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 30682
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 DQF-COSY' . . . 30682 1
2 '2D 1H-1H TOCSY' . . . 30682 1
3 '2D 1H-1H NOESY' . . . 30682 1
4 '2D 1H-13C HSQC' . . . 30682 1
5 '2D 1H-15N HSQC' . . . 30682 1
6 '3D HNCO' . . . 30682 1
7 '3D 1H-13C NOESY aliphatic' . . . 30682 1
8 '3D 1H-13C NOESY' . . . 30682 1
9 '3D 1H-15N NOESY' . . . 30682 1
10 '3D HBHA(CO)NH' . . . 30682 1
11 '3D HNCACB' . . . 30682 1
12 '3D CBCA(CO)NH' . . . 30682 1
13 '3D HNCA' . . . 30682 1
14 '3D HCCH-COSY' . . . 30682 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 2 2 SER HA H 1 4.555 0.001 . 1 . . . . A 2 SER HA . 30682 1
2 . 1 . 1 2 2 SER HB2 H 1 3.862 0.001 . 1 . . . . A 2 SER HB2 . 30682 1
3 . 1 . 1 2 2 SER HB3 H 1 3.862 0.001 . 1 . . . . A 2 SER HB3 . 30682 1
4 . 1 . 1 2 2 SER C C 13 173.831 0.000 . 1 . . . . A 2 SER C . 30682 1
5 . 1 . 1 2 2 SER CA C 13 58.550 0.000 . 1 . . . . A 2 SER CA . 30682 1
6 . 1 . 1 2 2 SER CB C 13 64.037 0.000 . 1 . . . . A 2 SER CB . 30682 1
7 . 1 . 1 3 3 THR H H 1 8.297 0.002 . 1 . . . . A 3 THR H . 30682 1
8 . 1 . 1 3 3 THR HA H 1 4.564 0.002 . 1 . . . . A 3 THR HA . 30682 1
9 . 1 . 1 3 3 THR HB H 1 4.123 0.002 . 1 . . . . A 3 THR HB . 30682 1
10 . 1 . 1 3 3 THR HG21 H 1 1.235 0.004 . 1 . . . . A 3 THR HG21 . 30682 1
11 . 1 . 1 3 3 THR HG22 H 1 1.235 0.004 . 1 . . . . A 3 THR HG22 . 30682 1
12 . 1 . 1 3 3 THR HG23 H 1 1.235 0.004 . 1 . . . . A 3 THR HG23 . 30682 1
13 . 1 . 1 3 3 THR CA C 13 60.003 0.043 . 1 . . . . A 3 THR CA . 30682 1
14 . 1 . 1 3 3 THR CB C 13 69.910 0.032 . 1 . . . . A 3 THR CB . 30682 1
15 . 1 . 1 3 3 THR CG2 C 13 21.556 0.069 . 1 . . . . A 3 THR CG2 . 30682 1
16 . 1 . 1 3 3 THR N N 15 118.416 0.012 . 1 . . . . A 3 THR N . 30682 1
17 . 1 . 1 4 4 PRO HA H 1 4.245 0.002 . 1 . . . . A 4 PRO HA . 30682 1
18 . 1 . 1 4 4 PRO HB2 H 1 1.905 0.007 . 2 . . . . A 4 PRO HB2 . 30682 1
19 . 1 . 1 4 4 PRO HB3 H 1 1.825 0.006 . 2 . . . . A 4 PRO HB3 . 30682 1
20 . 1 . 1 4 4 PRO HG2 H 1 1.814 0.001 . 2 . . . . A 4 PRO HG2 . 30682 1
21 . 1 . 1 4 4 PRO HG3 H 1 1.698 0.004 . 2 . . . . A 4 PRO HG3 . 30682 1
22 . 1 . 1 4 4 PRO HD2 H 1 3.594 0.005 . 2 . . . . A 4 PRO HD2 . 30682 1
23 . 1 . 1 4 4 PRO HD3 H 1 3.708 0.005 . 2 . . . . A 4 PRO HD3 . 30682 1
24 . 1 . 1 4 4 PRO C C 13 176.234 0.000 . 1 . . . . A 4 PRO C . 30682 1
25 . 1 . 1 4 4 PRO CA C 13 63.176 0.167 . 1 . . . . A 4 PRO CA . 30682 1
26 . 1 . 1 4 4 PRO CB C 13 32.158 0.049 . 1 . . . . A 4 PRO CB . 30682 1
27 . 1 . 1 4 4 PRO CG C 13 27.341 0.001 . 1 . . . . A 4 PRO CG . 30682 1
28 . 1 . 1 4 4 PRO CD C 13 50.983 0.161 . 1 . . . . A 4 PRO CD . 30682 1
29 . 1 . 1 5 5 ASP H H 1 8.408 0.002 . 1 . . . . A 5 ASP H . 30682 1
30 . 1 . 1 5 5 ASP HA H 1 4.628 0.003 . 1 . . . . A 5 ASP HA . 30682 1
31 . 1 . 1 5 5 ASP HB2 H 1 2.880 0.004 . 2 . . . . A 5 ASP HB2 . 30682 1
32 . 1 . 1 5 5 ASP HB3 H 1 2.763 0.003 . 2 . . . . A 5 ASP HB3 . 30682 1
33 . 1 . 1 5 5 ASP C C 13 176.894 0.000 . 1 . . . . A 5 ASP C . 30682 1
34 . 1 . 1 5 5 ASP CA C 13 54.203 0.054 . 1 . . . . A 5 ASP CA . 30682 1
35 . 1 . 1 5 5 ASP CB C 13 41.991 0.042 . 1 . . . . A 5 ASP CB . 30682 1
36 . 1 . 1 5 5 ASP N N 15 121.408 0.057 . 1 . . . . A 5 ASP N . 30682 1
37 . 1 . 1 6 6 GLY H H 1 8.705 0.003 . 1 . . . . A 6 GLY H . 30682 1
38 . 1 . 1 6 6 GLY HA2 H 1 4.047 0.006 . 1 . . . . A 6 GLY HA2 . 30682 1
39 . 1 . 1 6 6 GLY HA3 H 1 4.047 0.006 . 1 . . . . A 6 GLY HA3 . 30682 1
40 . 1 . 1 6 6 GLY C C 13 176.362 0.000 . 1 . . . . A 6 GLY C . 30682 1
41 . 1 . 1 6 6 GLY CA C 13 47.070 0.012 . 1 . . . . A 6 GLY CA . 30682 1
42 . 1 . 1 6 6 GLY N N 15 109.054 0.036 . 1 . . . . A 6 GLY N . 30682 1
43 . 1 . 1 7 7 THR H H 1 8.358 0.002 . 1 . . . . A 7 THR H . 30682 1
44 . 1 . 1 7 7 THR HA H 1 4.082 0.006 . 1 . . . . A 7 THR HA . 30682 1
45 . 1 . 1 7 7 THR HB H 1 4.397 0.004 . 1 . . . . A 7 THR HB . 30682 1
46 . 1 . 1 7 7 THR HG21 H 1 1.354 0.009 . 1 . . . . A 7 THR HG21 . 30682 1
47 . 1 . 1 7 7 THR HG22 H 1 1.354 0.009 . 1 . . . . A 7 THR HG22 . 30682 1
48 . 1 . 1 7 7 THR HG23 H 1 1.354 0.009 . 1 . . . . A 7 THR HG23 . 30682 1
49 . 1 . 1 7 7 THR C C 13 175.962 0.000 . 1 . . . . A 7 THR C . 30682 1
50 . 1 . 1 7 7 THR CA C 13 65.810 0.071 . 1 . . . . A 7 THR CA . 30682 1
51 . 1 . 1 7 7 THR CB C 13 68.812 0.035 . 1 . . . . A 7 THR CB . 30682 1
52 . 1 . 1 7 7 THR CG2 C 13 22.167 0.047 . 1 . . . . A 7 THR CG2 . 30682 1
53 . 1 . 1 7 7 THR N N 15 117.075 0.076 . 1 . . . . A 7 THR N . 30682 1
54 . 1 . 1 8 8 TRP H H 1 8.224 0.002 . 1 . . . . A 8 TRP H . 30682 1
55 . 1 . 1 8 8 TRP HA H 1 4.295 0.004 . 1 . . . . A 8 TRP HA . 30682 1
56 . 1 . 1 8 8 TRP HB2 H 1 3.654 0.003 . 2 . . . . A 8 TRP HB2 . 30682 1
57 . 1 . 1 8 8 TRP HB3 H 1 3.438 0.001 . 2 . . . . A 8 TRP HB3 . 30682 1
58 . 1 . 1 8 8 TRP HD1 H 1 7.347 0.005 . 1 . . . . A 8 TRP HD1 . 30682 1
59 . 1 . 1 8 8 TRP HE1 H 1 9.816 0.003 . 1 . . . . A 8 TRP HE1 . 30682 1
60 . 1 . 1 8 8 TRP HZ2 H 1 7.110 0.003 . 1 . . . . A 8 TRP HZ2 . 30682 1
61 . 1 . 1 8 8 TRP HH2 H 1 7.380 0.003 . 1 . . . . A 8 TRP HH2 . 30682 1
62 . 1 . 1 8 8 TRP C C 13 177.820 0.000 . 1 . . . . A 8 TRP C . 30682 1
63 . 1 . 1 8 8 TRP CA C 13 62.621 0.040 . 1 . . . . A 8 TRP CA . 30682 1
64 . 1 . 1 8 8 TRP CB C 13 30.041 0.038 . 1 . . . . A 8 TRP CB . 30682 1
65 . 1 . 1 8 8 TRP N N 15 126.860 0.025 . 1 . . . . A 8 TRP N . 30682 1
66 . 1 . 1 8 8 TRP NE1 N 15 129.720 0.017 . 1 . . . . A 8 TRP NE1 . 30682 1
67 . 1 . 1 9 9 VAL H H 1 8.367 0.002 . 1 . . . . A 9 VAL H . 30682 1
68 . 1 . 1 9 9 VAL HA H 1 3.607 0.002 . 1 . . . . A 9 VAL HA . 30682 1
69 . 1 . 1 9 9 VAL HB H 1 2.208 0.003 . 1 . . . . A 9 VAL HB . 30682 1
70 . 1 . 1 9 9 VAL HG11 H 1 1.327 0.004 . 2 . . . . A 9 VAL HG11 . 30682 1
71 . 1 . 1 9 9 VAL HG12 H 1 1.327 0.004 . 2 . . . . A 9 VAL HG12 . 30682 1
72 . 1 . 1 9 9 VAL HG13 H 1 1.327 0.004 . 2 . . . . A 9 VAL HG13 . 30682 1
73 . 1 . 1 9 9 VAL HG21 H 1 1.029 0.006 . 2 . . . . A 9 VAL HG21 . 30682 1
74 . 1 . 1 9 9 VAL HG22 H 1 1.029 0.006 . 2 . . . . A 9 VAL HG22 . 30682 1
75 . 1 . 1 9 9 VAL HG23 H 1 1.029 0.006 . 2 . . . . A 9 VAL HG23 . 30682 1
76 . 1 . 1 9 9 VAL C C 13 178.606 0.000 . 1 . . . . A 9 VAL C . 30682 1
77 . 1 . 1 9 9 VAL CA C 13 66.867 0.050 . 1 . . . . A 9 VAL CA . 30682 1
78 . 1 . 1 9 9 VAL CB C 13 32.397 0.091 . 1 . . . . A 9 VAL CB . 30682 1
79 . 1 . 1 9 9 VAL CG1 C 13 23.056 0.032 . 2 . . . . A 9 VAL CG1 . 30682 1
80 . 1 . 1 9 9 VAL CG2 C 13 21.333 0.001 . 2 . . . . A 9 VAL CG2 . 30682 1
81 . 1 . 1 9 9 VAL N N 15 118.227 0.020 . 1 . . . . A 9 VAL N . 30682 1
82 . 1 . 1 10 10 LYS H H 1 8.064 0.002 . 1 . . . . A 10 LYS H . 30682 1
83 . 1 . 1 10 10 LYS HA H 1 4.147 0.005 . 1 . . . . A 10 LYS HA . 30682 1
84 . 1 . 1 10 10 LYS HB2 H 1 1.933 0.000 . 1 . . . . A 10 LYS HB2 . 30682 1
85 . 1 . 1 10 10 LYS HB3 H 1 1.933 0.000 . 1 . . . . A 10 LYS HB3 . 30682 1
86 . 1 . 1 10 10 LYS HG2 H 1 1.465 0.007 . 2 . . . . A 10 LYS HG2 . 30682 1
87 . 1 . 1 10 10 LYS HG3 H 1 1.544 0.001 . 2 . . . . A 10 LYS HG3 . 30682 1
88 . 1 . 1 10 10 LYS HD2 H 1 1.678 0.002 . 2 . . . . A 10 LYS HD2 . 30682 1
89 . 1 . 1 10 10 LYS HD3 H 1 1.768 0.003 . 2 . . . . A 10 LYS HD3 . 30682 1
90 . 1 . 1 10 10 LYS HE2 H 1 3.041 0.004 . 1 . . . . A 10 LYS HE2 . 30682 1
91 . 1 . 1 10 10 LYS HE3 H 1 3.041 0.004 . 1 . . . . A 10 LYS HE3 . 30682 1
92 . 1 . 1 10 10 LYS C C 13 177.673 0.000 . 1 . . . . A 10 LYS C . 30682 1
93 . 1 . 1 10 10 LYS CA C 13 59.809 0.210 . 1 . . . . A 10 LYS CA . 30682 1
94 . 1 . 1 10 10 LYS CB C 13 32.537 0.007 . 1 . . . . A 10 LYS CB . 30682 1
95 . 1 . 1 10 10 LYS CG C 13 25.147 0.116 . 1 . . . . A 10 LYS CG . 30682 1
96 . 1 . 1 10 10 LYS CD C 13 29.146 0.000 . 1 . . . . A 10 LYS CD . 30682 1
97 . 1 . 1 10 10 LYS CE C 13 42.082 0.168 . 1 . . . . A 10 LYS CE . 30682 1
98 . 1 . 1 10 10 LYS N N 15 121.369 0.039 . 1 . . . . A 10 LYS N . 30682 1
99 . 1 . 1 11 11 CYS H H 1 8.062 0.001 . 1 . . . . A 11 CYS H . 30682 1
100 . 1 . 1 11 11 CYS HA H 1 4.391 0.005 . 1 . . . . A 11 CYS HA . 30682 1
101 . 1 . 1 11 11 CYS HB2 H 1 3.398 0.002 . 2 . . . . A 11 CYS HB2 . 30682 1
102 . 1 . 1 11 11 CYS HB3 H 1 3.263 0.004 . 2 . . . . A 11 CYS HB3 . 30682 1
103 . 1 . 1 11 11 CYS C C 13 176.119 0.000 . 1 . . . . A 11 CYS C . 30682 1
104 . 1 . 1 11 11 CYS CA C 13 59.225 0.003 . 1 . . . . A 11 CYS CA . 30682 1
105 . 1 . 1 11 11 CYS CB C 13 38.973 0.017 . 1 . . . . A 11 CYS CB . 30682 1
106 . 1 . 1 11 11 CYS N N 15 120.199 0.036 . 1 . . . . A 11 CYS N . 30682 1
107 . 1 . 1 12 12 ARG H H 1 8.378 0.003 . 1 . . . . A 12 ARG H . 30682 1
108 . 1 . 1 12 12 ARG HA H 1 3.633 0.003 . 1 . . . . A 12 ARG HA . 30682 1
109 . 1 . 1 12 12 ARG HB2 H 1 1.842 0.003 . 2 . . . . A 12 ARG HB2 . 30682 1
110 . 1 . 1 12 12 ARG HB3 H 1 1.517 0.003 . 2 . . . . A 12 ARG HB3 . 30682 1
111 . 1 . 1 12 12 ARG HG2 H 1 0.454 0.005 . 2 . . . . A 12 ARG HG2 . 30682 1
112 . 1 . 1 12 12 ARG HG3 H 1 0.743 0.006 . 2 . . . . A 12 ARG HG3 . 30682 1
113 . 1 . 1 12 12 ARG HD2 H 1 2.785 0.008 . 1 . . . . A 12 ARG HD2 . 30682 1
114 . 1 . 1 12 12 ARG HD3 H 1 2.786 0.008 . 1 . . . . A 12 ARG HD3 . 30682 1
115 . 1 . 1 12 12 ARG HE H 1 6.375 0.004 . 1 . . . . A 12 ARG HE . 30682 1
116 . 1 . 1 12 12 ARG C C 13 180.171 0.000 . 1 . . . . A 12 ARG C . 30682 1
117 . 1 . 1 12 12 ARG CA C 13 57.930 0.028 . 1 . . . . A 12 ARG CA . 30682 1
118 . 1 . 1 12 12 ARG CB C 13 29.276 0.011 . 1 . . . . A 12 ARG CB . 30682 1
119 . 1 . 1 12 12 ARG CG C 13 25.195 0.000 . 1 . . . . A 12 ARG CG . 30682 1
120 . 1 . 1 12 12 ARG CD C 13 42.535 0.000 . 1 . . . . A 12 ARG CD . 30682 1
121 . 1 . 1 12 12 ARG N N 15 122.433 0.048 . 1 . . . . A 12 ARG N . 30682 1
122 . 1 . 1 12 12 ARG NE N 15 84.4 0.033 . 1 . . . . A 12 ARG NE . 30682 1
123 . 1 . 1 13 13 HIS H H 1 8.533 0.003 . 1 . . . . A 13 HIS H . 30682 1
124 . 1 . 1 13 13 HIS HA H 1 4.549 0.004 . 1 . . . . A 13 HIS HA . 30682 1
125 . 1 . 1 13 13 HIS HB2 H 1 3.375 0.003 . 2 . . . . A 13 HIS HB2 . 30682 1
126 . 1 . 1 13 13 HIS HB3 H 1 3.456 0.000 . 2 . . . . A 13 HIS HB3 . 30682 1
127 . 1 . 1 13 13 HIS HD2 H 1 7.339 0.003 . 1 . . . . A 13 HIS HD2 . 30682 1
128 . 1 . 1 13 13 HIS HE1 H 1 8.365 0.001 . 1 . . . . A 13 HIS HE1 . 30682 1
129 . 1 . 1 13 13 HIS C C 13 177.362 0.003 . 1 . . . . A 13 HIS C . 30682 1
130 . 1 . 1 13 13 HIS CA C 13 59.650 0.007 . 1 . . . . A 13 HIS CA . 30682 1
131 . 1 . 1 13 13 HIS CB C 13 29.067 0.073 . 1 . . . . A 13 HIS CB . 30682 1
132 . 1 . 1 13 13 HIS CE1 C 13 137.453 0.000 . 1 . . . . A 13 HIS CE1 . 30682 1
133 . 1 . 1 13 13 HIS N N 15 120.845 0.042 . 1 . . . . A 13 HIS N . 30682 1
134 . 1 . 1 14 14 ASP H H 1 9.256 0.003 . 1 . . . . A 14 ASP H . 30682 1
135 . 1 . 1 14 14 ASP HA H 1 4.467 0.004 . 1 . . . . A 14 ASP HA . 30682 1
136 . 1 . 1 14 14 ASP HB2 H 1 2.907 0.005 . 2 . . . . A 14 ASP HB2 . 30682 1
137 . 1 . 1 14 14 ASP HB3 H 1 2.721 0.004 . 2 . . . . A 14 ASP HB3 . 30682 1
138 . 1 . 1 14 14 ASP C C 13 179.335 0.000 . 1 . . . . A 14 ASP C . 30682 1
139 . 1 . 1 14 14 ASP CA C 13 57.762 0.058 . 1 . . . . A 14 ASP CA . 30682 1
140 . 1 . 1 14 14 ASP CB C 13 40.099 0.036 . 1 . . . . A 14 ASP CB . 30682 1
141 . 1 . 1 14 14 ASP N N 15 123.462 0.088 . 1 . . . . A 14 ASP N . 30682 1
142 . 1 . 1 15 15 CYS H H 1 8.956 0.002 . 1 . . . . A 15 CYS H . 30682 1
143 . 1 . 1 15 15 CYS HA H 1 4.552 0.005 . 1 . . . . A 15 CYS HA . 30682 1
144 . 1 . 1 15 15 CYS HB2 H 1 2.944 0.008 . 2 . . . . A 15 CYS HB2 . 30682 1
145 . 1 . 1 15 15 CYS HB3 H 1 2.770 0.004 . 2 . . . . A 15 CYS HB3 . 30682 1
146 . 1 . 1 15 15 CYS C C 13 178.155 0.000 . 1 . . . . A 15 CYS C . 30682 1
147 . 1 . 1 15 15 CYS CA C 13 56.859 0.009 . 1 . . . . A 15 CYS CA . 30682 1
148 . 1 . 1 15 15 CYS CB C 13 36.712 0.091 . 1 . . . . A 15 CYS CB . 30682 1
149 . 1 . 1 15 15 CYS N N 15 116.768 0.044 . 1 . . . . A 15 CYS N . 30682 1
150 . 1 . 1 16 16 PHE H H 1 8.522 0.004 . 1 . . . . A 16 PHE H . 30682 1
151 . 1 . 1 16 16 PHE HA H 1 4.285 0.004 . 1 . . . . A 16 PHE HA . 30682 1
152 . 1 . 1 16 16 PHE HB2 H 1 3.571 0.002 . 2 . . . . A 16 PHE HB2 . 30682 1
153 . 1 . 1 16 16 PHE HB3 H 1 3.310 0.001 . 2 . . . . A 16 PHE HB3 . 30682 1
154 . 1 . 1 16 16 PHE HD1 H 1 7.137 0.002 . 1 . . . . A 16 PHE HD1 . 30682 1
155 . 1 . 1 16 16 PHE HD2 H 1 7.137 0.002 . 1 . . . . A 16 PHE HD2 . 30682 1
156 . 1 . 1 16 16 PHE HE1 H 1 7.237 0.002 . 1 . . . . A 16 PHE HE1 . 30682 1
157 . 1 . 1 16 16 PHE HE2 H 1 7.237 0.002 . 1 . . . . A 16 PHE HE2 . 30682 1
158 . 1 . 1 16 16 PHE C C 13 176.391 0.003 . 1 . . . . A 16 PHE C . 30682 1
159 . 1 . 1 16 16 PHE CA C 13 62.881 0.005 . 1 . . . . A 16 PHE CA . 30682 1
160 . 1 . 1 16 16 PHE CB C 13 38.819 0.015 . 1 . . . . A 16 PHE CB . 30682 1
161 . 1 . 1 16 16 PHE CD1 C 13 129.460 0.000 . 1 . . . . A 16 PHE CD1 . 30682 1
162 . 1 . 1 16 16 PHE CD2 C 13 129.460 0.000 . 1 . . . . A 16 PHE CD2 . 30682 1
163 . 1 . 1 16 16 PHE N N 15 124.197 0.088 . 1 . . . . A 16 PHE N . 30682 1
164 . 1 . 1 17 17 THR H H 1 8.923 0.003 . 1 . . . . A 17 THR H . 30682 1
165 . 1 . 1 17 17 THR HA H 1 3.694 0.003 . 1 . . . . A 17 THR HA . 30682 1
166 . 1 . 1 17 17 THR HB H 1 4.314 0.002 . 1 . . . . A 17 THR HB . 30682 1
167 . 1 . 1 17 17 THR HG21 H 1 1.204 0.003 . 1 . . . . A 17 THR HG21 . 30682 1
168 . 1 . 1 17 17 THR HG22 H 1 1.204 0.003 . 1 . . . . A 17 THR HG22 . 30682 1
169 . 1 . 1 17 17 THR HG23 H 1 1.204 0.003 . 1 . . . . A 17 THR HG23 . 30682 1
170 . 1 . 1 17 17 THR C C 13 177.402 0.043 . 1 . . . . A 17 THR C . 30682 1
171 . 1 . 1 17 17 THR CA C 13 67.009 0.007 . 1 . . . . A 17 THR CA . 30682 1
172 . 1 . 1 17 17 THR CB C 13 68.634 0.035 . 1 . . . . A 17 THR CB . 30682 1
173 . 1 . 1 17 17 THR CG2 C 13 21.858 0.066 . 1 . . . . A 17 THR CG2 . 30682 1
174 . 1 . 1 17 17 THR N N 15 117.263 0.047 . 1 . . . . A 17 THR N . 30682 1
175 . 1 . 1 18 18 LYS H H 1 7.739 0.002 . 1 . . . . A 18 LYS H . 30682 1
176 . 1 . 1 18 18 LYS HA H 1 4.052 0.004 . 1 . . . . A 18 LYS HA . 30682 1
177 . 1 . 1 18 18 LYS HB2 H 1 1.908 0.007 . 1 . . . . A 18 LYS HB2 . 30682 1
178 . 1 . 1 18 18 LYS HB3 H 1 1.908 0.007 . 1 . . . . A 18 LYS HB3 . 30682 1
179 . 1 . 1 18 18 LYS HG2 H 1 1.486 0.005 . 1 . . . . A 18 LYS HG2 . 30682 1
180 . 1 . 1 18 18 LYS HG3 H 1 1.486 0.000 . 1 . . . . A 18 LYS HG3 . 30682 1
181 . 1 . 1 18 18 LYS HD2 H 1 1.634 0.000 . 2 . . . . A 18 LYS HD2 . 30682 1
182 . 1 . 1 18 18 LYS HD3 H 1 1.716 0.001 . 2 . . . . A 18 LYS HD3 . 30682 1
183 . 1 . 1 18 18 LYS HE2 H 1 2.959 0.000 . 1 . . . . A 18 LYS HE2 . 30682 1
184 . 1 . 1 18 18 LYS HE3 H 1 2.959 0.000 . 1 . . . . A 18 LYS HE3 . 30682 1
185 . 1 . 1 18 18 LYS C C 13 178.471 0.000 . 1 . . . . A 18 LYS C . 30682 1
186 . 1 . 1 18 18 LYS CA C 13 59.732 0.328 . 1 . . . . A 18 LYS CA . 30682 1
187 . 1 . 1 18 18 LYS CB C 13 32.775 0.178 . 1 . . . . A 18 LYS CB . 30682 1
188 . 1 . 1 18 18 LYS CG C 13 25.064 0.136 . 1 . . . . A 18 LYS CG . 30682 1
189 . 1 . 1 18 18 LYS CD C 13 29.302 0.005 . 1 . . . . A 18 LYS CD . 30682 1
190 . 1 . 1 18 18 LYS CE C 13 42.242 0.010 . 1 . . . . A 18 LYS CE . 30682 1
191 . 1 . 1 18 18 LYS N N 15 121.441 0.042 . 1 . . . . A 18 LYS N . 30682 1
192 . 1 . 1 19 19 TYR H H 1 7.737 0.003 . 1 . . . . A 19 TYR H . 30682 1
193 . 1 . 1 19 19 TYR HA H 1 4.814 0.005 . 1 . . . . A 19 TYR HA . 30682 1
194 . 1 . 1 19 19 TYR HB2 H 1 3.017 0.006 . 2 . . . . A 19 TYR HB2 . 30682 1
195 . 1 . 1 19 19 TYR HB3 H 1 2.908 0.005 . 2 . . . . A 19 TYR HB3 . 30682 1
196 . 1 . 1 19 19 TYR HD1 H 1 6.554 0.002 . 1 . . . . A 19 TYR HD1 . 30682 1
197 . 1 . 1 19 19 TYR HD2 H 1 6.554 0.002 . 1 . . . . A 19 TYR HD2 . 30682 1
198 . 1 . 1 19 19 TYR HE1 H 1 6.440 0.003 . 1 . . . . A 19 TYR HE1 . 30682 1
199 . 1 . 1 19 19 TYR HE2 H 1 6.440 0.003 . 1 . . . . A 19 TYR HE2 . 30682 1
200 . 1 . 1 19 19 TYR C C 13 176.897 0.000 . 1 . . . . A 19 TYR C . 30682 1
201 . 1 . 1 19 19 TYR CA C 13 59.832 0.001 . 1 . . . . A 19 TYR CA . 30682 1
202 . 1 . 1 19 19 TYR CB C 13 38.057 0.005 . 1 . . . . A 19 TYR CB . 30682 1
203 . 1 . 1 19 19 TYR CG C 13 132.924 0.000 . 1 . . . . A 19 TYR CG . 30682 1
204 . 1 . 1 19 19 TYR CD1 C 13 133.375 0.000 . 1 . . . . A 19 TYR CD1 . 30682 1
205 . 1 . 1 19 19 TYR CD2 C 13 133.375 0.000 . 1 . . . . A 19 TYR CD2 . 30682 1
206 . 1 . 1 19 19 TYR CE1 C 13 117.760 0.000 . 1 . . . . A 19 TYR CE1 . 30682 1
207 . 1 . 1 19 19 TYR CE2 C 13 117.760 0.000 . 1 . . . . A 19 TYR CE2 . 30682 1
208 . 1 . 1 19 19 TYR N N 15 123.991 0.039 . 1 . . . . A 19 TYR N . 30682 1
209 . 1 . 1 20 20 LYS H H 1 8.381 0.003 . 1 . . . . A 20 LYS H . 30682 1
210 . 1 . 1 20 20 LYS HA H 1 3.510 0.007 . 1 . . . . A 20 LYS HA . 30682 1
211 . 1 . 1 20 20 LYS HB2 H 1 1.584 0.002 . 2 . . . . A 20 LYS HB2 . 30682 1
212 . 1 . 1 20 20 LYS HB3 H 1 1.498 0.002 . 2 . . . . A 20 LYS HB3 . 30682 1
213 . 1 . 1 20 20 LYS HG2 H 1 1.219 0.006 . 2 . . . . A 20 LYS HG2 . 30682 1
214 . 1 . 1 20 20 LYS HG3 H 1 1.044 0.002 . 2 . . . . A 20 LYS HG3 . 30682 1
215 . 1 . 1 20 20 LYS HD2 H 1 1.552 0.003 . 1 . . . . A 20 LYS HD2 . 30682 1
216 . 1 . 1 20 20 LYS HD3 H 1 1.552 0.003 . 1 . . . . A 20 LYS HD3 . 30682 1
217 . 1 . 1 20 20 LYS HE2 H 1 3.012 0.001 . 2 . . . . A 20 LYS HE2 . 30682 1
218 . 1 . 1 20 20 LYS HE3 H 1 2.892 0.002 . 2 . . . . A 20 LYS HE3 . 30682 1
219 . 1 . 1 20 20 LYS C C 13 178.940 0.000 . 1 . . . . A 20 LYS C . 30682 1
220 . 1 . 1 20 20 LYS CA C 13 58.369 0.092 . 1 . . . . A 20 LYS CA . 30682 1
221 . 1 . 1 20 20 LYS CB C 13 30.779 0.127 . 1 . . . . A 20 LYS CB . 30682 1
222 . 1 . 1 20 20 LYS CG C 13 24.454 0.122 . 1 . . . . A 20 LYS CG . 30682 1
223 . 1 . 1 20 20 LYS CD C 13 28.011 0.000 . 1 . . . . A 20 LYS CD . 30682 1
224 . 1 . 1 20 20 LYS CE C 13 42.246 0.001 . 1 . . . . A 20 LYS CE . 30682 1
225 . 1 . 1 20 20 LYS N N 15 121.140 0.019 . 1 . . . . A 20 LYS N . 30682 1
226 . 1 . 1 21 21 SER H H 1 7.964 0.003 . 1 . . . . A 21 SER H . 30682 1
227 . 1 . 1 21 21 SER HA H 1 4.074 0.007 . 1 . . . . A 21 SER HA . 30682 1
228 . 1 . 1 21 21 SER HB2 H 1 3.885 0.004 . 1 . . . . A 21 SER HB2 . 30682 1
229 . 1 . 1 21 21 SER HB3 H 1 3.885 0.004 . 1 . . . . A 21 SER HB3 . 30682 1
230 . 1 . 1 21 21 SER C C 13 176.320 0.000 . 1 . . . . A 21 SER C . 30682 1
231 . 1 . 1 21 21 SER CA C 13 61.722 0.007 . 1 . . . . A 21 SER CA . 30682 1
232 . 1 . 1 21 21 SER CB C 13 62.432 0.026 . 1 . . . . A 21 SER CB . 30682 1
233 . 1 . 1 21 21 SER N N 15 113.648 0.055 . 1 . . . . A 21 SER N . 30682 1
234 . 1 . 1 22 22 CYS H H 1 7.974 0.004 . 1 . . . . A 22 CYS H . 30682 1
235 . 1 . 1 22 22 CYS HA H 1 4.136 0.003 . 1 . . . . A 22 CYS HA . 30682 1
236 . 1 . 1 22 22 CYS HB2 H 1 3.495 0.004 . 2 . . . . A 22 CYS HB2 . 30682 1
237 . 1 . 1 22 22 CYS HB3 H 1 3.105 0.004 . 2 . . . . A 22 CYS HB3 . 30682 1
238 . 1 . 1 22 22 CYS C C 13 177.453 0.000 . 1 . . . . A 22 CYS C . 30682 1
239 . 1 . 1 22 22 CYS CA C 13 60.301 0.015 . 1 . . . . A 22 CYS CA . 30682 1
240 . 1 . 1 22 22 CYS CB C 13 35.994 0.046 . 1 . . . . A 22 CYS CB . 30682 1
241 . 1 . 1 22 22 CYS N N 15 122.289 0.028 . 1 . . . . A 22 CYS N . 30682 1
242 . 1 . 1 23 23 GLN H H 1 8.260 0.002 . 1 . . . . A 23 GLN H . 30682 1
243 . 1 . 1 23 23 GLN HA H 1 3.831 0.003 . 1 . . . . A 23 GLN HA . 30682 1
244 . 1 . 1 23 23 GLN HB2 H 1 1.820 0.006 . 1 . . . . A 23 GLN HB2 . 30682 1
245 . 1 . 1 23 23 GLN HB3 H 1 1.820 0.006 . 1 . . . . A 23 GLN HB3 . 30682 1
246 . 1 . 1 23 23 GLN HG2 H 1 1.967 0.008 . 1 . . . . A 23 GLN HG2 . 30682 1
247 . 1 . 1 23 23 GLN HG3 H 1 1.968 0.008 . 1 . . . . A 23 GLN HG3 . 30682 1
248 . 1 . 1 23 23 GLN HE21 H 1 6.327 0.008 . 1 . . . . A 23 GLN HE21 . 30682 1
249 . 1 . 1 23 23 GLN HE22 H 1 6.204 0.004 . 1 . . . . A 23 GLN HE22 . 30682 1
250 . 1 . 1 23 23 GLN C C 13 176.713 0.015 . 1 . . . . A 23 GLN C . 30682 1
251 . 1 . 1 23 23 GLN CA C 13 58.839 0.077 . 1 . . . . A 23 GLN CA . 30682 1
252 . 1 . 1 23 23 GLN CB C 13 29.290 0.005 . 1 . . . . A 23 GLN CB . 30682 1
253 . 1 . 1 23 23 GLN CG C 13 34.200 0.004 . 1 . . . . A 23 GLN CG . 30682 1
254 . 1 . 1 23 23 GLN N N 15 119.337 0.030 . 1 . . . . A 23 GLN N . 30682 1
255 . 1 . 1 23 23 GLN NE2 N 15 108.052 0.012 . 1 . . . . A 23 GLN NE2 . 30682 1
256 . 1 . 1 24 24 MET H H 1 7.596 0.002 . 1 . . . . A 24 MET H . 30682 1
257 . 1 . 1 24 24 MET HA H 1 4.367 0.001 . 1 . . . . A 24 MET HA . 30682 1
258 . 1 . 1 24 24 MET HB2 H 1 2.221 0.002 . 2 . . . . A 24 MET HB2 . 30682 1
259 . 1 . 1 24 24 MET HB3 H 1 2.023 0.005 . 2 . . . . A 24 MET HB3 . 30682 1
260 . 1 . 1 24 24 MET HG2 H 1 2.681 0.005 . 2 . . . . A 24 MET HG2 . 30682 1
261 . 1 . 1 24 24 MET HG3 H 1 2.550 0.009 . 2 . . . . A 24 MET HG3 . 30682 1
262 . 1 . 1 24 24 MET HE1 H 1 2.056 0.001 . 1 . . . . A 24 MET HE1 . 30682 1
263 . 1 . 1 24 24 MET HE2 H 1 2.056 0.001 . 1 . . . . A 24 MET HE2 . 30682 1
264 . 1 . 1 24 24 MET HE3 H 1 2.056 0.001 . 1 . . . . A 24 MET HE3 . 30682 1
265 . 1 . 1 24 24 MET C C 13 175.979 0.013 . 1 . . . . A 24 MET C . 30682 1
266 . 1 . 1 24 24 MET CA C 13 55.917 0.004 . 1 . . . . A 24 MET CA . 30682 1
267 . 1 . 1 24 24 MET CB C 13 32.912 0.016 . 1 . . . . A 24 MET CB . 30682 1
268 . 1 . 1 24 24 MET CG C 13 31.929 0.029 . 1 . . . . A 24 MET CG . 30682 1
269 . 1 . 1 24 24 MET CE C 13 16.660 0.031 . 1 . . . . A 24 MET CE . 30682 1
270 . 1 . 1 24 24 MET N N 15 115.098 0.016 . 1 . . . . A 24 MET N . 30682 1
271 . 1 . 1 25 25 SER H H 1 7.563 0.003 . 1 . . . . A 25 SER H . 30682 1
272 . 1 . 1 25 25 SER HA H 1 4.603 0.004 . 1 . . . . A 25 SER HA . 30682 1
273 . 1 . 1 25 25 SER HB2 H 1 4.198 0.001 . 1 . . . . A 25 SER HB2 . 30682 1
274 . 1 . 1 25 25 SER HB3 H 1 4.198 0.001 . 1 . . . . A 25 SER HB3 . 30682 1
275 . 1 . 1 25 25 SER C C 13 175.016 0.030 . 1 . . . . A 25 SER C . 30682 1
276 . 1 . 1 25 25 SER CA C 13 58.600 0.011 . 1 . . . . A 25 SER CA . 30682 1
277 . 1 . 1 25 25 SER CB C 13 65.831 0.031 . 1 . . . . A 25 SER CB . 30682 1
278 . 1 . 1 25 25 SER N N 15 116.072 0.027 . 1 . . . . A 25 SER N . 30682 1
279 . 1 . 1 26 26 ASP H H 1 8.882 0.006 . 1 . . . . A 26 ASP H . 30682 1
280 . 1 . 1 26 26 ASP HA H 1 4.473 0.005 . 1 . . . . A 26 ASP HA . 30682 1
281 . 1 . 1 26 26 ASP HB2 H 1 2.744 0.001 . 1 . . . . A 26 ASP HB2 . 30682 1
282 . 1 . 1 26 26 ASP HB3 H 1 2.744 0.001 . 1 . . . . A 26 ASP HB3 . 30682 1
283 . 1 . 1 26 26 ASP C C 13 176.898 0.000 . 1 . . . . A 26 ASP C . 30682 1
284 . 1 . 1 26 26 ASP CA C 13 55.993 0.013 . 1 . . . . A 26 ASP CA . 30682 1
285 . 1 . 1 26 26 ASP CB C 13 40.119 0.005 . 1 . . . . A 26 ASP CB . 30682 1
286 . 1 . 1 26 26 ASP N N 15 120.970 0.015 . 1 . . . . A 26 ASP N . 30682 1
287 . 1 . 1 27 27 SER H H 1 8.156 0.003 . 1 . . . . A 27 SER H . 30682 1
288 . 1 . 1 27 27 SER HA H 1 4.398 0.003 . 1 . . . . A 27 SER HA . 30682 1
289 . 1 . 1 27 27 SER HB2 H 1 3.912 0.002 . 1 . . . . A 27 SER HB2 . 30682 1
290 . 1 . 1 27 27 SER HB3 H 1 3.912 0.002 . 1 . . . . A 27 SER HB3 . 30682 1
291 . 1 . 1 27 27 SER C C 13 172.995 0.012 . 1 . . . . A 27 SER C . 30682 1
292 . 1 . 1 27 27 SER CA C 13 60.642 0.016 . 1 . . . . A 27 SER CA . 30682 1
293 . 1 . 1 27 27 SER CB C 13 63.284 0.004 . 1 . . . . A 27 SER CB . 30682 1
294 . 1 . 1 27 27 SER N N 15 114.860 0.099 . 1 . . . . A 27 SER N . 30682 1
295 . 1 . 1 28 28 CYS H H 1 7.650 0.004 . 1 . . . . A 28 CYS H . 30682 1
296 . 1 . 1 28 28 CYS HA H 1 4.747 0.012 . 1 . . . . A 28 CYS HA . 30682 1
297 . 1 . 1 28 28 CYS HB2 H 1 3.277 0.005 . 2 . . . . A 28 CYS HB2 . 30682 1
298 . 1 . 1 28 28 CYS HB3 H 1 3.164 0.008 . 2 . . . . A 28 CYS HB3 . 30682 1
299 . 1 . 1 28 28 CYS C C 13 172.262 0.000 . 1 . . . . A 28 CYS C . 30682 1
300 . 1 . 1 28 28 CYS CA C 13 54.107 0.006 . 1 . . . . A 28 CYS CA . 30682 1
301 . 1 . 1 28 28 CYS CB C 13 36.523 0.067 . 1 . . . . A 28 CYS CB . 30682 1
302 . 1 . 1 28 28 CYS N N 15 118.981 0.030 . 1 . . . . A 28 CYS N . 30682 1
303 . 1 . 1 29 29 HIS H H 1 8.389 0.004 . 1 . . . . A 29 HIS H . 30682 1
304 . 1 . 1 29 29 HIS HA H 1 5.075 0.005 . 1 . . . . A 29 HIS HA . 30682 1
305 . 1 . 1 29 29 HIS HB2 H 1 3.500 0.008 . 2 . . . . A 29 HIS HB2 . 30682 1
306 . 1 . 1 29 29 HIS HB3 H 1 3.107 0.004 . 2 . . . . A 29 HIS HB3 . 30682 1
307 . 1 . 1 29 29 HIS HD2 H 1 7.227 0.003 . 1 . . . . A 29 HIS HD2 . 30682 1
308 . 1 . 1 29 29 HIS HE1 H 1 8.543 0.002 . 1 . . . . A 29 HIS HE1 . 30682 1
309 . 1 . 1 29 29 HIS C C 13 172.288 0.000 . 1 . . . . A 29 HIS C . 30682 1
310 . 1 . 1 29 29 HIS CA C 13 54.885 0.071 . 1 . . . . A 29 HIS CA . 30682 1
311 . 1 . 1 29 29 HIS CB C 13 30.063 0.018 . 1 . . . . A 29 HIS CB . 30682 1
312 . 1 . 1 29 29 HIS CE1 C 13 136.923 0.000 . 1 . . . . A 29 HIS CE1 . 30682 1
313 . 1 . 1 29 29 HIS N N 15 119.837 0.025 . 1 . . . . A 29 HIS N . 30682 1
314 . 1 . 1 30 30 ASP H H 1 7.973 0.002 . 1 . . . . A 30 ASP H . 30682 1
315 . 1 . 1 30 30 ASP HA H 1 3.839 0.004 . 1 . . . . A 30 ASP HA . 30682 1
316 . 1 . 1 30 30 ASP HB2 H 1 3.261 0.002 . 2 . . . . A 30 ASP HB2 . 30682 1
317 . 1 . 1 30 30 ASP HB3 H 1 2.928 0.002 . 2 . . . . A 30 ASP HB3 . 30682 1
318 . 1 . 1 30 30 ASP C C 13 174.435 0.001 . 1 . . . . A 30 ASP C . 30682 1
319 . 1 . 1 30 30 ASP CA C 13 53.178 0.010 . 1 . . . . A 30 ASP CA . 30682 1
320 . 1 . 1 30 30 ASP CB C 13 39.915 0.027 . 1 . . . . A 30 ASP CB . 30682 1
321 . 1 . 1 30 30 ASP N N 15 119.565 0.017 . 1 . . . . A 30 ASP N . 30682 1
322 . 1 . 1 31 31 GLU H H 1 8.899 0.002 . 1 . . . . A 31 GLU H . 30682 1
323 . 1 . 1 31 31 GLU HA H 1 3.810 0.002 . 1 . . . . A 31 GLU HA . 30682 1
324 . 1 . 1 31 31 GLU HB2 H 1 1.969 0.004 . 1 . . . . A 31 GLU HB2 . 30682 1
325 . 1 . 1 31 31 GLU HB3 H 1 1.969 0.004 . 1 . . . . A 31 GLU HB3 . 30682 1
326 . 1 . 1 31 31 GLU HG2 H 1 2.195 0.002 . 1 . . . . A 31 GLU HG2 . 30682 1
327 . 1 . 1 31 31 GLU HG3 H 1 2.195 0.002 . 1 . . . . A 31 GLU HG3 . 30682 1
328 . 1 . 1 31 31 GLU C C 13 178.868 0.000 . 1 . . . . A 31 GLU C . 30682 1
329 . 1 . 1 31 31 GLU CA C 13 61.117 0.017 . 1 . . . . A 31 GLU CA . 30682 1
330 . 1 . 1 31 31 GLU CB C 13 29.439 0.019 . 1 . . . . A 31 GLU CB . 30682 1
331 . 1 . 1 31 31 GLU CG C 13 36.465 0.012 . 1 . . . . A 31 GLU CG . 30682 1
332 . 1 . 1 31 31 GLU N N 15 119.880 0.016 . 1 . . . . A 31 GLU N . 30682 1
333 . 1 . 1 32 32 GLN H H 1 8.548 0.001 . 1 . . . . A 32 GLN H . 30682 1
334 . 1 . 1 32 32 GLN HA H 1 4.120 0.006 . 1 . . . . A 32 GLN HA . 30682 1
335 . 1 . 1 32 32 GLN HB2 H 1 2.149 0.003 . 2 . . . . A 32 GLN HB2 . 30682 1
336 . 1 . 1 32 32 GLN HB3 H 1 2.090 0.001 . 2 . . . . A 32 GLN HB3 . 30682 1
337 . 1 . 1 32 32 GLN HG2 H 1 2.476 0.006 . 1 . . . . A 32 GLN HG2 . 30682 1
338 . 1 . 1 32 32 GLN HG3 H 1 2.476 0.006 . 1 . . . . A 32 GLN HG3 . 30682 1
339 . 1 . 1 32 32 GLN HE21 H 1 7.641 0.001 . 1 . . . . A 32 GLN HE21 . 30682 1
340 . 1 . 1 32 32 GLN HE22 H 1 6.871 0.003 . 1 . . . . A 32 GLN HE22 . 30682 1
341 . 1 . 1 32 32 GLN C C 13 178.836 0.000 . 1 . . . . A 32 GLN C . 30682 1
342 . 1 . 1 32 32 GLN CA C 13 59.537 0.007 . 1 . . . . A 32 GLN CA . 30682 1
343 . 1 . 1 32 32 GLN CB C 13 28.311 0.008 . 1 . . . . A 32 GLN CB . 30682 1
344 . 1 . 1 32 32 GLN CG C 13 34.059 0.020 . 1 . . . . A 32 GLN CG . 30682 1
345 . 1 . 1 32 32 GLN N N 15 118.530 0.053 . 1 . . . . A 32 GLN N . 30682 1
346 . 1 . 1 32 32 GLN NE2 N 15 112.230 0.007 . 1 . . . . A 32 GLN NE2 . 30682 1
347 . 1 . 1 33 33 SER H H 1 8.765 0.002 . 1 . . . . A 33 SER H . 30682 1
348 . 1 . 1 33 33 SER HA H 1 4.238 0.004 . 1 . . . . A 33 SER HA . 30682 1
349 . 1 . 1 33 33 SER HB2 H 1 3.765 0.001 . 1 . . . . A 33 SER HB2 . 30682 1
350 . 1 . 1 33 33 SER HB3 H 1 3.765 0.001 . 1 . . . . A 33 SER HB3 . 30682 1
351 . 1 . 1 33 33 SER C C 13 178.289 0.000 . 1 . . . . A 33 SER C . 30682 1
352 . 1 . 1 33 33 SER CA C 13 61.608 0.018 . 1 . . . . A 33 SER CA . 30682 1
353 . 1 . 1 33 33 SER CB C 13 62.149 0.043 . 1 . . . . A 33 SER CB . 30682 1
354 . 1 . 1 33 33 SER N N 15 117.600 0.023 . 1 . . . . A 33 SER N . 30682 1
355 . 1 . 1 34 34 CYS H H 1 8.472 0.002 . 1 . . . . A 34 CYS H . 30682 1
356 . 1 . 1 34 34 CYS HA H 1 4.443 0.001 . 1 . . . . A 34 CYS HA . 30682 1
357 . 1 . 1 34 34 CYS HB2 H 1 3.292 0.002 . 1 . . . . A 34 CYS HB2 . 30682 1
358 . 1 . 1 34 34 CYS HB3 H 1 3.292 0.002 . 1 . . . . A 34 CYS HB3 . 30682 1
359 . 1 . 1 34 34 CYS C C 13 177.226 0.000 . 1 . . . . A 34 CYS C . 30682 1
360 . 1 . 1 34 34 CYS CA C 13 60.103 0.019 . 1 . . . . A 34 CYS CA . 30682 1
361 . 1 . 1 34 34 CYS CB C 13 43.990 0.021 . 1 . . . . A 34 CYS CB . 30682 1
362 . 1 . 1 34 34 CYS N N 15 121.689 0.053 . 1 . . . . A 34 CYS N . 30682 1
363 . 1 . 1 35 35 HIS H H 1 8.304 0.001 . 1 . . . . A 35 HIS H . 30682 1
364 . 1 . 1 35 35 HIS HA H 1 4.648 0.005 . 1 . . . . A 35 HIS HA . 30682 1
365 . 1 . 1 35 35 HIS HB2 H 1 3.479 0.004 . 1 . . . . A 35 HIS HB2 . 30682 1
366 . 1 . 1 35 35 HIS HB3 H 1 3.479 0.004 . 1 . . . . A 35 HIS HB3 . 30682 1
367 . 1 . 1 35 35 HIS HD2 H 1 7.249 0.002 . 1 . . . . A 35 HIS HD2 . 30682 1
368 . 1 . 1 35 35 HIS HE1 H 1 8.282 0.001 . 1 . . . . A 35 HIS HE1 . 30682 1
369 . 1 . 1 35 35 HIS C C 13 177.398 0.000 . 1 . . . . A 35 HIS C . 30682 1
370 . 1 . 1 35 35 HIS CA C 13 59.644 0.030 . 1 . . . . A 35 HIS CA . 30682 1
371 . 1 . 1 35 35 HIS CB C 13 28.711 0.043 . 1 . . . . A 35 HIS CB . 30682 1
372 . 1 . 1 35 35 HIS CE1 C 13 137.310 0.000 . 1 . . . . A 35 HIS CE1 . 30682 1
373 . 1 . 1 35 35 HIS N N 15 120.861 0.050 . 1 . . . . A 35 HIS N . 30682 1
374 . 1 . 1 36 36 GLN H H 1 8.055 0.002 . 1 . . . . A 36 GLN H . 30682 1
375 . 1 . 1 36 36 GLN HA H 1 4.081 0.003 . 1 . . . . A 36 GLN HA . 30682 1
376 . 1 . 1 36 36 GLN HB2 H 1 2.237 0.002 . 2 . . . . A 36 GLN HB2 . 30682 1
377 . 1 . 1 36 36 GLN HB3 H 1 2.348 0.002 . 2 . . . . A 36 GLN HB3 . 30682 1
378 . 1 . 1 36 36 GLN HG2 H 1 2.592 0.005 . 1 . . . . A 36 GLN HG2 . 30682 1
379 . 1 . 1 36 36 GLN HG3 H 1 2.592 0.005 . 1 . . . . A 36 GLN HG3 . 30682 1
380 . 1 . 1 36 36 GLN HE21 H 1 7.021 0.001 . 1 . . . . A 36 GLN HE21 . 30682 1
381 . 1 . 1 36 36 GLN HE22 H 1 7.680 0.001 . 1 . . . . A 36 GLN HE22 . 30682 1
382 . 1 . 1 36 36 GLN C C 13 178.176 0.016 . 1 . . . . A 36 GLN C . 30682 1
383 . 1 . 1 36 36 GLN CA C 13 58.729 0.057 . 1 . . . . A 36 GLN CA . 30682 1
384 . 1 . 1 36 36 GLN CB C 13 27.816 0.014 . 1 . . . . A 36 GLN CB . 30682 1
385 . 1 . 1 36 36 GLN CG C 13 33.725 0.073 . 1 . . . . A 36 GLN CG . 30682 1
386 . 1 . 1 36 36 GLN N N 15 117.614 0.022 . 1 . . . . A 36 GLN N . 30682 1
387 . 1 . 1 36 36 GLN NE2 N 15 112.493 0.009 . 1 . . . . A 36 GLN NE2 . 30682 1
388 . 1 . 1 37 37 CYS H H 1 7.790 0.004 . 1 . . . . A 37 CYS H . 30682 1
389 . 1 . 1 37 37 CYS HA H 1 4.559 0.001 . 1 . . . . A 37 CYS HA . 30682 1
390 . 1 . 1 37 37 CYS HB2 H 1 3.331 0.007 . 2 . . . . A 37 CYS HB2 . 30682 1
391 . 1 . 1 37 37 CYS HB3 H 1 3.131 0.002 . 2 . . . . A 37 CYS HB3 . 30682 1
392 . 1 . 1 37 37 CYS C C 13 178.218 0.015 . 1 . . . . A 37 CYS C . 30682 1
393 . 1 . 1 37 37 CYS CA C 13 56.221 0.021 . 1 . . . . A 37 CYS CA . 30682 1
394 . 1 . 1 37 37 CYS CB C 13 35.636 0.016 . 1 . . . . A 37 CYS CB . 30682 1
395 . 1 . 1 37 37 CYS N N 15 115.695 0.027 . 1 . . . . A 37 CYS N . 30682 1
396 . 1 . 1 38 38 HIS H H 1 7.673 0.002 . 1 . . . . A 38 HIS H . 30682 1
397 . 1 . 1 38 38 HIS HA H 1 4.329 0.005 . 1 . . . . A 38 HIS HA . 30682 1
398 . 1 . 1 38 38 HIS HB2 H 1 3.478 0.002 . 2 . . . . A 38 HIS HB2 . 30682 1
399 . 1 . 1 38 38 HIS HB3 H 1 3.379 0.002 . 2 . . . . A 38 HIS HB3 . 30682 1
400 . 1 . 1 38 38 HIS HD2 H 1 7.049 0.002 . 1 . . . . A 38 HIS HD2 . 30682 1
401 . 1 . 1 38 38 HIS HE1 H 1 8.083 0.001 . 1 . . . . A 38 HIS HE1 . 30682 1
402 . 1 . 1 38 38 HIS C C 13 176.886 0.000 . 1 . . . . A 38 HIS C . 30682 1
403 . 1 . 1 38 38 HIS CA C 13 59.801 0.018 . 1 . . . . A 38 HIS CA . 30682 1
404 . 1 . 1 38 38 HIS CB C 13 29.617 0.012 . 1 . . . . A 38 HIS CB . 30682 1
405 . 1 . 1 38 38 HIS CE1 C 13 138.273 0.000 . 1 . . . . A 38 HIS CE1 . 30682 1
406 . 1 . 1 38 38 HIS N N 15 121.653 0.017 . 1 . . . . A 38 HIS N . 30682 1
407 . 1 . 1 39 39 VAL H H 1 7.901 0.003 . 1 . . . . A 39 VAL H . 30682 1
408 . 1 . 1 39 39 VAL HA H 1 3.572 0.004 . 1 . . . . A 39 VAL HA . 30682 1
409 . 1 . 1 39 39 VAL HB H 1 2.069 0.001 . 1 . . . . A 39 VAL HB . 30682 1
410 . 1 . 1 39 39 VAL HG11 H 1 0.934 0.002 . 2 . . . . A 39 VAL HG11 . 30682 1
411 . 1 . 1 39 39 VAL HG12 H 1 0.934 0.002 . 2 . . . . A 39 VAL HG12 . 30682 1
412 . 1 . 1 39 39 VAL HG13 H 1 0.934 0.002 . 2 . . . . A 39 VAL HG13 . 30682 1
413 . 1 . 1 39 39 VAL HG21 H 1 0.813 0.003 . 2 . . . . A 39 VAL HG21 . 30682 1
414 . 1 . 1 39 39 VAL HG22 H 1 0.813 0.003 . 2 . . . . A 39 VAL HG22 . 30682 1
415 . 1 . 1 39 39 VAL HG23 H 1 0.813 0.003 . 2 . . . . A 39 VAL HG23 . 30682 1
416 . 1 . 1 39 39 VAL C C 13 178.468 0.000 . 1 . . . . A 39 VAL C . 30682 1
417 . 1 . 1 39 39 VAL CA C 13 66.720 0.020 . 1 . . . . A 39 VAL CA . 30682 1
418 . 1 . 1 39 39 VAL CB C 13 32.051 0.016 . 1 . . . . A 39 VAL CB . 30682 1
419 . 1 . 1 39 39 VAL CG1 C 13 21.106 0.003 . 2 . . . . A 39 VAL CG1 . 30682 1
420 . 1 . 1 39 39 VAL CG2 C 13 22.148 0.004 . 2 . . . . A 39 VAL CG2 . 30682 1
421 . 1 . 1 39 39 VAL N N 15 121.808 0.076 . 1 . . . . A 39 VAL N . 30682 1
422 . 1 . 1 40 40 LYS H H 1 8.139 0.002 . 1 . . . . A 40 LYS H . 30682 1
423 . 1 . 1 40 40 LYS HA H 1 4.109 0.002 . 1 . . . . A 40 LYS HA . 30682 1
424 . 1 . 1 40 40 LYS HB2 H 1 1.897 0.008 . 1 . . . . A 40 LYS HB2 . 30682 1
425 . 1 . 1 40 40 LYS HB3 H 1 1.898 0.008 . 1 . . . . A 40 LYS HB3 . 30682 1
426 . 1 . 1 40 40 LYS HG2 H 1 1.598 0.003 . 1 . . . . A 40 LYS HG2 . 30682 1
427 . 1 . 1 40 40 LYS HG3 H 1 1.598 0.003 . 1 . . . . A 40 LYS HG3 . 30682 1
428 . 1 . 1 40 40 LYS HD2 H 1 1.650 0.001 . 2 . . . . A 40 LYS HD2 . 30682 1
429 . 1 . 1 40 40 LYS HD3 H 1 1.687 0.051 . 2 . . . . A 40 LYS HD3 . 30682 1
430 . 1 . 1 40 40 LYS HE2 H 1 2.939 0.012 . 1 . . . . A 40 LYS HE2 . 30682 1
431 . 1 . 1 40 40 LYS HE3 H 1 2.939 0.012 . 1 . . . . A 40 LYS HE3 . 30682 1
432 . 1 . 1 40 40 LYS C C 13 179.099 0.002 . 1 . . . . A 40 LYS C . 30682 1
433 . 1 . 1 40 40 LYS CA C 13 59.328 0.010 . 1 . . . . A 40 LYS CA . 30682 1
434 . 1 . 1 40 40 LYS CB C 13 32.548 0.015 . 1 . . . . A 40 LYS CB . 30682 1
435 . 1 . 1 40 40 LYS CG C 13 26.017 0.000 . 1 . . . . A 40 LYS CG . 30682 1
436 . 1 . 1 40 40 LYS CD C 13 29.147 0.003 . 1 . . . . A 40 LYS CD . 30682 1
437 . 1 . 1 40 40 LYS CE C 13 42.206 0.000 . 1 . . . . A 40 LYS CE . 30682 1
438 . 1 . 1 40 40 LYS N N 15 117.676 0.033 . 1 . . . . A 40 LYS N . 30682 1
439 . 1 . 1 41 41 HIS H H 1 7.806 0.002 . 1 . . . . A 41 HIS H . 30682 1
440 . 1 . 1 41 41 HIS HA H 1 4.705 0.003 . 1 . . . . A 41 HIS HA . 30682 1
441 . 1 . 1 41 41 HIS HB2 H 1 3.147 0.002 . 2 . . . . A 41 HIS HB2 . 30682 1
442 . 1 . 1 41 41 HIS HB3 H 1 2.939 0.003 . 2 . . . . A 41 HIS HB3 . 30682 1
443 . 1 . 1 41 41 HIS HD2 H 1 6.749 0.002 . 1 . . . . A 41 HIS HD2 . 30682 1
444 . 1 . 1 41 41 HIS HE1 H 1 7.625 0.001 . 1 . . . . A 41 HIS HE1 . 30682 1
445 . 1 . 1 41 41 HIS C C 13 176.493 0.000 . 1 . . . . A 41 HIS C . 30682 1
446 . 1 . 1 41 41 HIS CA C 13 60.454 0.023 . 1 . . . . A 41 HIS CA . 30682 1
447 . 1 . 1 41 41 HIS CB C 13 29.701 0.006 . 1 . . . . A 41 HIS CB . 30682 1
448 . 1 . 1 41 41 HIS CD2 C 13 121.553 0.000 . 1 . . . . A 41 HIS CD2 . 30682 1
449 . 1 . 1 41 41 HIS CE1 C 13 138.224 0.000 . 1 . . . . A 41 HIS CE1 . 30682 1
450 . 1 . 1 41 41 HIS N N 15 121.981 0.045 . 1 . . . . A 41 HIS N . 30682 1
451 . 1 . 1 42 42 THR H H 1 8.387 0.002 . 1 . . . . A 42 THR H . 30682 1
452 . 1 . 1 42 42 THR HA H 1 3.662 0.004 . 1 . . . . A 42 THR HA . 30682 1
453 . 1 . 1 42 42 THR HB H 1 4.280 0.004 . 1 . . . . A 42 THR HB . 30682 1
454 . 1 . 1 42 42 THR HG21 H 1 1.178 0.005 . 1 . . . . A 42 THR HG21 . 30682 1
455 . 1 . 1 42 42 THR HG22 H 1 1.178 0.005 . 1 . . . . A 42 THR HG22 . 30682 1
456 . 1 . 1 42 42 THR HG23 H 1 1.178 0.005 . 1 . . . . A 42 THR HG23 . 30682 1
457 . 1 . 1 42 42 THR C C 13 175.727 0.000 . 1 . . . . A 42 THR C . 30682 1
458 . 1 . 1 42 42 THR CA C 13 66.575 0.050 . 1 . . . . A 42 THR CA . 30682 1
459 . 1 . 1 42 42 THR CB C 13 68.770 0.013 . 1 . . . . A 42 THR CB . 30682 1
460 . 1 . 1 42 42 THR CG2 C 13 22.133 0.005 . 1 . . . . A 42 THR CG2 . 30682 1
461 . 1 . 1 42 42 THR N N 15 117.663 0.027 . 1 . . . . A 42 THR N . 30682 1
462 . 1 . 1 43 43 ASP H H 1 8.015 0.001 . 1 . . . . A 43 ASP H . 30682 1
463 . 1 . 1 43 43 ASP HA H 1 4.362 0.003 . 1 . . . . A 43 ASP HA . 30682 1
464 . 1 . 1 43 43 ASP HB2 H 1 2.650 0.004 . 1 . . . . A 43 ASP HB2 . 30682 1
465 . 1 . 1 43 43 ASP HB3 H 1 2.651 0.004 . 1 . . . . A 43 ASP HB3 . 30682 1
466 . 1 . 1 43 43 ASP C C 13 177.453 0.000 . 1 . . . . A 43 ASP C . 30682 1
467 . 1 . 1 43 43 ASP CA C 13 57.789 0.034 . 1 . . . . A 43 ASP CA . 30682 1
468 . 1 . 1 43 43 ASP CB C 13 40.968 0.006 . 1 . . . . A 43 ASP CB . 30682 1
469 . 1 . 1 43 43 ASP N N 15 120.720 0.035 . 1 . . . . A 43 ASP N . 30682 1
470 . 1 . 1 44 44 CYS H H 1 8.164 0.003 . 1 . . . . A 44 CYS H . 30682 1
471 . 1 . 1 44 44 CYS HA H 1 4.074 0.005 . 1 . . . . A 44 CYS HA . 30682 1
472 . 1 . 1 44 44 CYS HB2 H 1 3.489 0.005 . 2 . . . . A 44 CYS HB2 . 30682 1
473 . 1 . 1 44 44 CYS HB3 H 1 3.151 0.005 . 2 . . . . A 44 CYS HB3 . 30682 1
474 . 1 . 1 44 44 CYS C C 13 177.403 0.000 . 1 . . . . A 44 CYS C . 30682 1
475 . 1 . 1 44 44 CYS CA C 13 60.915 0.032 . 1 . . . . A 44 CYS CA . 30682 1
476 . 1 . 1 44 44 CYS CB C 13 37.202 0.021 . 1 . . . . A 44 CYS CB . 30682 1
477 . 1 . 1 44 44 CYS N N 15 122.145 0.066 . 1 . . . . A 44 CYS N . 30682 1
478 . 1 . 1 45 45 VAL H H 1 8.099 0.001 . 1 . . . . A 45 VAL H . 30682 1
479 . 1 . 1 45 45 VAL HA H 1 3.745 0.005 . 1 . . . . A 45 VAL HA . 30682 1
480 . 1 . 1 45 45 VAL HB H 1 1.847 0.003 . 1 . . . . A 45 VAL HB . 30682 1
481 . 1 . 1 45 45 VAL HG11 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG11 . 30682 1
482 . 1 . 1 45 45 VAL HG12 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG12 . 30682 1
483 . 1 . 1 45 45 VAL HG13 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG13 . 30682 1
484 . 1 . 1 45 45 VAL HG21 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG21 . 30682 1
485 . 1 . 1 45 45 VAL HG22 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG22 . 30682 1
486 . 1 . 1 45 45 VAL HG23 H 1 0.652 0.004 . 1 . . . . A 45 VAL HG23 . 30682 1
487 . 1 . 1 45 45 VAL C C 13 177.923 0.000 . 1 . . . . A 45 VAL C . 30682 1
488 . 1 . 1 45 45 VAL CA C 13 64.965 0.036 . 1 . . . . A 45 VAL CA . 30682 1
489 . 1 . 1 45 45 VAL CB C 13 31.771 0.012 . 1 . . . . A 45 VAL CB . 30682 1
490 . 1 . 1 45 45 VAL CG1 C 13 22.135 0.007 . 1 . . . . A 45 VAL CG1 . 30682 1
491 . 1 . 1 45 45 VAL CG2 C 13 22.135 0.007 . 1 . . . . A 45 VAL CG2 . 30682 1
492 . 1 . 1 45 45 VAL N N 15 119.330 0.030 . 1 . . . . A 45 VAL N . 30682 1
493 . 1 . 1 46 46 ASN H H 1 8.545 0.002 . 1 . . . . A 46 ASN H . 30682 1
494 . 1 . 1 46 46 ASN HA H 1 4.361 0.004 . 1 . . . . A 46 ASN HA . 30682 1
495 . 1 . 1 46 46 ASN HB2 H 1 2.942 0.003 . 2 . . . . A 46 ASN HB2 . 30682 1
496 . 1 . 1 46 46 ASN HB3 H 1 2.748 0.001 . 2 . . . . A 46 ASN HB3 . 30682 1
497 . 1 . 1 46 46 ASN HD21 H 1 7.643 0.002 . 1 . . . . A 46 ASN HD21 . 30682 1
498 . 1 . 1 46 46 ASN HD22 H 1 6.879 0.003 . 1 . . . . A 46 ASN HD22 . 30682 1
499 . 1 . 1 46 46 ASN C C 13 177.520 0.000 . 1 . . . . A 46 ASN C . 30682 1
500 . 1 . 1 46 46 ASN CA C 13 56.006 0.008 . 1 . . . . A 46 ASN CA . 30682 1
501 . 1 . 1 46 46 ASN CB C 13 37.901 0.006 . 1 . . . . A 46 ASN CB . 30682 1
502 . 1 . 1 46 46 ASN N N 15 118.072 0.025 . 1 . . . . A 46 ASN N . 30682 1
503 . 1 . 1 46 46 ASN ND2 N 15 111.560 0.059 . 1 . . . . A 46 ASN ND2 . 30682 1
504 . 1 . 1 47 47 THR H H 1 7.921 0.005 . 1 . . . . A 47 THR H . 30682 1
505 . 1 . 1 47 47 THR HA H 1 4.177 0.005 . 1 . . . . A 47 THR HA . 30682 1
506 . 1 . 1 47 47 THR HB H 1 4.179 0.002 . 1 . . . . A 47 THR HB . 30682 1
507 . 1 . 1 47 47 THR HG21 H 1 1.244 0.002 . 1 . . . . A 47 THR HG21 . 30682 1
508 . 1 . 1 47 47 THR HG22 H 1 1.244 0.002 . 1 . . . . A 47 THR HG22 . 30682 1
509 . 1 . 1 47 47 THR HG23 H 1 1.244 0.002 . 1 . . . . A 47 THR HG23 . 30682 1
510 . 1 . 1 47 47 THR C C 13 175.671 0.029 . 1 . . . . A 47 THR C . 30682 1
511 . 1 . 1 47 47 THR CA C 13 64.776 0.015 . 1 . . . . A 47 THR CA . 30682 1
512 . 1 . 1 47 47 THR CB C 13 69.674 0.015 . 1 . . . . A 47 THR CB . 30682 1
513 . 1 . 1 47 47 THR CG2 C 13 21.479 0.000 . 1 . . . . A 47 THR CG2 . 30682 1
514 . 1 . 1 47 47 THR N N 15 110.489 0.067 . 1 . . . . A 47 THR N . 30682 1
515 . 1 . 1 48 48 GLY H H 1 7.501 0.003 . 1 . . . . A 48 GLY H . 30682 1
516 . 1 . 1 48 48 GLY HA2 H 1 4.359 0.003 . 2 . . . . A 48 GLY HA2 . 30682 1
517 . 1 . 1 48 48 GLY HA3 H 1 3.927 0.006 . 2 . . . . A 48 GLY HA3 . 30682 1
518 . 1 . 1 48 48 GLY C C 13 174.303 0.000 . 1 . . . . A 48 GLY C . 30682 1
519 . 1 . 1 48 48 GLY CA C 13 47.038 0.020 . 1 . . . . A 48 GLY CA . 30682 1
520 . 1 . 1 48 48 GLY N N 15 106.692 0.075 . 1 . . . . A 48 GLY N . 30682 1
521 . 1 . 1 49 49 CYS H H 1 9.070 0.001 . 1 . . . . A 49 CYS H . 30682 1
522 . 1 . 1 49 49 CYS HA H 1 5.123 0.003 . 1 . . . . A 49 CYS HA . 30682 1
523 . 1 . 1 49 49 CYS HB2 H 1 3.038 0.004 . 2 . . . . A 49 CYS HB2 . 30682 1
524 . 1 . 1 49 49 CYS HB3 H 1 2.462 0.005 . 2 . . . . A 49 CYS HB3 . 30682 1
525 . 1 . 1 49 49 CYS CA C 13 54.184 0.046 . 1 . . . . A 49 CYS CA . 30682 1
526 . 1 . 1 49 49 CYS CB C 13 39.705 0.026 . 1 . . . . A 49 CYS CB . 30682 1
527 . 1 . 1 49 49 CYS N N 15 115.586 0.036 . 1 . . . . A 49 CYS N . 30682 1
528 . 1 . 1 50 50 PRO HA H 1 4.240 0.000 . 1 . . . . A 50 PRO HA . 30682 1
529 . 1 . 1 50 50 PRO HB2 H 1 2.347 0.000 . 2 . . . . A 50 PRO HB2 . 30682 1
530 . 1 . 1 50 50 PRO HB3 H 1 2.058 0.000 . 2 . . . . A 50 PRO HB3 . 30682 1
531 . 1 . 1 50 50 PRO HG2 H 1 2.080 0.000 . 2 . . . . A 50 PRO HG2 . 30682 1
532 . 1 . 1 50 50 PRO HG3 H 1 2.045 0.000 . 2 . . . . A 50 PRO HG3 . 30682 1
533 . 1 . 1 50 50 PRO HD2 H 1 3.703 0.003 . 2 . . . . A 50 PRO HD2 . 30682 1
534 . 1 . 1 50 50 PRO HD3 H 1 3.591 0.001 . 2 . . . . A 50 PRO HD3 . 30682 1
535 . 1 . 1 50 50 PRO CA C 13 65.590 0.010 . 1 . . . . A 50 PRO CA . 30682 1
536 . 1 . 1 50 50 PRO CD C 13 50.444 0.010 . 1 . . . . A 50 PRO CD . 30682 1
stop_
save_