Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11387
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $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 13C-separated NOESY' 1 $sample_1 isotropic 11387 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11387 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
1 $XWINNMR . . 11387 1
2 $NMRPipe . . 11387 1
3 $NMRView . . 11387 1
4 $Kujira . . 11387 1
5 $CYANA . . 11387 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 8 8 THR HA H 1 4.378 0.030 . 1 . . . . 8 THR HA . 11387 1
2 . 1 1 8 8 THR HB H 1 4.293 0.030 . 1 . . . . 8 THR HB . 11387 1
3 . 1 1 8 8 THR HG21 H 1 1.190 0.030 . 1 . . . . 8 THR HG2 . 11387 1
4 . 1 1 8 8 THR HG22 H 1 1.190 0.030 . 1 . . . . 8 THR HG2 . 11387 1
5 . 1 1 8 8 THR HG23 H 1 1.190 0.030 . 1 . . . . 8 THR HG2 . 11387 1
6 . 1 1 8 8 THR CA C 13 61.886 0.300 . 1 . . . . 8 THR CA . 11387 1
7 . 1 1 8 8 THR CB C 13 69.824 0.300 . 1 . . . . 8 THR CB . 11387 1
8 . 1 1 8 8 THR CG2 C 13 21.520 0.300 . 1 . . . . 8 THR CG2 . 11387 1
9 . 1 1 11 11 LYS HA H 1 4.475 0.030 . 1 . . . . 11 LYS HA . 11387 1
10 . 1 1 11 11 LYS HB2 H 1 1.547 0.030 . 2 . . . . 11 LYS HB2 . 11387 1
11 . 1 1 11 11 LYS HB3 H 1 1.401 0.030 . 2 . . . . 11 LYS HB3 . 11387 1
12 . 1 1 11 11 LYS HD2 H 1 1.524 0.030 . 2 . . . . 11 LYS HD2 . 11387 1
13 . 1 1 11 11 LYS HD3 H 1 1.449 0.030 . 2 . . . . 11 LYS HD3 . 11387 1
14 . 1 1 11 11 LYS HE2 H 1 2.945 0.030 . 1 . . . . 11 LYS HE2 . 11387 1
15 . 1 1 11 11 LYS HE3 H 1 2.945 0.030 . 1 . . . . 11 LYS HE3 . 11387 1
16 . 1 1 11 11 LYS HG2 H 1 1.167 0.030 . 2 . . . . 11 LYS HG2 . 11387 1
17 . 1 1 11 11 LYS HG3 H 1 1.321 0.030 . 2 . . . . 11 LYS HG3 . 11387 1
18 . 1 1 11 11 LYS CA C 13 53.839 0.300 . 1 . . . . 11 LYS CA . 11387 1
19 . 1 1 11 11 LYS CB C 13 33.228 0.300 . 1 . . . . 11 LYS CB . 11387 1
20 . 1 1 11 11 LYS CD C 13 29.427 0.300 . 1 . . . . 11 LYS CD . 11387 1
21 . 1 1 11 11 LYS CE C 13 42.303 0.300 . 1 . . . . 11 LYS CE . 11387 1
22 . 1 1 11 11 LYS CG C 13 24.900 0.300 . 1 . . . . 11 LYS CG . 11387 1
23 . 1 1 12 12 PRO HA H 1 4.243 0.030 . 1 . . . . 12 PRO HA . 11387 1
24 . 1 1 12 12 PRO HB2 H 1 1.982 0.030 . 2 . . . . 12 PRO HB2 . 11387 1
25 . 1 1 12 12 PRO HB3 H 1 1.164 0.030 . 2 . . . . 12 PRO HB3 . 11387 1
26 . 1 1 12 12 PRO HD2 H 1 3.583 0.030 . 2 . . . . 12 PRO HD2 . 11387 1
27 . 1 1 12 12 PRO HD3 H 1 3.501 0.030 . 2 . . . . 12 PRO HD3 . 11387 1
28 . 1 1 12 12 PRO HG2 H 1 1.737 0.030 . 2 . . . . 12 PRO HG2 . 11387 1
29 . 1 1 12 12 PRO HG3 H 1 1.356 0.030 . 2 . . . . 12 PRO HG3 . 11387 1
30 . 1 1 12 12 PRO C C 13 176.366 0.300 . 1 . . . . 12 PRO C . 11387 1
31 . 1 1 12 12 PRO CA C 13 63.598 0.300 . 1 . . . . 12 PRO CA . 11387 1
32 . 1 1 12 12 PRO CB C 13 32.252 0.300 . 1 . . . . 12 PRO CB . 11387 1
33 . 1 1 12 12 PRO CD C 13 50.339 0.300 . 1 . . . . 12 PRO CD . 11387 1
34 . 1 1 12 12 PRO CG C 13 26.462 0.300 . 1 . . . . 12 PRO CG . 11387 1
35 . 1 1 13 13 TYR H H 1 7.786 0.030 . 1 . . . . 13 TYR H . 11387 1
36 . 1 1 13 13 TYR HA H 1 4.785 0.030 . 1 . . . . 13 TYR HA . 11387 1
37 . 1 1 13 13 TYR HB2 H 1 2.785 0.030 . 2 . . . . 13 TYR HB2 . 11387 1
38 . 1 1 13 13 TYR HB3 H 1 3.028 0.030 . 2 . . . . 13 TYR HB3 . 11387 1
39 . 1 1 13 13 TYR HD1 H 1 6.962 0.030 . 1 . . . . 13 TYR HD1 . 11387 1
40 . 1 1 13 13 TYR HD2 H 1 6.962 0.030 . 1 . . . . 13 TYR HD2 . 11387 1
41 . 1 1 13 13 TYR HE1 H 1 6.844 0.030 . 1 . . . . 13 TYR HE1 . 11387 1
42 . 1 1 13 13 TYR HE2 H 1 6.844 0.030 . 1 . . . . 13 TYR HE2 . 11387 1
43 . 1 1 13 13 TYR CA C 13 56.662 0.300 . 1 . . . . 13 TYR CA . 11387 1
44 . 1 1 13 13 TYR CB C 13 38.255 0.300 . 1 . . . . 13 TYR CB . 11387 1
45 . 1 1 13 13 TYR CD1 C 13 132.930 0.300 . 1 . . . . 13 TYR CD1 . 11387 1
46 . 1 1 13 13 TYR CD2 C 13 132.930 0.300 . 1 . . . . 13 TYR CD2 . 11387 1
47 . 1 1 13 13 TYR CE1 C 13 118.512 0.300 . 1 . . . . 13 TYR CE1 . 11387 1
48 . 1 1 13 13 TYR CE2 C 13 118.512 0.300 . 1 . . . . 13 TYR CE2 . 11387 1
49 . 1 1 13 13 TYR N N 15 118.248 0.300 . 1 . . . . 13 TYR N . 11387 1
50 . 1 1 14 14 GLN H H 1 8.663 0.030 . 1 . . . . 14 GLN H . 11387 1
51 . 1 1 14 14 GLN HA H 1 5.010 0.030 . 1 . . . . 14 GLN HA . 11387 1
52 . 1 1 14 14 GLN HB2 H 1 1.939 0.030 . 2 . . . . 14 GLN HB2 . 11387 1
53 . 1 1 14 14 GLN HB3 H 1 1.839 0.030 . 2 . . . . 14 GLN HB3 . 11387 1
54 . 1 1 14 14 GLN HE21 H 1 7.541 0.030 . 2 . . . . 14 GLN HE21 . 11387 1
55 . 1 1 14 14 GLN HE22 H 1 6.760 0.030 . 2 . . . . 14 GLN HE22 . 11387 1
56 . 1 1 14 14 GLN HG2 H 1 2.089 0.030 . 1 . . . . 14 GLN HG2 . 11387 1
57 . 1 1 14 14 GLN HG3 H 1 2.089 0.030 . 1 . . . . 14 GLN HG3 . 11387 1
58 . 1 1 14 14 GLN CA C 13 54.580 0.300 . 1 . . . . 14 GLN CA . 11387 1
59 . 1 1 14 14 GLN CB C 13 31.978 0.300 . 1 . . . . 14 GLN CB . 11387 1
60 . 1 1 14 14 GLN CG C 13 34.054 0.300 . 1 . . . . 14 GLN CG . 11387 1
61 . 1 1 14 14 GLN N N 15 123.740 0.300 . 1 . . . . 14 GLN N . 11387 1
62 . 1 1 14 14 GLN NE2 N 15 111.555 0.300 . 1 . . . . 14 GLN NE2 . 11387 1
63 . 1 1 15 15 CYS H H 1 9.246 0.030 . 1 . . . . 15 CYS H . 11387 1
64 . 1 1 15 15 CYS HA H 1 4.524 0.030 . 1 . . . . 15 CYS HA . 11387 1
65 . 1 1 15 15 CYS HB2 H 1 3.439 0.030 . 2 . . . . 15 CYS HB2 . 11387 1
66 . 1 1 15 15 CYS HB3 H 1 2.901 0.030 . 2 . . . . 15 CYS HB3 . 11387 1
67 . 1 1 15 15 CYS CA C 13 59.631 0.300 . 1 . . . . 15 CYS CA . 11387 1
68 . 1 1 15 15 CYS CB C 13 29.708 0.300 . 1 . . . . 15 CYS CB . 11387 1
69 . 1 1 15 15 CYS N N 15 126.562 0.300 . 1 . . . . 15 CYS N . 11387 1
70 . 1 1 16 16 ASN H H 1 9.411 0.030 . 1 . . . . 16 ASN H . 11387 1
71 . 1 1 16 16 ASN HA H 1 4.574 0.030 . 1 . . . . 16 ASN HA . 11387 1
72 . 1 1 16 16 ASN HB2 H 1 2.907 0.030 . 1 . . . . 16 ASN HB2 . 11387 1
73 . 1 1 16 16 ASN HB3 H 1 2.907 0.030 . 1 . . . . 16 ASN HB3 . 11387 1
74 . 1 1 16 16 ASN HD21 H 1 7.679 0.030 . 2 . . . . 16 ASN HD21 . 11387 1
75 . 1 1 16 16 ASN HD22 H 1 6.982 0.030 . 2 . . . . 16 ASN HD22 . 11387 1
76 . 1 1 16 16 ASN CA C 13 55.603 0.300 . 1 . . . . 16 ASN CA . 11387 1
77 . 1 1 16 16 ASN CB C 13 38.436 0.300 . 1 . . . . 16 ASN CB . 11387 1
78 . 1 1 16 16 ASN N N 15 130.233 0.300 . 1 . . . . 16 ASN N . 11387 1
79 . 1 1 16 16 ASN ND2 N 15 113.035 0.300 . 1 . . . . 16 ASN ND2 . 11387 1
80 . 1 1 17 17 GLU H H 1 8.768 0.030 . 1 . . . . 17 GLU H . 11387 1
81 . 1 1 17 17 GLU HA H 1 4.258 0.030 . 1 . . . . 17 GLU HA . 11387 1
82 . 1 1 17 17 GLU HB2 H 1 1.336 0.030 . 1 . . . . 17 GLU HB2 . 11387 1
83 . 1 1 17 17 GLU HB3 H 1 1.336 0.030 . 1 . . . . 17 GLU HB3 . 11387 1
84 . 1 1 17 17 GLU HG2 H 1 1.905 0.030 . 2 . . . . 17 GLU HG2 . 11387 1
85 . 1 1 17 17 GLU HG3 H 1 1.814 0.030 . 2 . . . . 17 GLU HG3 . 11387 1
86 . 1 1 17 17 GLU CA C 13 58.339 0.300 . 1 . . . . 17 GLU CA . 11387 1
87 . 1 1 17 17 GLU CB C 13 29.592 0.300 . 1 . . . . 17 GLU CB . 11387 1
88 . 1 1 17 17 GLU CG C 13 35.714 0.300 . 1 . . . . 17 GLU CG . 11387 1
89 . 1 1 17 17 GLU N N 15 120.843 0.300 . 1 . . . . 17 GLU N . 11387 1
90 . 1 1 18 18 CYS H H 1 7.905 0.030 . 1 . . . . 18 CYS H . 11387 1
91 . 1 1 18 18 CYS HA H 1 5.176 0.030 . 1 . . . . 18 CYS HA . 11387 1
92 . 1 1 18 18 CYS HB2 H 1 3.454 0.030 . 2 . . . . 18 CYS HB2 . 11387 1
93 . 1 1 18 18 CYS HB3 H 1 2.888 0.030 . 2 . . . . 18 CYS HB3 . 11387 1
94 . 1 1 18 18 CYS CA C 13 58.353 0.300 . 1 . . . . 18 CYS CA . 11387 1
95 . 1 1 18 18 CYS CB C 13 32.558 0.300 . 1 . . . . 18 CYS CB . 11387 1
96 . 1 1 18 18 CYS N N 15 114.656 0.300 . 1 . . . . 18 CYS N . 11387 1
97 . 1 1 19 19 GLY H H 1 8.138 0.030 . 1 . . . . 19 GLY H . 11387 1
98 . 1 1 19 19 GLY HA2 H 1 4.265 0.030 . 2 . . . . 19 GLY HA2 . 11387 1
99 . 1 1 19 19 GLY HA3 H 1 3.856 0.030 . 2 . . . . 19 GLY HA3 . 11387 1
100 . 1 1 19 19 GLY CA C 13 46.195 0.300 . 1 . . . . 19 GLY CA . 11387 1
101 . 1 1 19 19 GLY N N 15 113.029 0.300 . 1 . . . . 19 GLY N . 11387 1
102 . 1 1 20 20 LYS H H 1 8.059 0.030 . 1 . . . . 20 LYS H . 11387 1
103 . 1 1 20 20 LYS HA H 1 3.959 0.030 . 1 . . . . 20 LYS HA . 11387 1
104 . 1 1 20 20 LYS HB2 H 1 1.456 0.030 . 2 . . . . 20 LYS HB2 . 11387 1
105 . 1 1 20 20 LYS HB3 H 1 1.239 0.030 . 2 . . . . 20 LYS HB3 . 11387 1
106 . 1 1 20 20 LYS HD2 H 1 1.513 0.030 . 2 . . . . 20 LYS HD2 . 11387 1
107 . 1 1 20 20 LYS HD3 H 1 1.444 0.030 . 2 . . . . 20 LYS HD3 . 11387 1
108 . 1 1 20 20 LYS HE2 H 1 2.993 0.030 . 2 . . . . 20 LYS HE2 . 11387 1
109 . 1 1 20 20 LYS HE3 H 1 2.934 0.030 . 2 . . . . 20 LYS HE3 . 11387 1
110 . 1 1 20 20 LYS HG2 H 1 1.087 0.030 . 2 . . . . 20 LYS HG2 . 11387 1
111 . 1 1 20 20 LYS HG3 H 1 1.429 0.030 . 2 . . . . 20 LYS HG3 . 11387 1
112 . 1 1 20 20 LYS CA C 13 58.359 0.300 . 1 . . . . 20 LYS CA . 11387 1
113 . 1 1 20 20 LYS CB C 13 33.714 0.300 . 1 . . . . 20 LYS CB . 11387 1
114 . 1 1 20 20 LYS CD C 13 29.367 0.300 . 1 . . . . 20 LYS CD . 11387 1
115 . 1 1 20 20 LYS CE C 13 42.283 0.300 . 1 . . . . 20 LYS CE . 11387 1
116 . 1 1 20 20 LYS CG C 13 26.200 0.300 . 1 . . . . 20 LYS CG . 11387 1
117 . 1 1 20 20 LYS N N 15 123.656 0.300 . 1 . . . . 20 LYS N . 11387 1
118 . 1 1 21 21 ALA H H 1 7.877 0.030 . 1 . . . . 21 ALA H . 11387 1
119 . 1 1 21 21 ALA HA H 1 5.114 0.030 . 1 . . . . 21 ALA HA . 11387 1
120 . 1 1 21 21 ALA HB1 H 1 1.238 0.030 . 1 . . . . 21 ALA HB . 11387 1
121 . 1 1 21 21 ALA HB2 H 1 1.238 0.030 . 1 . . . . 21 ALA HB . 11387 1
122 . 1 1 21 21 ALA HB3 H 1 1.238 0.030 . 1 . . . . 21 ALA HB . 11387 1
123 . 1 1 21 21 ALA CA C 13 50.625 0.300 . 1 . . . . 21 ALA CA . 11387 1
124 . 1 1 21 21 ALA CB C 13 22.201 0.300 . 1 . . . . 21 ALA CB . 11387 1
125 . 1 1 21 21 ALA N N 15 124.438 0.300 . 1 . . . . 21 ALA N . 11387 1
126 . 1 1 22 22 PHE H H 1 8.715 0.030 . 1 . . . . 22 PHE H . 11387 1
127 . 1 1 22 22 PHE HA H 1 4.785 0.030 . 1 . . . . 22 PHE HA . 11387 1
128 . 1 1 22 22 PHE HB2 H 1 2.724 0.030 . 2 . . . . 22 PHE HB2 . 11387 1
129 . 1 1 22 22 PHE HB3 H 1 3.336 0.030 . 2 . . . . 22 PHE HB3 . 11387 1
130 . 1 1 22 22 PHE HD1 H 1 7.262 0.030 . 1 . . . . 22 PHE HD1 . 11387 1
131 . 1 1 22 22 PHE HD2 H 1 7.262 0.030 . 1 . . . . 22 PHE HD2 . 11387 1
132 . 1 1 22 22 PHE HE1 H 1 6.891 0.030 . 1 . . . . 22 PHE HE1 . 11387 1
133 . 1 1 22 22 PHE HE2 H 1 6.891 0.030 . 1 . . . . 22 PHE HE2 . 11387 1
134 . 1 1 22 22 PHE HZ H 1 6.358 0.030 . 1 . . . . 22 PHE HZ . 11387 1
135 . 1 1 22 22 PHE CA C 13 56.943 0.300 . 1 . . . . 22 PHE CA . 11387 1
136 . 1 1 22 22 PHE CB C 13 44.599 0.300 . 1 . . . . 22 PHE CB . 11387 1
137 . 1 1 22 22 PHE CD1 C 13 132.464 0.300 . 1 . . . . 22 PHE CD1 . 11387 1
138 . 1 1 22 22 PHE CD2 C 13 132.464 0.300 . 1 . . . . 22 PHE CD2 . 11387 1
139 . 1 1 22 22 PHE CE1 C 13 130.760 0.300 . 1 . . . . 22 PHE CE1 . 11387 1
140 . 1 1 22 22 PHE CE2 C 13 130.760 0.300 . 1 . . . . 22 PHE CE2 . 11387 1
141 . 1 1 22 22 PHE CZ C 13 129.043 0.300 . 1 . . . . 22 PHE CZ . 11387 1
142 . 1 1 22 22 PHE N N 15 116.276 0.300 . 1 . . . . 22 PHE N . 11387 1
143 . 1 1 24 24 GLN HA H 1 4.380 0.030 . 1 . . . . 24 GLN HA . 11387 1
144 . 1 1 24 24 GLN HB2 H 1 2.126 0.030 . 2 . . . . 24 GLN HB2 . 11387 1
145 . 1 1 24 24 GLN HB3 H 1 1.971 0.030 . 2 . . . . 24 GLN HB3 . 11387 1
146 . 1 1 24 24 GLN HE21 H 1 6.979 0.030 . 2 . . . . 24 GLN HE21 . 11387 1
147 . 1 1 24 24 GLN HE22 H 1 7.578 0.030 . 2 . . . . 24 GLN HE22 . 11387 1
148 . 1 1 24 24 GLN HG2 H 1 2.351 0.030 . 1 . . . . 24 GLN HG2 . 11387 1
149 . 1 1 24 24 GLN HG3 H 1 2.351 0.030 . 1 . . . . 24 GLN HG3 . 11387 1
150 . 1 1 24 24 GLN CA C 13 55.765 0.300 . 1 . . . . 24 GLN CA . 11387 1
151 . 1 1 24 24 GLN CB C 13 29.630 0.300 . 1 . . . . 24 GLN CB . 11387 1
152 . 1 1 24 24 GLN CG C 13 33.779 0.300 . 1 . . . . 24 GLN CG . 11387 1
153 . 1 1 24 24 GLN NE2 N 15 112.092 0.300 . 1 . . . . 24 GLN NE2 . 11387 1
154 . 1 1 25 25 THR H H 1 8.391 0.030 . 1 . . . . 25 THR H . 11387 1
155 . 1 1 25 25 THR HA H 1 3.374 0.030 . 1 . . . . 25 THR HA . 11387 1
156 . 1 1 25 25 THR HB H 1 3.899 0.030 . 1 . . . . 25 THR HB . 11387 1
157 . 1 1 25 25 THR HG21 H 1 0.739 0.030 . 1 . . . . 25 THR HG2 . 11387 1
158 . 1 1 25 25 THR HG22 H 1 0.739 0.030 . 1 . . . . 25 THR HG2 . 11387 1
159 . 1 1 25 25 THR HG23 H 1 0.739 0.030 . 1 . . . . 25 THR HG2 . 11387 1
160 . 1 1 25 25 THR CA C 13 65.515 0.300 . 1 . . . . 25 THR CA . 11387 1
161 . 1 1 25 25 THR CB C 13 67.791 0.300 . 1 . . . . 25 THR CB . 11387 1
162 . 1 1 25 25 THR CG2 C 13 21.533 0.300 . 1 . . . . 25 THR CG2 . 11387 1
163 . 1 1 25 25 THR N N 15 121.299 0.300 . 1 . . . . 25 THR N . 11387 1
164 . 1 1 26 26 SER HA H 1 4.159 0.030 . 1 . . . . 26 SER HA . 11387 1
165 . 1 1 26 26 SER HB2 H 1 3.924 0.030 . 2 . . . . 26 SER HB2 . 11387 1
166 . 1 1 26 26 SER HB3 H 1 3.859 0.030 . 2 . . . . 26 SER HB3 . 11387 1
167 . 1 1 26 26 SER CA C 13 60.823 0.300 . 1 . . . . 26 SER CA . 11387 1
168 . 1 1 26 26 SER CB C 13 61.521 0.300 . 1 . . . . 26 SER CB . 11387 1
169 . 1 1 27 27 LYS H H 1 6.682 0.030 . 1 . . . . 27 LYS H . 11387 1
170 . 1 1 27 27 LYS HA H 1 4.033 0.030 . 1 . . . . 27 LYS HA . 11387 1
171 . 1 1 27 27 LYS HB2 H 1 1.995 0.030 . 1 . . . . 27 LYS HB2 . 11387 1
172 . 1 1 27 27 LYS HB3 H 1 1.995 0.030 . 1 . . . . 27 LYS HB3 . 11387 1
173 . 1 1 27 27 LYS HD2 H 1 1.928 0.030 . 2 . . . . 27 LYS HD2 . 11387 1
174 . 1 1 27 27 LYS HD3 H 1 1.851 0.030 . 2 . . . . 27 LYS HD3 . 11387 1
175 . 1 1 27 27 LYS HE2 H 1 3.087 0.030 . 1 . . . . 27 LYS HE2 . 11387 1
176 . 1 1 27 27 LYS HE3 H 1 3.087 0.030 . 1 . . . . 27 LYS HE3 . 11387 1
177 . 1 1 27 27 LYS HG2 H 1 1.640 0.030 . 2 . . . . 27 LYS HG2 . 11387 1
178 . 1 1 27 27 LYS HG3 H 1 1.516 0.030 . 2 . . . . 27 LYS HG3 . 11387 1
179 . 1 1 27 27 LYS CA C 13 58.488 0.300 . 1 . . . . 27 LYS CA . 11387 1
180 . 1 1 27 27 LYS CB C 13 32.789 0.300 . 1 . . . . 27 LYS CB . 11387 1
181 . 1 1 27 27 LYS CD C 13 29.311 0.300 . 1 . . . . 27 LYS CD . 11387 1
182 . 1 1 27 27 LYS CE C 13 42.367 0.300 . 1 . . . . 27 LYS CE . 11387 1
183 . 1 1 27 27 LYS CG C 13 26.145 0.300 . 1 . . . . 27 LYS CG . 11387 1
184 . 1 1 27 27 LYS N N 15 121.902 0.300 . 1 . . . . 27 LYS N . 11387 1
185 . 1 1 28 28 LEU H H 1 7.035 0.030 . 1 . . . . 28 LEU H . 11387 1
186 . 1 1 28 28 LEU HA H 1 3.167 0.030 . 1 . . . . 28 LEU HA . 11387 1
187 . 1 1 28 28 LEU HB2 H 1 1.197 0.030 . 2 . . . . 28 LEU HB2 . 11387 1
188 . 1 1 28 28 LEU HB3 H 1 1.862 0.030 . 2 . . . . 28 LEU HB3 . 11387 1
189 . 1 1 28 28 LEU HD11 H 1 0.917 0.030 . 1 . . . . 28 LEU HD1 . 11387 1
190 . 1 1 28 28 LEU HD12 H 1 0.917 0.030 . 1 . . . . 28 LEU HD1 . 11387 1
191 . 1 1 28 28 LEU HD13 H 1 0.917 0.030 . 1 . . . . 28 LEU HD1 . 11387 1
192 . 1 1 28 28 LEU HD21 H 1 0.985 0.030 . 1 . . . . 28 LEU HD2 . 11387 1
193 . 1 1 28 28 LEU HD22 H 1 0.985 0.030 . 1 . . . . 28 LEU HD2 . 11387 1
194 . 1 1 28 28 LEU HD23 H 1 0.985 0.030 . 1 . . . . 28 LEU HD2 . 11387 1
195 . 1 1 28 28 LEU HG H 1 1.493 0.030 . 1 . . . . 28 LEU HG . 11387 1
196 . 1 1 28 28 LEU CA C 13 57.797 0.300 . 1 . . . . 28 LEU CA . 11387 1
197 . 1 1 28 28 LEU CB C 13 40.520 0.300 . 1 . . . . 28 LEU CB . 11387 1
198 . 1 1 28 28 LEU CD1 C 13 26.395 0.300 . 2 . . . . 28 LEU CD1 . 11387 1
199 . 1 1 28 28 LEU CD2 C 13 22.839 0.300 . 2 . . . . 28 LEU CD2 . 11387 1
200 . 1 1 28 28 LEU CG C 13 27.351 0.300 . 1 . . . . 28 LEU CG . 11387 1
201 . 1 1 28 28 LEU N N 15 122.062 0.300 . 1 . . . . 28 LEU N . 11387 1
202 . 1 1 29 29 ALA H H 1 8.139 0.030 . 1 . . . . 29 ALA H . 11387 1
203 . 1 1 29 29 ALA HA H 1 4.165 0.030 . 1 . . . . 29 ALA HA . 11387 1
204 . 1 1 29 29 ALA HB1 H 1 1.407 0.030 . 1 . . . . 29 ALA HB . 11387 1
205 . 1 1 29 29 ALA HB2 H 1 1.407 0.030 . 1 . . . . 29 ALA HB . 11387 1
206 . 1 1 29 29 ALA HB3 H 1 1.407 0.030 . 1 . . . . 29 ALA HB . 11387 1
207 . 1 1 29 29 ALA CA C 13 55.067 0.300 . 1 . . . . 29 ALA CA . 11387 1
208 . 1 1 29 29 ALA CB C 13 17.742 0.300 . 1 . . . . 29 ALA CB . 11387 1
209 . 1 1 29 29 ALA N N 15 120.882 0.300 . 1 . . . . 29 ALA N . 11387 1
210 . 1 1 30 30 ARG H H 1 7.439 0.030 . 1 . . . . 30 ARG H . 11387 1
211 . 1 1 30 30 ARG HA H 1 3.981 0.030 . 1 . . . . 30 ARG HA . 11387 1
212 . 1 1 30 30 ARG HB2 H 1 1.850 0.030 . 1 . . . . 30 ARG HB2 . 11387 1
213 . 1 1 30 30 ARG HB3 H 1 1.850 0.030 . 1 . . . . 30 ARG HB3 . 11387 1
214 . 1 1 30 30 ARG HD2 H 1 3.209 0.030 . 1 . . . . 30 ARG HD2 . 11387 1
215 . 1 1 30 30 ARG HD3 H 1 3.209 0.030 . 1 . . . . 30 ARG HD3 . 11387 1
216 . 1 1 30 30 ARG HG2 H 1 1.655 0.030 . 2 . . . . 30 ARG HG2 . 11387 1
217 . 1 1 30 30 ARG HG3 H 1 1.754 0.030 . 2 . . . . 30 ARG HG3 . 11387 1
218 . 1 1 30 30 ARG CA C 13 58.946 0.300 . 1 . . . . 30 ARG CA . 11387 1
219 . 1 1 30 30 ARG CB C 13 30.089 0.300 . 1 . . . . 30 ARG CB . 11387 1
220 . 1 1 30 30 ARG CD C 13 43.414 0.300 . 1 . . . . 30 ARG CD . 11387 1
221 . 1 1 30 30 ARG CG C 13 27.462 0.300 . 1 . . . . 30 ARG CG . 11387 1
222 . 1 1 30 30 ARG N N 15 116.859 0.300 . 1 . . . . 30 ARG N . 11387 1
223 . 1 1 31 31 HIS H H 1 7.589 0.030 . 1 . . . . 31 HIS H . 11387 1
224 . 1 1 31 31 HIS HA H 1 4.259 0.030 . 1 . . . . 31 HIS HA . 11387 1
225 . 1 1 31 31 HIS HB2 H 1 2.950 0.030 . 2 . . . . 31 HIS HB2 . 11387 1
226 . 1 1 31 31 HIS HB3 H 1 3.162 0.030 . 2 . . . . 31 HIS HB3 . 11387 1
227 . 1 1 31 31 HIS HD2 H 1 6.945 0.030 . 1 . . . . 31 HIS HD2 . 11387 1
228 . 1 1 31 31 HIS HE1 H 1 8.038 0.030 . 1 . . . . 31 HIS HE1 . 11387 1
229 . 1 1 31 31 HIS CA C 13 58.928 0.300 . 1 . . . . 31 HIS CA . 11387 1
230 . 1 1 31 31 HIS CB C 13 28.544 0.300 . 1 . . . . 31 HIS CB . 11387 1
231 . 1 1 31 31 HIS CD2 C 13 127.263 0.300 . 1 . . . . 31 HIS CD2 . 11387 1
232 . 1 1 31 31 HIS CE1 C 13 139.839 0.300 . 1 . . . . 31 HIS CE1 . 11387 1
233 . 1 1 31 31 HIS N N 15 119.163 0.300 . 1 . . . . 31 HIS N . 11387 1
234 . 1 1 32 32 GLN H H 1 8.231 0.030 . 1 . . . . 32 GLN H . 11387 1
235 . 1 1 32 32 GLN HA H 1 3.695 0.030 . 1 . . . . 32 GLN HA . 11387 1
236 . 1 1 32 32 GLN HB2 H 1 2.247 0.030 . 1 . . . . 32 GLN HB2 . 11387 1
237 . 1 1 32 32 GLN HB3 H 1 2.247 0.030 . 1 . . . . 32 GLN HB3 . 11387 1
238 . 1 1 32 32 GLN HE21 H 1 7.065 0.030 . 2 . . . . 32 GLN HE21 . 11387 1
239 . 1 1 32 32 GLN HE22 H 1 7.531 0.030 . 2 . . . . 32 GLN HE22 . 11387 1
240 . 1 1 32 32 GLN HG2 H 1 2.797 0.030 . 1 . . . . 32 GLN HG2 . 11387 1
241 . 1 1 32 32 GLN HG3 H 1 2.797 0.030 . 1 . . . . 32 GLN HG3 . 11387 1
242 . 1 1 32 32 GLN CA C 13 59.374 0.300 . 1 . . . . 32 GLN CA . 11387 1
243 . 1 1 32 32 GLN CB C 13 28.288 0.300 . 1 . . . . 32 GLN CB . 11387 1
244 . 1 1 32 32 GLN CG C 13 35.283 0.300 . 1 . . . . 32 GLN CG . 11387 1
245 . 1 1 32 32 GLN N N 15 115.398 0.300 . 1 . . . . 32 GLN N . 11387 1
246 . 1 1 32 32 GLN NE2 N 15 112.567 0.300 . 1 . . . . 32 GLN NE2 . 11387 1
247 . 1 1 33 33 ARG H H 1 7.125 0.030 . 1 . . . . 33 ARG H . 11387 1
248 . 1 1 33 33 ARG HA H 1 4.159 0.030 . 1 . . . . 33 ARG HA . 11387 1
249 . 1 1 33 33 ARG HB2 H 1 1.897 0.030 . 2 . . . . 33 ARG HB2 . 11387 1
250 . 1 1 33 33 ARG HB3 H 1 1.818 0.030 . 2 . . . . 33 ARG HB3 . 11387 1
251 . 1 1 33 33 ARG HD2 H 1 3.206 0.030 . 1 . . . . 33 ARG HD2 . 11387 1
252 . 1 1 33 33 ARG HD3 H 1 3.206 0.030 . 1 . . . . 33 ARG HD3 . 11387 1
253 . 1 1 33 33 ARG HG2 H 1 1.705 0.030 . 2 . . . . 33 ARG HG2 . 11387 1
254 . 1 1 33 33 ARG HG3 H 1 1.809 0.030 . 2 . . . . 33 ARG HG3 . 11387 1
255 . 1 1 33 33 ARG CA C 13 58.290 0.300 . 1 . . . . 33 ARG CA . 11387 1
256 . 1 1 33 33 ARG CB C 13 29.964 0.300 . 1 . . . . 33 ARG CB . 11387 1
257 . 1 1 33 33 ARG CD C 13 43.436 0.300 . 1 . . . . 33 ARG CD . 11387 1
258 . 1 1 33 33 ARG CG C 13 27.343 0.300 . 1 . . . . 33 ARG CG . 11387 1
259 . 1 1 33 33 ARG N N 15 117.093 0.300 . 1 . . . . 33 ARG N . 11387 1
260 . 1 1 34 34 VAL H H 1 7.894 0.030 . 1 . . . . 34 VAL H . 11387 1
261 . 1 1 34 34 VAL HA H 1 3.922 0.030 . 1 . . . . 34 VAL HA . 11387 1
262 . 1 1 34 34 VAL HB H 1 1.918 0.030 . 1 . . . . 34 VAL HB . 11387 1
263 . 1 1 34 34 VAL HG11 H 1 0.658 0.030 . 1 . . . . 34 VAL HG1 . 11387 1
264 . 1 1 34 34 VAL HG12 H 1 0.658 0.030 . 1 . . . . 34 VAL HG1 . 11387 1
265 . 1 1 34 34 VAL HG13 H 1 0.658 0.030 . 1 . . . . 34 VAL HG1 . 11387 1
266 . 1 1 34 34 VAL HG21 H 1 0.530 0.030 . 1 . . . . 34 VAL HG2 . 11387 1
267 . 1 1 34 34 VAL HG22 H 1 0.530 0.030 . 1 . . . . 34 VAL HG2 . 11387 1
268 . 1 1 34 34 VAL HG23 H 1 0.530 0.030 . 1 . . . . 34 VAL HG2 . 11387 1
269 . 1 1 34 34 VAL CA C 13 64.035 0.300 . 1 . . . . 34 VAL CA . 11387 1
270 . 1 1 34 34 VAL CB C 13 31.158 0.300 . 1 . . . . 34 VAL CB . 11387 1
271 . 1 1 34 34 VAL CG1 C 13 19.964 0.300 . 2 . . . . 34 VAL CG1 . 11387 1
272 . 1 1 34 34 VAL CG2 C 13 19.781 0.300 . 2 . . . . 34 VAL CG2 . 11387 1
273 . 1 1 34 34 VAL N N 15 116.359 0.300 . 1 . . . . 34 VAL N . 11387 1
274 . 1 1 35 35 HIS H H 1 7.220 0.030 . 1 . . . . 35 HIS H . 11387 1
275 . 1 1 35 35 HIS HA H 1 4.869 0.030 . 1 . . . . 35 HIS HA . 11387 1
276 . 1 1 35 35 HIS HB2 H 1 3.373 0.030 . 2 . . . . 35 HIS HB2 . 11387 1
277 . 1 1 35 35 HIS HB3 H 1 3.219 0.030 . 2 . . . . 35 HIS HB3 . 11387 1
278 . 1 1 35 35 HIS HD2 H 1 6.740 0.030 . 1 . . . . 35 HIS HD2 . 11387 1
279 . 1 1 35 35 HIS HE1 H 1 8.049 0.030 . 1 . . . . 35 HIS HE1 . 11387 1
280 . 1 1 35 35 HIS CA C 13 55.320 0.300 . 1 . . . . 35 HIS CA . 11387 1
281 . 1 1 35 35 HIS CB C 13 28.661 0.300 . 1 . . . . 35 HIS CB . 11387 1
282 . 1 1 35 35 HIS CD2 C 13 127.635 0.300 . 1 . . . . 35 HIS CD2 . 11387 1
283 . 1 1 35 35 HIS CE1 C 13 139.980 0.300 . 1 . . . . 35 HIS CE1 . 11387 1
284 . 1 1 35 35 HIS N N 15 117.068 0.300 . 1 . . . . 35 HIS N . 11387 1
285 . 1 1 36 36 THR H H 1 7.782 0.030 . 1 . . . . 36 THR H . 11387 1
286 . 1 1 36 36 THR HA H 1 4.375 0.030 . 1 . . . . 36 THR HA . 11387 1
287 . 1 1 36 36 THR HB H 1 4.338 0.030 . 1 . . . . 36 THR HB . 11387 1
288 . 1 1 36 36 THR HG21 H 1 1.253 0.030 . 1 . . . . 36 THR HG2 . 11387 1
289 . 1 1 36 36 THR HG22 H 1 1.253 0.030 . 1 . . . . 36 THR HG2 . 11387 1
290 . 1 1 36 36 THR HG23 H 1 1.253 0.030 . 1 . . . . 36 THR HG2 . 11387 1
291 . 1 1 36 36 THR CA C 13 62.547 0.300 . 1 . . . . 36 THR CA . 11387 1
292 . 1 1 36 36 THR CB C 13 69.881 0.300 . 1 . . . . 36 THR CB . 11387 1
293 . 1 1 36 36 THR CG2 C 13 21.586 0.300 . 1 . . . . 36 THR CG2 . 11387 1
294 . 1 1 36 36 THR N N 15 111.630 0.300 . 1 . . . . 36 THR N . 11387 1
295 . 1 1 37 37 GLY H H 1 8.233 0.030 . 1 . . . . 37 GLY H . 11387 1
296 . 1 1 37 37 GLY HA2 H 1 4.048 0.030 . 2 . . . . 37 GLY HA2 . 11387 1
297 . 1 1 37 37 GLY HA3 H 1 3.966 0.030 . 2 . . . . 37 GLY HA3 . 11387 1
298 . 1 1 37 37 GLY CA C 13 45.408 0.300 . 1 . . . . 37 GLY CA . 11387 1
299 . 1 1 37 37 GLY N N 15 110.548 0.300 . 1 . . . . 37 GLY N . 11387 1
300 . 1 1 38 38 GLU H H 1 8.096 0.030 . 1 . . . . 38 GLU H . 11387 1
301 . 1 1 38 38 GLU HA H 1 4.264 0.030 . 1 . . . . 38 GLU HA . 11387 1
302 . 1 1 38 38 GLU HB2 H 1 1.923 0.030 . 2 . . . . 38 GLU HB2 . 11387 1
303 . 1 1 38 38 GLU HB3 H 1 2.008 0.030 . 2 . . . . 38 GLU HB3 . 11387 1
304 . 1 1 38 38 GLU HG2 H 1 2.227 0.030 . 2 . . . . 38 GLU HG2 . 11387 1
305 . 1 1 38 38 GLU HG3 H 1 2.301 0.030 . 2 . . . . 38 GLU HG3 . 11387 1
306 . 1 1 38 38 GLU CA C 13 56.491 0.300 . 1 . . . . 38 GLU CA . 11387 1
307 . 1 1 38 38 GLU CB C 13 30.550 0.300 . 1 . . . . 38 GLU CB . 11387 1
308 . 1 1 38 38 GLU CG C 13 36.236 0.300 . 1 . . . . 38 GLU CG . 11387 1
309 . 1 1 38 38 GLU N N 15 120.562 0.300 . 1 . . . . 38 GLU N . 11387 1
310 . 1 1 39 39 LYS H H 1 8.402 0.030 . 1 . . . . 39 LYS H . 11387 1
311 . 1 1 39 39 LYS HA H 1 4.621 0.030 . 1 . . . . 39 LYS HA . 11387 1
312 . 1 1 39 39 LYS HB2 H 1 1.832 0.030 . 2 . . . . 39 LYS HB2 . 11387 1
313 . 1 1 39 39 LYS HB3 H 1 1.743 0.030 . 2 . . . . 39 LYS HB3 . 11387 1
314 . 1 1 39 39 LYS HD2 H 1 1.699 0.030 . 1 . . . . 39 LYS HD2 . 11387 1
315 . 1 1 39 39 LYS HD3 H 1 1.699 0.030 . 1 . . . . 39 LYS HD3 . 11387 1
316 . 1 1 39 39 LYS HE2 H 1 3.020 0.030 . 1 . . . . 39 LYS HE2 . 11387 1
317 . 1 1 39 39 LYS HE3 H 1 3.020 0.030 . 1 . . . . 39 LYS HE3 . 11387 1
318 . 1 1 39 39 LYS HG2 H 1 1.484 0.030 . 1 . . . . 39 LYS HG2 . 11387 1
319 . 1 1 39 39 LYS HG3 H 1 1.484 0.030 . 1 . . . . 39 LYS HG3 . 11387 1
320 . 1 1 39 39 LYS CA C 13 54.089 0.300 . 1 . . . . 39 LYS CA . 11387 1
321 . 1 1 39 39 LYS CB C 13 32.520 0.300 . 1 . . . . 39 LYS CB . 11387 1
322 . 1 1 39 39 LYS CD C 13 29.200 0.300 . 1 . . . . 39 LYS CD . 11387 1
323 . 1 1 39 39 LYS CE C 13 42.202 0.300 . 1 . . . . 39 LYS CE . 11387 1
324 . 1 1 39 39 LYS CG C 13 24.478 0.300 . 1 . . . . 39 LYS CG . 11387 1
325 . 1 1 39 39 LYS N N 15 123.781 0.300 . 1 . . . . 39 LYS N . 11387 1
326 . 1 1 40 40 PRO HA H 1 4.479 0.030 . 1 . . . . 40 PRO HA . 11387 1
327 . 1 1 40 40 PRO HB2 H 1 2.316 0.030 . 2 . . . . 40 PRO HB2 . 11387 1
328 . 1 1 40 40 PRO HB3 H 1 1.969 0.030 . 2 . . . . 40 PRO HB3 . 11387 1
329 . 1 1 40 40 PRO HD2 H 1 3.831 0.030 . 2 . . . . 40 PRO HD2 . 11387 1
330 . 1 1 40 40 PRO HD3 H 1 3.659 0.030 . 2 . . . . 40 PRO HD3 . 11387 1
331 . 1 1 40 40 PRO HG2 H 1 2.032 0.030 . 1 . . . . 40 PRO HG2 . 11387 1
332 . 1 1 40 40 PRO HG3 H 1 2.032 0.030 . 1 . . . . 40 PRO HG3 . 11387 1
333 . 1 1 40 40 PRO CA C 13 63.325 0.300 . 1 . . . . 40 PRO CA . 11387 1
334 . 1 1 40 40 PRO CB C 13 32.198 0.300 . 1 . . . . 40 PRO CB . 11387 1
335 . 1 1 40 40 PRO CD C 13 50.703 0.300 . 1 . . . . 40 PRO CD . 11387 1
336 . 1 1 40 40 PRO CG C 13 27.214 0.300 . 1 . . . . 40 PRO CG . 11387 1
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