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 34248
_Assigned_chem_shift_list.ID 1
_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 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.3
_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 HNCA' . . . 34248 1
2 '3D CBCA(CO)NH' . . . 34248 1
3 '3D HBHA(CO)NH' . . . 34248 1
4 '3D HCCH-TOCSY' . . . 34248 1
5 '3D 1H-15N NOESY' . . . 34248 1
6 '3D 1H-13C NOESY aliphatic' . . . 34248 1
7 '3D 1H-13C NOESY aromatic' . . . 34248 1
8 '3D HNCA' . . . 34248 1
9 '3D CBCA(CO)NH' . . . 34248 1
10 '3D C(CO)NH' . . . 34248 1
11 '3D H(CCO)NH' . . . 34248 1
12 '3D 1H-15N NOESY' . . . 34248 1
13 '3D 1H-13C NOESY aliphatic' . . . 34248 1
14 '3D 1H-13C NOESY aromatic' . . . 34248 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.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 GLY HA2 H 1 4.053 0.02 . 1 . . . . A 2 GLY HA2 . 34248 1
2 . 1 1 2 2 GLY HA3 H 1 4.053 0.02 . 1 . . . . A 2 GLY HA3 . 34248 1
3 . 1 1 2 2 GLY CA C 13 45.371 0.3 . 1 . . . . A 2 GLY CA . 34248 1
4 . 1 1 3 3 SER H H 1 8.48 0.02 . 1 . . . . A 3 SER H . 34248 1
5 . 1 1 3 3 SER HA H 1 4.437 0.02 . 1 . . . . A 3 SER HA . 34248 1
6 . 1 1 3 3 SER HB2 H 1 3.849 0.02 . 2 . . . . A 3 SER HB2 . 34248 1
7 . 1 1 3 3 SER HB3 H 1 3.818 0.02 . 2 . . . . A 3 SER HB3 . 34248 1
8 . 1 1 3 3 SER CA C 13 58.465 0.3 . 1 . . . . A 3 SER CA . 34248 1
9 . 1 1 3 3 SER CB C 13 63.784 0.3 . 1 . . . . A 3 SER CB . 34248 1
10 . 1 1 3 3 SER N N 15 116.078 0.3 . 1 . . . . A 3 SER N . 34248 1
11 . 1 1 16 16 VAL H H 1 7.48 0.02 . 1 . . . . A 16 VAL H . 34248 1
12 . 1 1 16 16 VAL HA H 1 4.323 0.02 . 1 . . . . A 16 VAL HA . 34248 1
13 . 1 1 16 16 VAL HB H 1 1.773 0.02 . 1 . . . . A 16 VAL HB . 34248 1
14 . 1 1 16 16 VAL HG11 H 1 0.834 0.02 . 2 . . . . A 16 VAL HG11 . 34248 1
15 . 1 1 16 16 VAL HG12 H 1 0.834 0.02 . 2 . . . . A 16 VAL HG12 . 34248 1
16 . 1 1 16 16 VAL HG13 H 1 0.834 0.02 . 2 . . . . A 16 VAL HG13 . 34248 1
17 . 1 1 16 16 VAL HG21 H 1 0.765 0.02 . 2 . . . . A 16 VAL HG21 . 34248 1
18 . 1 1 16 16 VAL HG22 H 1 0.765 0.02 . 2 . . . . A 16 VAL HG22 . 34248 1
19 . 1 1 16 16 VAL HG23 H 1 0.765 0.02 . 2 . . . . A 16 VAL HG23 . 34248 1
20 . 1 1 16 16 VAL CA C 13 61.411 0.3 . 1 . . . . A 16 VAL CA . 34248 1
21 . 1 1 16 16 VAL CB C 13 33.847 0.3 . 1 . . . . A 16 VAL CB . 34248 1
22 . 1 1 16 16 VAL CG1 C 13 20.981 0.3 . 1 . . . . A 16 VAL CG1 . 34248 1
23 . 1 1 16 16 VAL CG2 C 13 20.778 0.3 . 1 . . . . A 16 VAL CG2 . 34248 1
24 . 1 1 16 16 VAL N N 15 121.886 0.3 . 1 . . . . A 16 VAL N . 34248 1
25 . 2 2 4 4 GLN H H 1 8.52 0.02 . 1 . . . . B 4 GLN H . 34248 1
26 . 2 2 4 4 GLN HA H 1 4.256 0.02 . 1 . . . . B 4 GLN HA . 34248 1
27 . 2 2 4 4 GLN HB2 H 1 2.03 0.02 . 2 . . . . B 4 GLN HB2 . 34248 1
28 . 2 2 4 4 GLN HB3 H 1 1.923 0.02 . 2 . . . . B 4 GLN HB3 . 34248 1
29 . 2 2 4 4 GLN HG2 H 1 2.299 0.02 . 2 . . . . B 4 GLN HG2 . 34248 1
30 . 2 2 4 4 GLN HG3 H 1 2.259 0.02 . 2 . . . . B 4 GLN HG3 . 34248 1
31 . 2 2 4 4 GLN HE21 H 1 7.557 0.02 . 1 . . . . B 4 GLN HE21 . 34248 1
32 . 2 2 4 4 GLN HE22 H 1 6.861 0.02 . 1 . . . . B 4 GLN HE22 . 34248 1
33 . 2 2 4 4 GLN CA C 13 56.114 0.3 . 1 . . . . B 4 GLN CA . 34248 1
34 . 2 2 4 4 GLN CB C 13 29.23 0.3 . 1 . . . . B 4 GLN CB . 34248 1
35 . 2 2 4 4 GLN CG C 13 33.744 0.3 . 1 . . . . B 4 GLN CG . 34248 1
36 . 2 2 4 4 GLN N N 15 122.078 0.3 . 1 . . . . B 4 GLN N . 34248 1
37 . 2 2 4 4 GLN NE2 N 15 112.601 0.3 . 1 . . . . B 4 GLN NE2 . 34248 1
38 . 2 2 5 5 HIS H H 1 8.291 0.02 . 1 . . . . B 5 HIS H . 34248 1
39 . 2 2 5 5 HIS HA H 1 4.602 0.02 . 1 . . . . B 5 HIS HA . 34248 1
40 . 2 2 5 5 HIS HB2 H 1 3.134 0.02 . 2 . . . . B 5 HIS HB2 . 34248 1
41 . 2 2 5 5 HIS HB3 H 1 3.079 0.02 . 2 . . . . B 5 HIS HB3 . 34248 1
42 . 2 2 5 5 HIS HD2 H 1 7.07 0.02 . 1 . . . . B 5 HIS HD2 . 34248 1
43 . 2 2 5 5 HIS HE1 H 1 8.04 0.02 . 1 . . . . B 5 HIS HE1 . 34248 1
44 . 2 2 5 5 HIS CA C 13 55.937 0.3 . 1 . . . . B 5 HIS CA . 34248 1
45 . 2 2 5 5 HIS CB C 13 30.271 0.3 . 1 . . . . B 5 HIS CB . 34248 1
46 . 2 2 5 5 HIS CD2 C 13 119.61 0.3 . 1 . . . . B 5 HIS CD2 . 34248 1
47 . 2 2 5 5 HIS CE1 C 13 137.816 0.3 . 1 . . . . B 5 HIS CE1 . 34248 1
48 . 2 2 5 5 HIS N N 15 120.104 0.3 . 1 . . . . B 5 HIS N . 34248 1
49 . 2 2 6 6 MET H H 1 8.359 0.02 . 1 . . . . B 6 MET H . 34248 1
50 . 2 2 6 6 MET HA H 1 4.444 0.02 . 1 . . . . B 6 MET HA . 34248 1
51 . 2 2 6 6 MET HB2 H 1 2.055 0.02 . 2 . . . . B 6 MET HB2 . 34248 1
52 . 2 2 6 6 MET HB3 H 1 1.945 0.02 . 2 . . . . B 6 MET HB3 . 34248 1
53 . 2 2 6 6 MET HG2 H 1 2.534 0.02 . 2 . . . . B 6 MET HG2 . 34248 1
54 . 2 2 6 6 MET HG3 H 1 2.448 0.02 . 2 . . . . B 6 MET HG3 . 34248 1
55 . 2 2 6 6 MET HE1 H 1 2.079 0.02 . 1 . . . . B 6 MET HE1 . 34248 1
56 . 2 2 6 6 MET HE2 H 1 2.079 0.02 . 1 . . . . B 6 MET HE2 . 34248 1
57 . 2 2 6 6 MET HE3 H 1 2.079 0.02 . 1 . . . . B 6 MET HE3 . 34248 1
58 . 2 2 6 6 MET CA C 13 55.227 0.3 . 1 . . . . B 6 MET CA . 34248 1
59 . 2 2 6 6 MET CB C 13 32.973 0.3 . 1 . . . . B 6 MET CB . 34248 1
60 . 2 2 6 6 MET CG C 13 31.885 0.3 . 1 . . . . B 6 MET CG . 34248 1
61 . 2 2 6 6 MET CE C 13 16.9 0.3 . 1 . . . . B 6 MET CE . 34248 1
62 . 2 2 6 6 MET N N 15 121.858 0.3 . 1 . . . . B 6 MET N . 34248 1
63 . 2 2 7 7 ARG H H 1 8.606 0.02 . 1 . . . . B 7 ARG H . 34248 1
64 . 2 2 7 7 ARG HA H 1 4.545 0.02 . 1 . . . . B 7 ARG HA . 34248 1
65 . 2 2 7 7 ARG HB2 H 1 1.921 0.02 . 2 . . . . B 7 ARG HB2 . 34248 1
66 . 2 2 7 7 ARG HB3 H 1 1.724 0.02 . 2 . . . . B 7 ARG HB3 . 34248 1
67 . 2 2 7 7 ARG HG2 H 1 1.551 0.02 . 2 . . . . B 7 ARG HG2 . 34248 1
68 . 2 2 7 7 ARG HG3 H 1 1.395 0.02 . 2 . . . . B 7 ARG HG3 . 34248 1
69 . 2 2 7 7 ARG HD2 H 1 2.641 0.02 . 2 . . . . B 7 ARG HD2 . 34248 1
70 . 2 2 7 7 ARG HD3 H 1 2.621 0.02 . 2 . . . . B 7 ARG HD3 . 34248 1
71 . 2 2 7 7 ARG HE H 1 9.273 0.02 . 1 . . . . B 7 ARG HE . 34248 1
72 . 2 2 7 7 ARG HH11 H 1 6.225 0.02 . 1 . . . . B 7 ARG HH11 . 34248 1
73 . 2 2 7 7 ARG HH12 H 1 6.225 0.02 . 1 . . . . B 7 ARG HH12 . 34248 1
74 . 2 2 7 7 ARG CA C 13 55.274 0.3 . 1 . . . . B 7 ARG CA . 34248 1
75 . 2 2 7 7 ARG CB C 13 30.23 0.3 . 1 . . . . B 7 ARG CB . 34248 1
76 . 2 2 7 7 ARG CG C 13 28.041 0.3 . 1 . . . . B 7 ARG CG . 34248 1
77 . 2 2 7 7 ARG CD C 13 43.573 0.3 . 1 . . . . B 7 ARG CD . 34248 1
78 . 2 2 7 7 ARG N N 15 123.476 0.3 . 1 . . . . B 7 ARG N . 34248 1
79 . 2 2 7 7 ARG NE N 15 85.154 0.3 . 1 . . . . B 7 ARG NE . 34248 1
80 . 2 2 7 7 ARG NH1 N 15 70.8 0.3 . 1 . . . . B 7 ARG NH1 . 34248 1
81 . 2 2 8 8 PRO HA H 1 4.586 0.02 . 1 . . . . B 8 PRO HA . 34248 1
82 . 2 2 8 8 PRO HB2 H 1 2.561 0.02 . 2 . . . . B 8 PRO HB2 . 34248 1
83 . 2 2 8 8 PRO HB3 H 1 2.327 0.02 . 2 . . . . B 8 PRO HB3 . 34248 1
84 . 2 2 8 8 PRO HG2 H 1 2.22 0.02 . 2 . . . . B 8 PRO HG2 . 34248 1
85 . 2 2 8 8 PRO HG3 H 1 2.115 0.02 . 2 . . . . B 8 PRO HG3 . 34248 1
86 . 2 2 8 8 PRO HD2 H 1 3.958 0.02 . 2 . . . . B 8 PRO HD2 . 34248 1
87 . 2 2 8 8 PRO HD3 H 1 3.835 0.02 . 2 . . . . B 8 PRO HD3 . 34248 1
88 . 2 2 8 8 PRO CA C 13 63.33 0.3 . 1 . . . . B 8 PRO CA . 34248 1
89 . 2 2 8 8 PRO CB C 13 33.165 0.3 . 1 . . . . B 8 PRO CB . 34248 1
90 . 2 2 8 8 PRO CG C 13 27.783 0.3 . 1 . . . . B 8 PRO CG . 34248 1
91 . 2 2 8 8 PRO CD C 13 50.909 0.3 . 1 . . . . B 8 PRO CD . 34248 1
92 . 2 2 9 9 ARG H H 1 8.302 0.02 . 1 . . . . B 9 ARG H . 34248 1
93 . 2 2 9 9 ARG HA H 1 4.836 0.02 . 1 . . . . B 9 ARG HA . 34248 1
94 . 2 2 9 9 ARG HB2 H 1 1.871 0.02 . 2 . . . . B 9 ARG HB2 . 34248 1
95 . 2 2 9 9 ARG HB3 H 1 1.61 0.02 . 2 . . . . B 9 ARG HB3 . 34248 1
96 . 2 2 9 9 ARG HG2 H 1 1.702 0.02 . 2 . . . . B 9 ARG HG2 . 34248 1
97 . 2 2 9 9 ARG HG3 H 1 1.625 0.02 . 2 . . . . B 9 ARG HG3 . 34248 1
98 . 2 2 9 9 ARG HD2 H 1 3.271 0.02 . 1 . . . . B 9 ARG HD2 . 34248 1
99 . 2 2 9 9 ARG HD3 H 1 3.271 0.02 . 1 . . . . B 9 ARG HD3 . 34248 1
100 . 2 2 9 9 ARG HE H 1 7.718 0.02 . 1 . . . . B 9 ARG HE . 34248 1
101 . 2 2 9 9 ARG CA C 13 52.071 0.3 . 1 . . . . B 9 ARG CA . 34248 1
102 . 2 2 9 9 ARG CB C 13 31.989 0.3 . 1 . . . . B 9 ARG CB . 34248 1
103 . 2 2 9 9 ARG CG C 13 26.317 0.3 . 1 . . . . B 9 ARG CG . 34248 1
104 . 2 2 9 9 ARG CD C 13 41.428 0.3 . 1 . . . . B 9 ARG CD . 34248 1
105 . 2 2 9 9 ARG N N 15 118.123 0.3 . 1 . . . . B 9 ARG N . 34248 1
106 . 2 2 9 9 ARG NE N 15 84.121 0.3 . 1 . . . . B 9 ARG NE . 34248 1
107 . 2 2 10 10 PHE H H 1 8.083 0.02 . 1 . . . . B 10 PHE H . 34248 1
108 . 2 2 10 10 PHE HA H 1 1.33 0.02 . 1 . . . . B 10 PHE HA . 34248 1
109 . 2 2 10 10 PHE HB2 H 1 2.214 0.02 . 2 . . . . B 10 PHE HB2 . 34248 1
110 . 2 2 10 10 PHE HB3 H 1 1.679 0.02 . 2 . . . . B 10 PHE HB3 . 34248 1
111 . 2 2 10 10 PHE HD1 H 1 6.755 0.02 . 1 . . . . B 10 PHE HD1 . 34248 1
112 . 2 2 10 10 PHE HD2 H 1 6.755 0.02 . 1 . . . . B 10 PHE HD2 . 34248 1
113 . 2 2 10 10 PHE HE1 H 1 7.052 0.02 . 1 . . . . B 10 PHE HE1 . 34248 1
114 . 2 2 10 10 PHE HE2 H 1 7.052 0.02 . 1 . . . . B 10 PHE HE2 . 34248 1
115 . 2 2 10 10 PHE CA C 13 58.025 0.3 . 1 . . . . B 10 PHE CA . 34248 1
116 . 2 2 10 10 PHE CB C 13 38.7 0.3 . 1 . . . . B 10 PHE CB . 34248 1
117 . 2 2 10 10 PHE CD1 C 13 131.921 0.3 . 1 . . . . B 10 PHE CD1 . 34248 1
118 . 2 2 10 10 PHE CD2 C 13 131.921 0.3 . 1 . . . . B 10 PHE CD2 . 34248 1
119 . 2 2 10 10 PHE CE1 C 13 130.6 0.3 . 1 . . . . B 10 PHE CE1 . 34248 1
120 . 2 2 10 10 PHE CE2 C 13 130.6 0.3 . 1 . . . . B 10 PHE CE2 . 34248 1
121 . 2 2 10 10 PHE N N 15 120.188 0.3 . 1 . . . . B 10 PHE N . 34248 1
122 . 2 2 11 11 ASN H H 1 5.565 0.02 . 1 . . . . B 11 ASN H . 34248 1
123 . 2 2 11 11 ASN HA H 1 4.046 0.02 . 1 . . . . B 11 ASN HA . 34248 1
124 . 2 2 11 11 ASN HB2 H 1 2.857 0.02 . 2 . . . . B 11 ASN HB2 . 34248 1
125 . 2 2 11 11 ASN HB3 H 1 2.669 0.02 . 2 . . . . B 11 ASN HB3 . 34248 1
126 . 2 2 11 11 ASN HD21 H 1 7.526 0.02 . 1 . . . . B 11 ASN HD21 . 34248 1
127 . 2 2 11 11 ASN HD22 H 1 7.059 0.02 . 1 . . . . B 11 ASN HD22 . 34248 1
128 . 2 2 11 11 ASN CA C 13 51.582 0.3 . 1 . . . . B 11 ASN CA . 34248 1
129 . 2 2 11 11 ASN CB C 13 40.119 0.3 . 1 . . . . B 11 ASN CB . 34248 1
130 . 2 2 11 11 ASN N N 15 125.581 0.3 . 1 . . . . B 11 ASN N . 34248 1
131 . 2 2 11 11 ASN ND2 N 15 112.605 0.3 . 1 . . . . B 11 ASN ND2 . 34248 1
132 . 2 2 12 12 ARG H H 1 8.456 0.02 . 1 . . . . B 12 ARG H . 34248 1
133 . 2 2 12 12 ARG HA H 1 3.609 0.02 . 1 . . . . B 12 ARG HA . 34248 1
134 . 2 2 12 12 ARG HB2 H 1 1.717 0.02 . 1 . . . . B 12 ARG HB2 . 34248 1
135 . 2 2 12 12 ARG HB3 H 1 1.717 0.02 . 1 . . . . B 12 ARG HB3 . 34248 1
136 . 2 2 12 12 ARG HG2 H 1 1.507 0.02 . 2 . . . . B 12 ARG HG2 . 34248 1
137 . 2 2 12 12 ARG HG3 H 1 1.418 0.02 . 2 . . . . B 12 ARG HG3 . 34248 1
138 . 2 2 12 12 ARG HD2 H 1 3.219 0.02 . 1 . . . . B 12 ARG HD2 . 34248 1
139 . 2 2 12 12 ARG HD3 H 1 3.219 0.02 . 1 . . . . B 12 ARG HD3 . 34248 1
140 . 2 2 12 12 ARG HE H 1 8.136 0.02 . 1 . . . . B 12 ARG HE . 34248 1
141 . 2 2 12 12 ARG CA C 13 58.49 0.3 . 1 . . . . B 12 ARG CA . 34248 1
142 . 2 2 12 12 ARG CB C 13 29.838 0.3 . 1 . . . . B 12 ARG CB . 34248 1
143 . 2 2 12 12 ARG CG C 13 28.302 0.3 . 1 . . . . B 12 ARG CG . 34248 1
144 . 2 2 12 12 ARG CD C 13 43.07 0.3 . 1 . . . . B 12 ARG CD . 34248 1
145 . 2 2 12 12 ARG N N 15 122.797 0.3 . 1 . . . . B 12 ARG N . 34248 1
146 . 2 2 12 12 ARG NE N 15 85.484 0.3 . 1 . . . . B 12 ARG NE . 34248 1
147 . 2 2 13 13 GLU H H 1 8.199 0.02 . 1 . . . . B 13 GLU H . 34248 1
148 . 2 2 13 13 GLU HA H 1 4.162 0.02 . 1 . . . . B 13 GLU HA . 34248 1
149 . 2 2 13 13 GLU HB2 H 1 2.076 0.02 . 2 . . . . B 13 GLU HB2 . 34248 1
150 . 2 2 13 13 GLU HB3 H 1 1.868 0.02 . 2 . . . . B 13 GLU HB3 . 34248 1
151 . 2 2 13 13 GLU HG2 H 1 2.284 0.02 . 2 . . . . B 13 GLU HG2 . 34248 1
152 . 2 2 13 13 GLU HG3 H 1 2.23 0.02 . 2 . . . . B 13 GLU HG3 . 34248 1
153 . 2 2 13 13 GLU CA C 13 57.813 0.3 . 1 . . . . B 13 GLU CA . 34248 1
154 . 2 2 13 13 GLU CB C 13 29.288 0.3 . 1 . . . . B 13 GLU CB . 34248 1
155 . 2 2 13 13 GLU CG C 13 36.719 0.3 . 1 . . . . B 13 GLU CG . 34248 1
156 . 2 2 13 13 GLU N N 15 117.269 0.3 . 1 . . . . B 13 GLU N . 34248 1
157 . 2 2 14 14 ASN H H 1 7.784 0.02 . 1 . . . . B 14 ASN H . 34248 1
158 . 2 2 14 14 ASN HA H 1 5.066 0.02 . 1 . . . . B 14 ASN HA . 34248 1
159 . 2 2 14 14 ASN HB2 H 1 3.103 0.02 . 2 . . . . B 14 ASN HB2 . 34248 1
160 . 2 2 14 14 ASN HB3 H 1 2.738 0.02 . 2 . . . . B 14 ASN HB3 . 34248 1
161 . 2 2 14 14 ASN HD21 H 1 7.516 0.02 . 1 . . . . B 14 ASN HD21 . 34248 1
162 . 2 2 14 14 ASN HD22 H 1 6.828 0.02 . 1 . . . . B 14 ASN HD22 . 34248 1
163 . 2 2 14 14 ASN CA C 13 51.88 0.3 . 1 . . . . B 14 ASN CA . 34248 1
164 . 2 2 14 14 ASN CB C 13 39.329 0.3 . 1 . . . . B 14 ASN CB . 34248 1
165 . 2 2 14 14 ASN N N 15 117.164 0.3 . 1 . . . . B 14 ASN N . 34248 1
166 . 2 2 14 14 ASN ND2 N 15 110.635 0.3 . 1 . . . . B 14 ASN ND2 . 34248 1
167 . 2 2 15 15 LYS H H 1 7.38 0.02 . 1 . . . . B 15 LYS H . 34248 1
168 . 2 2 15 15 LYS HA H 1 4.457 0.02 . 1 . . . . B 15 LYS HA . 34248 1
169 . 2 2 15 15 LYS HB2 H 1 1.792 0.02 . 2 . . . . B 15 LYS HB2 . 34248 1
170 . 2 2 15 15 LYS HB3 H 1 1.71 0.02 . 2 . . . . B 15 LYS HB3 . 34248 1
171 . 2 2 15 15 LYS HG2 H 1 1.666 0.02 . 2 . . . . B 15 LYS HG2 . 34248 1
172 . 2 2 15 15 LYS HG3 H 1 1.536 0.02 . 2 . . . . B 15 LYS HG3 . 34248 1
173 . 2 2 15 15 LYS HD2 H 1 1.978 0.02 . 2 . . . . B 15 LYS HD2 . 34248 1
174 . 2 2 15 15 LYS HD3 H 1 1.917 0.02 . 2 . . . . B 15 LYS HD3 . 34248 1
175 . 2 2 15 15 LYS HE2 H 1 3.188 0.02 . 1 . . . . B 15 LYS HE2 . 34248 1
176 . 2 2 15 15 LYS HE3 H 1 3.188 0.02 . 1 . . . . B 15 LYS HE3 . 34248 1
177 . 2 2 15 15 LYS CA C 13 56.305 0.3 . 1 . . . . B 15 LYS CA . 34248 1
178 . 2 2 15 15 LYS CB C 13 34.456 0.3 . 1 . . . . B 15 LYS CB . 34248 1
179 . 2 2 15 15 LYS CG C 13 24.048 0.3 . 1 . . . . B 15 LYS CG . 34248 1
180 . 2 2 15 15 LYS CD C 13 30.508 0.3 . 1 . . . . B 15 LYS CD . 34248 1
181 . 2 2 15 15 LYS CE C 13 41.571 0.3 . 1 . . . . B 15 LYS CE . 34248 1
182 . 2 2 15 15 LYS N N 15 116.437 0.3 . 1 . . . . B 15 LYS N . 34248 1
183 . 2 2 17 17 SER H H 1 9.238 0.02 . 1 . . . . B 17 SER H . 34248 1
184 . 2 2 17 17 SER HA H 1 4.888 0.02 . 1 . . . . B 17 SER HA . 34248 1
185 . 2 2 17 17 SER HB2 H 1 4.059 0.02 . 2 . . . . B 17 SER HB2 . 34248 1
186 . 2 2 17 17 SER HB3 H 1 3.947 0.02 . 2 . . . . B 17 SER HB3 . 34248 1
187 . 2 2 17 17 SER CA C 13 55.544 0.3 . 1 . . . . B 17 SER CA . 34248 1
188 . 2 2 17 17 SER CB C 13 63.448 0.3 . 1 . . . . B 17 SER CB . 34248 1
189 . 2 2 17 17 SER N N 15 125.096 0.3 . 1 . . . . B 17 SER N . 34248 1
190 . 2 2 18 18 PRO HA H 1 3.721 0.02 . 1 . . . . B 18 PRO HA . 34248 1
191 . 2 2 18 18 PRO HB2 H 1 1.335 0.02 . 2 . . . . B 18 PRO HB2 . 34248 1
192 . 2 2 18 18 PRO HB3 H 1 1.177 0.02 . 2 . . . . B 18 PRO HB3 . 34248 1
193 . 2 2 18 18 PRO HG2 H 1 1.521 0.02 . 2 . . . . B 18 PRO HG2 . 34248 1
194 . 2 2 18 18 PRO HG3 H 1 1.436 0.02 . 2 . . . . B 18 PRO HG3 . 34248 1
195 . 2 2 18 18 PRO HD2 H 1 3.979 0.02 . 1 . . . . B 18 PRO HD2 . 34248 1
196 . 2 2 18 18 PRO HD3 H 1 3.979 0.02 . 1 . . . . B 18 PRO HD3 . 34248 1
197 . 2 2 18 18 PRO CA C 13 65.588 0.3 . 1 . . . . B 18 PRO CA . 34248 1
198 . 2 2 18 18 PRO CB C 13 31.737 0.3 . 1 . . . . B 18 PRO CB . 34248 1
199 . 2 2 18 18 PRO CG C 13 27.293 0.3 . 1 . . . . B 18 PRO CG . 34248 1
200 . 2 2 18 18 PRO CD C 13 50.434 0.3 . 1 . . . . B 18 PRO CD . 34248 1
201 . 2 2 19 19 ALA H H 1 8.069 0.02 . 1 . . . . B 19 ALA H . 34248 1
202 . 2 2 19 19 ALA HA H 1 4.165 0.02 . 1 . . . . B 19 ALA HA . 34248 1
203 . 2 2 19 19 ALA HB1 H 1 1.454 0.02 . 1 . . . . B 19 ALA HB1 . 34248 1
204 . 2 2 19 19 ALA HB2 H 1 1.454 0.02 . 1 . . . . B 19 ALA HB2 . 34248 1
205 . 2 2 19 19 ALA HB3 H 1 1.454 0.02 . 1 . . . . B 19 ALA HB3 . 34248 1
206 . 2 2 19 19 ALA CA C 13 54.969 0.3 . 1 . . . . B 19 ALA CA . 34248 1
207 . 2 2 19 19 ALA CB C 13 18.492 0.3 . 1 . . . . B 19 ALA CB . 34248 1
208 . 2 2 19 19 ALA N N 15 116.669 0.3 . 1 . . . . B 19 ALA N . 34248 1
209 . 2 2 20 20 ASP H H 1 7.316 0.02 . 1 . . . . B 20 ASP H . 34248 1
210 . 2 2 20 20 ASP HA H 1 4.384 0.02 . 1 . . . . B 20 ASP HA . 34248 1
211 . 2 2 20 20 ASP HB2 H 1 2.821 0.02 . 2 . . . . B 20 ASP HB2 . 34248 1
212 . 2 2 20 20 ASP HB3 H 1 2.699 0.02 . 2 . . . . B 20 ASP HB3 . 34248 1
213 . 2 2 20 20 ASP CA C 13 56.666 0.3 . 1 . . . . B 20 ASP CA . 34248 1
214 . 2 2 20 20 ASP CB C 13 40.634 0.3 . 1 . . . . B 20 ASP CB . 34248 1
215 . 2 2 20 20 ASP N N 15 118.091 0.3 . 1 . . . . B 20 ASP N . 34248 1
216 . 2 2 21 21 ALA H H 1 8.22 0.02 . 1 . . . . B 21 ALA H . 34248 1
217 . 2 2 21 21 ALA HA H 1 4.037 0.02 . 1 . . . . B 21 ALA HA . 34248 1
218 . 2 2 21 21 ALA HB1 H 1 1.195 0.02 . 1 . . . . B 21 ALA HB1 . 34248 1
219 . 2 2 21 21 ALA HB2 H 1 1.195 0.02 . 1 . . . . B 21 ALA HB2 . 34248 1
220 . 2 2 21 21 ALA HB3 H 1 1.195 0.02 . 1 . . . . B 21 ALA HB3 . 34248 1
221 . 2 2 21 21 ALA CA C 13 54.894 0.3 . 1 . . . . B 21 ALA CA . 34248 1
222 . 2 2 21 21 ALA CB C 13 17.464 0.3 . 1 . . . . B 21 ALA CB . 34248 1
223 . 2 2 21 21 ALA N N 15 123.215 0.3 . 1 . . . . B 21 ALA N . 34248 1
224 . 2 2 22 22 ALA H H 1 8.551 0.02 . 1 . . . . B 22 ALA H . 34248 1
225 . 2 2 22 22 ALA HA H 1 3.595 0.02 . 1 . . . . B 22 ALA HA . 34248 1
226 . 2 2 22 22 ALA HB1 H 1 1.111 0.02 . 1 . . . . B 22 ALA HB1 . 34248 1
227 . 2 2 22 22 ALA HB2 H 1 1.111 0.02 . 1 . . . . B 22 ALA HB2 . 34248 1
228 . 2 2 22 22 ALA HB3 H 1 1.111 0.02 . 1 . . . . B 22 ALA HB3 . 34248 1
229 . 2 2 22 22 ALA CA C 13 55.315 0.3 . 1 . . . . B 22 ALA CA . 34248 1
230 . 2 2 22 22 ALA CB C 13 18.124 0.3 . 1 . . . . B 22 ALA CB . 34248 1
231 . 2 2 22 22 ALA N N 15 119.138 0.3 . 1 . . . . B 22 ALA N . 34248 1
232 . 2 2 23 23 LYS H H 1 7.267 0.02 . 1 . . . . B 23 LYS H . 34248 1
233 . 2 2 23 23 LYS HA H 1 4.006 0.02 . 1 . . . . B 23 LYS HA . 34248 1
234 . 2 2 23 23 LYS HB2 H 1 1.936 0.02 . 1 . . . . B 23 LYS HB2 . 34248 1
235 . 2 2 23 23 LYS HB3 H 1 1.936 0.02 . 1 . . . . B 23 LYS HB3 . 34248 1
236 . 2 2 23 23 LYS HG2 H 1 1.581 0.02 . 2 . . . . B 23 LYS HG2 . 34248 1
237 . 2 2 23 23 LYS HG3 H 1 1.468 0.02 . 2 . . . . B 23 LYS HG3 . 34248 1
238 . 2 2 23 23 LYS HD2 H 1 1.719 0.02 . 1 . . . . B 23 LYS HD2 . 34248 1
239 . 2 2 23 23 LYS HD3 H 1 1.719 0.02 . 1 . . . . B 23 LYS HD3 . 34248 1
240 . 2 2 23 23 LYS HE2 H 1 2.984 0.02 . 1 . . . . B 23 LYS HE2 . 34248 1
241 . 2 2 23 23 LYS HE3 H 1 2.984 0.02 . 1 . . . . B 23 LYS HE3 . 34248 1
242 . 2 2 23 23 LYS CA C 13 58.896 0.3 . 1 . . . . B 23 LYS CA . 34248 1
243 . 2 2 23 23 LYS CB C 13 32.333 0.3 . 1 . . . . B 23 LYS CB . 34248 1
244 . 2 2 23 23 LYS CG C 13 25.027 0.3 . 1 . . . . B 23 LYS CG . 34248 1
245 . 2 2 23 23 LYS CD C 13 29.37 0.3 . 1 . . . . B 23 LYS CD . 34248 1
246 . 2 2 23 23 LYS CE C 13 42.105 0.3 . 1 . . . . B 23 LYS CE . 34248 1
247 . 2 2 23 23 LYS N N 15 116.516 0.3 . 1 . . . . B 23 LYS N . 34248 1
248 . 2 2 24 24 LYS H H 1 7.19 0.02 . 1 . . . . B 24 LYS H . 34248 1
249 . 2 2 24 24 LYS HA H 1 4.125 0.02 . 1 . . . . B 24 LYS HA . 34248 1
250 . 2 2 24 24 LYS HB2 H 1 1.75 0.02 . 1 . . . . B 24 LYS HB2 . 34248 1
251 . 2 2 24 24 LYS HB3 H 1 1.75 0.02 . 1 . . . . B 24 LYS HB3 . 34248 1
252 . 2 2 24 24 LYS HG2 H 1 1.549 0.02 . 2 . . . . B 24 LYS HG2 . 34248 1
253 . 2 2 24 24 LYS HG3 H 1 1.415 0.02 . 2 . . . . B 24 LYS HG3 . 34248 1
254 . 2 2 24 24 LYS HD2 H 1 1.681 0.02 . 2 . . . . B 24 LYS HD2 . 34248 1
255 . 2 2 24 24 LYS HD3 H 1 1.645 0.02 . 2 . . . . B 24 LYS HD3 . 34248 1
256 . 2 2 24 24 LYS HE2 H 1 2.906 0.02 . 1 . . . . B 24 LYS HE2 . 34248 1
257 . 2 2 24 24 LYS HE3 H 1 2.906 0.02 . 1 . . . . B 24 LYS HE3 . 34248 1
258 . 2 2 24 24 LYS CA C 13 57.728 0.3 . 1 . . . . B 24 LYS CA . 34248 1
259 . 2 2 24 24 LYS CB C 13 33.568 0.3 . 1 . . . . B 24 LYS CB . 34248 1
260 . 2 2 24 24 LYS CG C 13 25.538 0.3 . 1 . . . . B 24 LYS CG . 34248 1
261 . 2 2 24 24 LYS CD C 13 29.402 0.3 . 1 . . . . B 24 LYS CD . 34248 1
262 . 2 2 24 24 LYS CE C 13 41.957 0.3 . 1 . . . . B 24 LYS CE . 34248 1
263 . 2 2 24 24 LYS N N 15 116.437 0.3 . 1 . . . . B 24 LYS N . 34248 1
264 . 2 2 25 25 ALA H H 1 7.697 0.02 . 1 . . . . B 25 ALA H . 34248 1
265 . 2 2 25 25 ALA HA H 1 4.021 0.02 . 1 . . . . B 25 ALA HA . 34248 1
266 . 2 2 25 25 ALA HB1 H 1 1.086 0.02 . 1 . . . . B 25 ALA HB1 . 34248 1
267 . 2 2 25 25 ALA HB2 H 1 1.086 0.02 . 1 . . . . B 25 ALA HB2 . 34248 1
268 . 2 2 25 25 ALA HB3 H 1 1.086 0.02 . 1 . . . . B 25 ALA HB3 . 34248 1
269 . 2 2 25 25 ALA CA C 13 53.355 0.3 . 1 . . . . B 25 ALA CA . 34248 1
270 . 2 2 25 25 ALA CB C 13 20.942 0.3 . 1 . . . . B 25 ALA CB . 34248 1
271 . 2 2 25 25 ALA N N 15 119.756 0.3 . 1 . . . . B 25 ALA N . 34248 1
272 . 2 2 26 26 LEU H H 1 7.225 0.02 . 1 . . . . B 26 LEU H . 34248 1
273 . 2 2 26 26 LEU HA H 1 4.019 0.02 . 1 . . . . B 26 LEU HA . 34248 1
274 . 2 2 26 26 LEU HB2 H 1 1.621 0.02 . 2 . . . . B 26 LEU HB2 . 34248 1
275 . 2 2 26 26 LEU HB3 H 1 1.492 0.02 . 2 . . . . B 26 LEU HB3 . 34248 1
276 . 2 2 26 26 LEU HG H 1 1.54 0.02 . 1 . . . . B 26 LEU HG . 34248 1
277 . 2 2 26 26 LEU HD11 H 1 0.763 0.02 . 2 . . . . B 26 LEU HD11 . 34248 1
278 . 2 2 26 26 LEU HD12 H 1 0.763 0.02 . 2 . . . . B 26 LEU HD12 . 34248 1
279 . 2 2 26 26 LEU HD13 H 1 0.763 0.02 . 2 . . . . B 26 LEU HD13 . 34248 1
280 . 2 2 26 26 LEU HD21 H 1 0.707 0.02 . 2 . . . . B 26 LEU HD21 . 34248 1
281 . 2 2 26 26 LEU HD22 H 1 0.707 0.02 . 2 . . . . B 26 LEU HD22 . 34248 1
282 . 2 2 26 26 LEU HD23 H 1 0.707 0.02 . 2 . . . . B 26 LEU HD23 . 34248 1
283 . 2 2 26 26 LEU CA C 13 57.19 0.3 . 1 . . . . B 26 LEU CA . 34248 1
284 . 2 2 26 26 LEU CB C 13 42.768 0.3 . 1 . . . . B 26 LEU CB . 34248 1
285 . 2 2 26 26 LEU CG C 13 27.13 0.3 . 1 . . . . B 26 LEU CG . 34248 1
286 . 2 2 26 26 LEU CD1 C 13 25.667 0.3 . 1 . . . . B 26 LEU CD1 . 34248 1
287 . 2 2 26 26 LEU CD2 C 13 22.89 0.3 . 1 . . . . B 26 LEU CD2 . 34248 1
288 . 2 2 26 26 LEU N N 15 122.944 0.3 . 1 . . . . B 26 LEU N . 34248 1
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