Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 19464
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $25C
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 1H-15N NOESY' 1 $HicA1H15N isotropic 19464 1
2 '3D 1H-15N TOCSY' 1 $HicA1H15N isotropic 19464 1
3 'HNHA (H{[N]+[HA]})' 1 $HicA1H15N isotropic 19464 1
4 '3D HNCA' 2 $HicA1H15N13C isotropic 19464 1
5 '2D 1H-15N HSQC/HMQC' 1 $HicA1H15N isotropic 19464 1
6 '2D 1H-13C HSQC/HMQC' 2 $HicA1H15N13C isotropic 19464 1
7 '3D 1H-13C NOESY' 2 $HicA1H15N13C isotropic 19464 1
8 '3D HNCO' 2 $HicA1H15N13C isotropic 19464 1
9 '3D HCCH-TOCSY' 2 $HicA1H15N13C isotropic 19464 1
10 '2D 1H-1H NOESY' 3 $HicA1H isotropic 19464 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 11 11 SER C C 13 175.257 0.0 . 1 . 221 . . 11 SER C . 19464 1
2 . 1 1 11 11 SER CA C 13 63.322 0.0 . 1 . 277 . . 11 SER CA . 19464 1
3 . 1 1 12 12 LYS H H 1 7.791 0.002 . 1 . 31 . . 12 LYS H . 19464 1
4 . 1 1 12 12 LYS HA H 1 4.015 0.012 . 1 . 168 . . 12 LYS HA . 19464 1
5 . 1 1 12 12 LYS HB2 H 1 1.913 0.011 . 2 . 295 . . 12 LYS HB2 . 19464 1
6 . 1 1 12 12 LYS HB3 H 1 1.957 0.034 . 2 . 296 . . 12 LYS HB3 . 19464 1
7 . 1 1 12 12 LYS C C 13 176.537 0.0 . 1 . 222 . . 12 LYS C . 19464 1
8 . 1 1 12 12 LYS CA C 13 59.543 0.282 . 1 . 119 . . 12 LYS CA . 19464 1
9 . 1 1 12 12 LYS CB C 13 33.514 0.095 . 1 . 443 . . 12 LYS CB . 19464 1
10 . 1 1 12 12 LYS N N 15 123.053 0.036 . 1 . 32 . . 12 LYS N . 19464 1
11 . 1 1 13 13 LEU H H 1 7.403 0.005 . 1 . 78 . . 13 LEU H . 19464 1
12 . 1 1 13 13 LEU HA H 1 4.001 0.005 . 1 . 169 . . 13 LEU HA . 19464 1
13 . 1 1 13 13 LEU HB2 H 1 1.638 0.008 . 2 . 444 . . 13 LEU HB2 . 19464 1
14 . 1 1 13 13 LEU HB3 H 1 1.641 0.006 . 2 . 445 . . 13 LEU HB3 . 19464 1
15 . 1 1 13 13 LEU HG H 1 0.844 0.008 . 1 . 298 . . 13 LEU HG . 19464 1
16 . 1 1 13 13 LEU C C 13 176.314 0.0 . 1 . 223 . . 13 LEU C . 19464 1
17 . 1 1 13 13 LEU CA C 13 58.755 0.099 . 1 . 120 . . 13 LEU CA . 19464 1
18 . 1 1 13 13 LEU CG C 13 25.027 0.137 . 1 . 297 . . 13 LEU CG . 19464 1
19 . 1 1 13 13 LEU N N 15 120.993 0.064 . 1 . 79 . . 13 LEU N . 19464 1
20 . 1 1 14 14 ILE H H 1 8.378 0.006 . 1 . 68 . . 14 ILE H . 19464 1
21 . 1 1 14 14 ILE HA H 1 3.103 0.006 . 1 . 170 . . 14 ILE HA . 19464 1
22 . 1 1 14 14 ILE HG12 H 1 1.613 0.009 . 2 . 300 . . 14 ILE HG12 . 19464 1
23 . 1 1 14 14 ILE HG13 H 1 0.757 0.01 . 2 . 301 . . 14 ILE HG13 . 19464 1
24 . 1 1 14 14 ILE HG21 H 1 0.849 0.009 . 1 . 303 . . 14 ILE HG21 . 19464 1
25 . 1 1 14 14 ILE HG22 H 1 0.849 0.009 . 1 . 303 . . 14 ILE HG22 . 19464 1
26 . 1 1 14 14 ILE HG23 H 1 0.849 0.009 . 1 . 303 . . 14 ILE HG23 . 19464 1
27 . 1 1 14 14 ILE HD11 H 1 0.129 0.006 . 1 . 304 . . 14 ILE HD11 . 19464 1
28 . 1 1 14 14 ILE HD12 H 1 0.129 0.006 . 1 . 304 . . 14 ILE HD12 . 19464 1
29 . 1 1 14 14 ILE HD13 H 1 0.129 0.006 . 1 . 304 . . 14 ILE HD13 . 19464 1
30 . 1 1 14 14 ILE C C 13 175.455 0.0 . 1 . 224 . . 14 ILE C . 19464 1
31 . 1 1 14 14 ILE CA C 13 67.498 0.036 . 1 . 121 . . 14 ILE CA . 19464 1
32 . 1 1 14 14 ILE CG1 C 13 31.411 0.314 . 1 . 299 . . 14 ILE CG1 . 19464 1
33 . 1 1 14 14 ILE CG2 C 13 17.560 0.101 . 1 . 302 . . 14 ILE CG2 . 19464 1
34 . 1 1 14 14 ILE CD1 C 13 12.635 0.131 . 1 . 305 . . 14 ILE CD1 . 19464 1
35 . 1 1 14 14 ILE N N 15 118.709 0.091 . 1 . 69 . . 14 ILE N . 19464 1
36 . 1 1 15 15 ARG H H 1 7.535 0.004 . 1 . 93 . . 15 ARG H . 19464 1
37 . 1 1 15 15 ARG HA H 1 4.187 0.005 . 1 . 171 . . 15 ARG HA . 19464 1
38 . 1 1 15 15 ARG HB2 H 1 1.946 0.007 . 2 . 308 . . 15 ARG HB2 . 19464 1
39 . 1 1 15 15 ARG HB3 H 1 1.946 0.007 . 2 . 307 . . 15 ARG HB3 . 19464 1
40 . 1 1 15 15 ARG HG2 H 1 1.733 0.01 . 2 . 313 . . 15 ARG HG2 . 19464 1
41 . 1 1 15 15 ARG HG3 H 1 1.733 0.01 . 2 . 315 . . 15 ARG HG3 . 19464 1
42 . 1 1 15 15 ARG HD2 H 1 3.261 0.01 . 1 . 311 . . 15 ARG HD2 . 19464 1
43 . 1 1 15 15 ARG HD3 H 1 3.261 0.01 . 1 . 310 . . 15 ARG HD3 . 19464 1
44 . 1 1 15 15 ARG C C 13 176.604 0.0 . 1 . 225 . . 15 ARG C . 19464 1
45 . 1 1 15 15 ARG CA C 13 60.238 0.125 . 1 . 122 . . 15 ARG CA . 19464 1
46 . 1 1 15 15 ARG CB C 13 30.343 0.068 . 1 . 312 . . 15 ARG CB . 19464 1
47 . 1 1 15 15 ARG CG C 13 27.911 0.166 . 1 . 314 . . 15 ARG CG . 19464 1
48 . 1 1 15 15 ARG CD C 13 44.358 0.0 . 1 . 309 . . 15 ARG CD . 19464 1
49 . 1 1 15 15 ARG N N 15 118.783 0.043 . 1 . 94 . . 15 ARG N . 19464 1
50 . 1 1 16 16 MET H H 1 7.574 0.008 . 1 . 95 . . 16 MET H . 19464 1
51 . 1 1 16 16 MET HA H 1 4.065 0.004 . 1 . 172 . . 16 MET HA . 19464 1
52 . 1 1 16 16 MET HB2 H 1 2.126 0.017 . 2 . 317 . . 16 MET HB2 . 19464 1
53 . 1 1 16 16 MET HB3 H 1 2.114 0.02 . 2 . 316 . . 16 MET HB3 . 19464 1
54 . 1 1 16 16 MET HG2 H 1 2.404 0.01 . 2 . 320 . . 16 MET HG2 . 19464 1
55 . 1 1 16 16 MET HG3 H 1 2.404 0.01 . 2 . 319 . . 16 MET HG3 . 19464 1
56 . 1 1 16 16 MET C C 13 177.284 0.0 . 1 . 226 . . 16 MET C . 19464 1
57 . 1 1 16 16 MET CA C 13 60.249 0.144 . 1 . 139 . . 16 MET CA . 19464 1
58 . 1 1 16 16 MET CB C 13 33.626 0.255 . 1 . 318 . . 16 MET CB . 19464 1
59 . 1 1 16 16 MET CG C 13 33.492 0.0 . 1 . 446 . . 16 MET CG . 19464 1
60 . 1 1 16 16 MET N N 15 117.892 0.113 . 1 . 96 . . 16 MET N . 19464 1
61 . 1 1 17 17 LEU H H 1 7.989 0.004 . 1 . 87 . . 17 LEU H . 19464 1
62 . 1 1 17 17 LEU HA H 1 3.948 0.007 . 1 . 173 . . 17 LEU HA . 19464 1
63 . 1 1 17 17 LEU HB2 H 1 1.375 0.012 . 2 . 326 . . 17 LEU HB2 . 19464 1
64 . 1 1 17 17 LEU HB3 H 1 1.569 0.026 . 2 . 325 . . 17 LEU HB3 . 19464 1
65 . 1 1 17 17 LEU HG H 1 0.761 0.006 . 1 . 321 . . 17 LEU HG . 19464 1
66 . 1 1 17 17 LEU HD11 H 1 -0.181 0.007 . 2 . 328 . . 17 LEU HD11 . 19464 1
67 . 1 1 17 17 LEU HD12 H 1 -0.181 0.007 . 2 . 328 . . 17 LEU HD12 . 19464 1
68 . 1 1 17 17 LEU HD13 H 1 -0.181 0.007 . 2 . 328 . . 17 LEU HD13 . 19464 1
69 . 1 1 17 17 LEU HD21 H 1 -0.083 0.006 . 2 . 324 . . 17 LEU HD21 . 19464 1
70 . 1 1 17 17 LEU HD22 H 1 -0.083 0.006 . 2 . 324 . . 17 LEU HD22 . 19464 1
71 . 1 1 17 17 LEU HD23 H 1 -0.083 0.006 . 2 . 324 . . 17 LEU HD23 . 19464 1
72 . 1 1 17 17 LEU C C 13 177.854 0.0 . 1 . 227 . . 17 LEU C . 19464 1
73 . 1 1 17 17 LEU CA C 13 58.829 0.098 . 1 . 138 . . 17 LEU CA . 19464 1
74 . 1 1 17 17 LEU CG C 13 26.571 0.299 . 1 . 322 . . 17 LEU CG . 19464 1
75 . 1 1 17 17 LEU CD1 C 13 27.439 0.178 . 2 . 327 . . 17 LEU CD1 . 19464 1
76 . 1 1 17 17 LEU CD2 C 13 23.750 0.098 . 2 . 323 . . 17 LEU CD2 . 19464 1
77 . 1 1 17 17 LEU N N 15 119.983 0.042 . 1 . 88 . . 17 LEU N . 19464 1
78 . 1 1 18 18 GLU H H 1 9.081 0.003 . 1 . 7 . . 18 GLU H . 19464 1
79 . 1 1 18 18 GLU HA H 1 4.639 0.013 . 1 . 174 . . 18 GLU HA . 19464 1
80 . 1 1 18 18 GLU HB2 H 1 2.333 0.012 . 2 . 448 . . 18 GLU HB2 . 19464 1
81 . 1 1 18 18 GLU HB3 H 1 2.053 0.005 . 2 . 449 . . 18 GLU HB3 . 19464 1
82 . 1 1 18 18 GLU HG2 H 1 2.363 0.003 . 2 . 447 . . 18 GLU HG2 . 19464 1
83 . 1 1 18 18 GLU HG3 H 1 2.362 0.002 . 2 . 450 . . 18 GLU HG3 . 19464 1
84 . 1 1 18 18 GLU C C 13 179.990 0.0 . 1 . 228 . . 18 GLU C . 19464 1
85 . 1 1 18 18 GLU CA C 13 60.389 0.146 . 1 . 137 . . 18 GLU CA . 19464 1
86 . 1 1 18 18 GLU CB C 13 30.316 0.121 . 1 . 162 . . 18 GLU CB . 19464 1
87 . 1 1 18 18 GLU N N 15 121.740 0.056 . 1 . 8 . . 18 GLU N . 19464 1
88 . 1 1 19 19 GLU H H 1 8.608 0.006 . 1 . 59 . . 19 GLU H . 19464 1
89 . 1 1 19 19 GLU HA H 1 4.136 0.008 . 1 . 175 . . 19 GLU HA . 19464 1
90 . 1 1 19 19 GLU HB2 H 1 2.199 0.011 . 2 . 250 . . 19 GLU HB2 . 19464 1
91 . 1 1 19 19 GLU HB3 H 1 2.199 0.011 . 2 . 249 . . 19 GLU HB3 . 19464 1
92 . 1 1 19 19 GLU HG2 H 1 2.372 0.009 . 2 . 251 . . 19 GLU HG2 . 19464 1
93 . 1 1 19 19 GLU HG3 H 1 2.578 0.004 . 2 . 252 . . 19 GLU HG3 . 19464 1
94 . 1 1 19 19 GLU C C 13 175.904 0.0 . 1 . 229 . . 19 GLU C . 19464 1
95 . 1 1 19 19 GLU CA C 13 60.357 0.052 . 1 . 136 . . 19 GLU CA . 19464 1
96 . 1 1 19 19 GLU CB C 13 30.149 0.077 . 1 . 253 . . 19 GLU CB . 19464 1
97 . 1 1 19 19 GLU CG C 13 37.810 0.176 . 1 . 254 . . 19 GLU CG . 19464 1
98 . 1 1 19 19 GLU N N 15 121.800 0.047 . 1 . 60 . . 19 GLU N . 19464 1
99 . 1 1 20 20 ASP H H 1 7.501 0.004 . 1 . 76 . . 20 ASP H . 19464 1
100 . 1 1 20 20 ASP HA H 1 4.932 0.005 . 1 . 176 . . 20 ASP HA . 19464 1
101 . 1 1 20 20 ASP HB2 H 1 2.835 0.008 . 2 . 246 . . 20 ASP HB2 . 19464 1
102 . 1 1 20 20 ASP HB3 H 1 3.191 0.006 . 2 . 247 . . 20 ASP HB3 . 19464 1
103 . 1 1 20 20 ASP C C 13 174.032 0.0 . 1 . 230 . . 20 ASP C . 19464 1
104 . 1 1 20 20 ASP CA C 13 55.430 0.11 . 1 . 115 . . 20 ASP CA . 19464 1
105 . 1 1 20 20 ASP CB C 13 45.304 0.079 . 1 . 248 . . 20 ASP CB . 19464 1
106 . 1 1 20 20 ASP N N 15 116.977 0.043 . 1 . 77 . . 20 ASP N . 19464 1
107 . 1 1 21 21 GLY H H 1 7.915 0.005 . 1 . 91 . . 21 GLY H . 19464 1
108 . 1 1 21 21 GLY HA2 H 1 3.572 0.003 . 2 . 178 . . 21 GLY HA2 . 19464 1
109 . 1 1 21 21 GLY HA3 H 1 4.139 0.003 . 2 . 177 . . 21 GLY HA3 . 19464 1
110 . 1 1 21 21 GLY C C 13 173.158 0.0 . 1 . 231 . . 21 GLY C . 19464 1
111 . 1 1 21 21 GLY CA C 13 45.911 0.062 . 1 . 111 . . 21 GLY CA . 19464 1
112 . 1 1 21 21 GLY N N 15 105.020 0.036 . 1 . 92 . . 21 GLY N . 19464 1
113 . 1 1 22 22 TRP H H 1 8.235 0.005 . 1 . 3 . . 22 TRP H . 19464 1
114 . 1 1 22 22 TRP HA H 1 4.266 0.016 . 1 . 179 . . 22 TRP HA . 19464 1
115 . 1 1 22 22 TRP HB2 H 1 2.743 0.009 . 2 . 330 . . 22 TRP HB2 . 19464 1
116 . 1 1 22 22 TRP HB3 H 1 3.211 0.007 . 2 . 329 . . 22 TRP HB3 . 19464 1
117 . 1 1 22 22 TRP HD1 H 1 7.987 0.008 . 1 . 417 . . 22 TRP HD1 . 19464 1
118 . 1 1 22 22 TRP HE1 H 1 9.812 0.01 . 1 . 421 . . 22 TRP HE1 . 19464 1
119 . 1 1 22 22 TRP C C 13 174.735 0.0 . 1 . 232 . . 22 TRP C . 19464 1
120 . 1 1 22 22 TRP CA C 13 59.932 0.224 . 1 . 112 . . 22 TRP CA . 19464 1
121 . 1 1 22 22 TRP CB C 13 29.946 0.202 . 1 . 331 . . 22 TRP CB . 19464 1
122 . 1 1 22 22 TRP CD1 C 13 129.039 0.098 . 1 . 418 . . 22 TRP CD1 . 19464 1
123 . 1 1 22 22 TRP N N 15 121.298 0.055 . 1 . 4 . . 22 TRP N . 19464 1
124 . 1 1 22 22 TRP NE1 N 15 129.888 0.143 . 1 . 67 . . 22 TRP NE1 . 19464 1
125 . 1 1 23 23 ARG H H 1 9.535 0.005 . 1 . 45 . . 23 ARG H . 19464 1
126 . 1 1 23 23 ARG HA H 1 5.152 0.004 . 1 . 181 . . 23 ARG HA . 19464 1
127 . 1 1 23 23 ARG HB2 H 1 1.797 0.008 . 1 . 333 . . 23 ARG HB2 . 19464 1
128 . 1 1 23 23 ARG HB3 H 1 1.797 0.008 . 1 . 332 . . 23 ARG HB3 . 19464 1
129 . 1 1 23 23 ARG HG2 H 1 1.638 0.002 . 2 . 334 . . 23 ARG HG2 . 19464 1
130 . 1 1 23 23 ARG HG3 H 1 1.638 0.002 . 2 . 335 . . 23 ARG HG3 . 19464 1
131 . 1 1 23 23 ARG HD2 H 1 3.262 0.003 . 1 . 337 . . 23 ARG HD2 . 19464 1
132 . 1 1 23 23 ARG HD3 H 1 3.262 0.003 . 1 . 336 . . 23 ARG HD3 . 19464 1
133 . 1 1 23 23 ARG C C 13 174.215 0.0 . 1 . 233 . . 23 ARG C . 19464 1
134 . 1 1 23 23 ARG CA C 13 54.447 0.2 . 1 . 113 . . 23 ARG CA . 19464 1
135 . 1 1 23 23 ARG CB C 13 34.191 0.296 . 1 . 353 . . 23 ARG CB . 19464 1
136 . 1 1 23 23 ARG N N 15 120.511 0.058 . 1 . 46 . . 23 ARG N . 19464 1
137 . 1 1 24 24 LEU H H 1 8.989 0.006 . 1 . 17 . . 24 LEU H . 19464 1
138 . 1 1 24 24 LEU HA H 1 3.640 0.004 . 1 . 180 . . 24 LEU HA . 19464 1
139 . 1 1 24 24 LEU HB2 H 1 1.293 0.003 . 2 . 354 . . 24 LEU HB2 . 19464 1
140 . 1 1 24 24 LEU HB3 H 1 1.693 0.011 . 2 . 355 . . 24 LEU HB3 . 19464 1
141 . 1 1 24 24 LEU HG H 1 1.046 0.007 . 1 . 358 . . 24 LEU HG . 19464 1
142 . 1 1 24 24 LEU HD11 H 1 0.370 0.008 . 2 . 357 . . 24 LEU HD11 . 19464 1
143 . 1 1 24 24 LEU HD12 H 1 0.370 0.008 . 2 . 357 . . 24 LEU HD12 . 19464 1
144 . 1 1 24 24 LEU HD13 H 1 0.370 0.008 . 2 . 357 . . 24 LEU HD13 . 19464 1
145 . 1 1 24 24 LEU HD21 H 1 0.666 0.007 . 2 . 471 . . 24 LEU HD21 . 19464 1
146 . 1 1 24 24 LEU HD22 H 1 0.666 0.007 . 2 . 471 . . 24 LEU HD22 . 19464 1
147 . 1 1 24 24 LEU HD23 H 1 0.666 0.007 . 2 . 471 . . 24 LEU HD23 . 19464 1
148 . 1 1 24 24 LEU C C 13 176.027 0.0 . 1 . 234 . . 24 LEU C . 19464 1
149 . 1 1 24 24 LEU CA C 13 56.691 0.188 . 1 . 114 . . 24 LEU CA . 19464 1
150 . 1 1 24 24 LEU CD1 C 13 25.024 0.103 . 2 . 356 . . 24 LEU CD1 . 19464 1
151 . 1 1 24 24 LEU CD2 C 13 26.578 0.045 . 2 . 472 . . 24 LEU CD2 . 19464 1
152 . 1 1 24 24 LEU N N 15 126.102 0.039 . 1 . 18 . . 24 LEU N . 19464 1
153 . 1 1 25 25 VAL H H 1 9.300 0.009 . 1 . 51 . . 25 VAL H . 19464 1
154 . 1 1 25 25 VAL HA H 1 4.577 0.007 . 1 . 182 . . 25 VAL HA . 19464 1
155 . 1 1 25 25 VAL HB H 1 2.189 0.004 . 1 . 363 . . 25 VAL HB . 19464 1
156 . 1 1 25 25 VAL HG11 H 1 0.817 0.007 . 2 . 361 . . 25 VAL HG11 . 19464 1
157 . 1 1 25 25 VAL HG12 H 1 0.817 0.007 . 2 . 361 . . 25 VAL HG12 . 19464 1
158 . 1 1 25 25 VAL HG13 H 1 0.817 0.007 . 2 . 361 . . 25 VAL HG13 . 19464 1
159 . 1 1 25 25 VAL HG21 H 1 0.965 0.006 . 2 . 359 . . 25 VAL HG21 . 19464 1
160 . 1 1 25 25 VAL HG22 H 1 0.965 0.006 . 2 . 359 . . 25 VAL HG22 . 19464 1
161 . 1 1 25 25 VAL HG23 H 1 0.965 0.006 . 2 . 359 . . 25 VAL HG23 . 19464 1
162 . 1 1 25 25 VAL C C 13 174.369 0.0 . 1 . 235 . . 25 VAL C . 19464 1
163 . 1 1 25 25 VAL CA C 13 62.301 0.145 . 1 . 140 . . 25 VAL CA . 19464 1
164 . 1 1 25 25 VAL CG1 C 13 20.229 0.136 . 2 . 362 . . 25 VAL CG1 . 19464 1
165 . 1 1 25 25 VAL CG2 C 13 22.715 0.111 . 2 . 360 . . 25 VAL CG2 . 19464 1
166 . 1 1 25 25 VAL N N 15 121.188 0.055 . 1 . 52 . . 25 VAL N . 19464 1
167 . 1 1 26 26 ARG H H 1 7.375 0.005 . 1 . 85 . . 26 ARG H . 19464 1
168 . 1 1 26 26 ARG HA H 1 4.461 0.008 . 1 . 183 . . 26 ARG HA . 19464 1
169 . 1 1 26 26 ARG HB2 H 1 1.546 0.007 . 2 . 365 . . 26 ARG HB2 . 19464 1
170 . 1 1 26 26 ARG HB3 H 1 1.838 0.005 . 2 . 364 . . 26 ARG HB3 . 19464 1
171 . 1 1 26 26 ARG HG2 H 1 1.536 0.011 . 2 . 371 . . 26 ARG HG2 . 19464 1
172 . 1 1 26 26 ARG HG3 H 1 1.295 0.008 . 2 . 366 . . 26 ARG HG3 . 19464 1
173 . 1 1 26 26 ARG HD2 H 1 2.938 0.008 . 2 . 367 . . 26 ARG HD2 . 19464 1
174 . 1 1 26 26 ARG HD3 H 1 2.936 0.007 . 2 . 368 . . 26 ARG HD3 . 19464 1
175 . 1 1 26 26 ARG C C 13 171.610 0.0 . 1 . 236 . . 26 ARG C . 19464 1
176 . 1 1 26 26 ARG CA C 13 57.479 0.296 . 1 . 141 . . 26 ARG CA . 19464 1
177 . 1 1 26 26 ARG CB C 13 34.207 0.222 . 1 . 369 . . 26 ARG CB . 19464 1
178 . 1 1 26 26 ARG CG C 13 27.951 0.063 . 1 . 370 . . 26 ARG CG . 19464 1
179 . 1 1 26 26 ARG N N 15 119.402 0.031 . 1 . 86 . . 26 ARG N . 19464 1
180 . 1 1 27 27 VAL H H 1 8.511 0.006 . 1 . 1 . . 27 VAL H . 19464 1
181 . 1 1 27 27 VAL HA H 1 4.581 0.011 . 1 . 184 . . 27 VAL HA . 19464 1
182 . 1 1 27 27 VAL HB H 1 1.757 0.004 . 1 . 348 . . 27 VAL HB . 19464 1
183 . 1 1 27 27 VAL HG11 H 1 0.438 0.008 . 2 . 350 . . 27 VAL HG11 . 19464 1
184 . 1 1 27 27 VAL HG12 H 1 0.438 0.008 . 2 . 350 . . 27 VAL HG12 . 19464 1
185 . 1 1 27 27 VAL HG13 H 1 0.438 0.008 . 2 . 350 . . 27 VAL HG13 . 19464 1
186 . 1 1 27 27 VAL HG21 H 1 0.658 0.009 . 2 . 349 . . 27 VAL HG21 . 19464 1
187 . 1 1 27 27 VAL HG22 H 1 0.658 0.009 . 2 . 349 . . 27 VAL HG22 . 19464 1
188 . 1 1 27 27 VAL HG23 H 1 0.658 0.009 . 2 . 349 . . 27 VAL HG23 . 19464 1
189 . 1 1 27 27 VAL C C 13 174.731 0.0 . 1 . 237 . . 27 VAL C . 19464 1
190 . 1 1 27 27 VAL CA C 13 62.427 0.063 . 1 . 142 . . 27 VAL CA . 19464 1
191 . 1 1 27 27 VAL CG1 C 13 22.037 0.26 . 2 . 351 . . 27 VAL CG1 . 19464 1
192 . 1 1 27 27 VAL CG2 C 13 22.355 0.191 . 2 . 352 . . 27 VAL CG2 . 19464 1
193 . 1 1 27 27 VAL N N 15 124.487 0.114 . 1 . 2 . . 27 VAL N . 19464 1
194 . 1 1 28 28 THR H H 1 8.982 0.004 . 1 . 63 . . 28 THR H . 19464 1
195 . 1 1 28 28 THR HA H 1 4.773 0.002 . 1 . 185 . . 28 THR HA . 19464 1
196 . 1 1 28 28 THR HB H 1 4.531 0.002 . 1 . 338 . . 28 THR HB . 19464 1
197 . 1 1 28 28 THR HG21 H 1 1.159 0.009 . 1 . 339 . . 28 THR HG21 . 19464 1
198 . 1 1 28 28 THR HG22 H 1 1.159 0.009 . 1 . 339 . . 28 THR HG22 . 19464 1
199 . 1 1 28 28 THR HG23 H 1 1.159 0.009 . 1 . 339 . . 28 THR HG23 . 19464 1
200 . 1 1 28 28 THR CA C 13 60.274 0.018 . 1 . 165 . . 28 THR CA . 19464 1
201 . 1 1 28 28 THR CB C 13 71.546 0.117 . 1 . 340 . . 28 THR CB . 19464 1
202 . 1 1 28 28 THR CG2 C 13 22.532 0.044 . 1 . 341 . . 28 THR CG2 . 19464 1
203 . 1 1 28 28 THR N N 15 119.100 0.087 . 1 . 64 . . 28 THR N . 19464 1
204 . 1 1 30 30 SER C C 13 173.514 0.0 . 1 . 238 . . 30 SER C . 19464 1
205 . 1 1 30 30 SER CA C 13 58.900 0.0 . 1 . 442 . . 30 SER CA . 19464 1
206 . 1 1 31 31 ALA H H 1 8.026 0.005 . 1 . 105 . . 31 ALA H . 19464 1
207 . 1 1 31 31 ALA HA H 1 4.781 0.003 . 1 . 186 . . 31 ALA HA . 19464 1
208 . 1 1 31 31 ALA HB1 H 1 1.130 0.003 . 1 . 342 . . 31 ALA HB1 . 19464 1
209 . 1 1 31 31 ALA HB2 H 1 1.130 0.003 . 1 . 342 . . 31 ALA HB2 . 19464 1
210 . 1 1 31 31 ALA HB3 H 1 1.130 0.003 . 1 . 342 . . 31 ALA HB3 . 19464 1
211 . 1 1 31 31 ALA C C 13 173.338 0.0 . 1 . 239 . . 31 ALA C . 19464 1
212 . 1 1 31 31 ALA CA C 13 53.729 0.001 . 1 . 164 . . 31 ALA CA . 19464 1
213 . 1 1 31 31 ALA CB C 13 22.569 0.109 . 1 . 343 . . 31 ALA CB . 19464 1
214 . 1 1 31 31 ALA N N 15 125.435 0.036 . 1 . 106 . . 31 ALA N . 19464 1
215 . 1 1 32 32 HIS H H 1 8.675 0.002 . 1 . 49 . . 32 HIS H . 19464 1
216 . 1 1 32 32 HIS HA H 1 4.818 0.004 . 1 . 187 . . 32 HIS HA . 19464 1
217 . 1 1 32 32 HIS HB2 H 1 2.813 0.013 . 2 . 345 . . 32 HIS HB2 . 19464 1
218 . 1 1 32 32 HIS HB3 H 1 3.110 0.014 . 2 . 344 . . 32 HIS HB3 . 19464 1
219 . 1 1 32 32 HIS C C 13 172.449 0.0 . 1 . 240 . . 32 HIS C . 19464 1
220 . 1 1 32 32 HIS CA C 13 56.513 0.043 . 1 . 163 . . 32 HIS CA . 19464 1
221 . 1 1 32 32 HIS N N 15 122.315 0.086 . 1 . 50 . . 32 HIS N . 19464 1
222 . 1 1 33 33 HIS H H 1 8.473 0.005 . 1 . 11 . . 33 HIS H . 19464 1
223 . 1 1 33 33 HIS HA H 1 5.602 0.004 . 1 . 188 . . 33 HIS HA . 19464 1
224 . 1 1 33 33 HIS HB2 H 1 2.861 0.008 . 2 . 347 . . 33 HIS HB2 . 19464 1
225 . 1 1 33 33 HIS HB3 H 1 2.979 0.007 . 2 . 346 . . 33 HIS HB3 . 19464 1
226 . 1 1 33 33 HIS C C 13 173.740 0.0 . 1 . 241 . . 33 HIS C . 19464 1
227 . 1 1 33 33 HIS CA C 13 55.852 0.004 . 1 . 161 . . 33 HIS CA . 19464 1
228 . 1 1 33 33 HIS N N 15 121.219 0.033 . 1 . 12 . . 33 HIS N . 19464 1
229 . 1 1 34 34 PHE H H 1 10.027 0.005 . 1 . 15 . . 34 PHE H . 19464 1
230 . 1 1 34 34 PHE HA H 1 5.637 0.007 . 1 . 189 . . 34 PHE HA . 19464 1
231 . 1 1 34 34 PHE HB2 H 1 3.427 0.004 . 2 . 373 . . 34 PHE HB2 . 19464 1
232 . 1 1 34 34 PHE HB3 H 1 3.047 0.005 . 2 . 372 . . 34 PHE HB3 . 19464 1
233 . 1 1 34 34 PHE HD1 H 1 7.049 0.012 . 3 . 414 . . 34 PHE HD1 . 19464 1
234 . 1 1 34 34 PHE HD2 H 1 7.049 0.012 . 3 . 414 . . 34 PHE HD2 . 19464 1
235 . 1 1 34 34 PHE HE1 H 1 7.254 0.017 . 3 . 415 . . 34 PHE HE1 . 19464 1
236 . 1 1 34 34 PHE HE2 H 1 7.254 0.017 . 3 . 415 . . 34 PHE HE2 . 19464 1
237 . 1 1 34 34 PHE C C 13 173.458 0.0 . 1 . 242 . . 34 PHE C . 19464 1
238 . 1 1 34 34 PHE CA C 13 58.394 0.143 . 1 . 150 . . 34 PHE CA . 19464 1
239 . 1 1 34 34 PHE CB C 13 45.335 0.079 . 1 . 374 . . 34 PHE CB . 19464 1
240 . 1 1 34 34 PHE CD1 C 13 132.511 0.096 . 3 . 413 . . 34 PHE CD1 . 19464 1
241 . 1 1 34 34 PHE CD2 C 13 132.511 0.096 . 3 . 413 . . 34 PHE CD2 . 19464 1
242 . 1 1 34 34 PHE CE1 C 13 128.160 0.0 . 3 . 416 . . 34 PHE CE1 . 19464 1
243 . 1 1 34 34 PHE CE2 C 13 128.160 0.0 . 3 . 416 . . 34 PHE CE2 . 19464 1
244 . 1 1 34 34 PHE N N 15 121.775 0.046 . 1 . 16 . . 34 PHE N . 19464 1
245 . 1 1 35 35 LYS H H 1 9.182 0.004 . 1 . 57 . . 35 LYS H . 19464 1
246 . 1 1 35 35 LYS HA H 1 5.373 0.004 . 1 . 190 . . 35 LYS HA . 19464 1
247 . 1 1 35 35 LYS HB2 H 1 1.971 0.006 . 2 . 256 . . 35 LYS HB2 . 19464 1
248 . 1 1 35 35 LYS HB3 H 1 1.711 0.008 . 2 . 258 . . 35 LYS HB3 . 19464 1
249 . 1 1 35 35 LYS HG2 H 1 1.591 0.003 . 2 . 375 . . 35 LYS HG2 . 19464 1
250 . 1 1 35 35 LYS HG3 H 1 1.591 0.003 . 2 . 376 . . 35 LYS HG3 . 19464 1
251 . 1 1 35 35 LYS C C 13 173.067 0.0 . 1 . 243 . . 35 LYS C . 19464 1
252 . 1 1 35 35 LYS CA C 13 56.341 0.017 . 1 . 151 . . 35 LYS CA . 19464 1
253 . 1 1 35 35 LYS CB C 13 38.648 0.227 . 1 . 257 . . 35 LYS CB . 19464 1
254 . 1 1 35 35 LYS N N 15 119.435 0.031 . 1 . 58 . . 35 LYS N . 19464 1
255 . 1 1 36 36 HIS H H 1 9.635 0.007 . 1 . 97 . . 36 HIS H . 19464 1
256 . 1 1 36 36 HIS HA H 1 4.538 0.006 . 1 . 191 . . 36 HIS HA . 19464 1
257 . 1 1 36 36 HIS HB2 H 1 -0.038 0.007 . 2 . 549 . . 36 HIS HB2 . 19464 1
258 . 1 1 36 36 HIS HB3 H 1 2.443 0.005 . 2 . 451 . . 36 HIS HB3 . 19464 1
259 . 1 1 36 36 HIS HD2 H 1 7.537 0.007 . 1 . 553 . . 36 HIS HD2 . 19464 1
260 . 1 1 36 36 HIS HE1 H 1 7.717 0.003 . 1 . 497 . . 36 HIS HE1 . 19464 1
261 . 1 1 36 36 HIS CA C 13 55.586 0.027 . 1 . 152 . . 36 HIS CA . 19464 1
262 . 1 1 36 36 HIS CD2 C 13 121.886 0.0 . 1 . 552 . . 36 HIS CD2 . 19464 1
263 . 1 1 36 36 HIS CE1 C 13 138.956 0.073 . 1 . 496 . . 36 HIS CE1 . 19464 1
264 . 1 1 36 36 HIS N N 15 128.959 0.056 . 1 . 98 . . 36 HIS N . 19464 1
265 . 1 1 37 37 PRO HA H 1 4.287 0.009 . 1 . 453 . . 37 PRO HA . 19464 1
266 . 1 1 37 37 PRO HB2 H 1 1.803 0.009 . 2 . 454 . . 37 PRO HB2 . 19464 1
267 . 1 1 37 37 PRO HB3 H 1 2.210 0.008 . 2 . 456 . . 37 PRO HB3 . 19464 1
268 . 1 1 37 37 PRO HG2 H 1 1.605 0.017 . 2 . 458 . . 37 PRO HG2 . 19464 1
269 . 1 1 37 37 PRO HG3 H 1 1.794 0.006 . 2 . 457 . . 37 PRO HG3 . 19464 1
270 . 1 1 37 37 PRO HD2 H 1 3.137 0.009 . 1 . 460 . . 37 PRO HD2 . 19464 1
271 . 1 1 37 37 PRO HD3 H 1 3.137 0.009 . 1 . 461 . . 37 PRO HD3 . 19464 1
272 . 1 1 37 37 PRO C C 13 175.455 0.0 . 1 . 498 . . 37 PRO C . 19464 1
273 . 1 1 37 37 PRO CA C 13 65.027 0.14 . 1 . 455 . . 37 PRO CA . 19464 1
274 . 1 1 37 37 PRO CB C 13 33.405 0.356 . 1 . 459 . . 37 PRO CB . 19464 1
275 . 1 1 37 37 PRO CG C 13 27.949 0.142 . 1 . 462 . . 37 PRO CG . 19464 1
276 . 1 1 38 38 LYS H H 1 10.404 0.004 . 1 . 21 . . 38 LYS H . 19464 1
277 . 1 1 38 38 LYS HA H 1 4.582 0.011 . 1 . 211 . . 38 LYS HA . 19464 1
278 . 1 1 38 38 LYS HB2 H 1 1.950 0.007 . 2 . 271 . . 38 LYS HB2 . 19464 1
279 . 1 1 38 38 LYS HB3 H 1 1.748 0.008 . 2 . 272 . . 38 LYS HB3 . 19464 1
280 . 1 1 38 38 LYS HG2 H 1 1.436 0.016 . 2 . 470 . . 38 LYS HG2 . 19464 1
281 . 1 1 38 38 LYS HG3 H 1 1.405 0.0 . 2 . 530 . . 38 LYS HG3 . 19464 1
282 . 1 1 38 38 LYS HD2 H 1 1.614 0.001 . 1 . 517 . . 38 LYS HD2 . 19464 1
283 . 1 1 38 38 LYS HD3 H 1 1.614 0.001 . 1 . 518 . . 38 LYS HD3 . 19464 1
284 . 1 1 38 38 LYS C C 13 175.008 0.0 . 1 . 556 . . 38 LYS C . 19464 1
285 . 1 1 38 38 LYS CA C 13 57.384 0.091 . 1 . 167 . . 38 LYS CA . 19464 1
286 . 1 1 38 38 LYS CB C 13 37.596 0.191 . 1 . 273 . . 38 LYS CB . 19464 1
287 . 1 1 38 38 LYS N N 15 120.013 0.051 . 1 . 22 . . 38 LYS N . 19464 1
288 . 1 1 39 39 LYS H H 1 8.694 0.003 . 1 . 103 . . 39 LYS H . 19464 1
289 . 1 1 39 39 LYS HA H 1 4.394 0.007 . 1 . 212 . . 39 LYS HA . 19464 1
290 . 1 1 39 39 LYS HB2 H 1 0.848 0.008 . 2 . 274 . . 39 LYS HB2 . 19464 1
291 . 1 1 39 39 LYS HB3 H 1 1.836 0.007 . 2 . 291 . . 39 LYS HB3 . 19464 1
292 . 1 1 39 39 LYS HG2 H 1 1.197 0.009 . 2 . 275 . . 39 LYS HG2 . 19464 1
293 . 1 1 39 39 LYS HG3 H 1 0.612 0.006 . 2 . 528 . . 39 LYS HG3 . 19464 1
294 . 1 1 39 39 LYS CA C 13 55.962 0.056 . 1 . 166 . . 39 LYS CA . 19464 1
295 . 1 1 39 39 LYS CB C 13 33.961 0.216 . 1 . 268 . . 39 LYS CB . 19464 1
296 . 1 1 39 39 LYS CG C 13 27.364 0.094 . 1 . 529 . . 39 LYS CG . 19464 1
297 . 1 1 39 39 LYS N N 15 123.785 0.098 . 1 . 104 . . 39 LYS N . 19464 1
298 . 1 1 40 40 PRO HA H 1 4.674 0.0 . 1 . 492 . . 40 PRO HA . 19464 1
299 . 1 1 40 40 PRO HB2 H 1 2.096 0.0 . 2 . 550 . . 40 PRO HB2 . 19464 1
300 . 1 1 40 40 PRO HB3 H 1 2.297 0.001 . 2 . 551 . . 40 PRO HB3 . 19464 1
301 . 1 1 40 40 PRO C C 13 175.809 0.0 . 1 . 424 . . 40 PRO C . 19464 1
302 . 1 1 40 40 PRO CA C 13 63.641 0.003 . 1 . 441 . . 40 PRO CA . 19464 1
303 . 1 1 41 41 GLY H H 1 8.384 0.003 . 1 . 80 . . 41 GLY H . 19464 1
304 . 1 1 41 41 GLY HA2 H 1 3.837 0.013 . 2 . 205 . . 41 GLY HA2 . 19464 1
305 . 1 1 41 41 GLY HA3 H 1 4.534 0.006 . 2 . 204 . . 41 GLY HA3 . 19464 1
306 . 1 1 41 41 GLY C C 13 171.778 0.0 . 1 . 425 . . 41 GLY C . 19464 1
307 . 1 1 41 41 GLY CA C 13 45.503 0.102 . 1 . 110 . . 41 GLY CA . 19464 1
308 . 1 1 41 41 GLY N N 15 105.684 0.041 . 1 . 81 . . 41 GLY N . 19464 1
309 . 1 1 42 42 LEU H H 1 8.118 0.004 . 1 . 29 . . 42 LEU H . 19464 1
310 . 1 1 42 42 LEU HA H 1 5.366 0.003 . 1 . 207 . . 42 LEU HA . 19464 1
311 . 1 1 42 42 LEU HB2 H 1 1.745 0.003 . 2 . 281 . . 42 LEU HB2 . 19464 1
312 . 1 1 42 42 LEU HB3 H 1 1.557 0.013 . 2 . 255 . . 42 LEU HB3 . 19464 1
313 . 1 1 42 42 LEU HG H 1 0.932 0.009 . 1 . 377 . . 42 LEU HG . 19464 1
314 . 1 1 42 42 LEU HD21 H 1 0.871 0.033 . 1 . 489 . . 42 LEU HD21 . 19464 1
315 . 1 1 42 42 LEU HD22 H 1 0.871 0.033 . 1 . 489 . . 42 LEU HD22 . 19464 1
316 . 1 1 42 42 LEU HD23 H 1 0.871 0.033 . 1 . 489 . . 42 LEU HD23 . 19464 1
317 . 1 1 42 42 LEU C C 13 175.478 0.0 . 1 . 426 . . 42 LEU C . 19464 1
318 . 1 1 42 42 LEU CA C 13 55.009 0.285 . 1 . 153 . . 42 LEU CA . 19464 1
319 . 1 1 42 42 LEU CB C 13 45.634 0.232 . 1 . 452 . . 42 LEU CB . 19464 1
320 . 1 1 42 42 LEU CG C 13 25.874 0.276 . 1 . 378 . . 42 LEU CG . 19464 1
321 . 1 1 42 42 LEU CD2 C 13 26.399 0.0 . 1 . 488 . . 42 LEU CD2 . 19464 1
322 . 1 1 42 42 LEU N N 15 120.568 0.05 . 1 . 30 . . 42 LEU N . 19464 1
323 . 1 1 43 43 VAL H H 1 8.890 0.006 . 1 . 55 . . 43 VAL H . 19464 1
324 . 1 1 43 43 VAL HA H 1 4.239 0.013 . 1 . 208 . . 43 VAL HA . 19464 1
325 . 1 1 43 43 VAL HB H 1 1.303 0.008 . 1 . 379 . . 43 VAL HB . 19464 1
326 . 1 1 43 43 VAL HG11 H 1 -0.130 0.01 . 2 . 381 . . 43 VAL HG11 . 19464 1
327 . 1 1 43 43 VAL HG12 H 1 -0.130 0.01 . 2 . 381 . . 43 VAL HG12 . 19464 1
328 . 1 1 43 43 VAL HG13 H 1 -0.130 0.01 . 2 . 381 . . 43 VAL HG13 . 19464 1
329 . 1 1 43 43 VAL HG21 H 1 0.432 0.006 . 2 . 380 . . 43 VAL HG21 . 19464 1
330 . 1 1 43 43 VAL HG22 H 1 0.432 0.006 . 2 . 380 . . 43 VAL HG22 . 19464 1
331 . 1 1 43 43 VAL HG23 H 1 0.432 0.006 . 2 . 380 . . 43 VAL HG23 . 19464 1
332 . 1 1 43 43 VAL C C 13 173.645 0.0 . 1 . 427 . . 43 VAL C . 19464 1
333 . 1 1 43 43 VAL CA C 13 62.441 0.125 . 1 . 154 . . 43 VAL CA . 19464 1
334 . 1 1 43 43 VAL CG1 C 13 22.531 0.057 . 2 . 382 . . 43 VAL CG1 . 19464 1
335 . 1 1 43 43 VAL CG2 C 13 23.135 0.129 . 2 . 383 . . 43 VAL CG2 . 19464 1
336 . 1 1 43 43 VAL N N 15 127.489 0.092 . 1 . 56 . . 43 VAL N . 19464 1
337 . 1 1 44 44 THR H H 1 8.576 0.005 . 1 . 89 . . 44 THR H . 19464 1
338 . 1 1 44 44 THR HA H 1 5.085 0.008 . 1 . 209 . . 44 THR HA . 19464 1
339 . 1 1 44 44 THR HB H 1 3.743 0.003 . 1 . 384 . . 44 THR HB . 19464 1
340 . 1 1 44 44 THR HG21 H 1 0.830 0.009 . 1 . 385 . . 44 THR HG21 . 19464 1
341 . 1 1 44 44 THR HG22 H 1 0.830 0.009 . 1 . 385 . . 44 THR HG22 . 19464 1
342 . 1 1 44 44 THR HG23 H 1 0.830 0.009 . 1 . 385 . . 44 THR HG23 . 19464 1
343 . 1 1 44 44 THR C C 13 172.481 0.0 . 1 . 428 . . 44 THR C . 19464 1
344 . 1 1 44 44 THR CA C 13 62.740 0.081 . 1 . 143 . . 44 THR CA . 19464 1
345 . 1 1 44 44 THR CB C 13 71.777 0.087 . 1 . 386 . . 44 THR CB . 19464 1
346 . 1 1 44 44 THR CG2 C 13 23.177 0.0 . 1 . 387 . . 44 THR CG2 . 19464 1
347 . 1 1 44 44 THR N N 15 124.773 0.052 . 1 . 90 . . 44 THR N . 19464 1
348 . 1 1 45 45 VAL H H 1 9.304 0.005 . 1 . 61 . . 45 VAL H . 19464 1
349 . 1 1 45 45 VAL HA H 1 4.565 0.013 . 1 . 210 . . 45 VAL HA . 19464 1
350 . 1 1 45 45 VAL HB H 1 2.044 0.008 . 1 . 388 . . 45 VAL HB . 19464 1
351 . 1 1 45 45 VAL HG11 H 1 0.649 0.004 . 2 . 390 . . 45 VAL HG11 . 19464 1
352 . 1 1 45 45 VAL HG12 H 1 0.649 0.004 . 2 . 390 . . 45 VAL HG12 . 19464 1
353 . 1 1 45 45 VAL HG13 H 1 0.649 0.004 . 2 . 390 . . 45 VAL HG13 . 19464 1
354 . 1 1 45 45 VAL HG21 H 1 0.947 0.008 . 2 . 389 . . 45 VAL HG21 . 19464 1
355 . 1 1 45 45 VAL HG22 H 1 0.947 0.008 . 2 . 389 . . 45 VAL HG22 . 19464 1
356 . 1 1 45 45 VAL HG23 H 1 0.947 0.008 . 2 . 389 . . 45 VAL HG23 . 19464 1
357 . 1 1 45 45 VAL CA C 13 59.255 0.029 . 1 . 440 . . 45 VAL CA . 19464 1
358 . 1 1 45 45 VAL CG1 C 13 22.866 0.125 . 2 . 391 . . 45 VAL CG1 . 19464 1
359 . 1 1 45 45 VAL CG2 C 13 21.605 0.052 . 2 . 392 . . 45 VAL CG2 . 19464 1
360 . 1 1 45 45 VAL N N 15 126.014 0.035 . 1 . 62 . . 45 VAL N . 19464 1
361 . 1 1 46 46 PRO HA H 1 3.877 0.005 . 1 . 464 . . 46 PRO HA . 19464 1
362 . 1 1 46 46 PRO HB2 H 1 1.735 0.016 . 2 . 465 . . 46 PRO HB2 . 19464 1
363 . 1 1 46 46 PRO HB3 H 1 1.349 0.013 . 2 . 466 . . 46 PRO HB3 . 19464 1
364 . 1 1 46 46 PRO HG2 H 1 1.364 0.0 . 1 . 467 . . 46 PRO HG2 . 19464 1
365 . 1 1 46 46 PRO HG3 H 1 1.364 0.0 . 1 . 468 . . 46 PRO HG3 . 19464 1
366 . 1 1 46 46 PRO HD2 H 1 4.326 0.0 . 1 . 520 . . 46 PRO HD2 . 19464 1
367 . 1 1 46 46 PRO HD3 H 1 4.326 0.0 . 1 . 519 . . 46 PRO HD3 . 19464 1
368 . 1 1 46 46 PRO C C 13 173.839 0.0 . 1 . 557 . . 46 PRO C . 19464 1
369 . 1 1 46 46 PRO CA C 13 63.258 0.199 . 1 . 463 . . 46 PRO CA . 19464 1
370 . 1 1 46 46 PRO CB C 13 34.025 0.056 . 1 . 469 . . 46 PRO CB . 19464 1
371 . 1 1 47 47 HIS H H 1 8.118 0.005 . 1 . 123 . . 47 HIS H . 19464 1
372 . 1 1 47 47 HIS HA H 1 4.992 0.007 . 1 . 206 . . 47 HIS HA . 19464 1
373 . 1 1 47 47 HIS HB2 H 1 2.783 0.007 . 2 . 420 . . 47 HIS HB2 . 19464 1
374 . 1 1 47 47 HIS HB3 H 1 2.067 0.003 . 2 . 419 . . 47 HIS HB3 . 19464 1
375 . 1 1 47 47 HIS N N 15 120.618 0.046 . 1 . 124 . . 47 HIS N . 19464 1
376 . 1 1 48 48 PRO HA H 1 4.290 0.007 . 1 . 532 . . 48 PRO HA . 19464 1
377 . 1 1 48 48 PRO HB2 H 1 1.990 0.005 . 2 . 536 . . 48 PRO HB2 . 19464 1
378 . 1 1 48 48 PRO HB3 H 1 2.090 0.003 . 2 . 535 . . 48 PRO HB3 . 19464 1
379 . 1 1 48 48 PRO HG2 H 1 2.272 0.006 . 1 . 539 . . 48 PRO HG2 . 19464 1
380 . 1 1 48 48 PRO HG3 H 1 2.272 0.006 . 1 . 538 . . 48 PRO HG3 . 19464 1
381 . 1 1 48 48 PRO C C 13 174.795 0.0 . 1 . 533 . . 48 PRO C . 19464 1
382 . 1 1 48 48 PRO CB C 13 30.798 0.322 . 1 . 537 . . 48 PRO CB . 19464 1
383 . 1 1 49 49 LYS H H 1 8.043 0.005 . 1 . 70 . . 49 LYS H . 19464 1
384 . 1 1 49 49 LYS HA H 1 4.383 0.007 . 1 . 216 . . 49 LYS HA . 19464 1
385 . 1 1 49 49 LYS C C 13 174.665 0.0 . 1 . 534 . . 49 LYS C . 19464 1
386 . 1 1 49 49 LYS CA C 13 55.953 0.142 . 1 . 261 . . 49 LYS CA . 19464 1
387 . 1 1 49 49 LYS N N 15 120.747 0.09 . 1 . 71 . . 49 LYS N . 19464 1
388 . 1 1 50 50 LYS H H 1 8.319 0.002 . 1 . 72 . . 50 LYS H . 19464 1
389 . 1 1 50 50 LYS HA H 1 4.503 0.007 . 1 . 217 . . 50 LYS HA . 19464 1
390 . 1 1 50 50 LYS HB2 H 1 2.029 0.008 . 2 . 548 . . 50 LYS HB2 . 19464 1
391 . 1 1 50 50 LYS HB3 H 1 2.030 0.008 . 2 . 263 . . 50 LYS HB3 . 19464 1
392 . 1 1 50 50 LYS C C 13 173.879 0.0 . 1 . 554 . . 50 LYS C . 19464 1
393 . 1 1 50 50 LYS CA C 13 56.394 0.033 . 1 . 262 . . 50 LYS CA . 19464 1
394 . 1 1 50 50 LYS CB C 13 35.126 0.105 . 1 . 264 . . 50 LYS CB . 19464 1
395 . 1 1 50 50 LYS N N 15 119.348 0.071 . 1 . 73 . . 50 LYS N . 19464 1
396 . 1 1 51 51 ASP H H 1 8.263 0.005 . 1 . 19 . . 51 ASP H . 19464 1
397 . 1 1 51 51 ASP HA H 1 4.558 0.015 . 1 . 213 . . 51 ASP HA . 19464 1
398 . 1 1 51 51 ASP HB2 H 1 2.637 0.007 . 2 . 269 . . 51 ASP HB2 . 19464 1
399 . 1 1 51 51 ASP HB3 H 1 2.472 0.01 . 2 . 270 . . 51 ASP HB3 . 19464 1
400 . 1 1 51 51 ASP C C 13 174.042 0.0 . 1 . 555 . . 51 ASP C . 19464 1
401 . 1 1 51 51 ASP CA C 13 53.627 0.038 . 1 . 259 . . 51 ASP CA . 19464 1
402 . 1 1 51 51 ASP CB C 13 41.380 0.277 . 1 . 290 . . 51 ASP CB . 19464 1
403 . 1 1 51 51 ASP N N 15 117.643 0.082 . 1 . 20 . . 51 ASP N . 19464 1
404 . 1 1 52 52 LEU H H 1 8.517 0.003 . 1 . 65 . . 52 LEU H . 19464 1
405 . 1 1 52 52 LEU HA H 1 4.493 0.013 . 1 . 215 . . 52 LEU HA . 19464 1
406 . 1 1 52 52 LEU HB2 H 1 1.684 0.017 . 2 . 476 . . 52 LEU HB2 . 19464 1
407 . 1 1 52 52 LEU HB3 H 1 1.730 0.02 . 2 . 475 . . 52 LEU HB3 . 19464 1
408 . 1 1 52 52 LEU HG H 1 1.066 0.0 . 1 . 477 . . 52 LEU HG . 19464 1
409 . 1 1 52 52 LEU HD11 H 1 0.733 0.003 . 2 . 479 . . 52 LEU HD11 . 19464 1
410 . 1 1 52 52 LEU HD12 H 1 0.733 0.003 . 2 . 479 . . 52 LEU HD12 . 19464 1
411 . 1 1 52 52 LEU HD13 H 1 0.733 0.003 . 2 . 479 . . 52 LEU HD13 . 19464 1
412 . 1 1 52 52 LEU HD21 H 1 0.921 0.008 . 2 . 473 . . 52 LEU HD21 . 19464 1
413 . 1 1 52 52 LEU HD22 H 1 0.921 0.008 . 2 . 473 . . 52 LEU HD22 . 19464 1
414 . 1 1 52 52 LEU HD23 H 1 0.921 0.008 . 2 . 473 . . 52 LEU HD23 . 19464 1
415 . 1 1 52 52 LEU CA C 13 54.126 0.13 . 1 . 260 . . 52 LEU CA . 19464 1
416 . 1 1 52 52 LEU CD1 C 13 27.568 0.102 . 2 . 478 . . 52 LEU CD1 . 19464 1
417 . 1 1 52 52 LEU CD2 C 13 25.281 0.052 . 2 . 474 . . 52 LEU CD2 . 19464 1
418 . 1 1 52 52 LEU N N 15 122.319 0.065 . 1 . 66 . . 52 LEU N . 19464 1
419 . 1 1 53 53 PRO HA H 1 4.612 0.014 . 1 . 516 . . 53 PRO HA . 19464 1
420 . 1 1 53 53 PRO HB2 H 1 2.459 0.004 . 2 . 540 . . 53 PRO HB2 . 19464 1
421 . 1 1 53 53 PRO HB3 H 1 2.079 0.006 . 2 . 542 . . 53 PRO HB3 . 19464 1
422 . 1 1 53 53 PRO HG2 H 1 2.150 0.003 . 2 . 543 . . 53 PRO HG2 . 19464 1
423 . 1 1 53 53 PRO HG3 H 1 2.150 0.003 . 2 . 544 . . 53 PRO HG3 . 19464 1
424 . 1 1 53 53 PRO HD2 H 1 4.100 0.0 . 2 . 546 . . 53 PRO HD2 . 19464 1
425 . 1 1 53 53 PRO HD3 H 1 3.508 0.0 . 2 . 547 . . 53 PRO HD3 . 19464 1
426 . 1 1 53 53 PRO C C 13 176.849 0.0 . 1 . 429 . . 53 PRO C . 19464 1
427 . 1 1 53 53 PRO CA C 13 63.057 0.04 . 1 . 135 . . 53 PRO CA . 19464 1
428 . 1 1 53 53 PRO CB C 13 33.338 0.211 . 1 . 541 . . 53 PRO CB . 19464 1
429 . 1 1 53 53 PRO CG C 13 28.842 0.201 . 1 . 545 . . 53 PRO CG . 19464 1
430 . 1 1 54 54 ILE H H 1 8.792 0.005 . 1 . 27 . . 54 ILE H . 19464 1
431 . 1 1 54 54 ILE HA H 1 3.916 0.014 . 1 . 482 . . 54 ILE HA . 19464 1
432 . 1 1 54 54 ILE HB H 1 1.880 0.006 . 1 . 483 . . 54 ILE HB . 19464 1
433 . 1 1 54 54 ILE HG12 H 1 1.414 0.037 . 2 . 484 . . 54 ILE HG12 . 19464 1
434 . 1 1 54 54 ILE HG13 H 1 1.342 0.027 . 2 . 485 . . 54 ILE HG13 . 19464 1
435 . 1 1 54 54 ILE HG21 H 1 0.965 0.003 . 1 . 480 . . 54 ILE HG21 . 19464 1
436 . 1 1 54 54 ILE HG22 H 1 0.965 0.003 . 1 . 480 . . 54 ILE HG22 . 19464 1
437 . 1 1 54 54 ILE HG23 H 1 0.965 0.003 . 1 . 480 . . 54 ILE HG23 . 19464 1
438 . 1 1 54 54 ILE HD11 H 1 0.902 0.01 . 1 . 487 . . 54 ILE HD11 . 19464 1
439 . 1 1 54 54 ILE HD12 H 1 0.902 0.01 . 1 . 487 . . 54 ILE HD12 . 19464 1
440 . 1 1 54 54 ILE HD13 H 1 0.902 0.01 . 1 . 487 . . 54 ILE HD13 . 19464 1
441 . 1 1 54 54 ILE C C 13 175.618 0.0 . 1 . 430 . . 54 ILE C . 19464 1
442 . 1 1 54 54 ILE CA C 13 64.228 0.166 . 1 . 134 . . 54 ILE CA . 19464 1
443 . 1 1 54 54 ILE CG1 C 13 29.674 0.193 . 1 . 508 . . 54 ILE CG1 . 19464 1
444 . 1 1 54 54 ILE CG2 C 13 18.597 0.228 . 1 . 481 . . 54 ILE CG2 . 19464 1
445 . 1 1 54 54 ILE CD1 C 13 14.166 0.203 . 1 . 486 . . 54 ILE CD1 . 19464 1
446 . 1 1 54 54 ILE N N 15 123.783 0.094 . 1 . 28 . . 54 ILE N . 19464 1
447 . 1 1 55 55 GLY H H 1 8.908 0.004 . 1 . 82 . . 55 GLY H . 19464 1
448 . 1 1 55 55 GLY HA2 H 1 3.829 0.013 . 2 . 493 . . 55 GLY HA2 . 19464 1
449 . 1 1 55 55 GLY HA3 H 1 3.810 0.001 . 2 . 527 . . 55 GLY HA3 . 19464 1
450 . 1 1 55 55 GLY C C 13 175.628 0.0 . 1 . 423 . . 55 GLY C . 19464 1
451 . 1 1 55 55 GLY CA C 13 47.902 0.009 . 1 . 133 . . 55 GLY CA . 19464 1
452 . 1 1 55 55 GLY N N 15 107.548 0.029 . 1 . 83 . . 55 GLY N . 19464 1
453 . 1 1 56 56 THR H H 1 7.332 0.01 . 1 . 41 . . 56 THR H . 19464 1
454 . 1 1 56 56 THR HA H 1 4.138 0.004 . 1 . 192 . . 56 THR HA . 19464 1
455 . 1 1 56 56 THR HB H 1 4.265 0.007 . 1 . 393 . . 56 THR HB . 19464 1
456 . 1 1 56 56 THR HG21 H 1 1.295 0.008 . 1 . 394 . . 56 THR HG21 . 19464 1
457 . 1 1 56 56 THR HG22 H 1 1.295 0.008 . 1 . 394 . . 56 THR HG22 . 19464 1
458 . 1 1 56 56 THR HG23 H 1 1.295 0.008 . 1 . 394 . . 56 THR HG23 . 19464 1
459 . 1 1 56 56 THR C C 13 174.084 0.0 . 1 . 431 . . 56 THR C . 19464 1
460 . 1 1 56 56 THR CA C 13 67.079 0.082 . 1 . 132 . . 56 THR CA . 19464 1
461 . 1 1 56 56 THR CB C 13 69.491 0.071 . 1 . 395 . . 56 THR CB . 19464 1
462 . 1 1 56 56 THR CG2 C 13 22.918 0.032 . 1 . 396 . . 56 THR CG2 . 19464 1
463 . 1 1 56 56 THR N N 15 119.294 0.056 . 1 . 42 . . 56 THR N . 19464 1
464 . 1 1 57 57 VAL H H 1 7.855 0.002 . 1 . 37 . . 57 VAL H . 19464 1
465 . 1 1 57 57 VAL HA H 1 3.303 0.005 . 1 . 193 . . 57 VAL HA . 19464 1
466 . 1 1 57 57 VAL HB H 1 2.244 0.008 . 1 . 397 . . 57 VAL HB . 19464 1
467 . 1 1 57 57 VAL HG11 H 1 0.927 0.008 . 2 . 490 . . 57 VAL HG11 . 19464 1
468 . 1 1 57 57 VAL HG12 H 1 0.927 0.008 . 2 . 490 . . 57 VAL HG12 . 19464 1
469 . 1 1 57 57 VAL HG13 H 1 0.927 0.008 . 2 . 490 . . 57 VAL HG13 . 19464 1
470 . 1 1 57 57 VAL HG21 H 1 0.906 0.012 . 2 . 398 . . 57 VAL HG21 . 19464 1
471 . 1 1 57 57 VAL HG22 H 1 0.906 0.012 . 2 . 398 . . 57 VAL HG22 . 19464 1
472 . 1 1 57 57 VAL HG23 H 1 0.906 0.012 . 2 . 398 . . 57 VAL HG23 . 19464 1
473 . 1 1 57 57 VAL C C 13 175.945 0.0 . 1 . 432 . . 57 VAL C . 19464 1
474 . 1 1 57 57 VAL CA C 13 68.745 0.027 . 1 . 131 . . 57 VAL CA . 19464 1
475 . 1 1 57 57 VAL CG1 C 13 24.563 0.136 . 2 . 491 . . 57 VAL CG1 . 19464 1
476 . 1 1 57 57 VAL CG2 C 13 22.379 0.293 . 2 . 399 . . 57 VAL CG2 . 19464 1
477 . 1 1 57 57 VAL N N 15 122.379 0.051 . 1 . 38 . . 57 VAL N . 19464 1
478 . 1 1 58 58 LYS H H 1 8.649 0.005 . 1 . 53 . . 58 LYS H . 19464 1
479 . 1 1 58 58 LYS HA H 1 4.116 0.008 . 1 . 194 . . 58 LYS HA . 19464 1
480 . 1 1 58 58 LYS HB2 H 1 1.851 0.006 . 2 . 495 . . 58 LYS HB2 . 19464 1
481 . 1 1 58 58 LYS HB3 H 1 1.848 0.003 . 2 . 494 . . 58 LYS HB3 . 19464 1
482 . 1 1 58 58 LYS HG2 H 1 1.621 0.01 . 1 . 499 . . 58 LYS HG2 . 19464 1
483 . 1 1 58 58 LYS HG3 H 1 1.621 0.01 . 1 . 500 . . 58 LYS HG3 . 19464 1
484 . 1 1 58 58 LYS HD2 H 1 1.473 0.01 . 2 . 501 . . 58 LYS HD2 . 19464 1
485 . 1 1 58 58 LYS HD3 H 1 1.473 0.01 . 2 . 502 . . 58 LYS HD3 . 19464 1
486 . 1 1 58 58 LYS C C 13 177.492 0.0 . 1 . 422 . . 58 LYS C . 19464 1
487 . 1 1 58 58 LYS CA C 13 60.237 0.13 . 1 . 130 . . 58 LYS CA . 19464 1
488 . 1 1 58 58 LYS N N 15 116.460 0.051 . 1 . 54 . . 58 LYS N . 19464 1
489 . 1 1 59 59 SER H H 1 7.736 0.003 . 1 . 99 . . 59 SER H . 19464 1
490 . 1 1 59 59 SER HA H 1 4.253 0.004 . 1 . 195 . . 59 SER HA . 19464 1
491 . 1 1 59 59 SER HB2 H 1 4.088 0.003 . 2 . 400 . . 59 SER HB2 . 19464 1
492 . 1 1 59 59 SER HB3 H 1 4.088 0.003 . 2 . 402 . . 59 SER HB3 . 19464 1
493 . 1 1 59 59 SER C C 13 175.866 0.0 . 1 . 433 . . 59 SER C . 19464 1
494 . 1 1 59 59 SER CA C 13 62.631 0.04 . 1 . 125 . . 59 SER CA . 19464 1
495 . 1 1 59 59 SER CB C 13 63.776 0.175 . 1 . 401 . . 59 SER CB . 19464 1
496 . 1 1 59 59 SER N N 15 115.149 0.06 . 1 . 100 . . 59 SER N . 19464 1
497 . 1 1 60 60 ILE H H 1 8.282 0.003 . 1 . 43 . . 60 ILE H . 19464 1
498 . 1 1 60 60 ILE HA H 1 3.626 0.004 . 1 . 196 . . 60 ILE HA . 19464 1
499 . 1 1 60 60 ILE HB H 1 1.862 0.002 . 1 . 283 . . 60 ILE HB . 19464 1
500 . 1 1 60 60 ILE HG12 H 1 1.109 0.005 . 2 . 284 . . 60 ILE HG12 . 19464 1
501 . 1 1 60 60 ILE HG13 H 1 1.961 0.013 . 2 . 285 . . 60 ILE HG13 . 19464 1
502 . 1 1 60 60 ILE HG21 H 1 0.600 0.008 . 1 . 286 . . 60 ILE HG21 . 19464 1
503 . 1 1 60 60 ILE HG22 H 1 0.600 0.008 . 1 . 286 . . 60 ILE HG22 . 19464 1
504 . 1 1 60 60 ILE HG23 H 1 0.600 0.008 . 1 . 286 . . 60 ILE HG23 . 19464 1
505 . 1 1 60 60 ILE HD11 H 1 0.877 0.015 . 1 . 282 . . 60 ILE HD11 . 19464 1
506 . 1 1 60 60 ILE HD12 H 1 0.877 0.015 . 1 . 282 . . 60 ILE HD12 . 19464 1
507 . 1 1 60 60 ILE HD13 H 1 0.877 0.015 . 1 . 282 . . 60 ILE HD13 . 19464 1
508 . 1 1 60 60 ILE C C 13 176.011 0.0 . 1 . 434 . . 60 ILE C . 19464 1
509 . 1 1 60 60 ILE CA C 13 66.561 0.077 . 1 . 126 . . 60 ILE CA . 19464 1
510 . 1 1 60 60 ILE CG1 C 13 30.572 0.217 . 1 . 288 . . 60 ILE CG1 . 19464 1
511 . 1 1 60 60 ILE CG2 C 13 18.531 0.056 . 1 . 287 . . 60 ILE CG2 . 19464 1
512 . 1 1 60 60 ILE CD1 C 13 16.853 0.155 . 1 . 289 . . 60 ILE CD1 . 19464 1
513 . 1 1 60 60 ILE N N 15 124.761 0.073 . 1 . 44 . . 60 ILE N . 19464 1
514 . 1 1 61 61 GLN H H 1 8.580 0.005 . 1 . 23 . . 61 GLN H . 19464 1
515 . 1 1 61 61 GLN HA H 1 3.391 0.016 . 1 . 197 . . 61 GLN HA . 19464 1
516 . 1 1 61 61 GLN HB2 H 1 2.043 0.014 . 2 . 403 . . 61 GLN HB2 . 19464 1
517 . 1 1 61 61 GLN HB3 H 1 1.796 0.013 . 2 . 404 . . 61 GLN HB3 . 19464 1
518 . 1 1 61 61 GLN HG2 H 1 1.892 0.003 . 1 . 522 . . 61 GLN HG2 . 19464 1
519 . 1 1 61 61 GLN HG3 H 1 1.892 0.003 . 1 . 521 . . 61 GLN HG3 . 19464 1
520 . 1 1 61 61 GLN HE21 H 1 6.438 0.005 . 1 . 5 . . 61 GLN HE21 . 19464 1
521 . 1 1 61 61 GLN HE22 H 1 6.639 0.005 . 1 . 107 . . 61 GLN HE22 . 19464 1
522 . 1 1 61 61 GLN C C 13 176.188 0.0 . 1 . 435 . . 61 GLN C . 19464 1
523 . 1 1 61 61 GLN CA C 13 61.255 0.136 . 1 . 127 . . 61 GLN CA . 19464 1
524 . 1 1 61 61 GLN CB C 13 35.093 0.03 . 1 . 405 . . 61 GLN CB . 19464 1
525 . 1 1 61 61 GLN N N 15 118.268 0.056 . 1 . 24 . . 61 GLN N . 19464 1
526 . 1 1 61 61 GLN NE2 N 15 108.526 0.013 . 1 . 6 . . 61 GLN NE2 . 19464 1
527 . 1 1 62 62 LYS H H 1 8.083 0.003 . 1 . 9 . . 62 LYS H . 19464 1
528 . 1 1 62 62 LYS HA H 1 4.158 0.016 . 1 . 198 . . 62 LYS HA . 19464 1
529 . 1 1 62 62 LYS HB2 H 1 1.958 0.005 . 2 . 523 . . 62 LYS HB2 . 19464 1
530 . 1 1 62 62 LYS HB3 H 1 1.962 0.008 . 2 . 524 . . 62 LYS HB3 . 19464 1
531 . 1 1 62 62 LYS HG2 H 1 1.514 0.0 . 1 . 525 . . 62 LYS HG2 . 19464 1
532 . 1 1 62 62 LYS HG3 H 1 1.514 0.0 . 1 . 526 . . 62 LYS HG3 . 19464 1
533 . 1 1 62 62 LYS C C 13 178.692 0.0 . 1 . 436 . . 62 LYS C . 19464 1
534 . 1 1 62 62 LYS CA C 13 60.119 0.088 . 1 . 128 . . 62 LYS CA . 19464 1
535 . 1 1 62 62 LYS N N 15 117.636 0.04 . 1 . 10 . . 62 LYS N . 19464 1
536 . 1 1 63 63 SER H H 1 8.337 0.01 . 1 . 74 . . 63 SER H . 19464 1
537 . 1 1 63 63 SER HA H 1 4.222 0.007 . 1 . 199 . . 63 SER HA . 19464 1
538 . 1 1 63 63 SER HB2 H 1 3.992 0.013 . 2 . 406 . . 63 SER HB2 . 19464 1
539 . 1 1 63 63 SER HB3 H 1 3.955 0.006 . 2 . 407 . . 63 SER HB3 . 19464 1
540 . 1 1 63 63 SER C C 13 173.393 0.0 . 1 . 437 . . 63 SER C . 19464 1
541 . 1 1 63 63 SER CA C 13 62.977 0.175 . 1 . 129 . . 63 SER CA . 19464 1
542 . 1 1 63 63 SER CB C 13 63.802 0.103 . 1 . 408 . . 63 SER CB . 19464 1
543 . 1 1 63 63 SER N N 15 118.062 0.094 . 1 . 75 . . 63 SER N . 19464 1
544 . 1 1 64 64 ALA H H 1 7.822 0.005 . 1 . 25 . . 64 ALA H . 19464 1
545 . 1 1 64 64 ALA HA H 1 4.313 0.007 . 1 . 200 . . 64 ALA HA . 19464 1
546 . 1 1 64 64 ALA HB1 H 1 0.848 0.008 . 1 . 409 . . 64 ALA HB1 . 19464 1
547 . 1 1 64 64 ALA HB2 H 1 0.848 0.008 . 1 . 409 . . 64 ALA HB2 . 19464 1
548 . 1 1 64 64 ALA HB3 H 1 0.848 0.008 . 1 . 409 . . 64 ALA HB3 . 19464 1
549 . 1 1 64 64 ALA C C 13 174.991 0.0 . 1 . 438 . . 64 ALA C . 19464 1
550 . 1 1 64 64 ALA CA C 13 52.239 0.056 . 1 . 118 . . 64 ALA CA . 19464 1
551 . 1 1 64 64 ALA CB C 13 21.064 0.199 . 1 . 410 . . 64 ALA CB . 19464 1
552 . 1 1 64 64 ALA N N 15 121.842 0.087 . 1 . 26 . . 64 ALA N . 19464 1
553 . 1 1 65 65 GLY H H 1 7.852 0.004 . 1 . 101 . . 65 GLY H . 19464 1
554 . 1 1 65 65 GLY HA2 H 1 3.870 0.004 . 2 . 201 . . 65 GLY HA2 . 19464 1
555 . 1 1 65 65 GLY HA3 H 1 4.003 0.007 . 2 . 202 . . 65 GLY HA3 . 19464 1
556 . 1 1 65 65 GLY C C 13 173.132 0.0 . 1 . 439 . . 65 GLY C . 19464 1
557 . 1 1 65 65 GLY CA C 13 47.919 0.075 . 1 . 116 . . 65 GLY CA . 19464 1
558 . 1 1 65 65 GLY N N 15 107.459 0.047 . 1 . 102 . . 65 GLY N . 19464 1
559 . 1 1 66 66 LEU H H 1 7.888 0.006 . 1 . 33 . . 66 LEU H . 19464 1
560 . 1 1 66 66 LEU HA H 1 4.269 0.002 . 1 . 203 . . 66 LEU HA . 19464 1
561 . 1 1 66 66 LEU HB2 H 1 1.589 0.0 . 1 . 503 . . 66 LEU HB2 . 19464 1
562 . 1 1 66 66 LEU HB3 H 1 1.589 0.0 . 1 . 504 . . 66 LEU HB3 . 19464 1
563 . 1 1 66 66 LEU HG H 1 1.367 0.006 . 1 . 505 . . 66 LEU HG . 19464 1
564 . 1 1 66 66 LEU HD11 H 1 0.857 0.0 . 2 . 506 . . 66 LEU HD11 . 19464 1
565 . 1 1 66 66 LEU HD12 H 1 0.857 0.0 . 2 . 506 . . 66 LEU HD12 . 19464 1
566 . 1 1 66 66 LEU HD13 H 1 0.857 0.0 . 2 . 506 . . 66 LEU HD13 . 19464 1
567 . 1 1 66 66 LEU HD21 H 1 0.756 0.0 . 2 . 507 . . 66 LEU HD21 . 19464 1
568 . 1 1 66 66 LEU HD22 H 1 0.756 0.0 . 2 . 507 . . 66 LEU HD22 . 19464 1
569 . 1 1 66 66 LEU HD23 H 1 0.756 0.0 . 2 . 507 . . 66 LEU HD23 . 19464 1
570 . 1 1 66 66 LEU CA C 13 56.087 0.239 . 1 . 117 . . 66 LEU CA . 19464 1
571 . 1 1 66 66 LEU N N 15 125.436 0.034 . 1 . 34 . . 66 LEU N . 19464 1
stop_
save_