.688 . . 1 . . 351 . . 23 THR CA . 25684 2
95 . 1 1 19 19 THR CB C 13 69.221 0.003 . 1 . . 352 . . 23 THR CB . 25684 2
96 . 1 1 19 19 THR CG2 C 13 21.392 . . 1 . . 369 . . 23 THR CG2 . 25684 2
97 . 1 1 20 20 GLY HA2 H 1 3.956 . . 1 . . 235 . . 24 GLY HA2 . 25684 2
98 . 1 1 20 20 GLY CA C 13 45.265 . . 1 . . 350 . . 24 GLY CA . 25684 2
99 . 1 1 21 21 TRP HA H 1 4.567 0.001 . 1 . . 238 . . 25 TRP HA . 25684 2
100 . 1 1 21 21 TRP HB3 H 1 3.248 0.019 . 1 . . 237 . . 25 TRP HB3 . 25684 2
101 . 1 1 21 21 TRP HD1 H 1 7.209 . . 1 . . 363 . . 25 TRP HD1 . 25684 2
102 . 1 1 21 21 TRP HE3 H 1 7.545 . . 1 . . 389 . . 25 TRP HE3 . 25684 2
103 . 1 1 21 21 TRP CA C 13 57.300 0.021 . 1 . . 70 . . 25 TRP CA . 25684 2
104 . 1 1 21 21 TRP CB C 13 29.549 0.005 . 1 . . 346 . . 25 TRP CB . 25684 2
105 . 1 1 22 22 LEU HA H 1 4.511 0.001 . 1 . . 360 . . 26 LEU HA . 25684 2
106 . 1 1 22 22 LEU HB2 H 1 1.426 0.003 . 2 . . 309 . . 26 LEU HB2 . 25684 2
107 . 1 1 22 22 LEU HB3 H 1 1.386 0.003 . 2 . . 362 . . 26 LEU HB3 . 25684 2
108 . 1 1 22 22 LEU HG H 1 1.519 . . 1 . . 370 . . 26 LEU HG . 25684 2
109 . 1 1 22 22 LEU HD11 H 1 0.886 0.004 . 2 . . 293 . . 26 LEU HD11 . 25684 2
110 . 1 1 22 22 LEU HD12 H 1 0.886 0.004 . 2 . . 293 . . 26 LEU HD12 . 25684 2
111 . 1 1 22 22 LEU HD13 H 1 0.886 0.004 . 2 . . 293 . . 26 LEU HD13 . 25684 2
112 . 1 1 22 22 LEU HD21 H 1 0.850 . . 2 . . 383 . . 26 LEU HD21 . 25684 2
113 . 1 1 22 22 LEU HD22 H 1 0.850 . . 2 . . 383 . . 26 LEU HD22 . 25684 2
114 . 1 1 22 22 LEU HD23 H 1 0.850 . . 2 . . 383 . . 26 LEU HD23 . 25684 2
115 . 1 1 22 22 LEU CA C 13 52.214 0.011 . 1 . . 71 . . 26 LEU CA . 25684 2
116 . 1 1 22 22 LEU CB C 13 42.426 0.002 . 1 . . 55 . . 26 LEU CB . 25684 2
117 . 1 1 22 22 LEU CD1 C 13 23.577 . . 1 . . 298 . . 26 LEU CD1 . 25684 2
118 . 1 1 22 22 LEU CD2 C 13 24.990 . . 1 . . 297 . . 26 LEU CD2 . 25684 2
119 . 1 1 23 23 PRO HA H 1 4.236 0.003 . 1 . . 371 . . 27 PRO HA . 25684 2
120 . 1 1 23 23 PRO HB2 H 1 1.716 0.003 . 2 . . 372 . . 27 PRO HB2 . 25684 2
121 . 1 1 23 23 PRO HB3 H 1 2.154 0.001 . 2 . . 373 . . 27 PRO HB3 . 25684 2
122 . 1 1 23 23 PRO HG3 H 1 1.933 0.0 . 1 . . 342 . . 27 PRO HG3 . 25684 2
123 . 1 1 23 23 PRO HD2 H 1 3.545 0.001 . 2 . . 375 . . 27 PRO HD2 . 25684 2
124 . 1 1 23 23 PRO HD3 H 1 3.515 0.004 . 2 . . 388 . . 27 PRO HD3 . 25684 2
125 . 1 1 23 23 PRO CA C 13 62.850 0.0 . 1 . . 112 . . 27 PRO CA . 25684 2
126 . 1 1 23 23 PRO CB C 13 31.530 0.007 . 1 . . 113 . . 27 PRO CB . 25684 2
127 . 1 1 23 23 PRO CG C 13 26.906 . . 1 . . 295 . . 27 PRO CG . 25684 2
128 . 1 1 23 23 PRO CD C 13 49.992 0.004 . 1 . . 374 . . 27 PRO CD . 25684 2
129 . 1 1 24 24 THR HA H 1 4.280 0.001 . 1 . . 240 . . 28 THR HA . 25684 2
130 . 1 1 24 24 THR HB H 1 4.273 0.001 . 1 . . 296 . . 28 THR HB . 25684 2
131 . 1 1 24 24 THR HG21 H 1 1.240 0.0 . 1 . . 239 . . 28 THR HG21 . 25684 2
132 . 1 1 24 24 THR HG22 H 1 1.240 0.0 . 1 . . 239 . . 28 THR HG22 . 25684 2
133 . 1 1 24 24 THR HG23 H 1 1.240 0.0 . 1 . . 239 . . 28 THR HG23 . 25684 2
134 . 1 1 24 24 THR CA C 13 61.973 0.002 . 1 . . 167 . . 28 THR CA . 25684 2
135 . 1 1 24 24 THR CB C 13 69.187 0.003 . 1 . . 116 . . 28 THR CB . 25684 2
136 . 1 1 24 24 THR CG2 C 13 21.237 . . 1 . . 376 . . 28 THR CG2 . 25684 2
137 . 1 1 25 25 TRP HA H 1 4.702 0.002 . 1 . . 241 . . 29 TRP HA . 25684 2
138 . 1 1 25 25 TRP HB2 H 1 3.343 . . 2 . . 242 . . 29 TRP HB2 . 25684 2
139 . 1 1 25 25 TRP HB3 H 1 3.300 0.003 . 2 . . 243 . . 29 TRP HB3 . 25684 2
140 . 1 1 25 25 TRP HD1 H 1 7.266 . . 1 . . 390 . . 29 TRP HD1 . 25684 2
141 . 1 1 25 25 TRP HE3 H 1 7.573 . . 1 . . 336 . . 29 TRP HE3 . 25684 2
142 . 1 1 25 25 TRP CA C 13 57.030 0.021 . 1 . . 117 . . 29 TRP CA . 25684 2
143 . 1 1 25 25 TRP CB C 13 29.206 . . 1 . . 347 . . 29 TRP CB . 25684 2
144 . 1 1 26 26 CYS HA H 1 4.663 0.001 . 1 . . 398 . . 30 CYS HA . 25684 2
145 . 1 1 26 26 CYS HB2 H 1 2.806 0.001 . 2 . . 290 . . 30 CYS HB2 . 25684 2
146 . 1 1 26 26 CYS HB3 H 1 2.720 0.003 . 2 . . 396 . . 30 CYS HB3 . 25684 2
147 . 1 1 26 26 CYS CA C 13 55.617 0.003 . 1 . . 377 . . 30 CYS CA . 25684 2
148 . 1 1 26 26 CYS CB C 13 27.389 0.003 . 1 . . 397 . . 30 CYS CB . 25684 2
149 . 1 1 27 27 PRO HA H 1 4.320 0.003 . 1 . . 356 . . 31 PRO HA . 25684 2
150 . 1 1 27 27 PRO HB2 H 1 1.993 0.003 . 2 . . 246 . . 31 PRO HB2 . 25684 2
151 . 1 1 27 27 PRO HB3 H 1 2.311 0.002 . 2 . . 247 . . 31 PRO HB3 . 25684 2
152 . 1 1 27 27 PRO HG3 H 1 2.017 0.0 . 1 . . 395 . . 31 PRO HG3 . 25684 2
153 . 1 1 27 27 PRO HD2 H 1 3.689 0.0 . 2 . . 245 . . 31 PRO HD2 . 25684 2
154 . 1 1 27 27 PRO HD3 H 1 3.441 0.002 . 2 . . 357 . . 31 PRO HD3 . 25684 2
155 . 1 1 27 27 PRO CA C 13 63.150 0.009 . 1 . . 127 . . 31 PRO CA . 25684 2
156 . 1 1 27 27 PRO CB C 13 31.877 0.006 . 1 . . 126 . . 31 PRO CB . 25684 2
157 . 1 1 27 27 PRO CG C 13 26.877 0.006 . 1 . . 359 . . 31 PRO CG . 25684 2
158 . 1 1 27 27 PRO CD C 13 50.373 0.003 . 1 . . 358 . . 31 PRO CD . 25684 2
159 . 1 1 28 28 THR HA H 1 4.447 0.001 . 1 . . 248 . . 32 THR HA . 25684 2
160 . 1 1 28 28 THR HB H 1 4.343 0.001 . 1 . . 353 . . 32 THR HB . 25684 2
161 . 1 1 28 28 THR HG21 H 1 1.262 0.008 . 1 . . 250 . . 32 THR HG21 . 25684 2
162 . 1 1 28 28 THR HG22 H 1 1.262 0.008 . 1 . . 250 . . 32 THR HG22 . 25684 2
163 . 1 1 28 28 THR HG23 H 1 1.262 0.008 . 1 . . 250 . . 32 THR HG23 . 25684 2
164 . 1 1 28 28 THR CA C 13 61.583 0.0 . 1 . . 121 . . 32 THR CA . 25684 2
165 . 1 1 28 28 THR CB C 13 69.329 0.016 . 1 . . 125 . . 32 THR CB . 25684 2
166 . 1 1 28 28 THR CG2 C 13 21.416 . . 1 . . 168 . . 32 THR CG2 . 25684 2
167 . 1 1 29 29 SER HA H 1 4.584 0.0 . 1 . . 251 . . 33 SER HA . 25684 2
168 . 1 1 29 29 SER HB2 H 1 3.945 0.002 . 2 . . 252 . . 33 SER HB2 . 25684 2
169 . 1 1 29 29 SER HB3 H 1 3.904 . . 2 . . 253 . . 33 SER HB3 . 25684 2
170 . 1 1 29 29 SER CA C 13 58.031 . . 1 . . 122 . . 33 SER CA . 25684 2
171 . 1 1 29 29 SER CB C 13 63.434 0.021 . 1 . . 120 . . 33 SER CB . 25684 2
172 . 1 1 30 30 THR HA H 1 4.302 . . 1 . . 255 . . 34 THR HA . 25684 2
173 . 1 1 30 30 THR HB H 1 4.351 0.006 . 1 . . 254 . . 34 THR HB . 25684 2
174 . 1 1 30 30 THR HG21 H 1 1.256 0.001 . 1 . . 256 . . 34 THR HG21 . 25684 2
175 . 1 1 30 30 THR HG22 H 1 1.256 0.001 . 1 . . 256 . . 34 THR HG22 . 25684 2
176 . 1 1 30 30 THR HG23 H 1 1.256 0.001 . 1 . . 256 . . 34 THR HG23 . 25684 2
177 . 1 1 30 30 THR CA C 13 61.625 . . 1 . . 101 . . 34 THR CA . 25684 2
178 . 1 1 30 30 THR CB C 13 69.128 . . 1 . . 130 . . 34 THR CB . 25684 2
179 . 1 1 30 30 THR CG2 C 13 21.121 . . 1 . . 169 . . 34 THR CG2 . 25684 2
180 . 1 1 31 31 SER HB2 H 1 3.870 . . 1 . . 291 . . 35 SER HB2 . 25684 2
181 . 1 1 31 31 SER CB C 13 63.649 . . 1 . . 100 . . 35 SER CB . 25684 2
182 . 1 1 32 32 HIS HA H 1 4.733 0.0 . 1 . . 257 . . 36 HIS HA . 25684 2
183 . 1 1 32 32 HIS HB2 H 1 3.276 0.025 . 2 . . 258 . . 36 HIS HB2 . 25684 2
184 . 1 1 32 32 HIS HB3 H 1 3.168 0.003 . 2 . . 259 . . 36 HIS HB3 . 25684 2
185 . 1 1 32 32 HIS CA C 13 55.490 . . 1 . . 83 . . 36 HIS CA . 25684 2
186 . 1 1 32 32 HIS CB C 13 29.437 . . 1 . . 63 . . 36 HIS CB . 25684 2
187 . 1 1 33 33 LEU HA H 1 4.374 0.001 . 1 . . 260 . . 37 LEU HA . 25684 2
188 . 1 1 33 33 LEU HB2 H 1 1.675 0.001 . 2 . . 261 . . 37 LEU HB2 . 25684 2
189 . 1 1 33 33 LEU HB3 H 1 1.616 0.003 . 2 . . 262 . . 37 LEU HB3 . 25684 2
190 . 1 1 33 33 LEU HG H 1 1.523 0.009 . 1 . . 263 . . 37 LEU HG . 25684 2
191 . 1 1 33 33 LEU HD11 H 1 0.961 0.004 . 2 . . 264 . . 37 LEU HD11 . 25684 2
192 . 1 1 33 33 LEU HD12 H 1 0.961 0.004 . 2 . . 264 . . 37 LEU HD12 . 25684 2
193 . 1 1 33 33 LEU HD13 H 1 0.961 0.004 . 2 . . 264 . . 37 LEU HD13 . 25684 2
194 . 1 1 33 33 LEU HD21 H 1 0.896 0.01 . 2 . . 265 . . 37 LEU HD21 . 25684 2
195 . 1 1 33 33 LEU HD22 H 1 0.896 0.01 . 2 . . 265 . . 37 LEU HD22 . 25684 2
196 . 1 1 33 33 LEU HD23 H 1 0.896 0.01 . 2 . . 265 . . 37 LEU HD23 . 25684 2
197 . 1 1 33 33 LEU CA C 13 54.820 0.041 . 1 . . 82 . . 37 LEU CA . 25684 2
198 . 1 1 33 33 LEU CB C 13 42.017 0.011 . 1 . . 64 . . 37 LEU CB . 25684 2
199 . 1 1 33 33 LEU CG C 13 26.595 . . 1 . . 173 . . 37 LEU CG . 25684 2
200 . 1 1 33 33 LEU CD1 C 13 24.638 0.0 . 2 . . 174 . . 37 LEU CD1 . 25684 2
201 . 1 1 33 33 LEU CD2 C 13 23.197 0.009 . 2 . . 175 . . 37 LEU CD2 . 25684 2
202 . 1 1 34 34 LYS HA H 1 4.350 0.001 . 1 . . 266 . . 38 LYS HA . 25684 2
203 . 1 1 34 34 LYS HB2 H 1 1.895 0.001 . 2 . . 272 . . 38 LYS HB2 . 25684 2
204 . 1 1 34 34 LYS HB3 H 1 1.813 0.002 . 2 . . 273 . . 38 LYS HB3 . 25684 2
205 . 1 1 34 34 LYS HG2 H 1 1.494 0.0 . 2 . . 268 . . 38 LYS HG2 . 25684 2
206 . 1 1 34 34 LYS HG3 H 1 1.477 . . 2 . . 269 . . 38 LYS HG3 . 25684 2
207 . 1 1 34 34 LYS HD2 H 1 1.711 . . 2 . . 270 . . 38 LYS HD2 . 25684 2
208 . 1 1 34 34 LYS HD3 H 1 1.745 0.0 . 2 . . 271 . . 38 LYS HD3 . 25684 2
209 . 1 1 34 34 LYS HE2 H 1 3.049 0.0 . 1 . . 267 . . 38 LYS HE2 . 25684 2
210 . 1 1 34 34 LYS CA C 13 56.073 0.0 . 1 . . 84 . . 38 LYS CA . 25684 2
211 . 1 1 34 34 LYS CB C 13 32.721 0.008 . 1 . . 65 . . 38 LYS CB . 25684 2
212 . 1 1 34 34 LYS CD C 13 28.715 0.001 . 1 . . 177 . . 38 LYS CD . 25684 2
213 . 1 1 34 34 LYS CE C 13 41.622 . . 1 . . 176 . . 38 LYS CE . 25684 2
214 . 1 1 35 35 GLU HA H 1 4.303 0.0 . 1 . . 274 . . 39 GLU HA . 25684 2
215 . 1 1 35 35 GLU HB2 H 1 2.140 0.0 . 2 . . 275 . . 39 GLU HB2 . 25684 2
216 . 1 1 35 35 GLU HB3 H 1 2.014 0.001 . 2 . . 276 . . 39 GLU HB3 . 25684 2
217 . 1 1 35 35 GLU HG2 H 1 2.358 0.0 . 1 . . 277 . . 39 GLU HG2 . 25684 2
218 . 1 1 35 35 GLU CA C 13 56.435 0.001 . 1 . . 89 . . 39 GLU CA . 25684 2
219 . 1 1 35 35 GLU CB C 13 29.861 0.001 . 1 . . 343 . . 39 GLU CB . 25684 2
220 . 1 1 35 35 GLU CG C 13 35.916 0.0 . 1 . . 179 . . 39 GLU CG . 25684 2
221 . 1 1 36 36 ALA HA H 1 4.356 0.0 . 1 . . 278 . . 40 ALA HA . 25684 2
222 . 1 1 36 36 ALA HB1 H 1 1.465 0.0 . 1 . . 279 . . 40 ALA HB1 . 25684 2
223 . 1 1 36 36 ALA HB2 H 1 1.465 0.0 . 1 . . 279 . . 40 ALA HB2 . 25684 2
224 . 1 1 36 36 ALA HB3 H 1 1.465 0.0 . 1 . . 279 . . 40 ALA HB3 . 25684 2
225 . 1 1 36 36 ALA CA C 13 52.291 0.001 . 1 . . 78 . . 40 ALA CA . 25684 2
226 . 1 1 36 36 ALA CB C 13 18.793 . . 1 . . 58 . . 40 ALA CB . 25684 2
227 . 1 1 37 37 GLU HA H 1 4.344 . . 1 . . 280 . . 41 GLU HA . 25684 2
228 . 1 1 37 37 GLU HB2 H 1 2.131 . . 2 . . 283 . . 41 GLU HB2 . 25684 2
229 . 1 1 37 37 GLU HB3 H 1 2.001 . . 2 . . 284 . . 41 GLU HB3 . 25684 2
230 . 1 1 37 37 GLU HG2 H 1 2.352 . . 2 . . 281 . . 41 GLU HG2 . 25684 2
231 . 1 1 37 37 GLU HG3 H 1 2.252 . . 2 . . 282 . . 41 GLU HG3 . 25684 2
232 . 1 1 37 37 GLU CA C 13 56.247 . . 1 . . 91 . . 41 GLU CA . 25684 2
233 . 1 1 37 37 GLU CB C 13 30.203 0.003 . 1 . . 345 . . 41 GLU CB . 25684 2
234 . 1 1 37 37 GLU CG C 13 36.425 0.003 . 1 . . 349 . . 41 GLU CG . 25684 2
235 . 1 1 38 38 GLU HA H 1 4.358 . . 1 . . 285 . . 42 GLU HA . 25684 2
236 . 1 1 38 38 GLU HB2 H 1 2.119 . . 2 . . 287 . . 42 GLU HB2 . 25684 2
237 . 1 1 38 38 GLU HB3 H 1 1.999 . . 2 . . 288 . . 42 GLU HB3 . 25684 2
238 . 1 1 38 38 GLU HG2 H 1 2.327 . . 1 . . 286 . . 42 GLU HG2 . 25684 2
239 . 1 1 38 38 GLU CA C 13 56.258 . . 1 . . 90 . . 42 GLU CA . 25684 2
240 . 1 1 38 38 GLU CB C 13 30.008 . . 1 . . 344 . . 42 GLU CB . 25684 2
241 . 1 1 38 38 GLU CG C 13 35.765 . . 1 . . 186 . . 42 GLU CG . 25684 2
242 . 1 1 39 39 LYS HA H 1 4.239 0.003 . 1 . . 299 . . 43 LYS HA . 25684 2
243 . 1 1 39 39 LYS HB2 H 1 1.901 . . 2 . . 300 . . 43 LYS HB2 . 25684 2
244 . 1 1 39 39 LYS HB3 H 1 1.775 . . 2 . . 303 . . 43 LYS HB3 . 25684 2
245 . 1 1 39 39 LYS CA C 13 57.186 . . 1 . . 85 . . 43 LYS CA . 25684 2
246 . 1 1 39 39 LYS CB C 13 33.504 0.004 . 1 . . 66 . . 43 LYS CB . 25684 2
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