Content for NMR-STAR saveframe, assigned_chemical_shifts_1
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50873
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'CREB 285-339 dimer with CRE DNA'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_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 '2D 1H-13C HMQC' . . . 50873 1
2 '2D 1H-15N HSQC' . . . 50873 1
3 '3D CBCA(CO)NH' . . . 50873 1
4 '3D HNCO' . . . 50873 1
5 '3D HNCA' . . . 50873 1
6 '3D HN(CA)CO' . . . 50873 1
7 '3D HBHA(CBCACO)NH' . . . 50873 1
8 '3D HCCH-TOCSY' . . . 50873 1
9 '3D HNCA' . . . 50873 1
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
3 $software_3 . . 50873 1
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 2 2 LYS C C 13 178.556 0.000 . 1 . . . . . 285 LYS C . 50873 1
2 . 1 . 1 2 2 LYS CA C 13 59.295 0.000 . 1 . . . . . 285 LYS CA . 50873 1
3 . 1 . 1 2 2 LYS CB C 13 32.750 0.000 . 1 . . . . . 285 LYS CB . 50873 1
4 . 1 . 1 3 3 ARG H H 1 8.853 0.019 . 1 . . . . . 286 ARG H . 50873 1
5 . 1 . 1 3 3 ARG HA H 1 3.776 0.000 . 1 . . . . . 286 ARG HA . 50873 1
6 . 1 . 1 3 3 ARG HB2 H 1 2.156 0.000 . 1 . . . . . 286 ARG HB2 . 50873 1
7 . 1 . 1 3 3 ARG HG2 H 1 1.791 0.000 . 1 . . . . . 286 ARG HG2 . 50873 1
8 . 1 . 1 3 3 ARG HD2 H 1 3.488 0.000 . 1 . . . . . 286 ARG HD2 . 50873 1
9 . 1 . 1 3 3 ARG C C 13 177.499 0.000 . 1 . . . . . 286 ARG C . 50873 1
10 . 1 . 1 3 3 ARG CA C 13 59.283 0.001 . 1 . . . . . 286 ARG CA . 50873 1
11 . 1 . 1 3 3 ARG CB C 13 29.917 0.017 . 1 . . . . . 286 ARG CB . 50873 1
12 . 1 . 1 3 3 ARG CG C 13 27.216 0.000 . 1 . . . . . 286 ARG CG . 50873 1
13 . 1 . 1 3 3 ARG CD C 13 43.776 0.000 . 1 . . . . . 286 ARG CD . 50873 1
14 . 1 . 1 3 3 ARG N N 15 121.365 0.021 . 1 . . . . . 286 ARG N . 50873 1
15 . 1 . 1 4 4 GLU H H 1 8.418 0.007 . 1 . . . . . 287 GLU H . 50873 1
16 . 1 . 1 4 4 GLU HA H 1 3.967 0.000 . 1 . . . . . 287 GLU HA . 50873 1
17 . 1 . 1 4 4 GLU HB2 H 1 1.838 0.000 . 2 . . . . . 287 GLU HB2 . 50873 1
18 . 1 . 1 4 4 GLU HB3 H 1 1.876 0.000 . 2 . . . . . 287 GLU HB3 . 50873 1
19 . 1 . 1 4 4 GLU C C 13 179.240 0.000 . 1 . . . . . 287 GLU C . 50873 1
20 . 1 . 1 4 4 GLU CA C 13 61.100 0.028 . 1 . . . . . 287 GLU CA . 50873 1
21 . 1 . 1 4 4 GLU CB C 13 28.732 0.000 . 1 . . . . . 287 GLU CB . 50873 1
22 . 1 . 1 4 4 GLU N N 15 118.543 0.067 . 1 . . . . . 287 GLU N . 50873 1
23 . 1 . 1 5 5 VAL H H 1 7.903 0.005 . 1 . . . . . 288 VAL H . 50873 1
24 . 1 . 1 5 5 VAL HA H 1 3.847 0.040 . 1 . . . . . 288 VAL HA . 50873 1
25 . 1 . 1 5 5 VAL HB H 1 2.133 0.004 . 1 . . . . . 288 VAL HB . 50873 1
26 . 1 . 1 5 5 VAL HG11 H 1 1.137 0.043 . 2 . . . . . 288 VAL HG11 . 50873 1
27 . 1 . 1 5 5 VAL HG12 H 1 1.137 0.043 . 2 . . . . . 288 VAL HG12 . 50873 1
28 . 1 . 1 5 5 VAL HG13 H 1 1.137 0.043 . 2 . . . . . 288 VAL HG13 . 50873 1
29 . 1 . 1 5 5 VAL HG21 H 1 1.060 0.043 . 2 . . . . . 288 VAL HG21 . 50873 1
30 . 1 . 1 5 5 VAL HG22 H 1 1.060 0.043 . 2 . . . . . 288 VAL HG22 . 50873 1
31 . 1 . 1 5 5 VAL HG23 H 1 1.060 0.043 . 2 . . . . . 288 VAL HG23 . 50873 1
32 . 1 . 1 5 5 VAL C C 13 177.661 0.000 . 1 . . . . . 288 VAL C . 50873 1
33 . 1 . 1 5 5 VAL CA C 13 66.373 0.059 . 1 . . . . . 288 VAL CA . 50873 1
34 . 1 . 1 5 5 VAL CB C 13 31.892 0.029 . 1 . . . . . 288 VAL CB . 50873 1
35 . 1 . 1 5 5 VAL CG1 C 13 22.491 0.016 . 2 . . . . . 288 VAL CG1 . 50873 1
36 . 1 . 1 5 5 VAL CG2 C 13 21.173 0.004 . 2 . . . . . 288 VAL CG2 . 50873 1
37 . 1 . 1 5 5 VAL N N 15 120.618 0.035 . 1 . . . . . 288 VAL N . 50873 1
38 . 1 . 1 6 6 ARG H H 1 7.934 0.022 . 1 . . . . . 289 ARG H . 50873 1
39 . 1 . 1 6 6 ARG HB2 H 1 2.010 0.000 . 1 . . . . . 289 ARG HB2 . 50873 1
40 . 1 . 1 6 6 ARG C C 13 179.135 0.000 . 1 . . . . . 289 ARG C . 50873 1
41 . 1 . 1 6 6 ARG CA C 13 59.456 0.005 . 1 . . . . . 289 ARG CA . 50873 1
42 . 1 . 1 6 6 ARG CB C 13 29.784 0.102 . 1 . . . . . 289 ARG CB . 50873 1
43 . 1 . 1 6 6 ARG N N 15 121.100 0.053 . 1 . . . . . 289 ARG N . 50873 1
44 . 1 . 1 7 7 LEU H H 1 8.466 0.005 . 1 . . . . . 290 LEU H . 50873 1
45 . 1 . 1 7 7 LEU HA H 1 4.338 0.000 . 1 . . . . . 290 LEU HA . 50873 1
46 . 1 . 1 7 7 LEU HB2 H 1 2.004 0.000 . 2 . . . . . 290 LEU HB2 . 50873 1
47 . 1 . 1 7 7 LEU HB3 H 1 1.915 0.047 . 2 . . . . . 290 LEU HB3 . 50873 1
48 . 1 . 1 7 7 LEU HD11 H 1 1.093 0.043 . 2 . . . . . 290 LEU HD11 . 50873 1
49 . 1 . 1 7 7 LEU HD12 H 1 1.093 0.043 . 2 . . . . . 290 LEU HD12 . 50873 1
50 . 1 . 1 7 7 LEU HD13 H 1 1.093 0.043 . 2 . . . . . 290 LEU HD13 . 50873 1
51 . 1 . 1 7 7 LEU HD21 H 1 1.013 0.045 . 2 . . . . . 290 LEU HD21 . 50873 1
52 . 1 . 1 7 7 LEU HD22 H 1 1.013 0.045 . 2 . . . . . 290 LEU HD22 . 50873 1
53 . 1 . 1 7 7 LEU HD23 H 1 1.013 0.045 . 2 . . . . . 290 LEU HD23 . 50873 1
54 . 1 . 1 7 7 LEU C C 13 174.243 0.000 . 1 . . . . . 290 LEU C . 50873 1
55 . 1 . 1 7 7 LEU CA C 13 58.318 0.010 . 1 . . . . . 290 LEU CA . 50873 1
56 . 1 . 1 7 7 LEU CB C 13 42.021 0.071 . 1 . . . . . 290 LEU CB . 50873 1
57 . 1 . 1 7 7 LEU CD1 C 13 23.317 0.035 . 2 . . . . . 290 LEU CD1 . 50873 1
58 . 1 . 1 7 7 LEU CD2 C 13 25.533 0.014 . 2 . . . . . 290 LEU CD2 . 50873 1
59 . 1 . 1 7 7 LEU N N 15 119.420 0.040 . 1 . . . . . 290 LEU N . 50873 1
60 . 1 . 1 8 8 MET H H 1 8.079 0.020 . 1 . . . . . 291 MET H . 50873 1
61 . 1 . 1 8 8 MET C C 13 178.426 0.000 . 1 . . . . . 291 MET C . 50873 1
62 . 1 . 1 8 8 MET CA C 13 59.029 0.000 . 1 . . . . . 291 MET CA . 50873 1
63 . 1 . 1 8 8 MET CB C 13 32.287 0.000 . 1 . . . . . 291 MET CB . 50873 1
64 . 1 . 1 8 8 MET N N 15 120.802 0.023 . 1 . . . . . 291 MET N . 50873 1
65 . 1 . 1 9 9 LYS H H 1 8.542 0.011 . 1 . . . . . 292 LYS H . 50873 1
66 . 1 . 1 9 9 LYS C C 13 180.332 0.000 . 1 . . . . . 292 LYS C . 50873 1
67 . 1 . 1 9 9 LYS CA C 13 59.251 0.063 . 1 . . . . . 292 LYS CA . 50873 1
68 . 1 . 1 9 9 LYS CB C 13 31.842 0.000 . 1 . . . . . 292 LYS CB . 50873 1
69 . 1 . 1 9 9 LYS N N 15 119.499 0.070 . 1 . . . . . 292 LYS N . 50873 1
70 . 1 . 1 10 10 ASN H H 1 8.741 0.006 . 1 . . . . . 293 ASN H . 50873 1
71 . 1 . 1 10 10 ASN HA H 1 4.112 0.000 . 1 . . . . . 293 ASN HA . 50873 1
72 . 1 . 1 10 10 ASN C C 13 176.933 0.000 . 1 . . . . . 293 ASN C . 50873 1
73 . 1 . 1 10 10 ASN CA C 13 57.274 0.033 . 1 . . . . . 293 ASN CA . 50873 1
74 . 1 . 1 10 10 ASN CB C 13 39.495 0.000 . 1 . . . . . 293 ASN CB . 50873 1
75 . 1 . 1 10 10 ASN N N 15 118.822 0.052 . 1 . . . . . 293 ASN N . 50873 1
76 . 1 . 1 11 11 ARG H H 1 8.340 0.021 . 1 . . . . . 294 ARG H . 50873 1
77 . 1 . 1 11 11 ARG HG2 H 1 1.830 0.045 . 1 . . . . . 294 ARG HG2 . 50873 1
78 . 1 . 1 11 11 ARG HD2 H 1 3.439 0.000 . 1 . . . . . 294 ARG HD2 . 50873 1
79 . 1 . 1 11 11 ARG C C 13 179.795 0.000 . 1 . . . . . 294 ARG C . 50873 1
80 . 1 . 1 11 11 ARG CA C 13 59.573 0.000 . 1 . . . . . 294 ARG CA . 50873 1
81 . 1 . 1 11 11 ARG CB C 13 30.083 0.000 . 1 . . . . . 294 ARG CB . 50873 1
82 . 1 . 1 11 11 ARG CG C 13 27.129 0.016 . 1 . . . . . 294 ARG CG . 50873 1
83 . 1 . 1 11 11 ARG CD C 13 43.493 0.000 . 1 . . . . . 294 ARG CD . 50873 1
84 . 1 . 1 11 11 ARG N N 15 119.724 0.056 . 1 . . . . . 294 ARG N . 50873 1
85 . 1 . 1 12 12 GLU H H 1 7.716 0.021 . 1 . . . . . 295 GLU H . 50873 1
86 . 1 . 1 12 12 GLU HA H 1 4.169 0.000 . 1 . . . . . 295 GLU HA . 50873 1
87 . 1 . 1 12 12 GLU HB2 H 1 2.199 0.000 . 1 . . . . . 295 GLU HB2 . 50873 1
88 . 1 . 1 12 12 GLU C C 13 178.823 0.000 . 1 . . . . . 295 GLU C . 50873 1
89 . 1 . 1 12 12 GLU CA C 13 59.168 0.000 . 1 . . . . . 295 GLU CA . 50873 1
90 . 1 . 1 12 12 GLU CB C 13 29.218 0.000 . 1 . . . . . 295 GLU CB . 50873 1
91 . 1 . 1 12 12 GLU N N 15 120.885 0.034 . 1 . . . . . 295 GLU N . 50873 1
92 . 1 . 1 13 13 ALA H H 1 8.363 0.018 . 1 . . . . . 296 ALA H . 50873 1
93 . 1 . 1 13 13 ALA HA H 1 4.330 0.042 . 1 . . . . . 296 ALA HA . 50873 1
94 . 1 . 1 13 13 ALA HB1 H 1 1.648 0.044 . 1 . . . . . 296 ALA HB1 . 50873 1
95 . 1 . 1 13 13 ALA HB2 H 1 1.648 0.044 . 1 . . . . . 296 ALA HB2 . 50873 1
96 . 1 . 1 13 13 ALA HB3 H 1 1.648 0.044 . 1 . . . . . 296 ALA HB3 . 50873 1
97 . 1 . 1 13 13 ALA C C 13 180.745 0.000 . 1 . . . . . 296 ALA C . 50873 1
98 . 1 . 1 13 13 ALA CA C 13 55.039 0.037 . 1 . . . . . 296 ALA CA . 50873 1
99 . 1 . 1 13 13 ALA CB C 13 18.582 0.051 . 1 . . . . . 296 ALA CB . 50873 1
100 . 1 . 1 13 13 ALA N N 15 123.675 0.052 . 1 . . . . . 296 ALA N . 50873 1
101 . 1 . 1 14 14 ALA H H 1 8.734 0.023 . 1 . . . . . 297 ALA H . 50873 1
102 . 1 . 1 14 14 ALA C C 13 179.689 0.000 . 1 . . . . . 297 ALA C . 50873 1
103 . 1 . 1 14 14 ALA CA C 13 55.470 0.014 . 1 . . . . . 297 ALA CA . 50873 1
104 . 1 . 1 14 14 ALA CB C 13 19.562 0.031 . 1 . . . . . 297 ALA CB . 50873 1
105 . 1 . 1 14 14 ALA N N 15 122.506 0.058 . 1 . . . . . 297 ALA N . 50873 1
106 . 1 . 1 15 15 ARG H H 1 7.499 0.024 . 1 . . . . . 298 ARG H . 50873 1
107 . 1 . 1 15 15 ARG HA H 1 4.340 0.000 . 1 . . . . . 298 ARG HA . 50873 1
108 . 1 . 1 15 15 ARG HB2 H 1 2.355 0.040 . 1 . . . . . 298 ARG HB2 . 50873 1
109 . 1 . 1 15 15 ARG HG2 H 1 1.976 0.000 . 1 . . . . . 298 ARG HG2 . 50873 1
110 . 1 . 1 15 15 ARG HD2 H 1 3.517 0.000 . 1 . . . . . 298 ARG HD2 . 50873 1
111 . 1 . 1 15 15 ARG C C 13 179.778 0.000 . 1 . . . . . 298 ARG C . 50873 1
112 . 1 . 1 15 15 ARG CA C 13 60.200 0.000 . 1 . . . . . 298 ARG CA . 50873 1
113 . 1 . 1 15 15 ARG CB C 13 30.205 0.035 . 1 . . . . . 298 ARG CB . 50873 1
114 . 1 . 1 15 15 ARG CG C 13 27.211 0.000 . 1 . . . . . 298 ARG CG . 50873 1
115 . 1 . 1 15 15 ARG CD C 13 44.387 0.000 . 1 . . . . . 298 ARG CD . 50873 1
116 . 1 . 1 15 15 ARG N N 15 118.396 0.057 . 1 . . . . . 298 ARG N . 50873 1
117 . 1 . 1 16 16 GLU H H 1 7.951 0.016 . 1 . . . . . 299 GLU H . 50873 1
118 . 1 . 1 16 16 GLU C C 13 178.675 0.000 . 1 . . . . . 299 GLU C . 50873 1
119 . 1 . 1 16 16 GLU CA C 13 58.684 0.057 . 1 . . . . . 299 GLU CA . 50873 1
120 . 1 . 1 16 16 GLU CB C 13 28.985 0.000 . 1 . . . . . 299 GLU CB . 50873 1
121 . 1 . 1 16 16 GLU N N 15 120.391 0.031 . 1 . . . . . 299 GLU N . 50873 1
122 . 1 . 1 17 17 SER H H 1 8.837 0.021 . 1 . . . . . 300 SER H . 50873 1
123 . 1 . 1 17 17 SER HA H 1 4.579 0.000 . 1 . . . . . 300 SER HA . 50873 1
124 . 1 . 1 17 17 SER HB2 H 1 4.069 0.000 . 1 . . . . . 300 SER HB2 . 50873 1
125 . 1 . 1 17 17 SER C C 13 178.242 0.000 . 1 . . . . . 300 SER C . 50873 1
126 . 1 . 1 17 17 SER CA C 13 62.658 0.000 . 1 . . . . . 300 SER CA . 50873 1
127 . 1 . 1 17 17 SER CB C 13 63.535 0.000 . 1 . . . . . 300 SER CB . 50873 1
128 . 1 . 1 17 17 SER N N 15 117.597 0.054 . 1 . . . . . 300 SER N . 50873 1
129 . 1 . 1 18 18 ARG H H 1 8.401 0.019 . 1 . . . . . 301 ARG H . 50873 1
130 . 1 . 1 18 18 ARG HG2 H 1 2.143 0.000 . 1 . . . . . 301 ARG HG2 . 50873 1
131 . 1 . 1 18 18 ARG C C 13 179.737 0.000 . 1 . . . . . 301 ARG C . 50873 1
132 . 1 . 1 18 18 ARG CA C 13 60.602 0.000 . 1 . . . . . 301 ARG CA . 50873 1
133 . 1 . 1 18 18 ARG CG C 13 27.427 0.000 . 1 . . . . . 301 ARG CG . 50873 1
134 . 1 . 1 18 18 ARG N N 15 120.008 0.056 . 1 . . . . . 301 ARG N . 50873 1
135 . 1 . 1 19 19 ARG H H 1 7.942 0.017 . 1 . . . . . 302 ARG H . 50873 1
136 . 1 . 1 19 19 ARG C C 13 178.927 0.000 . 1 . . . . . 302 ARG C . 50873 1
137 . 1 . 1 19 19 ARG CA C 13 59.989 0.000 . 1 . . . . . 302 ARG CA . 50873 1
138 . 1 . 1 19 19 ARG CB C 13 29.809 0.000 . 1 . . . . . 302 ARG CB . 50873 1
139 . 1 . 1 19 19 ARG N N 15 122.304 0.035 . 1 . . . . . 302 ARG N . 50873 1
140 . 1 . 1 20 20 LYS H H 1 8.607 0.005 . 1 . . . . . 303 LYS H . 50873 1
141 . 1 . 1 20 20 LYS HA H 1 4.034 0.000 . 1 . . . . . 303 LYS HA . 50873 1
142 . 1 . 1 20 20 LYS HB2 H 1 2.029 0.000 . 1 . . . . . 303 LYS HB2 . 50873 1
143 . 1 . 1 20 20 LYS HD2 H 1 1.533 0.043 . 1 . . . . . 303 LYS HD2 . 50873 1
144 . 1 . 1 20 20 LYS C C 13 179.989 0.000 . 1 . . . . . 303 LYS C . 50873 1
145 . 1 . 1 20 20 LYS CA C 13 60.033 0.009 . 1 . . . . . 303 LYS CA . 50873 1
146 . 1 . 1 20 20 LYS CB C 13 32.602 0.000 . 1 . . . . . 303 LYS CB . 50873 1
147 . 1 . 1 20 20 LYS CD C 13 27.757 0.066 . 1 . . . . . 303 LYS CD . 50873 1
148 . 1 . 1 20 20 LYS N N 15 120.262 0.054 . 1 . . . . . 303 LYS N . 50873 1
149 . 1 . 1 21 21 LYS H H 1 8.305 0.021 . 1 . . . . . 304 LYS H . 50873 1
150 . 1 . 1 21 21 LYS HA H 1 3.934 0.000 . 1 . . . . . 304 LYS HA . 50873 1
151 . 1 . 1 21 21 LYS HB2 H 1 1.486 0.000 . 1 . . . . . 304 LYS HB2 . 50873 1
152 . 1 . 1 21 21 LYS C C 13 178.555 0.000 . 1 . . . . . 304 LYS C . 50873 1
153 . 1 . 1 21 21 LYS CA C 13 58.776 0.008 . 1 . . . . . 304 LYS CA . 50873 1
154 . 1 . 1 21 21 LYS CB C 13 31.406 0.000 . 1 . . . . . 304 LYS CB . 50873 1
155 . 1 . 1 21 21 LYS N N 15 121.397 0.031 . 1 . . . . . 304 LYS N . 50873 1
156 . 1 . 1 22 22 LYS H H 1 8.020 0.022 . 1 . . . . . 305 LYS H . 50873 1
157 . 1 . 1 22 22 LYS HA H 1 4.125 0.000 . 1 . . . . . 305 LYS HA . 50873 1
158 . 1 . 1 22 22 LYS HB2 H 1 2.092 0.000 . 1 . . . . . 305 LYS HB2 . 50873 1
159 . 1 . 1 22 22 LYS C C 13 179.942 0.000 . 1 . . . . . 305 LYS C . 50873 1
160 . 1 . 1 22 22 LYS CA C 13 60.090 0.000 . 1 . . . . . 305 LYS CA . 50873 1
161 . 1 . 1 22 22 LYS N N 15 120.057 0.030 . 1 . . . . . 305 LYS N . 50873 1
162 . 1 . 1 23 23 GLU H H 1 8.179 0.020 . 1 . . . . . 306 GLU H . 50873 1
163 . 1 . 1 23 23 GLU HB2 H 1 2.209 0.000 . 1 . . . . . 306 GLU HB2 . 50873 1
164 . 1 . 1 23 23 GLU C C 13 179.124 0.000 . 1 . . . . . 306 GLU C . 50873 1
165 . 1 . 1 23 23 GLU CA C 13 59.140 0.011 . 1 . . . . . 306 GLU CA . 50873 1
166 . 1 . 1 23 23 GLU CB C 13 29.306 0.000 . 1 . . . . . 306 GLU CB . 50873 1
167 . 1 . 1 23 23 GLU N N 15 118.687 0.000 . 1 . . . . . 306 GLU N . 50873 1
168 . 1 . 1 24 24 TYR H H 1 8.537 0.008 . 1 . . . . . 307 TYR H . 50873 1
169 . 1 . 1 24 24 TYR HA H 1 4.291 0.000 . 1 . . . . . 307 TYR HA . 50873 1
170 . 1 . 1 24 24 TYR C C 13 178.110 0.000 . 1 . . . . . 307 TYR C . 50873 1
171 . 1 . 1 24 24 TYR CA C 13 60.903 0.000 . 1 . . . . . 307 TYR CA . 50873 1
172 . 1 . 1 24 24 TYR CB C 13 38.258 0.000 . 1 . . . . . 307 TYR CB . 50873 1
173 . 1 . 1 24 24 TYR N N 15 123.252 0.054 . 1 . . . . . 307 TYR N . 50873 1
174 . 1 . 1 25 25 VAL H H 1 8.490 0.008 . 1 . . . . . 308 VAL H . 50873 1
175 . 1 . 1 25 25 VAL HA H 1 3.967 0.000 . 1 . . . . . 308 VAL HA . 50873 1
176 . 1 . 1 25 25 VAL HB H 1 2.172 0.000 . 1 . . . . . 308 VAL HB . 50873 1
177 . 1 . 1 25 25 VAL HG11 H 1 1.338 0.047 . 2 . . . . . 308 VAL HG11 . 50873 1
178 . 1 . 1 25 25 VAL HG12 H 1 1.338 0.047 . 2 . . . . . 308 VAL HG12 . 50873 1
179 . 1 . 1 25 25 VAL HG13 H 1 1.338 0.047 . 2 . . . . . 308 VAL HG13 . 50873 1
180 . 1 . 1 25 25 VAL HG21 H 1 1.109 0.045 . 2 . . . . . 308 VAL HG21 . 50873 1
181 . 1 . 1 25 25 VAL HG22 H 1 1.109 0.045 . 2 . . . . . 308 VAL HG22 . 50873 1
182 . 1 . 1 25 25 VAL HG23 H 1 1.109 0.045 . 2 . . . . . 308 VAL HG23 . 50873 1
183 . 1 . 1 25 25 VAL C C 13 177.801 0.000 . 1 . . . . . 308 VAL C . 50873 1
184 . 1 . 1 25 25 VAL CA C 13 67.787 0.053 . 1 . . . . . 308 VAL CA . 50873 1
185 . 1 . 1 25 25 VAL CB C 13 31.518 0.000 . 1 . . . . . 308 VAL CB . 50873 1
186 . 1 . 1 25 25 VAL CG1 C 13 24.198 0.025 . 2 . . . . . 308 VAL CG1 . 50873 1
187 . 1 . 1 25 25 VAL CG2 C 13 21.718 0.007 . 2 . . . . . 308 VAL CG2 . 50873 1
188 . 1 . 1 25 25 VAL N N 15 120.618 0.052 . 1 . . . . . 308 VAL N . 50873 1
189 . 1 . 1 26 26 LYS H H 1 7.878 0.022 . 1 . . . . . 309 LYS H . 50873 1
190 . 1 . 1 26 26 LYS HA H 1 4.214 0.000 . 1 . . . . . 309 LYS HA . 50873 1
191 . 1 . 1 26 26 LYS HB2 H 1 1.937 0.000 . 1 . . . . . 309 LYS HB2 . 50873 1
192 . 1 . 1 26 26 LYS C C 13 179.390 0.000 . 1 . . . . . 309 LYS C . 50873 1
193 . 1 . 1 26 26 LYS CA C 13 58.983 0.000 . 1 . . . . . 309 LYS CA . 50873 1
194 . 1 . 1 26 26 LYS CB C 13 31.861 0.000 . 1 . . . . . 309 LYS CB . 50873 1
195 . 1 . 1 26 26 LYS N N 15 118.711 0.023 . 1 . . . . . 309 LYS N . 50873 1
196 . 1 . 1 27 27 SER H H 1 8.409 0.025 . 1 . . . . . 310 SER H . 50873 1
197 . 1 . 1 27 27 SER HA H 1 4.181 0.000 . 1 . . . . . 310 SER HA . 50873 1
198 . 1 . 1 27 27 SER HB2 H 1 3.505 0.000 . 2 . . . . . 310 SER HB2 . 50873 1
199 . 1 . 1 27 27 SER HB3 H 1 3.679 0.000 . 2 . . . . . 310 SER HB3 . 50873 1
200 . 1 . 1 27 27 SER C C 13 177.454 0.000 . 1 . . . . . 310 SER C . 50873 1
201 . 1 . 1 27 27 SER CA C 13 61.743 0.000 . 1 . . . . . 310 SER CA . 50873 1
202 . 1 . 1 27 27 SER CB C 13 62.492 0.000 . 1 . . . . . 310 SER CB . 50873 1
203 . 1 . 1 27 27 SER N N 15 116.114 0.017 . 1 . . . . . 310 SER N . 50873 1
204 . 1 . 1 28 28 LEU H H 1 7.983 0.021 . 1 . . . . . 311 LEU H . 50873 1
205 . 1 . 1 28 28 LEU HA H 1 4.117 0.000 . 1 . . . . . 311 LEU HA . 50873 1
206 . 1 . 1 28 28 LEU HB2 H 1 1.464 0.043 . 2 . . . . . 311 LEU HB2 . 50873 1
207 . 1 . 1 28 28 LEU HB3 H 1 1.657 0.000 . 2 . . . . . 311 LEU HB3 . 50873 1
208 . 1 . 1 28 28 LEU HG H 1 1.351 0.000 . 1 . . . . . 311 LEU HG . 50873 1
209 . 1 . 1 28 28 LEU HD11 H 1 0.737 0.000 . 2 . . . . . 311 LEU HD11 . 50873 1
210 . 1 . 1 28 28 LEU HD12 H 1 0.737 0.000 . 2 . . . . . 311 LEU HD12 . 50873 1
211 . 1 . 1 28 28 LEU HD13 H 1 0.737 0.000 . 2 . . . . . 311 LEU HD13 . 50873 1
212 . 1 . 1 28 28 LEU HD21 H 1 0.834 0.000 . 2 . . . . . 311 LEU HD21 . 50873 1
213 . 1 . 1 28 28 LEU HD22 H 1 0.834 0.000 . 2 . . . . . 311 LEU HD22 . 50873 1
214 . 1 . 1 28 28 LEU HD23 H 1 0.834 0.000 . 2 . . . . . 311 LEU HD23 . 50873 1
215 . 1 . 1 28 28 LEU C C 13 178.700 0.000 . 1 . . . . . 311 LEU C . 50873 1
216 . 1 . 1 28 28 LEU CA C 13 57.812 0.094 . 1 . . . . . 311 LEU CA . 50873 1
217 . 1 . 1 28 28 LEU CB C 13 43.498 0.000 . 1 . . . . . 311 LEU CB . 50873 1
218 . 1 . 1 28 28 LEU CG C 13 26.586 0.000 . 1 . . . . . 311 LEU CG . 50873 1
219 . 1 . 1 28 28 LEU CD1 C 13 26.802 0.000 . 2 . . . . . 311 LEU CD1 . 50873 1
220 . 1 . 1 28 28 LEU CD2 C 13 23.143 0.000 . 2 . . . . . 311 LEU CD2 . 50873 1
221 . 1 . 1 28 28 LEU N N 15 125.176 0.063 . 1 . . . . . 311 LEU N . 50873 1
222 . 1 . 1 29 29 GLU H H 1 8.399 0.021 . 1 . . . . . 312 GLU H . 50873 1
223 . 1 . 1 29 29 GLU C C 13 180.473 0.000 . 1 . . . . . 312 GLU C . 50873 1
224 . 1 . 1 29 29 GLU CA C 13 59.752 0.006 . 1 . . . . . 312 GLU CA . 50873 1
225 . 1 . 1 29 29 GLU CB C 13 29.503 0.000 . 1 . . . . . 312 GLU CB . 50873 1
226 . 1 . 1 29 29 GLU N N 15 118.552 0.006 . 1 . . . . . 312 GLU N . 50873 1
227 . 1 . 1 30 30 ASN H H 1 8.418 0.026 . 1 . . . . . 313 ASN H . 50873 1
228 . 1 . 1 30 30 ASN HA H 1 4.006 0.000 . 1 . . . . . 313 ASN HA . 50873 1
229 . 1 . 1 30 30 ASN HD21 H 1 6.956 0.000 . 1 . . . . . 313 ASN HD21 . 50873 1
230 . 1 . 1 30 30 ASN HD22 H 1 7.737 0.000 . 1 . . . . . 313 ASN HD22 . 50873 1
231 . 1 . 1 30 30 ASN C C 13 176.725 0.000 . 1 . . . . . 313 ASN C . 50873 1
232 . 1 . 1 30 30 ASN CA C 13 56.253 0.036 . 1 . . . . . 313 ASN CA . 50873 1
233 . 1 . 1 30 30 ASN CB C 13 38.710 0.037 . 1 . . . . . 313 ASN CB . 50873 1
234 . 1 . 1 30 30 ASN CG C 13 174.753 0.000 . 1 . . . . . 313 ASN CG . 50873 1
235 . 1 . 1 30 30 ASN N N 15 118.004 0.043 . 1 . . . . . 313 ASN N . 50873 1
236 . 1 . 1 30 30 ASN ND2 N 15 112.429 0.018 . 1 . . . . . 313 ASN ND2 . 50873 1
237 . 1 . 1 31 31 ARG H H 1 8.333 0.020 . 1 . . . . . 314 ARG H . 50873 1
238 . 1 . 1 31 31 ARG HB2 H 1 2.153 0.000 . 1 . . . . . 314 ARG HB2 . 50873 1
239 . 1 . 1 31 31 ARG C C 13 178.559 0.000 . 1 . . . . . 314 ARG C . 50873 1
240 . 1 . 1 31 31 ARG CA C 13 58.926 0.000 . 1 . . . . . 314 ARG CA . 50873 1
241 . 1 . 1 31 31 ARG CB C 13 29.926 0.004 . 1 . . . . . 314 ARG CB . 50873 1
242 . 1 . 1 31 31 ARG N N 15 121.652 0.018 . 1 . . . . . 314 ARG N . 50873 1
243 . 1 . 1 32 32 VAL H H 1 8.459 0.022 . 1 . . . . . 315 VAL H . 50873 1
244 . 1 . 1 32 32 VAL HA H 1 3.570 0.000 . 1 . . . . . 315 VAL HA . 50873 1
245 . 1 . 1 32 32 VAL HG11 H 1 0.935 0.044 . 1 . . . . . 315 VAL HG11 . 50873 1
246 . 1 . 1 32 32 VAL HG12 H 1 0.935 0.044 . 1 . . . . . 315 VAL HG12 . 50873 1
247 . 1 . 1 32 32 VAL HG13 H 1 0.935 0.044 . 1 . . . . . 315 VAL HG13 . 50873 1
248 . 1 . 1 32 32 VAL C C 13 176.800 0.000 . 1 . . . . . 315 VAL C . 50873 1
249 . 1 . 1 32 32 VAL CA C 13 67.393 0.053 . 1 . . . . . 315 VAL CA . 50873 1
250 . 1 . 1 32 32 VAL CB C 13 31.600 0.000 . 1 . . . . . 315 VAL CB . 50873 1
251 . 1 . 1 32 32 VAL CG1 C 13 21.624 0.003 . 1 . . . . . 315 VAL CG1 . 50873 1
252 . 1 . 1 32 32 VAL N N 15 118.430 0.080 . 1 . . . . . 315 VAL N . 50873 1
253 . 1 . 1 33 33 ALA H H 1 7.324 0.022 . 1 . . . . . 316 ALA H . 50873 1
254 . 1 . 1 33 33 ALA HA H 1 4.228 0.050 . 1 . . . . . 316 ALA HA . 50873 1
255 . 1 . 1 33 33 ALA HB1 H 1 1.609 0.042 . 1 . . . . . 316 ALA HB1 . 50873 1
256 . 1 . 1 33 33 ALA HB2 H 1 1.609 0.042 . 1 . . . . . 316 ALA HB2 . 50873 1
257 . 1 . 1 33 33 ALA HB3 H 1 1.609 0.042 . 1 . . . . . 316 ALA HB3 . 50873 1
258 . 1 . 1 33 33 ALA C C 13 181.293 0.000 . 1 . . . . . 316 ALA C . 50873 1
259 . 1 . 1 33 33 ALA CA C 13 55.417 0.052 . 1 . . . . . 316 ALA CA . 50873 1
260 . 1 . 1 33 33 ALA CB C 13 18.027 0.023 . 1 . . . . . 316 ALA CB . 50873 1
261 . 1 . 1 33 33 ALA N N 15 120.655 0.069 . 1 . . . . . 316 ALA N . 50873 1
262 . 1 . 1 34 34 VAL H H 1 8.258 0.017 . 1 . . . . . 317 VAL H . 50873 1
263 . 1 . 1 34 34 VAL HA H 1 3.806 0.057 . 1 . . . . . 317 VAL HA . 50873 1
264 . 1 . 1 34 34 VAL HB H 1 2.152 0.000 . 1 . . . . . 317 VAL HB . 50873 1
265 . 1 . 1 34 34 VAL HG11 H 1 1.164 0.044 . 2 . . . . . 317 VAL HG11 . 50873 1
266 . 1 . 1 34 34 VAL HG12 H 1 1.164 0.044 . 2 . . . . . 317 VAL HG12 . 50873 1
267 . 1 . 1 34 34 VAL HG13 H 1 1.164 0.044 . 2 . . . . . 317 VAL HG13 . 50873 1
268 . 1 . 1 34 34 VAL HG21 H 1 1.071 0.044 . 2 . . . . . 317 VAL HG21 . 50873 1
269 . 1 . 1 34 34 VAL HG22 H 1 1.071 0.044 . 2 . . . . . 317 VAL HG22 . 50873 1
270 . 1 . 1 34 34 VAL HG23 H 1 1.071 0.044 . 2 . . . . . 317 VAL HG23 . 50873 1
271 . 1 . 1 34 34 VAL C C 13 176.800 0.000 . 1 . . . . . 317 VAL C . 50873 1
272 . 1 . 1 34 34 VAL CA C 13 66.466 0.019 . 1 . . . . . 317 VAL CA . 50873 1
273 . 1 . 1 34 34 VAL CB C 13 29.674 0.000 . 1 . . . . . 317 VAL CB . 50873 1
274 . 1 . 1 34 34 VAL CG1 C 13 22.741 0.021 . 1 . . . . . 317 VAL CG1 . 50873 1
275 . 1 . 1 34 34 VAL CG2 C 13 22.741 0.021 . 1 . . . . . 317 VAL CG2 . 50873 1
276 . 1 . 1 34 34 VAL N N 15 119.245 0.055 . 1 . . . . . 317 VAL N . 50873 1
277 . 1 . 1 35 35 LEU H H 1 8.631 0.004 . 1 . . . . . 318 LEU H . 50873 1
278 . 1 . 1 35 35 LEU HA H 1 3.933 0.000 . 1 . . . . . 318 LEU HA . 50873 1
279 . 1 . 1 35 35 LEU HB2 H 1 1.897 0.000 . 1 . . . . . 318 LEU HB2 . 50873 1
280 . 1 . 1 35 35 LEU HD11 H 1 0.934 0.044 . 2 . . . . . 318 LEU HD11 . 50873 1
281 . 1 . 1 35 35 LEU HD12 H 1 0.934 0.044 . 2 . . . . . 318 LEU HD12 . 50873 1
282 . 1 . 1 35 35 LEU HD13 H 1 0.934 0.044 . 2 . . . . . 318 LEU HD13 . 50873 1
283 . 1 . 1 35 35 LEU HD21 H 1 1.030 0.044 . 2 . . . . . 318 LEU HD21 . 50873 1
284 . 1 . 1 35 35 LEU HD22 H 1 1.030 0.044 . 2 . . . . . 318 LEU HD22 . 50873 1
285 . 1 . 1 35 35 LEU HD23 H 1 1.030 0.044 . 2 . . . . . 318 LEU HD23 . 50873 1
286 . 1 . 1 35 35 LEU C C 13 179.911 0.000 . 1 . . . . . 318 LEU C . 50873 1
287 . 1 . 1 35 35 LEU CA C 13 58.047 0.084 . 1 . . . . . 318 LEU CA . 50873 1
288 . 1 . 1 35 35 LEU CB C 13 43.990 0.000 . 1 . . . . . 318 LEU CB . 50873 1
289 . 1 . 1 35 35 LEU CD1 C 13 22.931 0.008 . 2 . . . . . 318 LEU CD1 . 50873 1
290 . 1 . 1 35 35 LEU CD2 C 13 28.162 0.009 . 2 . . . . . 318 LEU CD2 . 50873 1
291 . 1 . 1 35 35 LEU N N 15 121.312 0.021 . 1 . . . . . 318 LEU N . 50873 1
292 . 1 . 1 36 36 GLU H H 1 9.137 0.022 . 1 . . . . . 319 GLU H . 50873 1
293 . 1 . 1 36 36 GLU HA H 1 4.011 0.000 . 1 . . . . . 319 GLU HA . 50873 1
294 . 1 . 1 36 36 GLU C C 13 179.824 0.000 . 1 . . . . . 319 GLU C . 50873 1
295 . 1 . 1 36 36 GLU CA C 13 60.220 0.053 . 1 . . . . . 319 GLU CA . 50873 1
296 . 1 . 1 36 36 GLU CB C 13 29.427 0.000 . 1 . . . . . 319 GLU CB . 50873 1
297 . 1 . 1 36 36 GLU N N 15 120.600 0.053 . 1 . . . . . 319 GLU N . 50873 1
298 . 1 . 1 37 37 ASN H H 1 7.784 0.023 . 1 . . . . . 320 ASN H . 50873 1
299 . 1 . 1 37 37 ASN HA H 1 4.306 0.000 . 1 . . . . . 320 ASN HA . 50873 1
300 . 1 . 1 37 37 ASN HD21 H 1 7.043 0.000 . 1 . . . . . 320 ASN HD21 . 50873 1
301 . 1 . 1 37 37 ASN HD22 H 1 7.772 0.000 . 1 . . . . . 320 ASN HD22 . 50873 1
302 . 1 . 1 37 37 ASN C C 13 177.952 0.000 . 1 . . . . . 320 ASN C . 50873 1
303 . 1 . 1 37 37 ASN CA C 13 56.796 0.013 . 1 . . . . . 320 ASN CA . 50873 1
304 . 1 . 1 37 37 ASN CB C 13 38.822 0.002 . 1 . . . . . 320 ASN CB . 50873 1
305 . 1 . 1 37 37 ASN CG C 13 173.871 0.000 . 1 . . . . . 320 ASN CG . 50873 1
306 . 1 . 1 37 37 ASN N N 15 118.277 0.071 . 1 . . . . . 320 ASN N . 50873 1
307 . 1 . 1 37 37 ASN ND2 N 15 113.592 0.001 . 1 . . . . . 320 ASN ND2 . 50873 1
308 . 1 . 1 38 38 GLN H H 1 8.696 0.021 . 1 . . . . . 321 GLN H . 50873 1
309 . 1 . 1 38 38 GLN HE21 H 1 6.833 0.019 . 1 . . . . . 321 GLN HE21 . 50873 1
310 . 1 . 1 38 38 GLN HE22 H 1 7.432 0.000 . 1 . . . . . 321 GLN HE22 . 50873 1
311 . 1 . 1 38 38 GLN C C 13 178.081 0.018 . 1 . . . . . 321 GLN C . 50873 1
312 . 1 . 1 38 38 GLN CA C 13 59.245 0.046 . 1 . . . . . 321 GLN CA . 50873 1
313 . 1 . 1 38 38 GLN CB C 13 28.582 0.000 . 1 . . . . . 321 GLN CB . 50873 1
314 . 1 . 1 38 38 GLN CD C 13 179.605 0.000 . 1 . . . . . 321 GLN CD . 50873 1
315 . 1 . 1 38 38 GLN N N 15 121.176 0.037 . 1 . . . . . 321 GLN N . 50873 1
316 . 1 . 1 38 38 GLN NE2 N 15 110.236 0.001 . 1 . . . . . 321 GLN NE2 . 50873 1
317 . 1 . 1 39 39 ASN H H 1 8.873 0.022 . 1 . . . . . 322 ASN H . 50873 1
318 . 1 . 1 39 39 ASN HA H 1 4.003 0.000 . 1 . . . . . 322 ASN HA . 50873 1
319 . 1 . 1 39 39 ASN C C 13 176.507 0.000 . 1 . . . . . 322 ASN C . 50873 1
320 . 1 . 1 39 39 ASN CA C 13 57.312 0.000 . 1 . . . . . 322 ASN CA . 50873 1
321 . 1 . 1 39 39 ASN CB C 13 38.725 0.000 . 1 . . . . . 322 ASN CB . 50873 1
322 . 1 . 1 39 39 ASN N N 15 119.733 0.044 . 1 . . . . . 322 ASN N . 50873 1
323 . 1 . 1 40 40 LYS H H 1 7.800 0.023 . 1 . . . . . 323 LYS H . 50873 1
324 . 1 . 1 40 40 LYS HA H 1 4.538 0.000 . 1 . . . . . 323 LYS HA . 50873 1
325 . 1 . 1 40 40 LYS HB2 H 1 2.028 0.000 . 2 . . . . . 323 LYS HB2 . 50873 1
326 . 1 . 1 40 40 LYS HB3 H 1 1.983 0.000 . 2 . . . . . 323 LYS HB3 . 50873 1
327 . 1 . 1 40 40 LYS C C 13 178.990 0.000 . 1 . . . . . 323 LYS C . 50873 1
328 . 1 . 1 40 40 LYS CA C 13 60.018 0.030 . 1 . . . . . 323 LYS CA . 50873 1
329 . 1 . 1 40 40 LYS CB C 13 32.363 0.000 . 1 . . . . . 323 LYS CB . 50873 1
330 . 1 . 1 40 40 LYS N N 15 118.486 0.058 . 1 . . . . . 323 LYS N . 50873 1
331 . 1 . 1 41 41 THR H H 1 7.882 0.012 . 1 . . . . . 324 THR H . 50873 1
332 . 1 . 1 41 41 THR HA H 1 4.041 0.043 . 1 . . . . . 324 THR HA . 50873 1
333 . 1 . 1 41 41 THR HB H 1 4.378 0.043 . 1 . . . . . 324 THR HB . 50873 1
334 . 1 . 1 41 41 THR HG21 H 1 1.410 0.000 . 1 . . . . . 324 THR HG21 . 50873 1
335 . 1 . 1 41 41 THR HG22 H 1 1.410 0.000 . 1 . . . . . 324 THR HG22 . 50873 1
336 . 1 . 1 41 41 THR HG23 H 1 1.410 0.000 . 1 . . . . . 324 THR HG23 . 50873 1
337 . 1 . 1 41 41 THR C C 13 176.925 0.000 . 1 . . . . . 324 THR C . 50873 1
338 . 1 . 1 41 41 THR CA C 13 66.603 0.040 . 1 . . . . . 324 THR CA . 50873 1
339 . 1 . 1 41 41 THR CB C 13 68.998 0.042 . 1 . . . . . 324 THR CB . 50873 1
340 . 1 . 1 41 41 THR CG2 C 13 21.796 0.000 . 1 . . . . . 324 THR CG2 . 50873 1
341 . 1 . 1 41 41 THR N N 15 115.643 0.052 . 1 . . . . . 324 THR N . 50873 1
342 . 1 . 1 42 42 LEU H H 1 8.351 0.022 . 1 . . . . . 325 LEU H . 50873 1
343 . 1 . 1 42 42 LEU HA H 1 4.096 0.000 . 1 . . . . . 325 LEU HA . 50873 1
344 . 1 . 1 42 42 LEU HD11 H 1 0.945 0.000 . 2 . . . . . 325 LEU HD11 . 50873 1
345 . 1 . 1 42 42 LEU HD12 H 1 0.945 0.000 . 2 . . . . . 325 LEU HD12 . 50873 1
346 . 1 . 1 42 42 LEU HD13 H 1 0.945 0.000 . 2 . . . . . 325 LEU HD13 . 50873 1
347 . 1 . 1 42 42 LEU HD21 H 1 1.040 0.000 . 2 . . . . . 325 LEU HD21 . 50873 1
348 . 1 . 1 42 42 LEU HD22 H 1 1.040 0.000 . 2 . . . . . 325 LEU HD22 . 50873 1
349 . 1 . 1 42 42 LEU HD23 H 1 1.040 0.000 . 2 . . . . . 325 LEU HD23 . 50873 1
350 . 1 . 1 42 42 LEU C C 13 178.750 0.000 . 1 . . . . . 325 LEU C . 50873 1
351 . 1 . 1 42 42 LEU CA C 13 58.583 0.000 . 1 . . . . . 325 LEU CA . 50873 1
352 . 1 . 1 42 42 LEU CB C 13 43.291 0.050 . 1 . . . . . 325 LEU CB . 50873 1
353 . 1 . 1 42 42 LEU CD1 C 13 23.345 0.000 . 2 . . . . . 325 LEU CD1 . 50873 1
354 . 1 . 1 42 42 LEU CD2 C 13 26.720 0.000 . 2 . . . . . 325 LEU CD2 . 50873 1
355 . 1 . 1 42 42 LEU N N 15 123.726 0.039 . 1 . . . . . 325 LEU N . 50873 1
356 . 1 . 1 43 43 ILE H H 1 8.385 0.021 . 1 . . . . . 326 ILE H . 50873 1
357 . 1 . 1 43 43 ILE HA H 1 3.970 0.000 . 1 . . . . . 326 ILE HA . 50873 1
358 . 1 . 1 43 43 ILE HB H 1 2.013 0.042 . 1 . . . . . 326 ILE HB . 50873 1
359 . 1 . 1 43 43 ILE HG21 H 1 0.982 0.042 . 1 . . . . . 326 ILE HG21 . 50873 1
360 . 1 . 1 43 43 ILE HG22 H 1 0.982 0.042 . 1 . . . . . 326 ILE HG22 . 50873 1
361 . 1 . 1 43 43 ILE HG23 H 1 0.982 0.042 . 1 . . . . . 326 ILE HG23 . 50873 1
362 . 1 . 1 43 43 ILE HD11 H 1 0.863 0.043 . 1 . . . . . 326 ILE HD11 . 50873 1
363 . 1 . 1 43 43 ILE HD12 H 1 0.863 0.043 . 1 . . . . . 326 ILE HD12 . 50873 1
364 . 1 . 1 43 43 ILE HD13 H 1 0.863 0.043 . 1 . . . . . 326 ILE HD13 . 50873 1
365 . 1 . 1 43 43 ILE C C 13 179.186 0.000 . 1 . . . . . 326 ILE C . 50873 1
366 . 1 . 1 43 43 ILE CA C 13 65.662 0.000 . 1 . . . . . 326 ILE CA . 50873 1
367 . 1 . 1 43 43 ILE CB C 13 38.039 0.025 . 1 . . . . . 326 ILE CB . 50873 1
368 . 1 . 1 43 43 ILE CG2 C 13 17.183 0.038 . 1 . . . . . 326 ILE CG2 . 50873 1
369 . 1 . 1 43 43 ILE CD1 C 13 13.298 0.028 . 1 . . . . . 326 ILE CD1 . 50873 1
370 . 1 . 1 43 43 ILE N N 15 119.721 0.073 . 1 . . . . . 326 ILE N . 50873 1
371 . 1 . 1 44 44 GLU H H 1 7.905 0.020 . 1 . . . . . 327 GLU H . 50873 1
372 . 1 . 1 44 44 GLU HA H 1 4.016 0.000 . 1 . . . . . 327 GLU HA . 50873 1
373 . 1 . 1 44 44 GLU HB2 H 1 2.168 0.000 . 1 . . . . . 327 GLU HB2 . 50873 1
374 . 1 . 1 44 44 GLU C C 13 179.542 0.013 . 1 . . . . . 327 GLU C . 50873 1
375 . 1 . 1 44 44 GLU CA C 13 59.350 0.000 . 1 . . . . . 327 GLU CA . 50873 1
376 . 1 . 1 44 44 GLU CB C 13 29.190 0.000 . 1 . . . . . 327 GLU CB . 50873 1
377 . 1 . 1 44 44 GLU N N 15 119.405 0.027 . 1 . . . . . 327 GLU N . 50873 1
378 . 1 . 1 45 45 GLU H H 1 8.365 0.020 . 1 . . . . . 328 GLU H . 50873 1
379 . 1 . 1 45 45 GLU HA H 1 4.063 0.000 . 1 . . . . . 328 GLU HA . 50873 1
380 . 1 . 1 45 45 GLU HB2 H 1 2.199 0.000 . 1 . . . . . 328 GLU HB2 . 50873 1
381 . 1 . 1 45 45 GLU C C 13 179.619 0.000 . 1 . . . . . 328 GLU C . 50873 1
382 . 1 . 1 45 45 GLU CA C 13 59.707 0.014 . 1 . . . . . 328 GLU CA . 50873 1
383 . 1 . 1 45 45 GLU CB C 13 29.544 0.000 . 1 . . . . . 328 GLU CB . 50873 1
384 . 1 . 1 45 45 GLU N N 15 122.660 0.076 . 1 . . . . . 328 GLU N . 50873 1
385 . 1 . 1 46 46 LEU H H 1 8.638 0.022 . 1 . . . . . 329 LEU H . 50873 1
386 . 1 . 1 46 46 LEU HA H 1 4.067 0.000 . 1 . . . . . 329 LEU HA . 50873 1
387 . 1 . 1 46 46 LEU HB2 H 1 1.756 0.000 . 1 . . . . . 329 LEU HB2 . 50873 1
388 . 1 . 1 46 46 LEU HD11 H 1 1.003 0.000 . 2 . . . . . 329 LEU HD11 . 50873 1
389 . 1 . 1 46 46 LEU HD12 H 1 1.003 0.000 . 2 . . . . . 329 LEU HD12 . 50873 1
390 . 1 . 1 46 46 LEU HD13 H 1 1.003 0.000 . 2 . . . . . 329 LEU HD13 . 50873 1
391 . 1 . 1 46 46 LEU HD21 H 1 1.043 0.000 . 2 . . . . . 329 LEU HD21 . 50873 1
392 . 1 . 1 46 46 LEU HD22 H 1 1.043 0.000 . 2 . . . . . 329 LEU HD22 . 50873 1
393 . 1 . 1 46 46 LEU HD23 H 1 1.043 0.000 . 2 . . . . . 329 LEU HD23 . 50873 1
394 . 1 . 1 46 46 LEU C C 13 178.435 0.000 . 1 . . . . . 329 LEU C . 50873 1
395 . 1 . 1 46 46 LEU CA C 13 58.471 0.053 . 1 . . . . . 329 LEU CA . 50873 1
396 . 1 . 1 46 46 LEU CB C 13 42.463 0.095 . 1 . . . . . 329 LEU CB . 50873 1
397 . 1 . 1 46 46 LEU CD1 C 13 25.650 0.000 . 2 . . . . . 329 LEU CD1 . 50873 1
398 . 1 . 1 46 46 LEU CD2 C 13 25.058 0.000 . 2 . . . . . 329 LEU CD2 . 50873 1
399 . 1 . 1 46 46 LEU N N 15 121.282 0.061 . 1 . . . . . 329 LEU N . 50873 1
400 . 1 . 1 47 47 LYS H H 1 8.170 0.005 . 1 . . . . . 330 LYS H . 50873 1
401 . 1 . 1 47 47 LYS HB2 H 1 2.132 0.000 . 1 . . . . . 330 LYS HB2 . 50873 1
402 . 1 . 1 47 47 LYS C C 13 178.820 0.000 . 1 . . . . . 330 LYS C . 50873 1
403 . 1 . 1 47 47 LYS CA C 13 59.820 0.086 . 1 . . . . . 330 LYS CA . 50873 1
404 . 1 . 1 47 47 LYS CB C 13 32.447 0.000 . 1 . . . . . 330 LYS CB . 50873 1
405 . 1 . 1 47 47 LYS N N 15 118.828 0.046 . 1 . . . . . 330 LYS N . 50873 1
406 . 1 . 1 48 48 ALA H H 1 7.919 0.015 . 1 . . . . . 331 ALA H . 50873 1
407 . 1 . 1 48 48 ALA HA H 1 4.232 0.037 . 1 . . . . . 331 ALA HA . 50873 1
408 . 1 . 1 48 48 ALA HB1 H 1 1.556 0.043 . 1 . . . . . 331 ALA HB1 . 50873 1
409 . 1 . 1 48 48 ALA HB2 H 1 1.556 0.043 . 1 . . . . . 331 ALA HB2 . 50873 1
410 . 1 . 1 48 48 ALA HB3 H 1 1.556 0.043 . 1 . . . . . 331 ALA HB3 . 50873 1
411 . 1 . 1 48 48 ALA C C 13 180.757 0.000 . 1 . . . . . 331 ALA C . 50873 1
412 . 1 . 1 48 48 ALA CA C 13 54.898 0.035 . 1 . . . . . 331 ALA CA . 50873 1
413 . 1 . 1 48 48 ALA CB C 13 18.063 0.056 . 1 . . . . . 331 ALA CB . 50873 1
414 . 1 . 1 48 48 ALA N N 15 120.363 0.111 . 1 . . . . . 331 ALA N . 50873 1
415 . 1 . 1 49 49 LEU H H 1 8.126 0.020 . 1 . . . . . 332 LEU H . 50873 1
416 . 1 . 1 49 49 LEU HA H 1 4.126 0.071 . 1 . . . . . 332 LEU HA . 50873 1
417 . 1 . 1 49 49 LEU HB2 H 1 1.908 0.000 . 2 . . . . . 332 LEU HB2 . 50873 1
418 . 1 . 1 49 49 LEU HB3 H 1 1.778 0.038 . 2 . . . . . 332 LEU HB3 . 50873 1
419 . 1 . 1 49 49 LEU HD11 H 1 0.972 0.000 . 2 . . . . . 332 LEU HD11 . 50873 1
420 . 1 . 1 49 49 LEU HD12 H 1 0.972 0.000 . 2 . . . . . 332 LEU HD12 . 50873 1
421 . 1 . 1 49 49 LEU HD13 H 1 0.972 0.000 . 2 . . . . . 332 LEU HD13 . 50873 1
422 . 1 . 1 49 49 LEU HD21 H 1 1.022 0.000 . 2 . . . . . 332 LEU HD21 . 50873 1
423 . 1 . 1 49 49 LEU HD22 H 1 1.022 0.000 . 2 . . . . . 332 LEU HD22 . 50873 1
424 . 1 . 1 49 49 LEU HD23 H 1 1.022 0.000 . 2 . . . . . 332 LEU HD23 . 50873 1
425 . 1 . 1 49 49 LEU C C 13 178.694 0.000 . 1 . . . . . 332 LEU C . 50873 1
426 . 1 . 1 49 49 LEU CA C 13 57.658 0.045 . 1 . . . . . 332 LEU CA . 50873 1
427 . 1 . 1 49 49 LEU CB C 13 42.330 0.050 . 1 . . . . . 332 LEU CB . 50873 1
428 . 1 . 1 49 49 LEU CD1 C 13 25.096 0.000 . 2 . . . . . 332 LEU CD1 . 50873 1
429 . 1 . 1 49 49 LEU CD2 C 13 25.514 0.000 . 2 . . . . . 332 LEU CD2 . 50873 1
430 . 1 . 1 49 49 LEU N N 15 120.212 0.069 . 1 . . . . . 332 LEU N . 50873 1
431 . 1 . 1 50 50 LYS H H 1 8.414 0.019 . 1 . . . . . 333 LYS H . 50873 1
432 . 1 . 1 50 50 LYS C C 13 179.822 0.054 . 1 . . . . . 333 LYS C . 50873 1
433 . 1 . 1 50 50 LYS CA C 13 60.320 0.000 . 1 . . . . . 333 LYS CA . 50873 1
434 . 1 . 1 50 50 LYS CB C 13 32.211 0.000 . 1 . . . . . 333 LYS CB . 50873 1
435 . 1 . 1 50 50 LYS N N 15 118.633 0.022 . 1 . . . . . 333 LYS N . 50873 1
436 . 1 . 1 51 51 ASP H H 1 8.082 0.019 . 1 . . . . . 334 ASP H . 50873 1
437 . 1 . 1 51 51 ASP HA H 1 4.398 0.000 . 1 . . . . . 334 ASP HA . 50873 1
438 . 1 . 1 51 51 ASP HB2 H 1 2.711 0.000 . 2 . . . . . 334 ASP HB2 . 50873 1
439 . 1 . 1 51 51 ASP HB3 H 1 2.631 0.000 . 2 . . . . . 334 ASP HB3 . 50873 1
440 . 1 . 1 51 51 ASP C C 13 178.461 0.029 . 1 . . . . . 334 ASP C . 50873 1
441 . 1 . 1 51 51 ASP CA C 13 56.960 0.016 . 1 . . . . . 334 ASP CA . 50873 1
442 . 1 . 1 51 51 ASP CB C 13 40.733 0.000 . 1 . . . . . 334 ASP CB . 50873 1
443 . 1 . 1 51 51 ASP N N 15 118.955 0.040 . 1 . . . . . 334 ASP N . 50873 1
444 . 1 . 1 52 52 LEU H H 1 7.764 0.002 . 1 . . . . . 335 LEU H . 50873 1
445 . 1 . 1 52 52 LEU HA H 1 3.987 0.000 . 1 . . . . . 335 LEU HA . 50873 1
446 . 1 . 1 52 52 LEU HB2 H 1 1.412 0.000 . 2 . . . . . 335 LEU HB2 . 50873 1
447 . 1 . 1 52 52 LEU HB3 H 1 1.524 0.000 . 2 . . . . . 335 LEU HB3 . 50873 1
448 . 1 . 1 52 52 LEU HD11 H 1 0.735 0.044 . 2 . . . . . 335 LEU HD11 . 50873 1
449 . 1 . 1 52 52 LEU HD12 H 1 0.735 0.044 . 2 . . . . . 335 LEU HD12 . 50873 1
450 . 1 . 1 52 52 LEU HD13 H 1 0.735 0.044 . 2 . . . . . 335 LEU HD13 . 50873 1
451 . 1 . 1 52 52 LEU HD21 H 1 0.837 0.044 . 2 . . . . . 335 LEU HD21 . 50873 1
452 . 1 . 1 52 52 LEU HD22 H 1 0.837 0.044 . 2 . . . . . 335 LEU HD22 . 50873 1
453 . 1 . 1 52 52 LEU HD23 H 1 0.837 0.044 . 2 . . . . . 335 LEU HD23 . 50873 1
454 . 1 . 1 52 52 LEU C C 13 179.038 0.000 . 1 . . . . . 335 LEU C . 50873 1
455 . 1 . 1 52 52 LEU CA C 13 57.653 0.055 . 1 . . . . . 335 LEU CA . 50873 1
456 . 1 . 1 52 52 LEU CB C 13 42.268 0.000 . 1 . . . . . 335 LEU CB . 50873 1
457 . 1 . 1 52 52 LEU CD1 C 13 24.503 0.010 . 2 . . . . . 335 LEU CD1 . 50873 1
458 . 1 . 1 52 52 LEU CD2 C 13 23.990 0.024 . 2 . . . . . 335 LEU CD2 . 50873 1
459 . 1 . 1 52 52 LEU N N 15 121.415 0.022 . 1 . . . . . 335 LEU N . 50873 1
460 . 1 . 1 53 53 TYR H H 1 7.876 0.018 . 1 . . . . . 336 TYR H . 50873 1
461 . 1 . 1 53 53 TYR HA H 1 4.428 0.000 . 1 . . . . . 336 TYR HA . 50873 1
462 . 1 . 1 53 53 TYR HB2 H 1 2.784 0.000 . 2 . . . . . 336 TYR HB2 . 50873 1
463 . 1 . 1 53 53 TYR HB3 H 1 2.429 0.000 . 2 . . . . . 336 TYR HB3 . 50873 1
464 . 1 . 1 53 53 TYR CA C 13 58.452 0.011 . 1 . . . . . 336 TYR CA . 50873 1
465 . 1 . 1 53 53 TYR CB C 13 38.093 0.000 . 1 . . . . . 336 TYR CB . 50873 1
466 . 1 . 1 53 53 TYR N N 15 116.068 0.029 . 1 . . . . . 336 TYR N . 50873 1
467 . 1 . 1 54 54 SER H H 1 7.801 0.003 . 1 . . . . . 337 SER H . 50873 1
468 . 1 . 1 54 54 SER HA H 1 4.194 0.000 . 1 . . . . . 337 SER HA . 50873 1
469 . 1 . 1 54 54 SER HB2 H 1 3.933 0.000 . 1 . . . . . 337 SER HB2 . 50873 1
470 . 1 . 1 54 54 SER C C 13 174.251 0.000 . 1 . . . . . 337 SER C . 50873 1
471 . 1 . 1 54 54 SER CA C 13 59.218 0.010 . 1 . . . . . 337 SER CA . 50873 1
472 . 1 . 1 54 54 SER CB C 13 63.627 0.000 . 1 . . . . . 337 SER CB . 50873 1
473 . 1 . 1 54 54 SER N N 15 114.751 0.032 . 1 . . . . . 337 SER N . 50873 1
474 . 1 . 1 55 55 HIS H H 1 8.054 0.019 . 1 . . . . . 338 HIS H . 50873 1
475 . 1 . 1 55 55 HIS HA H 1 4.690 0.013 . 1 . . . . . 338 HIS HA . 50873 1
476 . 1 . 1 55 55 HIS HB2 H 1 3.350 0.058 . 2 . . . . . 338 HIS HB2 . 50873 1
477 . 1 . 1 55 55 HIS HB3 H 1 3.209 0.059 . 2 . . . . . 338 HIS HB3 . 50873 1
478 . 1 . 1 55 55 HIS C C 13 173.782 0.000 . 1 . . . . . 338 HIS C . 50873 1
479 . 1 . 1 55 55 HIS CA C 13 55.686 0.010 . 1 . . . . . 338 HIS CA . 50873 1
480 . 1 . 1 55 55 HIS CB C 13 29.443 0.015 . 1 . . . . . 338 HIS CB . 50873 1
481 . 1 . 1 55 55 HIS N N 15 119.762 0.078 . 1 . . . . . 338 HIS N . 50873 1
482 . 1 . 1 56 56 LYS H H 1 7.921 0.023 . 1 . . . . . 339 LYS H . 50873 1
483 . 1 . 1 56 56 LYS C C 13 181.661 0.000 . 1 . . . . . 339 LYS C . 50873 1
484 . 1 . 1 56 56 LYS CA C 13 57.890 0.000 . 1 . . . . . 339 LYS CA . 50873 1
485 . 1 . 1 56 56 LYS N N 15 128.069 0.065 . 1 . . . . . 339 LYS N . 50873 1
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