Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25568
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.03
_Assigned_chem_shift_list.Chem_shift_13C_err 0.3
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_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
4 '3D HNCO' . . . 25568 1
5 '3D 1H-15N NOESY' . . . 25568 1
6 '2D 1H-13C HSQC aliphatic' . . . 25568 1
7 '2D 1H-13C HSQC aromatic' . . . 25568 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 1 1 SER HA H 1 4.183 0.03 . 1 . . . A 1 SER HA . 25568 1
2 . 1 1 1 1 SER HB2 H 1 4.017 0.03 . 2 . . . A 1 SER HB2 . 25568 1
3 . 1 1 1 1 SER HB3 H 1 3.957 0.03 . 2 . . . A 1 SER HB3 . 25568 1
4 . 1 1 1 1 SER C C 13 168.928 0.3 . 1 . . . A 1 SER C . 25568 1
5 . 1 1 1 1 SER CA C 13 57.390 0.3 . 1 . . . A 1 SER CA . 25568 1
6 . 1 1 1 1 SER CB C 13 63.065 0.3 . 1 . . . A 1 SER CB . 25568 1
7 . 1 1 2 2 GLU H H 1 8.802 0.03 . 1 . . . A 2 GLU H . 25568 1
8 . 1 1 2 2 GLU HA H 1 4.501 0.03 . 1 . . . A 2 GLU HA . 25568 1
9 . 1 1 2 2 GLU HB2 H 1 2.128 0.03 . 2 . . . A 2 GLU HB2 . 25568 1
10 . 1 1 2 2 GLU HB3 H 1 2.019 0.03 . 2 . . . A 2 GLU HB3 . 25568 1
11 . 1 1 2 2 GLU HG2 H 1 2.362 0.03 . 2 . . . A 2 GLU HG2 . 25568 1
12 . 1 1 2 2 GLU HG3 H 1 2.362 0.03 . 2 . . . A 2 GLU HG3 . 25568 1
13 . 1 1 2 2 GLU C C 13 173.747 0.3 . 1 . . . A 2 GLU C . 25568 1
14 . 1 1 2 2 GLU CA C 13 56.086 0.3 . 1 . . . A 2 GLU CA . 25568 1
15 . 1 1 2 2 GLU CB C 13 30.592 0.3 . 1 . . . A 2 GLU CB . 25568 1
16 . 1 1 2 2 GLU CG C 13 35.515 0.3 . 1 . . . A 2 GLU CG . 25568 1
17 . 1 1 2 2 GLU N N 15 121.648 0.2 . 1 . . . A 2 GLU N . 25568 1
18 . 1 1 3 3 CYS H H 1 8.252 0.03 . 1 . . . A 3 CYS H . 25568 1
19 . 1 1 3 3 CYS HA H 1 4.568 0.03 . 1 . . . A 3 CYS HA . 25568 1
20 . 1 1 3 3 CYS HB2 H 1 2.821 0.03 . 2 . . . A 3 CYS HB2 . 25568 1
21 . 1 1 3 3 CYS HB3 H 1 3.073 0.03 . 2 . . . A 3 CYS HB3 . 25568 1
22 . 1 1 3 3 CYS C C 13 171.833 0.3 . 1 . . . A 3 CYS C . 25568 1
23 . 1 1 3 3 CYS CA C 13 54.337 0.3 . 1 . . . A 3 CYS CA . 25568 1
24 . 1 1 3 3 CYS CB C 13 41.809 0.3 . 1 . . . A 3 CYS CB . 25568 1
25 . 1 1 3 3 CYS N N 15 119.267 0.2 . 1 . . . A 3 CYS N . 25568 1
26 . 1 1 4 4 GLY H H 1 8.642 0.03 . 1 . . . A 4 GLY H . 25568 1
27 . 1 1 4 4 GLY HA2 H 1 3.886 0.03 . 2 . . . A 4 GLY HA2 . 25568 1
28 . 1 1 4 4 GLY HA3 H 1 3.886 0.03 . 2 . . . A 4 GLY HA3 . 25568 1
29 . 1 1 4 4 GLY CA C 13 46.766 0.3 . 1 . . . A 4 GLY CA . 25568 1
30 . 1 1 4 4 GLY N N 15 107.188 0.2 . 1 . . . A 4 GLY N . 25568 1
31 . 1 1 5 5 LYS H H 1 5.250 0.03 . 1 . . . A 5 LYS H . 25568 1
32 . 1 1 5 5 LYS HA H 1 3.978 0.03 . 1 . . . A 5 LYS HA . 25568 1
33 . 1 1 5 5 LYS HB2 H 1 0.506 0.03 . 2 . . . A 5 LYS HB2 . 25568 1
34 . 1 1 5 5 LYS HB3 H 1 1.740 0.03 . 2 . . . A 5 LYS HB3 . 25568 1
35 . 1 1 5 5 LYS HG2 H 1 0.936 0.03 . 2 . . . A 5 LYS HG2 . 25568 1
36 . 1 1 5 5 LYS HG3 H 1 0.786 0.03 . 2 . . . A 5 LYS HG3 . 25568 1
37 . 1 1 5 5 LYS HD2 H 1 1.410 0.03 . 2 . . . A 5 LYS HD2 . 25568 1
38 . 1 1 5 5 LYS HD3 H 1 1.352 0.03 . 2 . . . A 5 LYS HD3 . 25568 1
39 . 1 1 5 5 LYS HE2 H 1 2.860 0.03 . 2 . . . A 5 LYS HE2 . 25568 1
40 . 1 1 5 5 LYS HE3 H 1 2.799 0.03 . 2 . . . A 5 LYS HE3 . 25568 1
41 . 1 1 5 5 LYS C C 13 172.710 0.3 . 1 . . . A 5 LYS C . 25568 1
42 . 1 1 5 5 LYS CA C 13 54.483 0.3 . 1 . . . A 5 LYS CA . 25568 1
43 . 1 1 5 5 LYS CB C 13 32.688 0.3 . 1 . . . A 5 LYS CB . 25568 1
44 . 1 1 5 5 LYS CG C 13 25.423 0.3 . 1 . . . A 5 LYS CG . 25568 1
45 . 1 1 5 5 LYS CD C 13 29.281 0.3 . 1 . . . A 5 LYS CD . 25568 1
46 . 1 1 5 5 LYS CE C 13 42.216 0.3 . 1 . . . A 5 LYS CE . 25568 1
47 . 1 1 5 5 LYS N N 15 124.281 0.2 . 1 . . . A 5 LYS N . 25568 1
48 . 1 1 6 6 PHE H H 1 8.141 0.03 . 1 . . . A 6 PHE H . 25568 1
49 . 1 1 6 6 PHE HA H 1 4.077 0.03 . 1 . . . A 6 PHE HA . 25568 1
50 . 1 1 6 6 PHE HB2 H 1 3.104 0.03 . 2 . . . A 6 PHE HB2 . 25568 1
51 . 1 1 6 6 PHE HB3 H 1 2.771 0.03 . 2 . . . A 6 PHE HB3 . 25568 1
52 . 1 1 6 6 PHE HD1 H 1 7.281 0.03 . 3 . . . A 6 PHE HD1 . 25568 1
53 . 1 1 6 6 PHE HD2 H 1 7.281 0.03 . 3 . . . A 6 PHE HD2 . 25568 1
54 . 1 1 6 6 PHE HE1 H 1 7.470 0.03 . 3 . . . A 6 PHE HE1 . 25568 1
55 . 1 1 6 6 PHE HE2 H 1 7.470 0.03 . 3 . . . A 6 PHE HE2 . 25568 1
56 . 1 1 6 6 PHE HZ H 1 7.326 0.03 . 1 . . . A 6 PHE HZ . 25568 1
57 . 1 1 6 6 PHE C C 13 174.609 0.3 . 1 . . . A 6 PHE C . 25568 1
58 . 1 1 6 6 PHE CA C 13 59.363 0.3 . 1 . . . A 6 PHE CA . 25568 1
59 . 1 1 6 6 PHE CB C 13 38.968 0.3 . 1 . . . A 6 PHE CB . 25568 1
60 . 1 1 6 6 PHE CD1 C 13 131.744 0.3 . 3 . . . A 6 PHE CD1 . 25568 1
61 . 1 1 6 6 PHE CE1 C 13 131.545 0.3 . 3 . . . A 6 PHE CE1 . 25568 1
62 . 1 1 6 6 PHE CZ C 13 130.000 0.3 . 1 . . . A 6 PHE CZ . 25568 1
63 . 1 1 6 6 PHE N N 15 119.437 0.2 . 1 . . . A 6 PHE N . 25568 1
64 . 1 1 7 7 MET H H 1 9.152 0.03 . 1 . . . A 7 MET H . 25568 1
65 . 1 1 7 7 MET HA H 1 2.968 0.03 . 1 . . . A 7 MET HA . 25568 1
66 . 1 1 7 7 MET HB2 H 1 1.630 0.03 . 2 . . . A 7 MET HB2 . 25568 1
67 . 1 1 7 7 MET HB3 H 1 1.450 0.03 . 2 . . . A 7 MET HB3 . 25568 1
68 . 1 1 7 7 MET HG2 H 1 0.288 0.03 . 2 . . . A 7 MET HG2 . 25568 1
69 . 1 1 7 7 MET HG3 H 1 0.654 0.03 . 2 . . . A 7 MET HG3 . 25568 1
70 . 1 1 7 7 MET HE1 H 1 1.131 0.03 . 1 . . . A 7 MET HE1 . 25568 1
71 . 1 1 7 7 MET HE2 H 1 1.131 0.03 . 1 . . . A 7 MET HE2 . 25568 1
72 . 1 1 7 7 MET HE3 H 1 1.131 0.03 . 1 . . . A 7 MET HE3 . 25568 1
73 . 1 1 7 7 MET C C 13 174.035 0.3 . 1 . . . A 7 MET C . 25568 1
74 . 1 1 7 7 MET CA C 13 58.125 0.3 . 1 . . . A 7 MET CA . 25568 1
75 . 1 1 7 7 MET CB C 13 29.062 0.3 . 1 . . . A 7 MET CB . 25568 1
76 . 1 1 7 7 MET CG C 13 31.668 0.3 . 1 . . . A 7 MET CG . 25568 1
77 . 1 1 7 7 MET CE C 13 15.688 0.3 . 1 . . . A 7 MET CE . 25568 1
78 . 1 1 7 7 MET N N 15 118.789 0.2 . 1 . . . A 7 MET N . 25568 1
79 . 1 1 8 8 TRP H H 1 8.796 0.03 . 1 . . . A 8 TRP H . 25568 1
80 . 1 1 8 8 TRP HA H 1 4.626 0.03 . 1 . . . A 8 TRP HA . 25568 1
81 . 1 1 8 8 TRP HB2 H 1 3.309 0.03 . 2 . . . A 8 TRP HB2 . 25568 1
82 . 1 1 8 8 TRP HB3 H 1 3.410 0.03 . 2 . . . A 8 TRP HB3 . 25568 1
83 . 1 1 8 8 TRP HD1 H 1 7.098 0.03 . 1 . . . A 8 TRP HD1 . 25568 1
84 . 1 1 8 8 TRP HE1 H 1 10.343 0.03 . 1 . . . A 8 TRP HE1 . 25568 1
85 . 1 1 8 8 TRP HE3 H 1 7.854 0.03 . 1 . . . A 8 TRP HE3 . 25568 1
86 . 1 1 8 8 TRP HZ2 H 1 7.549 0.03 . 1 . . . A 8 TRP HZ2 . 25568 1
87 . 1 1 8 8 TRP HZ3 H 1 7.170 0.03 . 1 . . . A 8 TRP HZ3 . 25568 1
88 . 1 1 8 8 TRP HH2 H 1 7.296 0.03 . 1 . . . A 8 TRP HH2 . 25568 1
89 . 1 1 8 8 TRP C C 13 174.497 0.3 . 1 . . . A 8 TRP C . 25568 1
90 . 1 1 8 8 TRP CA C 13 57.397 0.3 . 1 . . . A 8 TRP CA . 25568 1
91 . 1 1 8 8 TRP CB C 13 28.697 0.3 . 1 . . . A 8 TRP CB . 25568 1
92 . 1 1 8 8 TRP CD1 C 13 126.332 0.3 . 1 . . . A 8 TRP CD1 . 25568 1
93 . 1 1 8 8 TRP CE3 C 13 121.196 0.3 . 1 . . . A 8 TRP CE3 . 25568 1
94 . 1 1 8 8 TRP CZ2 C 13 114.752 0.3 . 1 . . . A 8 TRP CZ2 . 25568 1
95 . 1 1 8 8 TRP CZ3 C 13 122.740 0.3 . 1 . . . A 8 TRP CZ3 . 25568 1
96 . 1 1 8 8 TRP CH2 C 13 125.285 0.3 . 1 . . . A 8 TRP CH2 . 25568 1
97 . 1 1 8 8 TRP N N 15 122.588 0.2 . 1 . . . A 8 TRP N . 25568 1
98 . 1 1 8 8 TRP NE1 N 15 130.578 0.2 . 1 . . . A 8 TRP NE1 . 25568 1
99 . 1 1 9 9 LYS H H 1 8.289 0.03 . 1 . . . A 9 LYS H . 25568 1
100 . 1 1 9 9 LYS HA H 1 4.639 0.03 . 1 . . . A 9 LYS HA . 25568 1
101 . 1 1 9 9 LYS HB2 H 1 1.847 0.03 . 2 . . . A 9 LYS HB2 . 25568 1
102 . 1 1 9 9 LYS HB3 H 1 1.918 0.03 . 2 . . . A 9 LYS HB3 . 25568 1
103 . 1 1 9 9 LYS HG2 H 1 1.657 0.03 . 2 . . . A 9 LYS HG2 . 25568 1
104 . 1 1 9 9 LYS HG3 H 1 1.605 0.03 . 2 . . . A 9 LYS HG3 . 25568 1
105 . 1 1 9 9 LYS HD2 H 1 1.801 0.03 . 2 . . . A 9 LYS HD2 . 25568 1
106 . 1 1 9 9 LYS HD3 H 1 1.801 0.03 . 2 . . . A 9 LYS HD3 . 25568 1
107 . 1 1 9 9 LYS HE2 H 1 3.097 0.03 . 2 . . . A 9 LYS HE2 . 25568 1
108 . 1 1 9 9 LYS HE3 H 1 3.097 0.03 . 2 . . . A 9 LYS HE3 . 25568 1
109 . 1 1 9 9 LYS C C 13 173.588 0.3 . 1 . . . A 9 LYS C . 25568 1
110 . 1 1 9 9 LYS CA C 13 57.251 0.3 . 1 . . . A 9 LYS CA . 25568 1
111 . 1 1 9 9 LYS CB C 13 32.559 0.3 . 1 . . . A 9 LYS CB . 25568 1
112 . 1 1 9 9 LYS CG C 13 24.739 0.3 . 1 . . . A 9 LYS CG . 25568 1
113 . 1 1 9 9 LYS CD C 13 28.893 0.3 . 1 . . . A 9 LYS CD . 25568 1
114 . 1 1 9 9 LYS CE C 13 42.073 0.3 . 1 . . . A 9 LYS CE . 25568 1
115 . 1 1 9 9 LYS N N 15 121.982 0.2 . 1 . . . A 9 LYS N . 25568 1
116 . 1 1 10 10 CYS H H 1 8.131 0.03 . 1 . . . A 10 CYS H . 25568 1
117 . 1 1 10 10 CYS HA H 1 5.000 0.03 . 1 . . . A 10 CYS HA . 25568 1
118 . 1 1 10 10 CYS HB2 H 1 3.274 0.03 . 2 . . . A 10 CYS HB2 . 25568 1
119 . 1 1 10 10 CYS HB3 H 1 3.274 0.03 . 2 . . . A 10 CYS HB3 . 25568 1
120 . 1 1 10 10 CYS C C 13 170.732 0.3 . 1 . . . A 10 CYS C . 25568 1
121 . 1 1 10 10 CYS CA C 13 53.609 0.3 . 1 . . . A 10 CYS CA . 25568 1
122 . 1 1 10 10 CYS CB C 13 47.345 0.3 . 1 . . . A 10 CYS CB . 25568 1
123 . 1 1 10 10 CYS N N 15 115.637 0.2 . 1 . . . A 10 CYS N . 25568 1
124 . 1 1 11 11 LYS H H 1 9.543 0.03 . 1 . . . A 11 LYS H . 25568 1
125 . 1 1 11 11 LYS HA H 1 4.429 0.03 . 1 . . . A 11 LYS HA . 25568 1
126 . 1 1 11 11 LYS HB2 H 1 1.860 0.03 . 2 . . . A 11 LYS HB2 . 25568 1
127 . 1 1 11 11 LYS HB3 H 1 1.860 0.03 . 2 . . . A 11 LYS HB3 . 25568 1
128 . 1 1 11 11 LYS HG2 H 1 1.489 0.03 . 2 . . . A 11 LYS HG2 . 25568 1
129 . 1 1 11 11 LYS HG3 H 1 1.417 0.03 . 2 . . . A 11 LYS HG3 . 25568 1
130 . 1 1 11 11 LYS HD2 H 1 1.715 0.03 . 2 . . . A 11 LYS HD2 . 25568 1
131 . 1 1 11 11 LYS HD3 H 1 1.715 0.03 . 2 . . . A 11 LYS HD3 . 25568 1
132 . 1 1 11 11 LYS HE2 H 1 3.003 0.03 . 2 . . . A 11 LYS HE2 . 25568 1
133 . 1 1 11 11 LYS HE3 H 1 3.003 0.03 . 2 . . . A 11 LYS HE3 . 25568 1
134 . 1 1 11 11 LYS C C 13 174.737 0.3 . 1 . . . A 11 LYS C . 25568 1
135 . 1 1 11 11 LYS CA C 13 57.470 0.3 . 1 . . . A 11 LYS CA . 25568 1
136 . 1 1 11 11 LYS CB C 13 34.015 0.3 . 1 . . . A 11 LYS CB . 25568 1
137 . 1 1 11 11 LYS CG C 13 24.994 0.3 . 1 . . . A 11 LYS CG . 25568 1
138 . 1 1 11 11 LYS CD C 13 29.071 0.3 . 1 . . . A 11 LYS CD . 25568 1
139 . 1 1 11 11 LYS CE C 13 41.886 0.3 . 1 . . . A 11 LYS CE . 25568 1
140 . 1 1 11 11 LYS N N 15 119.567 0.2 . 1 . . . A 11 LYS N . 25568 1
141 . 1 1 12 12 ASN H H 1 8.125 0.03 . 1 . . . A 12 ASN H . 25568 1
142 . 1 1 12 12 ASN HA H 1 4.723 0.03 . 1 . . . A 12 ASN HA . 25568 1
143 . 1 1 12 12 ASN HB2 H 1 3.004 0.03 . 2 . . . A 12 ASN HB2 . 25568 1
144 . 1 1 12 12 ASN HB3 H 1 2.962 0.03 . 2 . . . A 12 ASN HB3 . 25568 1
145 . 1 1 12 12 ASN HD21 H 1 7.715 0.03 . 2 . . . A 12 ASN HD21 . 25568 1
146 . 1 1 12 12 ASN HD22 H 1 6.959 0.03 . 2 . . . A 12 ASN HD22 . 25568 1
147 . 1 1 12 12 ASN C C 13 174.896 0.3 . 1 . . . A 12 ASN C . 25568 1
148 . 1 1 12 12 ASN CA C 13 52.079 0.3 . 1 . . . A 12 ASN CA . 25568 1
149 . 1 1 12 12 ASN CB C 13 40.935 0.3 . 1 . . . A 12 ASN CB . 25568 1
150 . 1 1 12 12 ASN N N 15 115.051 0.2 . 1 . . . A 12 ASN N . 25568 1
151 . 1 1 12 12 ASN ND2 N 15 114.531 0.2 . 1 . . . A 12 ASN ND2 . 25568 1
152 . 1 1 13 13 SER H H 1 9.317 0.03 . 1 . . . A 13 SER H . 25568 1
153 . 1 1 13 13 SER HA H 1 4.116 0.03 . 1 . . . A 13 SER HA . 25568 1
154 . 1 1 13 13 SER HB2 H 1 4.170 0.03 . 2 . . . A 13 SER HB2 . 25568 1
155 . 1 1 13 13 SER HB3 H 1 4.052 0.03 . 2 . . . A 13 SER HB3 . 25568 1
156 . 1 1 13 13 SER C C 13 173.269 0.3 . 1 . . . A 13 SER C . 25568 1
157 . 1 1 13 13 SER CA C 13 63.151 0.3 . 1 . . . A 13 SER CA . 25568 1
158 . 1 1 13 13 SER CB C 13 62.968 0.3 . 1 . . . A 13 SER CB . 25568 1
159 . 1 1 13 13 SER N N 15 117.741 0.2 . 1 . . . A 13 SER N . 25568 1
160 . 1 1 14 14 ASN H H 1 8.579 0.03 . 1 . . . A 14 ASN H . 25568 1
161 . 1 1 14 14 ASN HA H 1 4.648 0.03 . 1 . . . A 14 ASN HA . 25568 1
162 . 1 1 14 14 ASN HB2 H 1 2.922 0.03 . 2 . . . A 14 ASN HB2 . 25568 1
163 . 1 1 14 14 ASN HB3 H 1 2.876 0.03 . 2 . . . A 14 ASN HB3 . 25568 1
164 . 1 1 14 14 ASN HD21 H 1 7.588 0.03 . 2 . . . A 14 ASN HD21 . 25568 1
165 . 1 1 14 14 ASN HD22 H 1 6.949 0.03 . 2 . . . A 14 ASN HD22 . 25568 1
166 . 1 1 14 14 ASN C C 13 174.242 0.3 . 1 . . . A 14 ASN C . 25568 1
167 . 1 1 14 14 ASN CA C 13 55.139 0.3 . 1 . . . A 14 ASN CA . 25568 1
168 . 1 1 14 14 ASN CB C 13 37.439 0.3 . 1 . . . A 14 ASN CB . 25568 1
169 . 1 1 14 14 ASN N N 15 119.511 0.2 . 1 . . . A 14 ASN N . 25568 1
170 . 1 1 14 14 ASN ND2 N 15 112.906 0.2 . 1 . . . A 14 ASN ND2 . 25568 1
171 . 1 1 15 15 ASP H H 1 7.797 0.03 . 1 . . . A 15 ASP H . 25568 1
172 . 1 1 15 15 ASP HA H 1 4.687 0.03 . 1 . . . A 15 ASP HA . 25568 1
173 . 1 1 15 15 ASP HB2 H 1 3.131 0.03 . 2 . . . A 15 ASP HB2 . 25568 1
174 . 1 1 15 15 ASP HB3 H 1 3.037 0.03 . 2 . . . A 15 ASP HB3 . 25568 1
175 . 1 1 15 15 ASP C C 13 175.614 0.3 . 1 . . . A 15 ASP C . 25568 1
176 . 1 1 15 15 ASP CA C 13 55.721 0.3 . 1 . . . A 15 ASP CA . 25568 1
177 . 1 1 15 15 ASP CB C 13 42.465 0.3 . 1 . . . A 15 ASP CB . 25568 1
178 . 1 1 15 15 ASP N N 15 116.823 0.2 . 1 . . . A 15 ASP N . 25568 1
179 . 1 1 16 16 CYS H H 1 7.816 0.03 . 1 . . . A 16 CYS H . 25568 1
180 . 1 1 16 16 CYS HA H 1 5.083 0.03 . 1 . . . A 16 CYS HA . 25568 1
181 . 1 1 16 16 CYS HB2 H 1 2.791 0.03 . 2 . . . A 16 CYS HB2 . 25568 1
182 . 1 1 16 16 CYS HB3 H 1 3.205 0.03 . 2 . . . A 16 CYS HB3 . 25568 1
183 . 1 1 16 16 CYS C C 13 172.327 0.3 . 1 . . . A 16 CYS C . 25568 1
184 . 1 1 16 16 CYS CA C 13 53.682 0.3 . 1 . . . A 16 CYS CA . 25568 1
185 . 1 1 16 16 CYS CB C 13 41.809 0.3 . 1 . . . A 16 CYS CB . 25568 1
186 . 1 1 16 16 CYS N N 15 118.609 0.2 . 1 . . . A 16 CYS N . 25568 1
187 . 1 1 17 17 CYS H H 1 9.560 0.03 . 1 . . . A 17 CYS H . 25568 1
188 . 1 1 17 17 CYS HA H 1 4.511 0.03 . 1 . . . A 17 CYS HA . 25568 1
189 . 1 1 17 17 CYS HB2 H 1 3.339 0.03 . 2 . . . A 17 CYS HB2 . 25568 1
190 . 1 1 17 17 CYS HB3 H 1 2.497 0.03 . 2 . . . A 17 CYS HB3 . 25568 1
191 . 1 1 17 17 CYS C C 13 170.811 0.3 . 1 . . . A 17 CYS C . 25568 1
192 . 1 1 17 17 CYS CA C 13 54.483 0.3 . 1 . . . A 17 CYS CA . 25568 1
193 . 1 1 17 17 CYS CB C 13 40.134 0.3 . 1 . . . A 17 CYS CB . 25568 1
194 . 1 1 17 17 CYS N N 15 120.994 0.2 . 1 . . . A 17 CYS N . 25568 1
195 . 1 1 18 18 LYS H H 1 8.004 0.03 . 1 . . . A 18 LYS H . 25568 1
196 . 1 1 18 18 LYS HA H 1 4.052 0.03 . 1 . . . A 18 LYS HA . 25568 1
197 . 1 1 18 18 LYS HB2 H 1 1.805 0.03 . 2 . . . A 18 LYS HB2 . 25568 1
198 . 1 1 18 18 LYS HB3 H 1 1.690 0.03 . 2 . . . A 18 LYS HB3 . 25568 1
199 . 1 1 18 18 LYS HG2 H 1 1.431 0.03 . 2 . . . A 18 LYS HG2 . 25568 1
200 . 1 1 18 18 LYS HG3 H 1 1.431 0.03 . 2 . . . A 18 LYS HG3 . 25568 1
201 . 1 1 18 18 LYS HD2 H 1 1.710 0.03 . 2 . . . A 18 LYS HD2 . 25568 1
202 . 1 1 18 18 LYS HD3 H 1 1.649 0.03 . 2 . . . A 18 LYS HD3 . 25568 1
203 . 1 1 18 18 LYS HE2 H 1 3.003 0.03 . 2 . . . A 18 LYS HE2 . 25568 1
204 . 1 1 18 18 LYS HE3 H 1 3.003 0.03 . 2 . . . A 18 LYS HE3 . 25568 1
205 . 1 1 18 18 LYS C C 13 174.322 0.3 . 1 . . . A 18 LYS C . 25568 1
206 . 1 1 18 18 LYS CA C 13 58.562 0.3 . 1 . . . A 18 LYS CA . 25568 1
207 . 1 1 18 18 LYS CB C 13 32.631 0.3 . 1 . . . A 18 LYS CB . 25568 1
208 . 1 1 18 18 LYS CG C 13 24.393 0.3 . 1 . . . A 18 LYS CG . 25568 1
209 . 1 1 18 18 LYS CD C 13 29.185 0.3 . 1 . . . A 18 LYS CD . 25568 1
210 . 1 1 18 18 LYS CE C 13 42.251 0.3 . 1 . . . A 18 LYS CE . 25568 1
211 . 1 1 18 18 LYS N N 15 118.089 0.2 . 1 . . . A 18 LYS N . 25568 1
212 . 1 1 19 19 ASP H H 1 8.715 0.03 . 1 . . . A 19 ASP H . 25568 1
213 . 1 1 19 19 ASP HA H 1 4.295 0.03 . 1 . . . A 19 ASP HA . 25568 1
214 . 1 1 19 19 ASP HB2 H 1 3.143 0.03 . 2 . . . A 19 ASP HB2 . 25568 1
215 . 1 1 19 19 ASP HB3 H 1 2.882 0.03 . 2 . . . A 19 ASP HB3 . 25568 1
216 . 1 1 19 19 ASP C C 13 172.790 0.3 . 1 . . . A 19 ASP C . 25568 1
217 . 1 1 19 19 ASP CA C 13 56.741 0.3 . 1 . . . A 19 ASP CA . 25568 1
218 . 1 1 19 19 ASP CB C 13 38.677 0.3 . 1 . . . A 19 ASP CB . 25568 1
219 . 1 1 19 19 ASP N N 15 116.375 0.2 . 1 . . . A 19 ASP N . 25568 1
220 . 1 1 20 20 LEU H H 1 8.286 0.03 . 1 . . . A 20 LEU H . 25568 1
221 . 1 1 20 20 LEU HA H 1 5.229 0.03 . 1 . . . A 20 LEU HA . 25568 1
222 . 1 1 20 20 LEU HB2 H 1 2.052 0.03 . 2 . . . A 20 LEU HB2 . 25568 1
223 . 1 1 20 20 LEU HB3 H 1 1.506 0.03 . 2 . . . A 20 LEU HB3 . 25568 1
224 . 1 1 20 20 LEU HG H 1 0.788 0.03 . 1 . . . A 20 LEU HG . 25568 1
225 . 1 1 20 20 LEU HD11 H 1 1.508 0.03 . 1 . . . A 20 LEU HD11 . 25568 1
226 . 1 1 20 20 LEU HD12 H 1 1.508 0.03 . 1 . . . A 20 LEU HD12 . 25568 1
227 . 1 1 20 20 LEU HD13 H 1 1.508 0.03 . 1 . . . A 20 LEU HD13 . 25568 1
228 . 1 1 20 20 LEU HD21 H 1 0.830 0.03 . 1 . . . A 20 LEU HD21 . 25568 1
229 . 1 1 20 20 LEU HD22 H 1 0.830 0.03 . 1 . . . A 20 LEU HD22 . 25568 1
230 . 1 1 20 20 LEU HD23 H 1 0.830 0.03 . 1 . . . A 20 LEU HD23 . 25568 1
231 . 1 1 20 20 LEU C C 13 173.971 0.3 . 1 . . . A 20 LEU C . 25568 1
232 . 1 1 20 20 LEU CA C 13 54.920 0.3 . 1 . . . A 20 LEU CA . 25568 1
233 . 1 1 20 20 LEU CB C 13 44.577 0.3 . 1 . . . A 20 LEU CB . 25568 1
234 . 1 1 20 20 LEU CG C 13 25.105 0.3 . 1 . . . A 20 LEU CG . 25568 1
235 . 1 1 20 20 LEU CD1 C 13 28.257 0.3 . 2 . . . A 20 LEU CD1 . 25568 1
236 . 1 1 20 20 LEU CD2 C 13 26.867 0.3 . 2 . . . A 20 LEU CD2 . 25568 1
237 . 1 1 20 20 LEU N N 15 120.437 0.2 . 1 . . . A 20 LEU N . 25568 1
238 . 1 1 21 21 VAL H H 1 9.324 0.03 . 1 . . . A 21 VAL H . 25568 1
239 . 1 1 21 21 VAL HA H 1 4.579 0.03 . 1 . . . A 21 VAL HA . 25568 1
240 . 1 1 21 21 VAL HB H 1 2.049 0.03 . 1 . . . A 21 VAL HB . 25568 1
241 . 1 1 21 21 VAL HG11 H 1 0.888 0.03 . 1 . . . A 21 VAL HG11 . 25568 1
242 . 1 1 21 21 VAL HG12 H 1 0.888 0.03 . 1 . . . A 21 VAL HG12 . 25568 1
243 . 1 1 21 21 VAL HG13 H 1 0.888 0.03 . 1 . . . A 21 VAL HG13 . 25568 1
244 . 1 1 21 21 VAL HG21 H 1 0.720 0.03 . 1 . . . A 21 VAL HG21 . 25568 1
245 . 1 1 21 21 VAL HG22 H 1 0.720 0.03 . 1 . . . A 21 VAL HG22 . 25568 1
246 . 1 1 21 21 VAL HG23 H 1 0.720 0.03 . 1 . . . A 21 VAL HG23 . 25568 1
247 . 1 1 21 21 VAL C C 13 172.790 0.3 . 1 . . . A 21 VAL C . 25568 1
248 . 1 1 21 21 VAL CA C 13 58.999 0.3 . 1 . . . A 21 VAL CA . 25568 1
249 . 1 1 21 21 VAL CB C 13 35.836 0.3 . 1 . . . A 21 VAL CB . 25568 1
250 . 1 1 21 21 VAL CG1 C 13 21.968 0.3 . 2 . . . A 21 VAL CG1 . 25568 1
251 . 1 1 21 21 VAL CG2 C 13 18.790 0.3 . 2 . . . A 21 VAL CG2 . 25568 1
252 . 1 1 21 21 VAL N N 15 112.441 0.2 . 1 . . . A 21 VAL N . 25568 1
253 . 1 1 22 22 CYS H H 1 8.806 0.03 . 1 . . . A 22 CYS H . 25568 1
254 . 1 1 22 22 CYS HA H 1 4.806 0.03 . 1 . . . A 22 CYS HA . 25568 1
255 . 1 1 22 22 CYS HB2 H 1 2.495 0.03 . 2 . . . A 22 CYS HB2 . 25568 1
256 . 1 1 22 22 CYS HB3 H 1 2.703 0.03 . 2 . . . A 22 CYS HB3 . 25568 1
257 . 1 1 22 22 CYS C C 13 173.348 0.3 . 1 . . . A 22 CYS C . 25568 1
258 . 1 1 22 22 CYS CA C 13 54.629 0.3 . 1 . . . A 22 CYS CA . 25568 1
259 . 1 1 22 22 CYS CB C 13 39.843 0.3 . 1 . . . A 22 CYS CB . 25568 1
260 . 1 1 22 22 CYS N N 15 121.656 0.2 . 1 . . . A 22 CYS N . 25568 1
261 . 1 1 23 23 SER H H 1 8.391 0.03 . 1 . . . A 23 SER H . 25568 1
262 . 1 1 23 23 SER HA H 1 4.397 0.03 . 1 . . . A 23 SER HA . 25568 1
263 . 1 1 23 23 SER HB2 H 1 3.914 0.03 . 2 . . . A 23 SER HB2 . 25568 1
264 . 1 1 23 23 SER HB3 H 1 4.389 0.03 . 2 . . . A 23 SER HB3 . 25568 1
265 . 1 1 23 23 SER C C 13 175.215 0.3 . 1 . . . A 23 SER C . 25568 1
266 . 1 1 23 23 SER CA C 13 58.271 0.3 . 1 . . . A 23 SER CA . 25568 1
267 . 1 1 23 23 SER CB C 13 63.442 0.3 . 1 . . . A 23 SER CB . 25568 1
268 . 1 1 23 23 SER N N 15 124.577 0.2 . 1 . . . A 23 SER N . 25568 1
269 . 1 1 24 24 SER H H 1 9.050 0.03 . 1 . . . A 24 SER H . 25568 1
270 . 1 1 24 24 SER HA H 1 4.129 0.03 . 1 . . . A 24 SER HA . 25568 1
271 . 1 1 24 24 SER HB2 H 1 3.880 0.03 . 2 . . . A 24 SER HB2 . 25568 1
272 . 1 1 24 24 SER HB3 H 1 3.854 0.03 . 2 . . . A 24 SER HB3 . 25568 1
273 . 1 1 24 24 SER C C 13 172.950 0.3 . 1 . . . A 24 SER C . 25568 1
274 . 1 1 24 24 SER CA C 13 60.747 0.3 . 1 . . . A 24 SER CA . 25568 1
275 . 1 1 24 24 SER CB C 13 62.430 0.3 . 1 . . . A 24 SER CB . 25568 1
276 . 1 1 24 24 SER N N 15 126.697 0.2 . 1 . . . A 24 SER N . 25568 1
277 . 1 1 25 25 ARG H H 1 7.499 0.03 . 1 . . . A 25 ARG H . 25568 1
278 . 1 1 25 25 ARG HA H 1 3.867 0.03 . 1 . . . A 25 ARG HA . 25568 1
279 . 1 1 25 25 ARG HB2 H 1 1.249 0.03 . 2 . . . A 25 ARG HB2 . 25568 1
280 . 1 1 25 25 ARG HB3 H 1 0.692 0.03 . 2 . . . A 25 ARG HB3 . 25568 1
281 . 1 1 25 25 ARG HG2 H 1 0.209 0.03 . 2 . . . A 25 ARG HG2 . 25568 1
282 . 1 1 25 25 ARG HG3 H 1 0.447 0.03 . 2 . . . A 25 ARG HG3 . 25568 1
283 . 1 1 25 25 ARG HD2 H 1 2.546 0.03 . 2 . . . A 25 ARG HD2 . 25568 1
284 . 1 1 25 25 ARG HD3 H 1 2.333 0.03 . 2 . . . A 25 ARG HD3 . 25568 1
285 . 1 1 25 25 ARG HE H 1 6.567 0.03 . 1 . . . A 25 ARG HE . 25568 1
286 . 1 1 25 25 ARG C C 13 175.662 0.3 . 1 . . . A 25 ARG C . 25568 1
287 . 1 1 25 25 ARG CA C 13 57.542 0.3 . 1 . . . A 25 ARG CA . 25568 1
288 . 1 1 25 25 ARG CB C 13 30.592 0.3 . 1 . . . A 25 ARG CB . 25568 1
289 . 1 1 25 25 ARG CG C 13 25.799 0.3 . 1 . . . A 25 ARG CG . 25568 1
290 . 1 1 25 25 ARG CD C 13 42.594 0.3 . 1 . . . A 25 ARG CD . 25568 1
291 . 1 1 25 25 ARG N N 15 120.375 0.2 . 1 . . . A 25 ARG N . 25568 1
292 . 1 1 25 25 ARG NE N 15 110.875 0.2 . 1 . . . A 25 ARG NE . 25568 1
293 . 1 1 26 26 TRP H H 1 7.098 0.03 . 1 . . . A 26 TRP H . 25568 1
294 . 1 1 26 26 TRP HA H 1 4.168 0.03 . 1 . . . A 26 TRP HA . 25568 1
295 . 1 1 26 26 TRP HB2 H 1 1.311 0.03 . 2 . . . A 26 TRP HB2 . 25568 1
296 . 1 1 26 26 TRP HB3 H 1 1.019 0.03 . 2 . . . A 26 TRP HB3 . 25568 1
297 . 1 1 26 26 TRP HD1 H 1 6.885 0.03 . 1 . . . A 26 TRP HD1 . 25568 1
298 . 1 1 26 26 TRP HE1 H 1 10.045 0.03 . 1 . . . A 26 TRP HE1 . 25568 1
299 . 1 1 26 26 TRP HE3 H 1 7.223 0.03 . 1 . . . A 26 TRP HE3 . 25568 1
300 . 1 1 26 26 TRP HZ2 H 1 7.413 0.03 . 1 . . . A 26 TRP HZ2 . 25568 1
301 . 1 1 26 26 TRP HZ3 H 1 7.099 0.03 . 1 . . . A 26 TRP HZ3 . 25568 1
302 . 1 1 26 26 TRP HH2 H 1 7.203 0.03 . 1 . . . A 26 TRP HH2 . 25568 1
303 . 1 1 26 26 TRP C C 13 173.077 0.3 . 1 . . . A 26 TRP C . 25568 1
304 . 1 1 26 26 TRP CA C 13 56.158 0.3 . 1 . . . A 26 TRP CA . 25568 1
305 . 1 1 26 26 TRP CB C 13 28.553 0.3 . 1 . . . A 26 TRP CB . 25568 1
306 . 1 1 26 26 TRP CD1 C 13 126.954 0.3 . 1 . . . A 26 TRP CD1 . 25568 1
307 . 1 1 26 26 TRP CE3 C 13 121.339 0.3 . 1 . . . A 26 TRP CE3 . 25568 1
308 . 1 1 26 26 TRP CZ2 C 13 114.425 0.3 . 1 . . . A 26 TRP CZ2 . 25568 1
309 . 1 1 26 26 TRP CZ3 C 13 121.556 0.3 . 1 . . . A 26 TRP CZ3 . 25568 1
310 . 1 1 26 26 TRP CH2 C 13 124.664 0.3 . 1 . . . A 26 TRP CH2 . 25568 1
311 . 1 1 26 26 TRP N N 15 115.667 0.2 . 1 . . . A 26 TRP N . 25568 1
312 . 1 1 26 26 TRP NE1 N 15 127.531 0.2 . 1 . . . A 26 TRP NE1 . 25568 1
313 . 1 1 27 27 LYS H H 1 8.001 0.03 . 1 . . . A 27 LYS H . 25568 1
314 . 1 1 27 27 LYS HA H 1 3.881 0.03 . 1 . . . A 27 LYS HA . 25568 1
315 . 1 1 27 27 LYS HB2 H 1 2.225 0.03 . 2 . . . A 27 LYS HB2 . 25568 1
316 . 1 1 27 27 LYS HB3 H 1 2.065 0.03 . 2 . . . A 27 LYS HB3 . 25568 1
317 . 1 1 27 27 LYS HG2 H 1 1.195 0.03 . 2 . . . A 27 LYS HG2 . 25568 1
318 . 1 1 27 27 LYS HG3 H 1 1.316 0.03 . 2 . . . A 27 LYS HG3 . 25568 1
319 . 1 1 27 27 LYS HD2 H 1 1.646 0.03 . 2 . . . A 27 LYS HD2 . 25568 1
320 . 1 1 27 27 LYS HD3 H 1 1.604 0.03 . 2 . . . A 27 LYS HD3 . 25568 1
321 . 1 1 27 27 LYS HE2 H 1 3.011 0.03 . 2 . . . A 27 LYS HE2 . 25568 1
322 . 1 1 27 27 LYS HE3 H 1 2.940 0.03 . 2 . . . A 27 LYS HE3 . 25568 1
323 . 1 1 27 27 LYS C C 13 173.971 0.3 . 1 . . . A 27 LYS C . 25568 1
324 . 1 1 27 27 LYS CA C 13 56.287 0.3 . 1 . . . A 27 LYS CA . 25568 1
325 . 1 1 27 27 LYS CB C 13 27.169 0.3 . 1 . . . A 27 LYS CB . 25568 1
326 . 1 1 27 27 LYS CG C 13 24.347 0.3 . 1 . . . A 27 LYS CG . 25568 1
327 . 1 1 27 27 LYS CD C 13 28.318 0.3 . 1 . . . A 27 LYS CD . 25568 1
328 . 1 1 27 27 LYS CE C 13 42.492 0.3 . 1 . . . A 27 LYS CE . 25568 1
329 . 1 1 27 27 LYS N N 15 112.484 0.2 . 1 . . . A 27 LYS N . 25568 1
330 . 1 1 28 28 TRP H H 1 6.947 0.03 . 1 . . . A 28 TRP H . 25568 1
331 . 1 1 28 28 TRP HA H 1 5.581 0.03 . 1 . . . A 28 TRP HA . 25568 1
332 . 1 1 28 28 TRP HB2 H 1 2.608 0.03 . 2 . . . A 28 TRP HB2 . 25568 1
333 . 1 1 28 28 TRP HB3 H 1 3.130 0.03 . 2 . . . A 28 TRP HB3 . 25568 1
334 . 1 1 28 28 TRP HD1 H 1 6.870 0.03 . 1 . . . A 28 TRP HD1 . 25568 1
335 . 1 1 28 28 TRP HE1 H 1 9.895 0.03 . 1 . . . A 28 TRP HE1 . 25568 1
336 . 1 1 28 28 TRP HE3 H 1 7.386 0.03 . 1 . . . A 28 TRP HE3 . 25568 1
337 . 1 1 28 28 TRP HZ2 H 1 6.565 0.03 . 1 . . . A 28 TRP HZ2 . 25568 1
338 . 1 1 28 28 TRP HZ3 H 1 7.037 0.03 . 1 . . . A 28 TRP HZ3 . 25568 1
339 . 1 1 28 28 TRP HH2 H 1 6.726 0.03 . 1 . . . A 28 TRP HH2 . 25568 1
340 . 1 1 28 28 TRP C C 13 175.710 0.3 . 1 . . . A 28 TRP C . 25568 1
341 . 1 1 28 28 TRP CA C 13 55.284 0.3 . 1 . . . A 28 TRP CA . 25568 1
342 . 1 1 28 28 TRP CB C 13 30.519 0.3 . 1 . . . A 28 TRP CB . 25568 1
343 . 1 1 28 28 TRP CD1 C 13 124.962 0.3 . 1 . . . A 28 TRP CD1 . 25568 1
344 . 1 1 28 28 TRP CE3 C 13 120.692 0.3 . 1 . . . A 28 TRP CE3 . 25568 1
345 . 1 1 28 28 TRP CZ2 C 13 114.163 0.3 . 1 . . . A 28 TRP CZ2 . 25568 1
346 . 1 1 28 28 TRP CZ3 C 13 121.393 0.3 . 1 . . . A 28 TRP CZ3 . 25568 1
347 . 1 1 28 28 TRP CH2 C 13 124.194 0.3 . 1 . . . A 28 TRP CH2 . 25568 1
348 . 1 1 28 28 TRP N N 15 110.998 0.2 . 1 . . . A 28 TRP N . 25568 1
349 . 1 1 28 28 TRP NE1 N 15 128.953 0.2 . 1 . . . A 28 TRP NE1 . 25568 1
350 . 1 1 29 29 CYS H H 1 9.113 0.03 . 1 . . . A 29 CYS H . 25568 1
351 . 1 1 29 29 CYS HA H 1 5.254 0.03 . 1 . . . A 29 CYS HA . 25568 1
352 . 1 1 29 29 CYS HB2 H 1 3.471 0.03 . 2 . . . A 29 CYS HB2 . 25568 1
353 . 1 1 29 29 CYS HB3 H 1 2.805 0.03 . 2 . . . A 29 CYS HB3 . 25568 1
354 . 1 1 29 29 CYS C C 13 173.157 0.3 . 1 . . . A 29 CYS C . 25568 1
355 . 1 1 29 29 CYS CA C 13 56.596 0.3 . 1 . . . A 29 CYS CA . 25568 1
356 . 1 1 29 29 CYS CB C 13 41.518 0.3 . 1 . . . A 29 CYS CB . 25568 1
357 . 1 1 29 29 CYS N N 15 121.176 0.2 . 1 . . . A 29 CYS N . 25568 1
358 . 1 1 30 30 VAL H H 1 9.923 0.03 . 1 . . . A 30 VAL H . 25568 1
359 . 1 1 30 30 VAL HA H 1 5.139 0.03 . 1 . . . A 30 VAL HA . 25568 1
360 . 1 1 30 30 VAL HB H 1 2.698 0.03 . 1 . . . A 30 VAL HB . 25568 1
361 . 1 1 30 30 VAL HG11 H 1 1.394 0.03 . 1 . . . A 30 VAL HG11 . 25568 1
362 . 1 1 30 30 VAL HG12 H 1 1.394 0.03 . 1 . . . A 30 VAL HG12 . 25568 1
363 . 1 1 30 30 VAL HG13 H 1 1.394 0.03 . 1 . . . A 30 VAL HG13 . 25568 1
364 . 1 1 30 30 VAL HG21 H 1 1.001 0.03 . 1 . . . A 30 VAL HG21 . 25568 1
365 . 1 1 30 30 VAL HG22 H 1 1.001 0.03 . 1 . . . A 30 VAL HG22 . 25568 1
366 . 1 1 30 30 VAL HG23 H 1 1.001 0.03 . 1 . . . A 30 VAL HG23 . 25568 1
367 . 1 1 30 30 VAL C C 13 173.269 0.3 . 1 . . . A 30 VAL C . 25568 1
368 . 1 1 30 30 VAL CA C 13 59.800 0.3 . 1 . . . A 30 VAL CA . 25568 1
369 . 1 1 30 30 VAL CB C 13 35.909 0.3 . 1 . . . A 30 VAL CB . 25568 1
370 . 1 1 30 30 VAL CG1 C 13 23.286 0.3 . 2 . . . A 30 VAL CG1 . 25568 1
371 . 1 1 30 30 VAL CG2 C 13 18.710 0.3 . 2 . . . A 30 VAL CG2 . 25568 1
372 . 1 1 30 30 VAL N N 15 117.187 0.2 . 1 . . . A 30 VAL N . 25568 1
373 . 1 1 31 31 LEU H H 1 8.331 0.03 . 1 . . . A 31 LEU H . 25568 1
374 . 1 1 31 31 LEU HA H 1 4.406 0.03 . 1 . . . A 31 LEU HA . 25568 1
375 . 1 1 31 31 LEU HB2 H 1 1.664 0.03 . 2 . . . A 31 LEU HB2 . 25568 1
376 . 1 1 31 31 LEU HB3 H 1 1.607 0.03 . 2 . . . A 31 LEU HB3 . 25568 1
377 . 1 1 31 31 LEU HG H 1 1.669 0.03 . 1 . . . A 31 LEU HG . 25568 1
378 . 1 1 31 31 LEU HD11 H 1 0.844 0.03 . 1 . . . A 31 LEU HD11 . 25568 1
379 . 1 1 31 31 LEU HD12 H 1 0.844 0.03 . 1 . . . A 31 LEU HD12 . 25568 1
380 . 1 1 31 31 LEU HD13 H 1 0.844 0.03 . 1 . . . A 31 LEU HD13 . 25568 1
381 . 1 1 31 31 LEU HD21 H 1 0.844 0.03 . 1 . . . A 31 LEU HD21 . 25568 1
382 . 1 1 31 31 LEU HD22 H 1 0.844 0.03 . 1 . . . A 31 LEU HD22 . 25568 1
383 . 1 1 31 31 LEU HD23 H 1 0.844 0.03 . 1 . . . A 31 LEU HD23 . 25568 1
384 . 1 1 31 31 LEU C C 13 176.285 0.3 . 1 . . . A 31 LEU C . 25568 1
385 . 1 1 31 31 LEU CA C 13 56.668 0.3 . 1 . . . A 31 LEU CA . 25568 1
386 . 1 1 31 31 LEU CB C 13 41.882 0.3 . 1 . . . A 31 LEU CB . 25568 1
387 . 1 1 31 31 LEU CG C 13 27.661 0.3 . 1 . . . A 31 LEU CG . 25568 1
388 . 1 1 31 31 LEU CD1 C 13 23.348 0.3 . 2 . . . A 31 LEU CD1 . 25568 1
389 . 1 1 31 31 LEU CD2 C 13 24.960 0.3 . 2 . . . A 31 LEU CD2 . 25568 1
390 . 1 1 31 31 LEU N N 15 120.354 0.2 . 1 . . . A 31 LEU N . 25568 1
391 . 1 1 32 32 ALA H H 1 8.366 0.03 . 1 . . . A 32 ALA H . 25568 1
392 . 1 1 32 32 ALA HA H 1 4.201 0.03 . 1 . . . A 32 ALA HA . 25568 1
393 . 1 1 32 32 ALA HB1 H 1 1.298 0.03 . 1 . . . A 32 ALA HB1 . 25568 1
394 . 1 1 32 32 ALA HB2 H 1 1.298 0.03 . 1 . . . A 32 ALA HB2 . 25568 1
395 . 1 1 32 32 ALA HB3 H 1 1.298 0.03 . 1 . . . A 32 ALA HB3 . 25568 1
396 . 1 1 32 32 ALA C C 13 175.758 0.3 . 1 . . . A 32 ALA C . 25568 1
397 . 1 1 32 32 ALA CA C 13 52.881 0.3 . 1 . . . A 32 ALA CA . 25568 1
398 . 1 1 32 32 ALA CB C 13 19.229 0.3 . 1 . . . A 32 ALA CB . 25568 1
399 . 1 1 32 32 ALA N N 15 124.391 0.2 . 1 . . . A 32 ALA N . 25568 1
400 . 1 1 33 33 SER H H 1 8.188 0.03 . 1 . . . A 33 SER H . 25568 1
401 . 1 1 33 33 SER HA H 1 4.763 0.03 . 1 . . . A 33 SER HA . 25568 1
402 . 1 1 33 33 SER HB2 H 1 3.818 0.03 . 2 . . . A 33 SER HB2 . 25568 1
403 . 1 1 33 33 SER HB3 H 1 3.778 0.03 . 2 . . . A 33 SER HB3 . 25568 1
404 . 1 1 33 33 SER CA C 13 56.062 0.3 . 1 . . . A 33 SER CA . 25568 1
405 . 1 1 33 33 SER CB C 13 63.765 0.3 . 1 . . . A 33 SER CB . 25568 1
406 . 1 1 33 33 SER N N 15 115.562 0.2 . 1 . . . A 33 SER N . 25568 1
407 . 1 1 34 34 PRO HA H 1 4.387 0.03 . 1 . . . A 34 PRO HA . 25568 1
408 . 1 1 34 34 PRO HB2 H 1 2.156 0.03 . 2 . . . A 34 PRO HB2 . 25568 1
409 . 1 1 34 34 PRO HB3 H 1 1.817 0.03 . 2 . . . A 34 PRO HB3 . 25568 1
410 . 1 1 34 34 PRO HG2 H 1 1.932 0.03 . 2 . . . A 34 PRO HG2 . 25568 1
411 . 1 1 34 34 PRO HG3 H 1 1.741 0.03 . 2 . . . A 34 PRO HG3 . 25568 1
412 . 1 1 34 34 PRO HD2 H 1 3.697 0.03 . 2 . . . A 34 PRO HD2 . 25568 1
413 . 1 1 34 34 PRO HD3 H 1 3.624 0.03 . 2 . . . A 34 PRO HD3 . 25568 1
414 . 1 1 34 34 PRO C C 13 173.907 0.3 . 1 . . . A 34 PRO C . 25568 1
415 . 1 1 34 34 PRO CA C 13 63.667 0.3 . 1 . . . A 34 PRO CA . 25568 1
416 . 1 1 34 34 PRO CB C 13 31.736 0.3 . 1 . . . A 34 PRO CB . 25568 1
417 . 1 1 34 34 PRO CG C 13 26.837 0.3 . 1 . . . A 34 PRO CG . 25568 1
418 . 1 1 34 34 PRO CD C 13 50.640 0.3 . 1 . . . A 34 PRO CD . 25568 1
419 . 1 1 35 35 PHE H H 1 7.482 0.03 . 1 . . . A 35 PHE H . 25568 1
420 . 1 1 35 35 PHE HA H 1 4.451 0.03 . 1 . . . A 35 PHE HA . 25568 1
421 . 1 1 35 35 PHE HB2 H 1 3.166 0.03 . 2 . . . A 35 PHE HB2 . 25568 1
422 . 1 1 35 35 PHE HB3 H 1 2.969 0.03 . 2 . . . A 35 PHE HB3 . 25568 1
423 . 1 1 35 35 PHE HD1 H 1 7.237 0.03 . 3 . . . A 35 PHE HD1 . 25568 1
424 . 1 1 35 35 PHE HD2 H 1 7.237 0.03 . 3 . . . A 35 PHE HD2 . 25568 1
425 . 1 1 35 35 PHE HE1 H 1 7.349 0.03 . 3 . . . A 35 PHE HE1 . 25568 1
426 . 1 1 35 35 PHE HE2 H 1 7.349 0.03 . 3 . . . A 35 PHE HE2 . 25568 1
427 . 1 1 35 35 PHE HZ H 1 7.290 0.03 . 1 . . . A 35 PHE HZ . 25568 1
428 . 1 1 35 35 PHE CA C 13 58.718 0.3 . 1 . . . A 35 PHE CA . 25568 1
429 . 1 1 35 35 PHE CB C 13 40.125 0.3 . 1 . . . A 35 PHE CB . 25568 1
430 . 1 1 35 35 PHE CD2 C 13 132.344 0.3 . 3 . . . A 35 PHE CD2 . 25568 1
431 . 1 1 35 35 PHE CE2 C 13 131.562 0.3 . 3 . . . A 35 PHE CE2 . 25568 1
432 . 1 1 35 35 PHE CZ C 13 129.219 0.3 . 1 . . . A 35 PHE CZ . 25568 1
433 . 1 1 35 35 PHE N N 15 123.230 0.2 . 1 . . . A 35 PHE N . 25568 1
stop_
save_