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 51013
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Human Amylin HNa-PEGylated'
_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-1H TOCSY' . . . 51013 1
2 '2D 1H-13C HSQC' . . . 51013 1
3 '2D 1H-1H NOESY' . . . 51013 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 $software_1 . . 51013 1
2 $software_2 . . 51013 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 1 1 LYS H H 1 7.403 0.020 . 1 . . . . . 1 LYS H . 51013 1
2 . 1 . 1 1 1 LYS HA H 1 4.073 0.020 . 1 . . . . . 1 LYS HA . 51013 1
3 . 1 . 1 1 1 LYS HB2 H 1 1.705 0.020 . 1 . . . . . 1 LYS HB2 . 51013 1
4 . 1 . 1 1 1 LYS HB3 H 1 1.705 0.020 . 1 . . . . . 1 LYS HB3 . 51013 1
5 . 1 . 1 1 1 LYS HG2 H 1 1.419 0.020 . 1 . . . . . 1 LYS HG2 . 51013 1
6 . 1 . 1 1 1 LYS HG3 H 1 1.419 0.020 . 1 . . . . . 1 LYS HG3 . 51013 1
7 . 1 . 1 1 1 LYS HD2 H 1 1.667 0.020 . 1 . . . . . 1 LYS HD2 . 51013 1
8 . 1 . 1 1 1 LYS HD3 H 1 1.667 0.020 . 1 . . . . . 1 LYS HD3 . 51013 1
9 . 1 . 1 1 1 LYS HE2 H 1 2.972 0.020 . 1 . . . . . 1 LYS HE2 . 51013 1
10 . 1 . 1 1 1 LYS HE3 H 1 2.972 0.020 . 1 . . . . . 1 LYS HE3 . 51013 1
11 . 1 . 1 1 1 LYS HZ1 H 1 7.570 0.020 . 1 . . . . . 1 LYS HZ1 . 51013 1
12 . 1 . 1 1 1 LYS HZ2 H 1 7.570 0.020 . 1 . . . . . 1 LYS HZ2 . 51013 1
13 . 1 . 1 1 1 LYS HZ3 H 1 7.570 0.020 . 1 . . . . . 1 LYS HZ3 . 51013 1
14 . 1 . 1 1 1 LYS CD C 13 28.913 0.3 . 1 . . . . . 1 LYS CD . 51013 1
15 . 1 . 1 1 1 LYS CE C 13 41.831 0.3 . 1 . . . . . 1 LYS CE . 51013 1
16 . 1 . 1 2 2 CYS H H 1 8.715 0.020 . 1 . . . . . 2 CYS H . 51013 1
17 . 1 . 1 2 2 CYS HA H 1 4.681 0.020 . 1 . . . . . 2 CYS HA . 51013 1
18 . 1 . 1 2 2 CYS HB2 H 1 3.158 0.020 . 2 . . . . . 2 CYS HB2 . 51013 1
19 . 1 . 1 2 2 CYS HB3 H 1 3.189 0.020 . 2 . . . . . 2 CYS HB3 . 51013 1
20 . 1 . 1 2 2 CYS CB C 13 41.045 0.3 . 1 . . . . . 2 CYS CB . 51013 1
21 . 1 . 1 3 3 ASN H H 1 8.907 0.020 . 1 . . . . . 3 ASN H . 51013 1
22 . 1 . 1 3 3 ASN HA H 1 4.960 0.020 . 1 . . . . . 3 ASN HA . 51013 1
23 . 1 . 1 3 3 ASN HB2 H 1 2.858 0.020 . 1 . . . . . 3 ASN HB2 . 51013 1
24 . 1 . 1 3 3 ASN HB3 H 1 2.858 0.020 . 1 . . . . . 3 ASN HB3 . 51013 1
25 . 1 . 1 3 3 ASN HD21 H 1 7.627 0.020 . 1 . . . . . 3 ASN HD21 . 51013 1
26 . 1 . 1 3 3 ASN HD22 H 1 6.947 0.020 . 1 . . . . . 3 ASN HD22 . 51013 1
27 . 1 . 1 3 3 ASN CB C 13 39.007 0.3 . 1 . . . . . 3 ASN CB . 51013 1
28 . 1 . 1 4 4 THR H H 1 7.626 0.020 . 1 . . . . . 4 THR H . 51013 1
29 . 1 . 1 4 4 THR HA H 1 4.509 0.020 . 1 . . . . . 4 THR HA . 51013 1
30 . 1 . 1 4 4 THR HB H 1 4.551 0.020 . 1 . . . . . 4 THR HB . 51013 1
31 . 1 . 1 4 4 THR HG21 H 1 1.274 0.020 . 1 . . . . . 4 THR HG21 . 51013 1
32 . 1 . 1 4 4 THR HG22 H 1 1.274 0.020 . 1 . . . . . 4 THR HG22 . 51013 1
33 . 1 . 1 4 4 THR HG23 H 1 1.274 0.020 . 1 . . . . . 4 THR HG23 . 51013 1
34 . 1 . 1 4 4 THR CA C 13 60.960 0.3 . 1 . . . . . 4 THR CA . 51013 1
35 . 1 . 1 4 4 THR CG2 C 13 21.481 0.3 . 1 . . . . . 4 THR CG2 . 51013 1
36 . 1 . 1 5 5 ALA H H 1 8.765 0.020 . 1 . . . . . 5 ALA H . 51013 1
37 . 1 . 1 5 5 ALA HA H 1 4.218 0.020 . 1 . . . . . 5 ALA HA . 51013 1
38 . 1 . 1 5 5 ALA HB1 H 1 1.478 0.020 . 1 . . . . . 5 ALA HB1 . 51013 1
39 . 1 . 1 5 5 ALA HB2 H 1 1.478 0.020 . 1 . . . . . 5 ALA HB2 . 51013 1
40 . 1 . 1 5 5 ALA HB3 H 1 1.478 0.020 . 1 . . . . . 5 ALA HB3 . 51013 1
41 . 1 . 1 5 5 ALA CB C 13 18.373 0.3 . 1 . . . . . 5 ALA CB . 51013 1
42 . 1 . 1 6 6 THR H H 1 7.989 0.020 . 1 . . . . . 6 THR H . 51013 1
43 . 1 . 1 6 6 THR HA H 1 4.234 0.020 . 1 . . . . . 6 THR HA . 51013 1
44 . 1 . 1 6 6 THR HB H 1 4.211 0.020 . 1 . . . . . 6 THR HB . 51013 1
45 . 1 . 1 6 6 THR HG21 H 1 1.197 0.020 . 1 . . . . . 6 THR HG21 . 51013 1
46 . 1 . 1 6 6 THR HG22 H 1 1.197 0.020 . 1 . . . . . 6 THR HG22 . 51013 1
47 . 1 . 1 6 6 THR HG23 H 1 1.197 0.020 . 1 . . . . . 6 THR HG23 . 51013 1
48 . 1 . 1 6 6 THR CG2 C 13 21.388 0.3 . 1 . . . . . 6 THR CG2 . 51013 1
49 . 1 . 1 7 7 CYS H H 1 8.078 0.020 . 1 . . . . . 7 CYS H . 51013 1
50 . 1 . 1 7 7 CYS HA H 1 4.483 0.020 . 1 . . . . . 7 CYS HA . 51013 1
51 . 1 . 1 7 7 CYS HB2 H 1 3.083 0.020 . 2 . . . . . 7 CYS HB2 . 51013 1
52 . 1 . 1 7 7 CYS HB3 H 1 3.272 0.020 . 2 . . . . . 7 CYS HB3 . 51013 1
53 . 1 . 1 7 7 CYS CA C 13 58.084 0.3 . 1 . . . . . 7 CYS CA . 51013 1
54 . 1 . 1 7 7 CYS CB C 13 40.761 0.3 . 1 . . . . . 7 CYS CB . 51013 1
55 . 1 . 1 8 8 ALA H H 1 8.238 0.020 . 1 . . . . . 8 ALA H . 51013 1
56 . 1 . 1 8 8 ALA HA H 1 4.245 0.020 . 1 . . . . . 8 ALA HA . 51013 1
57 . 1 . 1 8 8 ALA HB1 H 1 1.446 0.020 . 1 . . . . . 8 ALA HB1 . 51013 1
58 . 1 . 1 8 8 ALA HB2 H 1 1.446 0.020 . 1 . . . . . 8 ALA HB2 . 51013 1
59 . 1 . 1 8 8 ALA HB3 H 1 1.446 0.020 . 1 . . . . . 8 ALA HB3 . 51013 1
60 . 1 . 1 8 8 ALA CA C 13 54.004 0.3 . 1 . . . . . 8 ALA CA . 51013 1
61 . 1 . 1 8 8 ALA CB C 13 18.450 0.3 . 1 . . . . . 8 ALA CB . 51013 1
62 . 1 . 1 9 9 THR H H 1 8.159 0.020 . 1 . . . . . 9 THR H . 51013 1
63 . 1 . 1 9 9 THR HA H 1 4.172 0.020 . 1 . . . . . 9 THR HA . 51013 1
64 . 1 . 1 9 9 THR HB H 1 4.225 0.020 . 1 . . . . . 9 THR HB . 51013 1
65 . 1 . 1 9 9 THR HG21 H 1 1.230 0.020 . 1 . . . . . 9 THR HG21 . 51013 1
66 . 1 . 1 9 9 THR HG22 H 1 1.230 0.020 . 1 . . . . . 9 THR HG22 . 51013 1
67 . 1 . 1 9 9 THR HG23 H 1 1.230 0.020 . 1 . . . . . 9 THR HG23 . 51013 1
68 . 1 . 1 9 9 THR CA C 13 63.161 0.3 . 1 . . . . . 9 THR CA . 51013 1
69 . 1 . 1 9 9 THR CB C 13 69.274 0.3 . 1 . . . . . 9 THR CB . 51013 1
70 . 1 . 1 9 9 THR CG2 C 13 21.590 0.3 . 1 . . . . . 9 THR CG2 . 51013 1
71 . 1 . 1 10 10 GLN H H 1 8.224 0.020 . 1 . . . . . 10 GLN H . 51013 1
72 . 1 . 1 10 10 GLN HA H 1 4.226 0.020 . 1 . . . . . 10 GLN HA . 51013 1
73 . 1 . 1 10 10 GLN HB2 H 1 2.000 0.020 . 2 . . . . . 10 GLN HB2 . 51013 1
74 . 1 . 1 10 10 GLN HB3 H 1 2.099 0.020 . 2 . . . . . 10 GLN HB3 . 51013 1
75 . 1 . 1 10 10 GLN HG2 H 1 2.384 0.020 . 2 . . . . . 10 GLN HG2 . 51013 1
76 . 1 . 1 10 10 GLN HG3 H 1 2.387 0.020 . 2 . . . . . 10 GLN HG3 . 51013 1
77 . 1 . 1 10 10 GLN HE21 H 1 7.533 0.020 . 1 . . . . . 10 GLN HE21 . 51013 1
78 . 1 . 1 10 10 GLN HE22 H 1 6.890 0.020 . 1 . . . . . 10 GLN HE22 . 51013 1
79 . 1 . 1 10 10 GLN CG C 13 33.761 0.3 . 1 . . . . . 10 GLN CG . 51013 1
80 . 1 . 1 11 11 ARG H H 1 8.270 0.020 . 1 . . . . . 11 ARG H . 51013 1
81 . 1 . 1 11 11 ARG HA H 1 4.239 0.020 . 1 . . . . . 11 ARG HA . 51013 1
82 . 1 . 1 11 11 ARG HB2 H 1 1.821 0.020 . 1 . . . . . 11 ARG HB2 . 51013 1
83 . 1 . 1 11 11 ARG HB3 H 1 1.821 0.020 . 1 . . . . . 11 ARG HB3 . 51013 1
84 . 1 . 1 11 11 ARG HG2 H 1 1.589 0.020 . 2 . . . . . 11 ARG HG2 . 51013 1
85 . 1 . 1 11 11 ARG HG3 H 1 1.669 0.020 . 2 . . . . . 11 ARG HG3 . 51013 1
86 . 1 . 1 11 11 ARG HD2 H 1 3.174 0.020 . 1 . . . . . 11 ARG HD2 . 51013 1
87 . 1 . 1 11 11 ARG HD3 H 1 3.174 0.020 . 1 . . . . . 11 ARG HD3 . 51013 1
88 . 1 . 1 11 11 ARG HE H 1 7.265 0.020 . 1 . . . . . 11 ARG HE . 51013 1
89 . 1 . 1 11 11 ARG CA C 13 56.528 0.3 . 1 . . . . . 11 ARG CA . 51013 1
90 . 1 . 1 11 11 ARG CB C 13 30.401 0.3 . 1 . . . . . 11 ARG CB . 51013 1
91 . 1 . 1 11 11 ARG CG C 13 27.055 0.3 . 1 . . . . . 11 ARG CG . 51013 1
92 . 1 . 1 11 11 ARG CD C 13 43.110 0.3 . 1 . . . . . 11 ARG CD . 51013 1
93 . 1 . 1 12 12 LEU H H 1 8.129 0.020 . 1 . . . . . 12 LEU H . 51013 1
94 . 1 . 1 12 12 LEU HA H 1 4.290 0.020 . 1 . . . . . 12 LEU HA . 51013 1
95 . 1 . 1 12 12 LEU HB2 H 1 1.646 0.020 . 1 . . . . . 12 LEU HB2 . 51013 1
96 . 1 . 1 12 12 LEU HB3 H 1 1.646 0.020 . 1 . . . . . 12 LEU HB3 . 51013 1
97 . 1 . 1 12 12 LEU HD11 H 1 0.875 0.020 . 1 . . . . . 12 LEU HD11 . 51013 1
98 . 1 . 1 12 12 LEU HD12 H 1 0.875 0.020 . 1 . . . . . 12 LEU HD12 . 51013 1
99 . 1 . 1 12 12 LEU HD13 H 1 0.875 0.020 . 1 . . . . . 12 LEU HD13 . 51013 1
100 . 1 . 1 12 12 LEU CA C 13 55.214 0.3 . 1 . . . . . 12 LEU CA . 51013 1
101 . 1 . 1 12 12 LEU CD1 C 13 23.208 0.3 . 1 . . . . . 12 LEU CD1 . 51013 1
102 . 1 . 1 13 13 ALA H H 1 8.200 0.020 . 1 . . . . . 13 ALA H . 51013 1
103 . 1 . 1 13 13 ALA HA H 1 4.185 0.020 . 1 . . . . . 13 ALA HA . 51013 1
104 . 1 . 1 13 13 ALA HB1 H 1 1.343 0.020 . 1 . . . . . 13 ALA HB1 . 51013 1
105 . 1 . 1 13 13 ALA HB2 H 1 1.343 0.020 . 1 . . . . . 13 ALA HB2 . 51013 1
106 . 1 . 1 13 13 ALA HB3 H 1 1.343 0.020 . 1 . . . . . 13 ALA HB3 . 51013 1
107 . 1 . 1 13 13 ALA CA C 13 52.817 0.3 . 1 . . . . . 13 ALA CA . 51013 1
108 . 1 . 1 13 13 ALA CB C 13 18.619 0.3 . 1 . . . . . 13 ALA CB . 51013 1
109 . 1 . 1 14 14 ASN H H 1 8.243 0.020 . 1 . . . . . 14 ASN H . 51013 1
110 . 1 . 1 14 14 ASN HA H 1 4.566 0.020 . 1 . . . . . 14 ASN HA . 51013 1
111 . 1 . 1 14 14 ASN HB2 H 1 2.724 0.020 . 1 . . . . . 14 ASN HB2 . 51013 1
112 . 1 . 1 14 14 ASN HB3 H 1 2.724 0.020 . 1 . . . . . 14 ASN HB3 . 51013 1
113 . 1 . 1 14 14 ASN CB C 13 38.436 0.3 . 1 . . . . . 14 ASN CB . 51013 1
114 . 1 . 1 15 15 PHE H H 1 8.051 0.020 . 1 . . . . . 15 PHE H . 51013 1
115 . 1 . 1 15 15 PHE HA H 1 4.535 0.020 . 1 . . . . . 15 PHE HA . 51013 1
116 . 1 . 1 15 15 PHE HB2 H 1 3.086 0.020 . 2 . . . . . 15 PHE HB2 . 51013 1
117 . 1 . 1 15 15 PHE HB3 H 1 3.181 0.020 . 2 . . . . . 15 PHE HB3 . 51013 1
118 . 1 . 1 15 15 PHE HD1 H 1 7.235 0.020 . 3 . . . . . 15 PHE HD1 . 51013 1
119 . 1 . 1 15 15 PHE HD2 H 1 7.250 0.020 . 3 . . . . . 15 PHE HD2 . 51013 1
120 . 1 . 1 15 15 PHE HE1 H 1 7.333 0.020 . 1 . . . . . 15 PHE HE1 . 51013 1
121 . 1 . 1 15 15 PHE HE2 H 1 7.333 0.020 . 1 . . . . . 15 PHE HE2 . 51013 1
122 . 1 . 1 15 15 PHE CA C 13 58.003 0.3 . 1 . . . . . 15 PHE CA . 51013 1
123 . 1 . 1 15 15 PHE CB C 13 39.000 0.3 . 1 . . . . . 15 PHE CB . 51013 1
124 . 1 . 1 15 15 PHE CD1 C 13 131.520 0.3 . 1 . . . . . 15 PHE CD1 . 51013 1
125 . 1 . 1 15 15 PHE CD2 C 13 131.556 0.3 . 1 . . . . . 15 PHE CD2 . 51013 1
126 . 1 . 1 15 15 PHE CE1 C 13 131.127 0.3 . 1 . . . . . 15 PHE CE1 . 51013 1
127 . 1 . 1 15 15 PHE CE2 C 13 131.204 0.3 . 1 . . . . . 15 PHE CE2 . 51013 1
128 . 1 . 1 16 16 LEU H H 1 8.073 0.020 . 1 . . . . . 16 LEU H . 51013 1
129 . 1 . 1 16 16 LEU HA H 1 4.242 0.020 . 1 . . . . . 16 LEU HA . 51013 1
130 . 1 . 1 16 16 LEU HB2 H 1 1.492 0.020 . 2 . . . . . 16 LEU HB2 . 51013 1
131 . 1 . 1 16 16 LEU HB3 H 1 1.634 0.020 . 2 . . . . . 16 LEU HB3 . 51013 1
132 . 1 . 1 16 16 LEU HG H 1 1.631 0.020 . 1 . . . . . 16 LEU HG . 51013 1
133 . 1 . 1 16 16 LEU HD11 H 1 0.840 0.020 . 1 . . . . . 16 LEU HD11 . 51013 1
134 . 1 . 1 16 16 LEU HD12 H 1 0.840 0.020 . 1 . . . . . 16 LEU HD12 . 51013 1
135 . 1 . 1 16 16 LEU HD13 H 1 0.840 0.020 . 1 . . . . . 16 LEU HD13 . 51013 1
136 . 1 . 1 16 16 LEU HD21 H 1 0.909 0.020 . 1 . . . . . 16 LEU HD21 . 51013 1
137 . 1 . 1 16 16 LEU HD22 H 1 0.909 0.020 . 1 . . . . . 16 LEU HD22 . 51013 1
138 . 1 . 1 16 16 LEU HD23 H 1 0.909 0.020 . 1 . . . . . 16 LEU HD23 . 51013 1
139 . 1 . 1 16 16 LEU CA C 13 54.885 0.3 . 1 . . . . . 16 LEU CA . 51013 1
140 . 1 . 1 16 16 LEU CB C 13 42.081 0.3 . 1 . . . . . 16 LEU CB . 51013 1
141 . 1 . 1 16 16 LEU CG C 13 26.646 0.3 . 1 . . . . . 16 LEU CG . 51013 1
142 . 1 . 1 16 16 LEU CD1 C 13 23.202 0.3 . 1 . . . . . 16 LEU CD1 . 51013 1
143 . 1 . 1 16 16 LEU CD2 C 13 24.626 0.3 . 1 . . . . . 16 LEU CD2 . 51013 1
144 . 1 . 1 17 17 VAL H H 1 7.971 0.020 . 1 . . . . . 17 VAL H . 51013 1
145 . 1 . 1 17 17 VAL HA H 1 3.973 0.020 . 1 . . . . . 17 VAL HA . 51013 1
146 . 1 . 1 17 17 VAL HB H 1 2.013 0.020 . 1 . . . . . 17 VAL HB . 51013 1
147 . 1 . 1 17 17 VAL HG11 H 1 0.849 0.020 . 1 . . . . . 17 VAL HG11 . 51013 1
148 . 1 . 1 17 17 VAL HG12 H 1 0.849 0.020 . 1 . . . . . 17 VAL HG12 . 51013 1
149 . 1 . 1 17 17 VAL HG13 H 1 0.849 0.020 . 1 . . . . . 17 VAL HG13 . 51013 1
150 . 1 . 1 17 17 VAL HG21 H 1 0.918 0.020 . 1 . . . . . 17 VAL HG21 . 51013 1
151 . 1 . 1 17 17 VAL HG22 H 1 0.918 0.020 . 1 . . . . . 17 VAL HG22 . 51013 1
152 . 1 . 1 17 17 VAL HG23 H 1 0.918 0.020 . 1 . . . . . 17 VAL HG23 . 51013 1
153 . 1 . 1 17 17 VAL CA C 13 62.426 0.3 . 1 . . . . . 17 VAL CA . 51013 1
154 . 1 . 1 17 17 VAL CG1 C 13 20.852 0.3 . 1 . . . . . 17 VAL CG1 . 51013 1
155 . 1 . 1 17 17 VAL CG2 C 13 20.852 0.3 . 1 . . . . . 17 VAL CG2 . 51013 1
156 . 1 . 1 18 18 HIS H H 1 8.587 0.020 . 1 . . . . . 18 HIS H . 51013 1
157 . 1 . 1 18 18 HIS HA H 1 4.730 0.020 . 1 . . . . . 18 HIS HA . 51013 1
158 . 1 . 1 18 18 HIS HB2 H 1 3.165 0.020 . 2 . . . . . 18 HIS HB2 . 51013 1
159 . 1 . 1 18 18 HIS HB3 H 1 3.250 0.020 . 2 . . . . . 18 HIS HB3 . 51013 1
160 . 1 . 1 18 18 HIS HD2 H 1 7.275 0.020 . 1 . . . . . 18 HIS HD2 . 51013 1
161 . 1 . 1 18 18 HIS HE1 H 1 8.573 0.020 . 1 . . . . . 18 HIS HE1 . 51013 1
162 . 1 . 1 18 18 HIS CB C 13 28.712 0.3 . 1 . . . . . 18 HIS CB . 51013 1
163 . 1 . 1 19 19 SER H H 1 8.402 0.020 . 1 . . . . . 19 SER H . 51013 1
164 . 1 . 1 19 19 SER HA H 1 4.457 0.020 . 1 . . . . . 19 SER HA . 51013 1
165 . 1 . 1 19 19 SER HB2 H 1 3.794 0.020 . 2 . . . . . 19 SER HB2 . 51013 1
166 . 1 . 1 19 19 SER HB3 H 1 3.877 0.020 . 2 . . . . . 19 SER HB3 . 51013 1
167 . 1 . 1 19 19 SER CA C 13 58.134 0.3 . 1 . . . . . 19 SER CA . 51013 1
168 . 1 . 1 19 19 SER CB C 13 63.554 0.3 . 1 . . . . . 19 SER CB . 51013 1
169 . 1 . 1 20 20 SER H H 1 8.517 0.020 . 1 . . . . . 20 SER H . 51013 1
170 . 1 . 1 20 20 SER HA H 1 4.452 0.020 . 1 . . . . . 20 SER HA . 51013 1
171 . 1 . 1 20 20 SER HB2 H 1 3.861 0.020 . 1 . . . . . 20 SER HB2 . 51013 1
172 . 1 . 1 20 20 SER HB3 H 1 3.861 0.020 . 1 . . . . . 20 SER HB3 . 51013 1
173 . 1 . 1 20 20 SER CA C 13 58.134 0.3 . 1 . . . . . 20 SER CA . 51013 1
174 . 1 . 1 20 20 SER CB C 13 63.554 0.3 . 1 . . . . . 20 SER CB . 51013 1
175 . 1 . 1 21 21 ASN H H 1 8.460 0.020 . 1 . . . . . 21 ASN H . 51013 1
176 . 1 . 1 21 21 ASN HA H 1 4.646 0.020 . 1 . . . . . 21 ASN HA . 51013 1
177 . 1 . 1 21 21 ASN HB2 H 1 2.673 0.020 . 2 . . . . . 21 ASN HB2 . 51013 1
178 . 1 . 1 21 21 ASN HB3 H 1 2.710 0.020 . 2 . . . . . 21 ASN HB3 . 51013 1
179 . 1 . 1 21 21 ASN CA C 13 52.766 0.3 . 1 . . . . . 21 ASN CA . 51013 1
180 . 1 . 1 21 21 ASN CB C 13 38.537 0.3 . 1 . . . . . 21 ASN CB . 51013 1
181 . 1 . 1 22 22 ASN H H 1 8.348 0.020 . 1 . . . . . 22 ASN H . 51013 1
182 . 1 . 1 22 22 ASN HA H 1 4.648 0.020 . 1 . . . . . 22 ASN HA . 51013 1
183 . 1 . 1 22 22 ASN HB2 H 1 2.629 0.020 . 2 . . . . . 22 ASN HB2 . 51013 1
184 . 1 . 1 22 22 ASN HB3 H 1 2.730 0.020 . 2 . . . . . 22 ASN HB3 . 51013 1
185 . 1 . 1 22 22 ASN HD21 H 1 7.558 0.020 . 1 . . . . . 22 ASN HD21 . 51013 1
186 . 1 . 1 22 22 ASN HD22 H 1 6.898 0.020 . 1 . . . . . 22 ASN HD22 . 51013 1
187 . 1 . 1 22 22 ASN CA C 13 52.766 0.3 . 1 . . . . . 22 ASN CA . 51013 1
188 . 1 . 1 22 22 ASN CB C 13 38.429 0.3 . 1 . . . . . 22 ASN CB . 51013 1
189 . 1 . 1 23 23 PHE H H 1 8.283 0.020 . 1 . . . . . 23 PHE H . 51013 1
190 . 1 . 1 23 23 PHE HA H 1 4.533 0.020 . 1 . . . . . 23 PHE HA . 51013 1
191 . 1 . 1 23 23 PHE HB2 H 1 3.030 0.020 . 2 . . . . . 23 PHE HB2 . 51013 1
192 . 1 . 1 23 23 PHE HB3 H 1 3.177 0.020 . 2 . . . . . 23 PHE HB3 . 51013 1
193 . 1 . 1 23 23 PHE HD1 H 1 7.222 0.020 . 3 . . . . . 23 PHE HD1 . 51013 1
194 . 1 . 1 23 23 PHE HD2 H 1 7.238 0.020 . 3 . . . . . 23 PHE HD2 . 51013 1
195 . 1 . 1 23 23 PHE HE1 H 1 7.344 0.020 . 3 . . . . . 23 PHE HE1 . 51013 1
196 . 1 . 1 23 23 PHE HE2 H 1 7.356 0.020 . 3 . . . . . 23 PHE HE2 . 51013 1
197 . 1 . 1 23 23 PHE CA C 13 57.840 0.3 . 1 . . . . . 23 PHE CA . 51013 1
198 . 1 . 1 23 23 PHE CB C 13 39.021 0.3 . 1 . . . . . 23 PHE CB . 51013 1
199 . 1 . 1 23 23 PHE CD1 C 13 131.431 0.3 . 1 . . . . . 23 PHE CD1 . 51013 1
200 . 1 . 1 23 23 PHE CD2 C 13 131.357 0.3 . 1 . . . . . 23 PHE CD2 . 51013 1
201 . 1 . 1 23 23 PHE CE1 C 13 131.364 0.3 . 1 . . . . . 23 PHE CE1 . 51013 1
202 . 1 . 1 23 23 PHE CE2 C 13 131.201 0.3 . 1 . . . . . 23 PHE CE2 . 51013 1
203 . 1 . 1 24 24 GLY H H 1 8.349 0.020 . 1 . . . . . 24 GLY H . 51013 1
204 . 1 . 1 24 24 GLY HA2 H 1 3.822 0.020 . 2 . . . . . 24 GLY HA2 . 51013 1
205 . 1 . 1 24 24 GLY HA3 H 1 3.872 0.020 . 2 . . . . . 24 GLY HA3 . 51013 1
206 . 1 . 1 24 24 GLY CA C 13 45.145 0.3 . 1 . . . . . 24 GLY CA . 51013 1
207 . 1 . 1 25 25 ALA H H 1 8.035 0.020 . 1 . . . . . 25 ALA H . 51013 1
208 . 1 . 1 25 25 ALA HA H 1 4.290 0.020 . 1 . . . . . 25 ALA HA . 51013 1
209 . 1 . 1 25 25 ALA HB1 H 1 1.347 0.020 . 1 . . . . . 25 ALA HB1 . 51013 1
210 . 1 . 1 25 25 ALA HB2 H 1 1.347 0.020 . 1 . . . . . 25 ALA HB2 . 51013 1
211 . 1 . 1 25 25 ALA HB3 H 1 1.347 0.020 . 1 . . . . . 25 ALA HB3 . 51013 1
212 . 1 . 1 25 25 ALA CA C 13 52.380 0.3 . 1 . . . . . 25 ALA CA . 51013 1
213 . 1 . 1 25 25 ALA CB C 13 19.120 0.3 . 1 . . . . . 25 ALA CB . 51013 1
214 . 1 . 1 26 26 ILE H H 1 8.222 0.020 . 1 . . . . . 26 ILE H . 51013 1
215 . 1 . 1 26 26 ILE HA H 1 4.111 0.020 . 1 . . . . . 26 ILE HA . 51013 1
216 . 1 . 1 26 26 ILE HB H 1 1.836 0.020 . 1 . . . . . 26 ILE HB . 51013 1
217 . 1 . 1 26 26 ILE HG12 H 1 1.173 0.020 . 2 . . . . . 26 ILE HG12 . 51013 1
218 . 1 . 1 26 26 ILE HG13 H 1 1.173 0.020 . 1 . . . . . 26 ILE HG13 . 51013 1
219 . 1 . 1 26 26 ILE HG21 H 1 0.876 0.020 . 1 . . . . . 26 ILE HG21 . 51013 1
220 . 1 . 1 26 26 ILE HG22 H 1 0.876 0.020 . 1 . . . . . 26 ILE HG22 . 51013 1
221 . 1 . 1 26 26 ILE HG23 H 1 0.876 0.020 . 1 . . . . . 26 ILE HG23 . 51013 1
222 . 1 . 1 26 26 ILE HD11 H 1 0.838 0.020 . 1 . . . . . 26 ILE HD11 . 51013 1
223 . 1 . 1 26 26 ILE HD12 H 1 0.838 0.020 . 1 . . . . . 26 ILE HD12 . 51013 1
224 . 1 . 1 26 26 ILE HD13 H 1 0.838 0.020 . 1 . . . . . 26 ILE HD13 . 51013 1
225 . 1 . 1 26 26 ILE CA C 13 60.912 0.3 . 1 . . . . . 26 ILE CA . 51013 1
226 . 1 . 1 26 26 ILE CB C 13 38.204 0.3 . 1 . . . . . 26 ILE CB . 51013 1
227 . 1 . 1 26 26 ILE CG1 C 13 26.827 0.3 . 1 . . . . . 26 ILE CG1 . 51013 1
228 . 1 . 1 26 26 ILE CG2 C 13 17.267 0.3 . 1 . . . . . 26 ILE CG2 . 51013 1
229 . 1 . 1 26 26 ILE CD1 C 13 12.479 0.3 . 1 . . . . . 26 ILE CD1 . 51013 1
230 . 1 . 1 27 27 LEU H H 1 8.448 0.020 . 1 . . . . . 27 LEU H . 51013 1
231 . 1 . 1 27 27 LEU HA H 1 4.403 0.020 . 1 . . . . . 27 LEU HA . 51013 1
232 . 1 . 1 27 27 LEU HB2 H 1 1.599 0.020 . 1 . . . . . 27 LEU HB2 . 51013 1
233 . 1 . 1 27 27 LEU HB3 H 1 1.599 0.020 . 1 . . . . . 27 LEU HB3 . 51013 1
234 . 1 . 1 27 27 LEU HG H 1 1.627 0.020 . 1 . . . . . 27 LEU HG . 51013 1
235 . 1 . 1 27 27 LEU HD11 H 1 0.841 0.020 . 1 . . . . . 27 LEU HD11 . 51013 1
236 . 1 . 1 27 27 LEU HD12 H 1 0.841 0.020 . 1 . . . . . 27 LEU HD12 . 51013 1
237 . 1 . 1 27 27 LEU HD13 H 1 0.841 0.020 . 1 . . . . . 27 LEU HD13 . 51013 1
238 . 1 . 1 27 27 LEU HD21 H 1 0.897 0.020 . 1 . . . . . 27 LEU HD21 . 51013 1
239 . 1 . 1 27 27 LEU HD22 H 1 0.897 0.020 . 1 . . . . . 27 LEU HD22 . 51013 1
240 . 1 . 1 27 27 LEU HD23 H 1 0.897 0.020 . 1 . . . . . 27 LEU HD23 . 51013 1
241 . 1 . 1 27 27 LEU CA C 13 54.891 0.3 . 1 . . . . . 27 LEU CA . 51013 1
242 . 1 . 1 27 27 LEU CB C 13 42.153 0.3 . 1 . . . . . 27 LEU CB . 51013 1
243 . 1 . 1 27 27 LEU CG C 13 26.760 0.3 . 1 . . . . . 27 LEU CG . 51013 1
244 . 1 . 1 27 27 LEU CD1 C 13 23.202 0.3 . 1 . . . . . 27 LEU CD1 . 51013 1
245 . 1 . 1 27 27 LEU CD2 C 13 24.651 0.3 . 1 . . . . . 27 LEU CD2 . 51013 1
246 . 1 . 1 28 28 SER H H 1 8.398 0.020 . 1 . . . . . 28 SER H . 51013 1
247 . 1 . 1 28 28 SER HA H 1 4.444 0.020 . 1 . . . . . 28 SER HA . 51013 1
248 . 1 . 1 28 28 SER HB2 H 1 3.838 0.020 . 1 . . . . . 28 SER HB2 . 51013 1
249 . 1 . 1 28 28 SER HB3 H 1 3.838 0.020 . 1 . . . . . 28 SER HB3 . 51013 1
250 . 1 . 1 28 28 SER CA C 13 58.134 0.3 . 1 . . . . . 28 SER CA . 51013 1
251 . 1 . 1 28 28 SER CB C 13 63.553 0.3 . 1 . . . . . 28 SER CB . 51013 1
252 . 1 . 1 29 29 SER H H 1 8.463 0.020 . 1 . . . . . 29 SER H . 51013 1
253 . 1 . 1 29 29 SER HA H 1 4.506 0.020 . 1 . . . . . 29 SER HA . 51013 1
254 . 1 . 1 29 29 SER HB2 H 1 3.890 0.020 . 1 . . . . . 29 SER HB2 . 51013 1
255 . 1 . 1 29 29 SER HB3 H 1 3.890 0.020 . 1 . . . . . 29 SER HB3 . 51013 1
256 . 1 . 1 29 29 SER CA C 13 58.080 0.3 . 1 . . . . . 29 SER CA . 51013 1
257 . 1 . 1 29 29 SER CB C 13 63.540 0.3 . 1 . . . . . 29 SER CB . 51013 1
258 . 1 . 1 30 30 THR H H 1 8.204 0.020 . 1 . . . . . 30 THR H . 51013 1
259 . 1 . 1 30 30 THR HA H 1 4.349 0.020 . 1 . . . . . 30 THR HA . 51013 1
260 . 1 . 1 30 30 THR HB H 1 4.223 0.020 . 1 . . . . . 30 THR HB . 51013 1
261 . 1 . 1 30 30 THR HG21 H 1 1.182 0.020 . 1 . . . . . 30 THR HG21 . 51013 1
262 . 1 . 1 30 30 THR HG22 H 1 1.182 0.020 . 1 . . . . . 30 THR HG22 . 51013 1
263 . 1 . 1 30 30 THR HG23 H 1 1.182 0.020 . 1 . . . . . 30 THR HG23 . 51013 1
264 . 1 . 1 30 30 THR CB C 13 69.150 0.3 . 1 . . . . . 30 THR CB . 51013 1
265 . 1 . 1 30 30 THR CG2 C 13 21.295 0.3 . 1 . . . . . 30 THR CG2 . 51013 1
266 . 1 . 1 31 31 ASN H H 1 8.451 0.020 . 1 . . . . . 31 ASN H . 51013 1
267 . 1 . 1 31 31 ASN HA H 1 4.747 0.020 . 1 . . . . . 31 ASN HA . 51013 1
268 . 1 . 1 31 31 ASN HB2 H 1 2.741 0.020 . 2 . . . . . 31 ASN HB2 . 51013 1
269 . 1 . 1 31 31 ASN HB3 H 1 2.819 0.020 . 2 . . . . . 31 ASN HB3 . 51013 1
270 . 1 . 1 31 31 ASN CB C 13 38.648 0.3 . 1 . . . . . 31 ASN CB . 51013 1
271 . 1 . 1 32 32 VAL H H 1 8.221 0.020 . 1 . . . . . 32 VAL H . 51013 1
272 . 1 . 1 32 32 VAL HA H 1 4.098 0.020 . 1 . . . . . 32 VAL HA . 51013 1
273 . 1 . 1 32 32 VAL HB H 1 2.117 0.020 . 1 . . . . . 32 VAL HB . 51013 1
274 . 1 . 1 32 32 VAL HG11 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG11 . 51013 1
275 . 1 . 1 32 32 VAL HG12 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG12 . 51013 1
276 . 1 . 1 32 32 VAL HG13 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG13 . 51013 1
277 . 1 . 1 32 32 VAL HG21 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG21 . 51013 1
278 . 1 . 1 32 32 VAL HG22 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG22 . 51013 1
279 . 1 . 1 32 32 VAL HG23 H 1 0.929 0.020 . 1 . . . . . 32 VAL HG23 . 51013 1
280 . 1 . 1 32 32 VAL CA C 13 62.280 0.3 . 1 . . . . . 32 VAL CA . 51013 1
281 . 1 . 1 32 32 VAL CB C 13 32.455 0.3 . 1 . . . . . 32 VAL CB . 51013 1
282 . 1 . 1 32 32 VAL CG1 C 13 20.154 0.3 . 1 . . . . . 32 VAL CG1 . 51013 1
283 . 1 . 1 32 32 VAL CG2 C 13 20.154 0.3 . 1 . . . . . 32 VAL CG2 . 51013 1
284 . 1 . 1 33 33 GLY H H 1 8.567 0.020 . 1 . . . . . 33 GLY H . 51013 1
285 . 1 . 1 33 33 GLY HA2 H 1 3.975 0.020 . 1 . . . . . 33 GLY HA2 . 51013 1
286 . 1 . 1 33 33 GLY HA3 H 1 3.975 0.020 . 1 . . . . . 33 GLY HA3 . 51013 1
287 . 1 . 1 33 33 GLY CA C 13 45.037 0.3 . 1 . . . . . 33 GLY CA . 51013 1
288 . 1 . 1 34 34 SER H H 1 8.269 0.020 . 1 . . . . . 34 SER H . 51013 1
289 . 1 . 1 34 34 SER HA H 1 4.419 0.020 . 1 . . . . . 34 SER HA . 51013 1
290 . 1 . 1 34 34 SER HB2 H 1 3.827 0.020 . 2 . . . . . 34 SER HB2 . 51013 1
291 . 1 . 1 34 34 SER HB3 H 1 3.872 0.020 . 2 . . . . . 34 SER HB3 . 51013 1
292 . 1 . 1 34 34 SER CA C 13 58.410 0.3 . 1 . . . . . 34 SER CA . 51013 1
293 . 1 . 1 34 34 SER CB C 13 63.554 0.3 . 1 . . . . . 34 SER CB . 51013 1
294 . 1 . 1 35 35 ASN H H 1 8.579 0.020 . 1 . . . . . 35 ASN H . 51013 1
295 . 1 . 1 35 35 ASN HA H 1 4.751 0.020 . 1 . . . . . 35 ASN HA . 51013 1
296 . 1 . 1 35 35 ASN HB2 H 1 2.759 0.020 . 1 . . . . . 35 ASN HB2 . 51013 1
297 . 1 . 1 35 35 ASN HB3 H 1 2.759 0.020 . 1 . . . . . 35 ASN HB3 . 51013 1
298 . 1 . 1 35 35 ASN CB C 13 38.451 0.3 . 1 . . . . . 35 ASN CB . 51013 1
299 . 1 . 1 36 36 THR H H 1 8.113 0.020 . 1 . . . . . 36 THR H . 51013 1
300 . 1 . 1 36 36 THR HA H 1 4.206 0.020 . 1 . . . . . 36 THR HA . 51013 1
301 . 1 . 1 36 36 THR HB H 1 4.086 0.020 . 1 . . . . . 36 THR HB . 51013 1
302 . 1 . 1 36 36 THR HG21 H 1 1.060 0.020 . 1 . . . . . 36 THR HG21 . 51013 1
303 . 1 . 1 36 36 THR HG22 H 1 1.060 0.020 . 1 . . . . . 36 THR HG22 . 51013 1
304 . 1 . 1 36 36 THR HG23 H 1 1.060 0.020 . 1 . . . . . 36 THR HG23 . 51013 1
305 . 1 . 1 36 36 THR CA C 13 61.802 0.3 . 1 . . . . . 36 THR CA . 51013 1
306 . 1 . 1 36 36 THR CB C 13 69.539 0.3 . 1 . . . . . 36 THR CB . 51013 1
307 . 1 . 1 36 36 THR CG2 C 13 21.255 0.3 . 1 . . . . . 36 THR CG2 . 51013 1
308 . 1 . 1 37 37 TYR H H 1 8.186 0.020 . 1 . . . . . 37 TYR H . 51013 1
309 . 1 . 1 37 37 TYR HA H 1 4.523 0.020 . 1 . . . . . 37 TYR HA . 51013 1
310 . 1 . 1 37 37 TYR HB2 H 1 2.921 0.020 . 2 . . . . . 37 TYR HB2 . 51013 1
311 . 1 . 1 37 37 TYR HB3 H 1 3.081 0.020 . 2 . . . . . 37 TYR HB3 . 51013 1
312 . 1 . 1 37 37 TYR HD1 H 1 7.122 0.020 . 1 . . . . . 37 TYR HD1 . 51013 1
313 . 1 . 1 37 37 TYR HD2 H 1 7.122 0.020 . 1 . . . . . 37 TYR HD2 . 51013 1
314 . 1 . 1 37 37 TYR HE1 H 1 6.810 0.020 . 1 . . . . . 37 TYR HE1 . 51013 1
315 . 1 . 1 37 37 TYR HE2 H 1 6.810 0.020 . 1 . . . . . 37 TYR HE2 . 51013 1
316 . 1 . 1 37 37 TYR CA C 13 57.778 0.3 . 1 . . . . . 37 TYR CA . 51013 1
317 . 1 . 1 37 37 TYR CE1 C 13 117.949 0.3 . 1 . . . . . 37 TYR CE1 . 51013 1
318 . 1 . 1 37 37 TYR CE2 C 13 117.949 0.3 . 1 . . . . . 37 TYR CE2 . 51013 1
319 . 1 . 1 38 38 NH2 HN1 H 1 7.127 0.020 . 1 . . . . . 38 NH2 HT21 . 51013 1
320 . 1 . 1 38 38 NH2 HN2 H 1 7.502 0.020 . 1 . . . . . 38 NH2 HT22 . 51013 1
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