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 25605
_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 0.005
_Assigned_chem_shift_list.Chem_shift_13C_err 0.050
_Assigned_chem_shift_list.Chem_shift_15N_err 0.010
_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' 1 $sample_1 isotropic 25605 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 25605 1
3 '2D 1H-15N HSQC' 1 $sample_1 isotropic 25605 1
4 '2D 1H-13C HSQC' 2 $sample_2 isotropic 25605 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 2 2 GLY H H 1 8.644 0.002 . 1 . . . A 2 GLY H . 25605 1
2 . 1 1 2 2 GLY HA2 H 1 4.007 0.011 . 2 . . . A 2 GLY HA2 . 25605 1
3 . 1 1 2 2 GLY HA3 H 1 4.026 0.008 . 2 . . . A 2 GLY HA3 . 25605 1
4 . 1 1 2 2 GLY CA C 13 44.988 0.073 . 1 . . . A 2 GLY CA . 25605 1
5 . 1 1 2 2 GLY N N 15 109.098 0.010 . 1 . . . A 2 GLY N . 25605 1
6 . 1 1 3 3 VAL H H 1 8.031 0.002 . 1 . . . A 3 VAL H . 25605 1
7 . 1 1 3 3 VAL HA H 1 4.048 0.004 . 1 . . . A 3 VAL HA . 25605 1
8 . 1 1 3 3 VAL HB H 1 1.909 0.010 . 1 . . . A 3 VAL HB . 25605 1
9 . 1 1 3 3 VAL HG11 H 1 0.825 0.008 . 1 . . . A 3 VAL HG11 . 25605 1
10 . 1 1 3 3 VAL HG12 H 1 0.825 0.008 . 1 . . . A 3 VAL HG12 . 25605 1
11 . 1 1 3 3 VAL HG13 H 1 0.825 0.008 . 1 . . . A 3 VAL HG13 . 25605 1
12 . 1 1 3 3 VAL HG21 H 1 0.738 0.004 . 1 . . . A 3 VAL HG21 . 25605 1
13 . 1 1 3 3 VAL HG22 H 1 0.738 0.004 . 1 . . . A 3 VAL HG22 . 25605 1
14 . 1 1 3 3 VAL HG23 H 1 0.738 0.004 . 1 . . . A 3 VAL HG23 . 25605 1
15 . 1 1 3 3 VAL CA C 13 61.915 0.050 . 1 . . . A 3 VAL CA . 25605 1
16 . 1 1 3 3 VAL CG1 C 13 20.959 0.050 . 1 . . . A 3 VAL CG1 . 25605 1
17 . 1 1 3 3 VAL CG2 C 13 20.623 0.050 . 1 . . . A 3 VAL CG2 . 25605 1
18 . 1 1 3 3 VAL N N 15 119.869 0.010 . 1 . . . A 3 VAL N . 25605 1
19 . 1 1 4 4 LYS H H 1 8.548 0.003 . 1 . . . A 4 LYS H . 25605 1
20 . 1 1 4 4 LYS HA H 1 4.273 0.002 . 1 . . . A 4 LYS HA . 25605 1
21 . 1 1 4 4 LYS HB2 H 1 1.795 0.003 . 1 . . . A 4 LYS HB2 . 25605 1
22 . 1 1 4 4 LYS HB3 H 1 1.795 0.003 . 1 . . . A 4 LYS HB3 . 25605 1
23 . 1 1 4 4 LYS HG2 H 1 1.351 0.004 . 2 . . . A 4 LYS HG2 . 25605 1
24 . 1 1 4 4 LYS HG3 H 1 1.357 0.010 . 2 . . . A 4 LYS HG3 . 25605 1
25 . 1 1 4 4 LYS HD2 H 1 1.654 0.003 . 1 . . . A 4 LYS HD2 . 25605 1
26 . 1 1 4 4 LYS HD3 H 1 1.654 0.003 . 1 . . . A 4 LYS HD3 . 25605 1
27 . 1 1 4 4 LYS HE2 H 1 2.957 0.006 . 2 . . . A 4 LYS HE2 . 25605 1
28 . 1 1 4 4 LYS HE3 H 1 2.958 0.005 . 2 . . . A 4 LYS HE3 . 25605 1
29 . 1 1 4 4 LYS HZ1 H 1 7.487 0.001 . 1 . . . A 4 LYS HZ1 . 25605 1
30 . 1 1 4 4 LYS HZ2 H 1 7.487 0.001 . 1 . . . A 4 LYS HZ2 . 25605 1
31 . 1 1 4 4 LYS HZ3 H 1 7.487 0.001 . 1 . . . A 4 LYS HZ3 . 25605 1
32 . 1 1 4 4 LYS CA C 13 56.197 0.050 . 1 . . . A 4 LYS CA . 25605 1
33 . 1 1 4 4 LYS CB C 13 30.638 0.050 . 1 . . . A 4 LYS CB . 25605 1
34 . 1 1 4 4 LYS CG C 13 25.084 0.050 . 1 . . . A 4 LYS CG . 25605 1
35 . 1 1 4 4 LYS CD C 13 29.065 0.050 . 1 . . . A 4 LYS CD . 25605 1
36 . 1 1 4 4 LYS CE C 13 41.972 0.050 . 1 . . . A 4 LYS CE . 25605 1
37 . 1 1 5 5 LEU H H 1 8.198 0.005 . 1 . . . A 5 LEU H . 25605 1
38 . 1 1 5 5 LEU HA H 1 4.983 0.008 . 1 . . . A 5 LEU HA . 25605 1
39 . 1 1 5 5 LEU HB2 H 1 1.575 0.002 . 1 . . . A 5 LEU HB2 . 25605 1
40 . 1 1 5 5 LEU HB3 H 1 0.898 0.001 . 1 . . . A 5 LEU HB3 . 25605 1
41 . 1 1 5 5 LEU HG H 1 1.289 0.006 . 1 . . . A 5 LEU HG . 25605 1
42 . 1 1 5 5 LEU HD11 H 1 0.583 0.003 . 1 . . . A 5 LEU HD11 . 25605 1
43 . 1 1 5 5 LEU HD12 H 1 0.583 0.003 . 1 . . . A 5 LEU HD12 . 25605 1
44 . 1 1 5 5 LEU HD13 H 1 0.583 0.003 . 1 . . . A 5 LEU HD13 . 25605 1
45 . 1 1 5 5 LEU HD21 H 1 0.000 0.003 . 1 . . . A 5 LEU HD21 . 25605 1
46 . 1 1 5 5 LEU HD22 H 1 0.000 0.003 . 1 . . . A 5 LEU HD22 . 25605 1
47 . 1 1 5 5 LEU HD23 H 1 0.000 0.003 . 1 . . . A 5 LEU HD23 . 25605 1
48 . 1 1 5 5 LEU CA C 13 53.265 0.050 . 1 . . . A 5 LEU CA . 25605 1
49 . 1 1 5 5 LEU CB C 13 44.504 0.004 . 1 . . . A 5 LEU CB . 25605 1
50 . 1 1 5 5 LEU CG C 13 26.249 0.050 . 1 . . . A 5 LEU CG . 25605 1
51 . 1 1 5 5 LEU CD1 C 13 25.475 0.050 . 1 . . . A 5 LEU CD1 . 25605 1
52 . 1 1 5 5 LEU CD2 C 13 22.415 0.050 . 1 . . . A 5 LEU CD2 . 25605 1
53 . 1 1 5 5 LEU N N 15 123.800 0.010 . 1 . . . A 5 LEU N . 25605 1
54 . 1 1 6 6 CYS H H 1 9.409 0.001 . 1 . . . A 6 CYS H . 25605 1
55 . 1 1 6 6 CYS HA H 1 4.907 0.004 . 1 . . . A 6 CYS HA . 25605 1
56 . 1 1 6 6 CYS HB2 H 1 2.747 0.004 . 1 . . . A 6 CYS HB2 . 25605 1
57 . 1 1 6 6 CYS HB3 H 1 2.833 0.002 . 1 . . . A 6 CYS HB3 . 25605 1
58 . 1 1 6 6 CYS CA C 13 58.402 0.050 . 1 . . . A 6 CYS CA . 25605 1
59 . 1 1 6 6 CYS N N 15 121.818 0.010 . 1 . . . A 6 CYS N . 25605 1
60 . 1 1 7 7 ASP H H 1 8.504 0.003 . 1 . . . A 7 ASP H . 25605 1
61 . 1 1 7 7 ASP HA H 1 5.290 0.005 . 1 . . . A 7 ASP HA . 25605 1
62 . 1 1 7 7 ASP HB2 H 1 2.400 0.012 . 1 . . . A 7 ASP HB2 . 25605 1
63 . 1 1 7 7 ASP HB3 H 1 2.188 0.005 . 1 . . . A 7 ASP HB3 . 25605 1
64 . 1 1 7 7 ASP CA C 13 54.035 0.050 . 1 . . . A 7 ASP CA . 25605 1
65 . 1 1 7 7 ASP CB C 13 42.047 0.010 . 1 . . . A 7 ASP CB . 25605 1
66 . 1 1 7 7 ASP N N 15 128.015 0.010 . 1 . . . A 7 ASP N . 25605 1
67 . 1 1 8 8 VAL H H 1 9.341 0.002 . 1 . . . A 8 VAL H . 25605 1
68 . 1 1 8 8 VAL HA H 1 4.777 0.011 . 1 . . . A 8 VAL HA . 25605 1
69 . 1 1 8 8 VAL HB H 1 1.877 0.005 . 1 . . . A 8 VAL HB . 25605 1
70 . 1 1 8 8 VAL HG11 H 1 0.820 0.004 . 1 . . . A 8 VAL HG11 . 25605 1
71 . 1 1 8 8 VAL HG12 H 1 0.820 0.004 . 1 . . . A 8 VAL HG12 . 25605 1
72 . 1 1 8 8 VAL HG13 H 1 0.820 0.004 . 1 . . . A 8 VAL HG13 . 25605 1
73 . 1 1 8 8 VAL HG21 H 1 0.720 0.009 . 1 . . . A 8 VAL HG21 . 25605 1
74 . 1 1 8 8 VAL HG22 H 1 0.720 0.009 . 1 . . . A 8 VAL HG22 . 25605 1
75 . 1 1 8 8 VAL HG23 H 1 0.720 0.009 . 1 . . . A 8 VAL HG23 . 25605 1
76 . 1 1 8 8 VAL CB C 13 30.752 0.050 . 1 . . . A 8 VAL CB . 25605 1
77 . 1 1 8 8 VAL CG1 C 13 20.396 0.050 . 1 . . . A 8 VAL CG1 . 25605 1
78 . 1 1 8 8 VAL CG2 C 13 19.868 0.050 . 1 . . . A 8 VAL CG2 . 25605 1
79 . 1 1 8 8 VAL N N 15 121.916 0.010 . 1 . . . A 8 VAL N . 25605 1
80 . 1 1 9 9 PRO HA H 1 3.739 0.007 . 1 . . . A 9 PRO HA . 25605 1
81 . 1 1 9 9 PRO HB2 H 1 1.946 0.002 . 2 . . . A 9 PRO HB2 . 25605 1
82 . 1 1 9 9 PRO HB3 H 1 1.744 0.006 . 2 . . . A 9 PRO HB3 . 25605 1
83 . 1 1 9 9 PRO HG2 H 1 1.894 0.005 . 2 . . . A 9 PRO HG2 . 25605 1
84 . 1 1 9 9 PRO HG3 H 1 2.117 0.001 . 2 . . . A 9 PRO HG3 . 25605 1
85 . 1 1 9 9 PRO HD2 H 1 3.725 0.006 . 2 . . . A 9 PRO HD2 . 25605 1
86 . 1 1 9 9 PRO HD3 H 1 3.866 0.005 . 2 . . . A 9 PRO HD3 . 25605 1
87 . 1 1 9 9 PRO CA C 13 63.759 0.050 . 1 . . . A 9 PRO CA . 25605 1
88 . 1 1 9 9 PRO CB C 13 31.589 0.065 . 1 . . . A 9 PRO CB . 25605 1
89 . 1 1 9 9 PRO CG C 13 27.912 0.021 . 1 . . . A 9 PRO CG . 25605 1
90 . 1 1 9 9 PRO CD C 13 50.651 0.013 . 1 . . . A 9 PRO CD . 25605 1
91 . 1 1 10 10 SER H H 1 7.948 0.002 . 1 . . . A 10 SER H . 25605 1
92 . 1 1 10 10 SER HA H 1 4.528 0.004 . 1 . . . A 10 SER HA . 25605 1
93 . 1 1 10 10 SER HB2 H 1 3.526 0.002 . 2 . . . A 10 SER HB2 . 25605 1
94 . 1 1 10 10 SER HB3 H 1 3.926 0.001 . 2 . . . A 10 SER HB3 . 25605 1
95 . 1 1 10 10 SER CA C 13 58.298 0.050 . 1 . . . A 10 SER CA . 25605 1
96 . 1 1 10 10 SER CB C 13 63.746 0.050 . 1 . . . A 10 SER CB . 25605 1
97 . 1 1 10 10 SER N N 15 116.537 0.010 . 1 . . . A 10 SER N . 25605 1
98 . 1 1 11 11 GLY H H 1 10.294 0.003 . 1 . . . A 11 GLY H . 25605 1
99 . 1 1 11 11 GLY HA2 H 1 3.868 0.001 . 2 . . . A 11 GLY HA2 . 25605 1
100 . 1 1 11 11 GLY HA3 H 1 4.290 0.003 . 2 . . . A 11 GLY HA3 . 25605 1
101 . 1 1 11 11 GLY CA C 13 45.168 0.005 . 1 . . . A 11 GLY CA . 25605 1
102 . 1 1 12 12 THR H H 1 8.184 0.001 . 1 . . . A 12 THR H . 25605 1
103 . 1 1 12 12 THR HA H 1 4.490 0.006 . 1 . . . A 12 THR HA . 25605 1
104 . 1 1 12 12 THR HB H 1 4.119 0.005 . 1 . . . A 12 THR HB . 25605 1
105 . 1 1 12 12 THR HG21 H 1 1.069 0.002 . 1 . . . A 12 THR HG21 . 25605 1
106 . 1 1 12 12 THR HG22 H 1 1.069 0.002 . 1 . . . A 12 THR HG22 . 25605 1
107 . 1 1 12 12 THR HG23 H 1 1.069 0.002 . 1 . . . A 12 THR HG23 . 25605 1
108 . 1 1 12 12 THR CA C 13 62.040 0.050 . 1 . . . A 12 THR CA . 25605 1
109 . 1 1 12 12 THR CB C 13 69.828 0.050 . 1 . . . A 12 THR CB . 25605 1
110 . 1 1 12 12 THR CG2 C 13 21.623 0.050 . 1 . . . A 12 THR CG2 . 25605 1
111 . 1 1 12 12 THR N N 15 119.855 0.010 . 1 . . . A 12 THR N . 25605 1
112 . 1 1 13 13 TRP H H 1 8.069 0.003 . 1 . . . A 13 TRP H . 25605 1
113 . 1 1 13 13 TRP HA H 1 4.168 0.004 . 1 . . . A 13 TRP HA . 25605 1
114 . 1 1 13 13 TRP HB2 H 1 3.165 0.004 . 1 . . . A 13 TRP HB2 . 25605 1
115 . 1 1 13 13 TRP HB3 H 1 3.082 0.005 . 1 . . . A 13 TRP HB3 . 25605 1
116 . 1 1 13 13 TRP HD1 H 1 7.049 0.004 . 1 . . . A 13 TRP HD1 . 25605 1
117 . 1 1 13 13 TRP HE1 H 1 8.749 0.001 . 1 . . . A 13 TRP HE1 . 25605 1
118 . 1 1 13 13 TRP HE3 H 1 7.387 0.005 . 1 . . . A 13 TRP HE3 . 25605 1
119 . 1 1 13 13 TRP HZ2 H 1 7.768 0.009 . 1 . . . A 13 TRP HZ2 . 25605 1
120 . 1 1 13 13 TRP HZ3 H 1 6.852 0.004 . 1 . . . A 13 TRP HZ3 . 25605 1
121 . 1 1 13 13 TRP HH2 H 1 7.169 0.002 . 1 . . . A 13 TRP HH2 . 25605 1
122 . 1 1 13 13 TRP CA C 13 60.197 0.050 . 1 . . . A 13 TRP CA . 25605 1
123 . 1 1 13 13 TRP CB C 13 28.530 0.065 . 1 . . . A 13 TRP CB . 25605 1
124 . 1 1 13 13 TRP CD1 C 13 128.435 0.050 . 1 . . . A 13 TRP CD1 . 25605 1
125 . 1 1 13 13 TRP CE3 C 13 120.452 0.050 . 1 . . . A 13 TRP CE3 . 25605 1
126 . 1 1 13 13 TRP CZ2 C 13 114.414 0.050 . 1 . . . A 13 TRP CZ2 . 25605 1
127 . 1 1 13 13 TRP CZ3 C 13 121.173 0.050 . 1 . . . A 13 TRP CZ3 . 25605 1
128 . 1 1 13 13 TRP CH2 C 13 123.989 0.050 . 1 . . . A 13 TRP CH2 . 25605 1
129 . 1 1 13 13 TRP N N 15 125.473 0.010 . 1 . . . A 13 TRP N . 25605 1
130 . 1 1 14 14 SER H H 1 7.441 0.004 . 1 . . . A 14 SER H . 25605 1
131 . 1 1 14 14 SER HA H 1 4.575 0.003 . 1 . . . A 14 SER HA . 25605 1
132 . 1 1 14 14 SER HB2 H 1 3.548 0.008 . 2 . . . A 14 SER HB2 . 25605 1
133 . 1 1 14 14 SER HB3 H 1 3.569 0.011 . 2 . . . A 14 SER HB3 . 25605 1
134 . 1 1 14 14 SER CB C 13 64.433 0.050 . 1 . . . A 14 SER CB . 25605 1
135 . 1 1 14 14 SER N N 15 122.343 0.010 . 1 . . . A 14 SER N . 25605 1
136 . 1 1 15 15 GLY H H 1 8.331 0.005 . 1 . . . A 15 GLY H . 25605 1
137 . 1 1 15 15 GLY HA2 H 1 3.879 0.005 . 2 . . . A 15 GLY HA2 . 25605 1
138 . 1 1 15 15 GLY HA3 H 1 4.068 0.003 . 2 . . . A 15 GLY HA3 . 25605 1
139 . 1 1 15 15 GLY CA C 13 44.122 0.056 . 1 . . . A 15 GLY CA . 25605 1
140 . 1 1 15 15 GLY N N 15 110.941 0.010 . 1 . . . A 15 GLY N . 25605 1
141 . 1 1 16 16 HIS H H 1 8.824 0.003 . 1 . . . A 16 HIS H . 25605 1
142 . 1 1 16 16 HIS HA H 1 4.527 0.004 . 1 . . . A 16 HIS HA . 25605 1
143 . 1 1 16 16 HIS HB2 H 1 3.228 0.002 . 2 . . . A 16 HIS HB2 . 25605 1
144 . 1 1 16 16 HIS HB3 H 1 3.325 0.003 . 2 . . . A 16 HIS HB3 . 25605 1
145 . 1 1 16 16 HIS HD2 H 1 7.327 0.007 . 1 . . . A 16 HIS HD2 . 25605 1
146 . 1 1 16 16 HIS HE1 H 1 8.665 0.001 . 1 . . . A 16 HIS HE1 . 25605 1
147 . 1 1 16 16 HIS CD2 C 13 119.923 0.050 . 1 . . . A 16 HIS CD2 . 25605 1
148 . 1 1 16 16 HIS CE1 C 13 136.655 0.050 . 1 . . . A 16 HIS CE1 . 25605 1
149 . 1 1 16 16 HIS N N 15 118.837 0.010 . 1 . . . A 16 HIS N . 25605 1
150 . 1 1 17 17 CYS H H 1 8.287 0.006 . 1 . . . A 17 CYS H . 25605 1
151 . 1 1 17 17 CYS HA H 1 4.736 0.006 . 1 . . . A 17 CYS HA . 25605 1
152 . 1 1 17 17 CYS HB2 H 1 1.869 0.005 . 1 . . . A 17 CYS HB2 . 25605 1
153 . 1 1 17 17 CYS HB3 H 1 2.906 0.006 . 1 . . . A 17 CYS HB3 . 25605 1
154 . 1 1 17 17 CYS CA C 13 55.028 0.050 . 1 . . . A 17 CYS CA . 25605 1
155 . 1 1 17 17 CYS N N 15 128.452 0.010 . 1 . . . A 17 CYS N . 25605 1
156 . 1 1 18 18 GLY H H 1 8.502 0.005 . 1 . . . A 18 GLY H . 25605 1
157 . 1 1 18 18 GLY HA2 H 1 3.846 0.003 . 2 . . . A 18 GLY HA2 . 25605 1
158 . 1 1 18 18 GLY HA3 H 1 4.261 0.003 . 2 . . . A 18 GLY HA3 . 25605 1
159 . 1 1 18 18 GLY CA C 13 45.098 0.064 . 1 . . . A 18 GLY CA . 25605 1
160 . 1 1 18 18 GLY N N 15 114.186 0.010 . 1 . . . A 18 GLY N . 25605 1
161 . 1 1 19 19 SER H H 1 7.228 0.005 . 1 . . . A 19 SER H . 25605 1
162 . 1 1 19 19 SER HA H 1 4.830 0.010 . 1 . . . A 19 SER HA . 25605 1
163 . 1 1 19 19 SER HB2 H 1 3.776 0.004 . 1 . . . A 19 SER HB2 . 25605 1
164 . 1 1 19 19 SER HB3 H 1 4.041 0.004 . 1 . . . A 19 SER HB3 . 25605 1
165 . 1 1 19 19 SER CB C 13 63.432 0.100 . 1 . . . A 19 SER CB . 25605 1
166 . 1 1 19 19 SER N N 15 112.984 0.010 . 1 . . . A 19 SER N . 25605 1
167 . 1 1 20 20 SER H H 1 9.478 0.001 . 1 . . . A 20 SER H . 25605 1
168 . 1 1 20 20 SER HA H 1 4.207 0.006 . 1 . . . A 20 SER HA . 25605 1
169 . 1 1 20 20 SER HB2 H 1 4.046 0.006 . 1 . . . A 20 SER HB2 . 25605 1
170 . 1 1 20 20 SER HB3 H 1 4.046 0.006 . 1 . . . A 20 SER HB3 . 25605 1
171 . 1 1 20 20 SER CA C 13 59.683 0.050 . 1 . . . A 20 SER CA . 25605 1
172 . 1 1 20 20 SER CB C 13 62.922 0.050 . 1 . . . A 20 SER CB . 25605 1
173 . 1 1 20 20 SER N N 15 129.026 0.010 . 1 . . . A 20 SER N . 25605 1
174 . 1 1 21 21 SER H H 1 8.524 0.003 . 1 . . . A 21 SER H . 25605 1
175 . 1 1 21 21 SER HA H 1 4.273 0.007 . 1 . . . A 21 SER HA . 25605 1
176 . 1 1 21 21 SER HB2 H 1 3.873 0.007 . 1 . . . A 21 SER HB2 . 25605 1
177 . 1 1 21 21 SER HB3 H 1 3.873 0.007 . 1 . . . A 21 SER HB3 . 25605 1
178 . 1 1 21 21 SER CA C 13 59.245 0.050 . 1 . . . A 21 SER CA . 25605 1
179 . 1 1 21 21 SER CB C 13 63.806 0.050 . 1 . . . A 21 SER CB . 25605 1
180 . 1 1 22 22 LYS H H 1 7.911 0.002 . 1 . . . A 22 LYS H . 25605 1
181 . 1 1 22 22 LYS HA H 1 4.256 0.008 . 1 . . . A 22 LYS HA . 25605 1
182 . 1 1 22 22 LYS HB2 H 1 2.077 0.003 . 2 . . . A 22 LYS HB2 . 25605 1
183 . 1 1 22 22 LYS HB3 H 1 2.193 0.002 . 2 . . . A 22 LYS HB3 . 25605 1
184 . 1 1 22 22 LYS HG2 H 1 1.617 0.003 . 2 . . . A 22 LYS HG2 . 25605 1
185 . 1 1 22 22 LYS HG3 H 1 1.719 0.003 . 2 . . . A 22 LYS HG3 . 25605 1
186 . 1 1 22 22 LYS HD2 H 1 1.843 0.003 . 2 . . . A 22 LYS HD2 . 25605 1
187 . 1 1 22 22 LYS HD3 H 1 1.846 0.003 . 2 . . . A 22 LYS HD3 . 25605 1
188 . 1 1 22 22 LYS HE2 H 1 3.038 0.003 . 1 . . . A 22 LYS HE2 . 25605 1
189 . 1 1 22 22 LYS HE3 H 1 3.038 0.003 . 1 . . . A 22 LYS HE3 . 25605 1
190 . 1 1 22 22 LYS HZ1 H 1 7.597 0.005 . 1 . . . A 22 LYS HZ1 . 25605 1
191 . 1 1 22 22 LYS HZ2 H 1 7.597 0.005 . 1 . . . A 22 LYS HZ2 . 25605 1
192 . 1 1 22 22 LYS HZ3 H 1 7.597 0.005 . 1 . . . A 22 LYS HZ3 . 25605 1
193 . 1 1 22 22 LYS CA C 13 56.886 0.050 . 1 . . . A 22 LYS CA . 25605 1
194 . 1 1 22 22 LYS N N 15 124.019 0.010 . 1 . . . A 22 LYS N . 25605 1
195 . 1 1 23 23 CYS H H 1 7.600 0.004 . 1 . . . A 23 CYS H . 25605 1
196 . 1 1 23 23 CYS HA H 1 4.234 0.011 . 1 . . . A 23 CYS HA . 25605 1
197 . 1 1 23 23 CYS HB2 H 1 2.324 0.003 . 1 . . . A 23 CYS HB2 . 25605 1
198 . 1 1 23 23 CYS HB3 H 1 2.324 0.003 . 1 . . . A 23 CYS HB3 . 25605 1
199 . 1 1 23 23 CYS CA C 13 61.269 0.050 . 1 . . . A 23 CYS CA . 25605 1
200 . 1 1 23 23 CYS N N 15 119.457 0.010 . 1 . . . A 23 CYS N . 25605 1
201 . 1 1 24 24 SER H H 1 8.528 0.003 . 1 . . . A 24 SER H . 25605 1
202 . 1 1 24 24 SER HA H 1 4.284 0.007 . 1 . . . A 24 SER HA . 25605 1
203 . 1 1 24 24 SER HB2 H 1 3.677 0.003 . 2 . . . A 24 SER HB2 . 25605 1
204 . 1 1 24 24 SER HB3 H 1 4.152 0.005 . 2 . . . A 24 SER HB3 . 25605 1
205 . 1 1 25 25 GLN H H 1 8.063 0.005 . 1 . . . A 25 GLN H . 25605 1
206 . 1 1 25 25 GLN HA H 1 3.995 0.002 . 1 . . . A 25 GLN HA . 25605 1
207 . 1 1 25 25 GLN HB2 H 1 2.255 0.006 . 1 . . . A 25 GLN HB2 . 25605 1
208 . 1 1 25 25 GLN HB3 H 1 2.255 0.006 . 1 . . . A 25 GLN HB3 . 25605 1
209 . 1 1 25 25 GLN HG2 H 1 2.452 0.003 . 2 . . . A 25 GLN HG2 . 25605 1
210 . 1 1 25 25 GLN HG3 H 1 2.573 0.005 . 2 . . . A 25 GLN HG3 . 25605 1
211 . 1 1 25 25 GLN HE21 H 1 6.906 0.002 . 2 . . . A 25 GLN HE21 . 25605 1
212 . 1 1 25 25 GLN HE22 H 1 7.676 0.005 . 2 . . . A 25 GLN HE22 . 25605 1
213 . 1 1 25 25 GLN CA C 13 55.020 0.050 . 1 . . . A 25 GLN CA . 25605 1
214 . 1 1 25 25 GLN CB C 13 28.399 0.050 . 1 . . . A 25 GLN CB . 25605 1
215 . 1 1 25 25 GLN CG C 13 33.484 0.008 . 1 . . . A 25 GLN CG . 25605 1
216 . 1 1 25 25 GLN N N 15 117.248 0.010 . 1 . . . A 25 GLN N . 25605 1
217 . 1 1 25 25 GLN NE2 N 15 112.827 0.010 . 1 . . . A 25 GLN NE2 . 25605 1
218 . 1 1 26 26 GLN H H 1 8.248 0.003 . 1 . . . A 26 GLN H . 25605 1
219 . 1 1 26 26 GLN HA H 1 4.176 0.002 . 1 . . . A 26 GLN HA . 25605 1
220 . 1 1 26 26 GLN HB2 H 1 2.538 0.006 . 1 . . . A 26 GLN HB2 . 25605 1
221 . 1 1 26 26 GLN HB3 H 1 2.402 0.010 . 1 . . . A 26 GLN HB3 . 25605 1
222 . 1 1 26 26 GLN HG2 H 1 2.452 0.002 . 2 . . . A 26 GLN HG2 . 25605 1
223 . 1 1 26 26 GLN HG3 H 1 2.531 0.007 . 2 . . . A 26 GLN HG3 . 25605 1
224 . 1 1 26 26 GLN HE21 H 1 7.870 0.002 . 1 . . . A 26 GLN HE21 . 25605 1
225 . 1 1 26 26 GLN HE22 H 1 6.646 0.003 . 1 . . . A 26 GLN HE22 . 25605 1
226 . 1 1 26 26 GLN CB C 13 27.792 0.003 . 1 . . . A 26 GLN CB . 25605 1
227 . 1 1 27 27 CYS H H 1 8.797 0.001 . 1 . . . A 27 CYS H . 25605 1
228 . 1 1 27 27 CYS HA H 1 4.335 0.004 . 1 . . . A 27 CYS HA . 25605 1
229 . 1 1 27 27 CYS HB2 H 1 3.125 0.002 . 2 . . . A 27 CYS HB2 . 25605 1
230 . 1 1 27 27 CYS HB3 H 1 3.131 0.009 . 2 . . . A 27 CYS HB3 . 25605 1
231 . 1 1 27 27 CYS N N 15 119.429 0.010 . 1 . . . A 27 CYS N . 25605 1
232 . 1 1 28 28 LYS H H 1 8.329 0.010 . 1 . . . A 28 LYS H . 25605 1
233 . 1 1 28 28 LYS HA H 1 4.355 0.003 . 1 . . . A 28 LYS HA . 25605 1
234 . 1 1 28 28 LYS HB2 H 1 1.819 0.003 . 1 . . . A 28 LYS HB2 . 25605 1
235 . 1 1 28 28 LYS HB3 H 1 1.819 0.003 . 1 . . . A 28 LYS HB3 . 25605 1
236 . 1 1 28 28 LYS HG2 H 1 1.481 0.004 . 1 . . . A 28 LYS HG2 . 25605 1
237 . 1 1 28 28 LYS HG3 H 1 1.481 0.004 . 1 . . . A 28 LYS HG3 . 25605 1
238 . 1 1 28 28 LYS HD2 H 1 1.631 0.002 . 1 . . . A 28 LYS HD2 . 25605 1
239 . 1 1 28 28 LYS HD3 H 1 1.631 0.002 . 1 . . . A 28 LYS HD3 . 25605 1
240 . 1 1 28 28 LYS HE2 H 1 2.919 0.003 . 1 . . . A 28 LYS HE2 . 25605 1
241 . 1 1 28 28 LYS HE3 H 1 2.919 0.003 . 1 . . . A 28 LYS HE3 . 25605 1
242 . 1 1 28 28 LYS HZ1 H 1 7.543 0.005 . 1 . . . A 28 LYS HZ1 . 25605 1
243 . 1 1 28 28 LYS HZ2 H 1 7.543 0.005 . 1 . . . A 28 LYS HZ2 . 25605 1
244 . 1 1 28 28 LYS HZ3 H 1 7.543 0.005 . 1 . . . A 28 LYS HZ3 . 25605 1
245 . 1 1 28 28 LYS N N 15 115.684 0.010 . 1 . . . A 28 LYS N . 25605 1
246 . 1 1 29 29 ASP H H 1 9.021 0.003 . 1 . . . A 29 ASP H . 25605 1
247 . 1 1 29 29 ASP HA H 1 4.492 0.004 . 1 . . . A 29 ASP HA . 25605 1
248 . 1 1 29 29 ASP HB2 H 1 2.837 0.002 . 2 . . . A 29 ASP HB2 . 25605 1
249 . 1 1 29 29 ASP HB3 H 1 2.901 0.008 . 2 . . . A 29 ASP HB3 . 25605 1
250 . 1 1 29 29 ASP N N 15 117.769 0.010 . 1 . . . A 29 ASP N . 25605 1
251 . 1 1 30 30 ARG H H 1 8.340 0.003 . 1 . . . A 30 ARG H . 25605 1
252 . 1 1 30 30 ARG HA H 1 4.490 0.004 . 1 . . . A 30 ARG HA . 25605 1
253 . 1 1 30 30 ARG HB2 H 1 2.035 0.008 . 1 . . . A 30 ARG HB2 . 25605 1
254 . 1 1 30 30 ARG HB3 H 1 2.035 0.008 . 1 . . . A 30 ARG HB3 . 25605 1
255 . 1 1 30 30 ARG HG2 H 1 1.666 0.008 . 2 . . . A 30 ARG HG2 . 25605 1
256 . 1 1 30 30 ARG HG3 H 1 1.765 0.003 . 2 . . . A 30 ARG HG3 . 25605 1
257 . 1 1 30 30 ARG HD2 H 1 3.193 0.002 . 1 . . . A 30 ARG HD2 . 25605 1
258 . 1 1 30 30 ARG HD3 H 1 3.193 0.002 . 1 . . . A 30 ARG HD3 . 25605 1
259 . 1 1 30 30 ARG HE H 1 7.364 0.001 . 1 . . . A 30 ARG HE . 25605 1
260 . 1 1 31 31 GLU H H 1 6.895 0.004 . 1 . . . A 31 GLU H . 25605 1
261 . 1 1 31 31 GLU HA H 1 4.389 0.003 . 1 . . . A 31 GLU HA . 25605 1
262 . 1 1 31 31 GLU HB2 H 1 2.232 0.002 . 2 . . . A 31 GLU HB2 . 25605 1
263 . 1 1 31 31 GLU HB3 H 1 2.285 0.005 . 2 . . . A 31 GLU HB3 . 25605 1
264 . 1 1 31 31 GLU HG2 H 1 2.675 0.005 . 2 . . . A 31 GLU HG2 . 25605 1
265 . 1 1 31 31 GLU HG3 H 1 2.753 0.006 . 2 . . . A 31 GLU HG3 . 25605 1
266 . 1 1 31 31 GLU N N 15 114.001 0.010 . 1 . . . A 31 GLU N . 25605 1
267 . 1 1 32 32 HIS H H 1 6.841 0.002 . 1 . . . A 32 HIS H . 25605 1
268 . 1 1 32 32 HIS HA H 1 4.394 0.003 . 1 . . . A 32 HIS HA . 25605 1
269 . 1 1 32 32 HIS HB2 H 1 3.353 0.004 . 1 . . . A 32 HIS HB2 . 25605 1
270 . 1 1 32 32 HIS HB3 H 1 3.353 0.004 . 1 . . . A 32 HIS HB3 . 25605 1
271 . 1 1 32 32 HIS HD2 H 1 7.116 0.006 . 1 . . . A 32 HIS HD2 . 25605 1
272 . 1 1 32 32 HIS HE1 H 1 8.571 0.009 . 1 . . . A 32 HIS HE1 . 25605 1
273 . 1 1 32 32 HIS CB C 13 28.445 0.050 . 1 . . . A 32 HIS CB . 25605 1
274 . 1 1 32 32 HIS CD2 C 13 119.572 0.050 . 1 . . . A 32 HIS CD2 . 25605 1
275 . 1 1 32 32 HIS CE1 C 13 135.943 0.050 . 1 . . . A 32 HIS CE1 . 25605 1
276 . 1 1 32 32 HIS N N 15 110.470 0.010 . 1 . . . A 32 HIS N . 25605 1
277 . 1 1 33 33 PHE H H 1 8.607 0.002 . 1 . . . A 33 PHE H . 25605 1
278 . 1 1 33 33 PHE HA H 1 4.883 0.007 . 1 . . . A 33 PHE HA . 25605 1
279 . 1 1 33 33 PHE HB2 H 1 2.690 0.004 . 1 . . . A 33 PHE HB2 . 25605 1
280 . 1 1 33 33 PHE HB3 H 1 3.536 0.006 . 1 . . . A 33 PHE HB3 . 25605 1
281 . 1 1 33 33 PHE HD1 H 1 7.447 0.008 . 3 . . . A 33 PHE HD1 . 25605 1
282 . 1 1 33 33 PHE HD2 H 1 7.447 0.008 . 3 . . . A 33 PHE HD2 . 25605 1
283 . 1 1 33 33 PHE HE1 H 1 7.375 0.009 . 3 . . . A 33 PHE HE1 . 25605 1
284 . 1 1 33 33 PHE HE2 H 1 7.375 0.009 . 3 . . . A 33 PHE HE2 . 25605 1
285 . 1 1 33 33 PHE CD1 C 13 131.849 0.050 . 3 . . . A 33 PHE CD1 . 25605 1
286 . 1 1 33 33 PHE CD2 C 13 131.849 0.050 . 3 . . . A 33 PHE CD2 . 25605 1
287 . 1 1 33 33 PHE CE1 C 13 130.264 0.050 . 3 . . . A 33 PHE CE1 . 25605 1
288 . 1 1 33 33 PHE CE2 C 13 130.264 0.050 . 3 . . . A 33 PHE CE2 . 25605 1
289 . 1 1 33 33 PHE N N 15 119.898 0.010 . 1 . . . A 33 PHE N . 25605 1
290 . 1 1 34 34 ALA H H 1 8.567 0.002 . 1 . . . A 34 ALA H . 25605 1
291 . 1 1 34 34 ALA HA H 1 3.996 0.001 . 1 . . . A 34 ALA HA . 25605 1
292 . 1 1 34 34 ALA HB1 H 1 1.263 0.003 . 1 . . . A 34 ALA HB1 . 25605 1
293 . 1 1 34 34 ALA HB2 H 1 1.263 0.003 . 1 . . . A 34 ALA HB2 . 25605 1
294 . 1 1 34 34 ALA HB3 H 1 1.263 0.003 . 1 . . . A 34 ALA HB3 . 25605 1
295 . 1 1 34 34 ALA CA C 13 58.732 0.050 . 1 . . . A 34 ALA CA . 25605 1
296 . 1 1 34 34 ALA CB C 13 18.729 0.067 . 1 . . . A 34 ALA CB . 25605 1
297 . 1 1 35 35 TYR H H 1 9.080 0.002 . 1 . . . A 35 TYR H . 25605 1
298 . 1 1 35 35 TYR HA H 1 4.336 0.011 . 1 . . . A 35 TYR HA . 25605 1
299 . 1 1 35 35 TYR HB2 H 1 3.135 0.010 . 1 . . . A 35 TYR HB2 . 25605 1
300 . 1 1 35 35 TYR HB3 H 1 2.726 0.007 . 1 . . . A 35 TYR HB3 . 25605 1
301 . 1 1 35 35 TYR HD1 H 1 7.296 0.006 . 3 . . . A 35 TYR HD1 . 25605 1
302 . 1 1 35 35 TYR HD2 H 1 7.296 0.006 . 3 . . . A 35 TYR HD2 . 25605 1
303 . 1 1 35 35 TYR HE1 H 1 6.829 0.003 . 3 . . . A 35 TYR HE1 . 25605 1
304 . 1 1 35 35 TYR HE2 H 1 6.829 0.003 . 3 . . . A 35 TYR HE2 . 25605 1
305 . 1 1 35 35 TYR CD1 C 13 133.351 0.050 . 3 . . . A 35 TYR CD1 . 25605 1
306 . 1 1 35 35 TYR CD2 C 13 133.351 0.050 . 3 . . . A 35 TYR CD2 . 25605 1
307 . 1 1 35 35 TYR CE1 C 13 117.810 0.050 . 3 . . . A 35 TYR CE1 . 25605 1
308 . 1 1 35 35 TYR CE2 C 13 117.810 0.050 . 3 . . . A 35 TYR CE2 . 25605 1
309 . 1 1 35 35 TYR N N 15 113.001 0.010 . 1 . . . A 35 TYR N . 25605 1
310 . 1 1 36 36 GLY H H 1 8.232 0.004 . 1 . . . A 36 GLY H . 25605 1
311 . 1 1 36 36 GLY HA2 H 1 3.598 0.005 . 2 . . . A 36 GLY HA2 . 25605 1
312 . 1 1 36 36 GLY HA3 H 1 4.178 0.002 . 2 . . . A 36 GLY HA3 . 25605 1
313 . 1 1 36 36 GLY CA C 13 45.137 0.050 . 1 . . . A 36 GLY CA . 25605 1
314 . 1 1 36 36 GLY N N 15 108.566 0.010 . 1 . . . A 36 GLY N . 25605 1
315 . 1 1 37 37 GLY H H 1 7.890 0.001 . 1 . . . A 37 GLY H . 25605 1
316 . 1 1 37 37 GLY HA2 H 1 4.383 0.009 . 2 . . . A 37 GLY HA2 . 25605 1
317 . 1 1 37 37 GLY HA3 H 1 4.571 0.005 . 2 . . . A 37 GLY HA3 . 25605 1
318 . 1 1 37 37 GLY CA C 13 46.598 0.022 . 1 . . . A 37 GLY CA . 25605 1
319 . 1 1 38 38 ALA H H 1 9.057 0.002 . 1 . . . A 38 ALA H . 25605 1
320 . 1 1 38 38 ALA HA H 1 4.298 0.006 . 1 . . . A 38 ALA HA . 25605 1
321 . 1 1 38 38 ALA HB1 H 1 1.389 0.003 . 1 . . . A 38 ALA HB1 . 25605 1
322 . 1 1 38 38 ALA HB2 H 1 1.389 0.003 . 1 . . . A 38 ALA HB2 . 25605 1
323 . 1 1 38 38 ALA HB3 H 1 1.389 0.003 . 1 . . . A 38 ALA HB3 . 25605 1
324 . 1 1 38 38 ALA CA C 13 53.232 0.050 . 1 . . . A 38 ALA CA . 25605 1
325 . 1 1 38 38 ALA CB C 13 21.884 0.050 . 1 . . . A 38 ALA CB . 25605 1
326 . 1 1 38 38 ALA N N 15 125.415 0.010 . 1 . . . A 38 ALA N . 25605 1
327 . 1 1 39 39 CYS H H 1 8.376 0.002 . 1 . . . A 39 CYS H . 25605 1
328 . 1 1 39 39 CYS HA H 1 5.452 0.005 . 1 . . . A 39 CYS HA . 25605 1
329 . 1 1 39 39 CYS HB2 H 1 2.662 0.001 . 1 . . . A 39 CYS HB2 . 25605 1
330 . 1 1 39 39 CYS HB3 H 1 2.513 0.005 . 1 . . . A 39 CYS HB3 . 25605 1
331 . 1 1 39 39 CYS CA C 13 52.231 0.050 . 1 . . . A 39 CYS CA . 25605 1
332 . 1 1 39 39 CYS N N 15 119.246 0.010 . 1 . . . A 39 CYS N . 25605 1
333 . 1 1 40 40 HIS H H 1 9.476 0.002 . 1 . . . A 40 HIS H . 25605 1
334 . 1 1 40 40 HIS HA H 1 4.865 0.005 . 1 . . . A 40 HIS HA . 25605 1
335 . 1 1 40 40 HIS HB2 H 1 3.036 0.006 . 2 . . . A 40 HIS HB2 . 25605 1
336 . 1 1 40 40 HIS HB3 H 1 3.039 0.011 . 2 . . . A 40 HIS HB3 . 25605 1
337 . 1 1 40 40 HIS HD2 H 1 6.722 0.001 . 1 . . . A 40 HIS HD2 . 25605 1
338 . 1 1 40 40 HIS HE1 H 1 8.314 0.005 . 1 . . . A 40 HIS HE1 . 25605 1
339 . 1 1 40 40 HIS CB C 13 31.749 0.050 . 1 . . . A 40 HIS CB . 25605 1
340 . 1 1 40 40 HIS N N 15 119.364 0.010 . 1 . . . A 40 HIS N . 25605 1
341 . 1 1 41 41 TYR H H 1 9.046 0.003 . 1 . . . A 41 TYR H . 25605 1
342 . 1 1 41 41 TYR HA H 1 4.531 0.002 . 1 . . . A 41 TYR HA . 25605 1
343 . 1 1 41 41 TYR HB2 H 1 3.022 0.008 . 1 . . . A 41 TYR HB2 . 25605 1
344 . 1 1 41 41 TYR HB3 H 1 2.842 0.012 . 1 . . . A 41 TYR HB3 . 25605 1
345 . 1 1 41 41 TYR HD1 H 1 6.980 0.008 . 3 . . . A 41 TYR HD1 . 25605 1
346 . 1 1 41 41 TYR HD2 H 1 6.980 0.008 . 3 . . . A 41 TYR HD2 . 25605 1
347 . 1 1 41 41 TYR HE1 H 1 6.782 0.005 . 3 . . . A 41 TYR HE1 . 25605 1
348 . 1 1 41 41 TYR HE2 H 1 6.782 0.005 . 3 . . . A 41 TYR HE2 . 25605 1
349 . 1 1 41 41 TYR CD1 C 13 133.315 0.050 . 3 . . . A 41 TYR CD1 . 25605 1
350 . 1 1 41 41 TYR CD2 C 13 133.315 0.050 . 3 . . . A 41 TYR CD2 . 25605 1
351 . 1 1 41 41 TYR CE1 C 13 117.853 0.050 . 3 . . . A 41 TYR CE1 . 25605 1
352 . 1 1 41 41 TYR CE2 C 13 117.853 0.050 . 3 . . . A 41 TYR CE2 . 25605 1
353 . 1 1 42 42 GLN H H 1 8.169 0.003 . 1 . . . A 42 GLN H . 25605 1
354 . 1 1 42 42 GLN HA H 1 4.085 0.003 . 1 . . . A 42 GLN HA . 25605 1
355 . 1 1 42 42 GLN HB2 H 1 1.946 0.003 . 2 . . . A 42 GLN HB2 . 25605 1
356 . 1 1 42 42 GLN HB3 H 1 1.947 0.004 . 2 . . . A 42 GLN HB3 . 25605 1
357 . 1 1 42 42 GLN HG2 H 1 2.195 0.006 . 2 . . . A 42 GLN HG2 . 25605 1
358 . 1 1 42 42 GLN HG3 H 1 2.337 0.004 . 2 . . . A 42 GLN HG3 . 25605 1
359 . 1 1 42 42 GLN HE21 H 1 6.972 0.003 . 2 . . . A 42 GLN HE21 . 25605 1
360 . 1 1 42 42 GLN HE22 H 1 7.750 0.002 . 2 . . . A 42 GLN HE22 . 25605 1
361 . 1 1 42 42 GLN CG C 13 34.049 0.006 . 1 . . . A 42 GLN CG . 25605 1
362 . 1 1 42 42 GLN N N 15 124.759 0.010 . 1 . . . A 42 GLN N . 25605 1
363 . 1 1 42 42 GLN NE2 N 15 112.488 0.012 . 1 . . . A 42 GLN NE2 . 25605 1
364 . 1 1 43 43 PHE H H 1 8.800 0.001 . 1 . . . A 43 PHE H . 25605 1
365 . 1 1 43 43 PHE HA H 1 4.096 0.003 . 1 . . . A 43 PHE HA . 25605 1
366 . 1 1 43 43 PHE HB2 H 1 2.891 0.005 . 2 . . . A 43 PHE HB2 . 25605 1
367 . 1 1 43 43 PHE HB3 H 1 3.257 0.004 . 2 . . . A 43 PHE HB3 . 25605 1
368 . 1 1 43 43 PHE HD1 H 1 7.381 0.003 . 3 . . . A 43 PHE HD1 . 25605 1
369 . 1 1 43 43 PHE HD2 H 1 7.381 0.003 . 3 . . . A 43 PHE HD2 . 25605 1
370 . 1 1 44 44 PRO HA H 1 3.948 0.003 . 1 . . . A 44 PRO HA . 25605 1
371 . 1 1 44 44 PRO HB2 H 1 1.982 0.007 . 2 . . . A 44 PRO HB2 . 25605 1
372 . 1 1 44 44 PRO HB3 H 1 0.673 0.009 . 2 . . . A 44 PRO HB3 . 25605 1
373 . 1 1 44 44 PRO HG2 H 1 1.473 0.004 . 2 . . . A 44 PRO HG2 . 25605 1
374 . 1 1 44 44 PRO HG3 H 1 1.662 0.004 . 2 . . . A 44 PRO HG3 . 25605 1
375 . 1 1 44 44 PRO HD2 H 1 3.280 0.008 . 2 . . . A 44 PRO HD2 . 25605 1
376 . 1 1 44 44 PRO HD3 H 1 3.286 0.010 . 2 . . . A 44 PRO HD3 . 25605 1
377 . 1 1 44 44 PRO CA C 13 64.712 0.050 . 1 . . . A 44 PRO CA . 25605 1
378 . 1 1 44 44 PRO CB C 13 33.500 0.006 . 1 . . . A 44 PRO CB . 25605 1
379 . 1 1 44 44 PRO CD C 13 48.629 0.035 . 1 . . . A 44 PRO CD . 25605 1
380 . 1 1 45 45 SER H H 1 8.392 0.003 . 1 . . . A 45 SER H . 25605 1
381 . 1 1 45 45 SER HA H 1 4.946 0.005 . 1 . . . A 45 SER HA . 25605 1
382 . 1 1 45 45 SER HB2 H 1 3.681 0.007 . 2 . . . A 45 SER HB2 . 25605 1
383 . 1 1 45 45 SER HB3 H 1 3.703 0.010 . 2 . . . A 45 SER HB3 . 25605 1
384 . 1 1 45 45 SER CA C 13 57.931 0.050 . 1 . . . A 45 SER CA . 25605 1
385 . 1 1 45 45 SER CB C 13 66.241 0.016 . 1 . . . A 45 SER CB . 25605 1
386 . 1 1 45 45 SER N N 15 120.658 0.010 . 1 . . . A 45 SER N . 25605 1
387 . 1 1 46 46 VAL H H 1 8.548 0.004 . 1 . . . A 46 VAL H . 25605 1
388 . 1 1 46 46 VAL HA H 1 4.342 0.003 . 1 . . . A 46 VAL HA . 25605 1
389 . 1 1 46 46 VAL HB H 1 1.921 0.004 . 1 . . . A 46 VAL HB . 25605 1
390 . 1 1 46 46 VAL HG11 H 1 1.137 0.004 . 1 . . . A 46 VAL HG11 . 25605 1
391 . 1 1 46 46 VAL HG12 H 1 1.137 0.004 . 1 . . . A 46 VAL HG12 . 25605 1
392 . 1 1 46 46 VAL HG13 H 1 1.137 0.004 . 1 . . . A 46 VAL HG13 . 25605 1
393 . 1 1 46 46 VAL HG21 H 1 0.903 0.002 . 1 . . . A 46 VAL HG21 . 25605 1
394 . 1 1 46 46 VAL HG22 H 1 0.903 0.002 . 1 . . . A 46 VAL HG22 . 25605 1
395 . 1 1 46 46 VAL HG23 H 1 0.903 0.002 . 1 . . . A 46 VAL HG23 . 25605 1
396 . 1 1 47 47 LYS H H 1 8.350 0.002 . 1 . . . A 47 LYS H . 25605 1
397 . 1 1 47 47 LYS HA H 1 4.559 0.004 . 1 . . . A 47 LYS HA . 25605 1
398 . 1 1 47 47 LYS HB2 H 1 1.422 0.004 . 2 . . . A 47 LYS HB2 . 25605 1
399 . 1 1 47 47 LYS HB3 H 1 1.684 0.002 . 2 . . . A 47 LYS HB3 . 25605 1
400 . 1 1 47 47 LYS HG2 H 1 1.245 0.003 . 2 . . . A 47 LYS HG2 . 25605 1
401 . 1 1 47 47 LYS HG3 H 1 1.350 0.004 . 2 . . . A 47 LYS HG3 . 25605 1
402 . 1 1 47 47 LYS HD3 H 1 1.549 0.005 . 2 . . . A 47 LYS HD3 . 25605 1
403 . 1 1 47 47 LYS HE2 H 1 2.906 0.004 . 1 . . . A 47 LYS HE2 . 25605 1
404 . 1 1 47 47 LYS HE3 H 1 2.906 0.004 . 1 . . . A 47 LYS HE3 . 25605 1
405 . 1 1 47 47 LYS CB C 13 33.327 0.050 . 1 . . . A 47 LYS CB . 25605 1
406 . 1 1 47 47 LYS CG C 13 25.127 0.050 . 1 . . . A 47 LYS CG . 25605 1
407 . 1 1 47 47 LYS CD C 13 29.262 0.050 . 1 . . . A 47 LYS CD . 25605 1
408 . 1 1 47 47 LYS CE C 13 41.709 0.050 . 1 . . . A 47 LYS CE . 25605 1
409 . 1 1 48 48 CYS H H 1 8.868 0.004 . 1 . . . A 48 CYS H . 25605 1
410 . 1 1 48 48 CYS HA H 1 4.653 0.006 . 1 . . . A 48 CYS HA . 25605 1
411 . 1 1 48 48 CYS HB2 H 1 1.683 0.003 . 2 . . . A 48 CYS HB2 . 25605 1
412 . 1 1 48 48 CYS HB3 H 1 2.148 0.001 . 2 . . . A 48 CYS HB3 . 25605 1
413 . 1 1 48 48 CYS N N 15 123.704 0.010 . 1 . . . A 48 CYS N . 25605 1
414 . 1 1 49 49 PHE H H 1 8.534 0.004 . 1 . . . A 49 PHE H . 25605 1
415 . 1 1 49 49 PHE HA H 1 4.773 0.006 . 1 . . . A 49 PHE HA . 25605 1
416 . 1 1 49 49 PHE HB2 H 1 2.806 0.003 . 1 . . . A 49 PHE HB2 . 25605 1
417 . 1 1 49 49 PHE HB3 H 1 2.555 0.002 . 1 . . . A 49 PHE HB3 . 25605 1
418 . 1 1 49 49 PHE HD1 H 1 6.824 0.005 . 3 . . . A 49 PHE HD1 . 25605 1
419 . 1 1 49 49 PHE HD2 H 1 6.824 0.005 . 3 . . . A 49 PHE HD2 . 25605 1
420 . 1 1 49 49 PHE HE1 H 1 7.213 0.004 . 3 . . . A 49 PHE HE1 . 25605 1
421 . 1 1 49 49 PHE HE2 H 1 7.213 0.004 . 3 . . . A 49 PHE HE2 . 25605 1
422 . 1 1 49 49 PHE CB C 13 41.036 0.088 . 1 . . . A 49 PHE CB . 25605 1
423 . 1 1 49 49 PHE CD1 C 13 131.323 0.050 . 3 . . . A 49 PHE CD1 . 25605 1
424 . 1 1 49 49 PHE CD2 C 13 131.323 0.050 . 3 . . . A 49 PHE CD2 . 25605 1
425 . 1 1 49 49 PHE CE1 C 13 131.505 0.050 . 3 . . . A 49 PHE CE1 . 25605 1
426 . 1 1 49 49 PHE CE2 C 13 131.505 0.050 . 3 . . . A 49 PHE CE2 . 25605 1
427 . 1 1 50 50 CYS H H 1 8.995 0.003 . 1 . . . A 50 CYS H . 25605 1
428 . 1 1 50 50 CYS HA H 1 5.366 0.002 . 1 . . . A 50 CYS HA . 25605 1
429 . 1 1 50 50 CYS HB2 H 1 2.451 0.004 . 2 . . . A 50 CYS HB2 . 25605 1
430 . 1 1 50 50 CYS HB3 H 1 1.396 0.008 . 2 . . . A 50 CYS HB3 . 25605 1
431 . 1 1 50 50 CYS CA C 13 51.653 0.050 . 1 . . . A 50 CYS CA . 25605 1
432 . 1 1 50 50 CYS N N 15 121.520 0.010 . 1 . . . A 50 CYS N . 25605 1
433 . 1 1 51 51 LYS H H 1 8.213 0.006 . 1 . . . A 51 LYS H . 25605 1
434 . 1 1 51 51 LYS HA H 1 4.994 0.008 . 1 . . . A 51 LYS HA . 25605 1
435 . 1 1 51 51 LYS HB2 H 1 1.372 0.003 . 2 . . . A 51 LYS HB2 . 25605 1
436 . 1 1 51 51 LYS HB3 H 1 1.373 0.003 . 2 . . . A 51 LYS HB3 . 25605 1
437 . 1 1 51 51 LYS HG2 H 1 1.123 0.004 . 1 . . . A 51 LYS HG2 . 25605 1
438 . 1 1 51 51 LYS HG3 H 1 1.123 0.004 . 1 . . . A 51 LYS HG3 . 25605 1
439 . 1 1 51 51 LYS HD2 H 1 1.378 0.002 . 2 . . . A 51 LYS HD2 . 25605 1
440 . 1 1 51 51 LYS HD3 H 1 1.535 0.009 . 2 . . . A 51 LYS HD3 . 25605 1
441 . 1 1 51 51 LYS HE2 H 1 2.772 0.009 . 1 . . . A 51 LYS HE2 . 25605 1
442 . 1 1 51 51 LYS HE3 H 1 2.772 0.009 . 1 . . . A 51 LYS HE3 . 25605 1
443 . 1 1 51 51 LYS HZ1 H 1 7.548 0.005 . 1 . . . A 51 LYS HZ1 . 25605 1
444 . 1 1 51 51 LYS HZ2 H 1 7.548 0.005 . 1 . . . A 51 LYS HZ2 . 25605 1
445 . 1 1 51 51 LYS HZ3 H 1 7.548 0.005 . 1 . . . A 51 LYS HZ3 . 25605 1
446 . 1 1 51 51 LYS CA C 13 54.366 0.050 . 1 . . . A 51 LYS CA . 25605 1
447 . 1 1 51 51 LYS CB C 13 35.300 0.050 . 1 . . . A 51 LYS CB . 25605 1
448 . 1 1 51 51 LYS CG C 13 25.210 0.050 . 1 . . . A 51 LYS CG . 25605 1
449 . 1 1 51 51 LYS CD C 13 29.060 0.050 . 1 . . . A 51 LYS CD . 25605 1
450 . 1 1 51 51 LYS CE C 13 41.912 0.050 . 1 . . . A 51 LYS CE . 25605 1
451 . 1 1 51 51 LYS N N 15 120.278 0.010 . 1 . . . A 51 LYS N . 25605 1
452 . 1 1 52 52 ARG H H 1 8.835 0.009 . 1 . . . A 52 ARG H . 25605 1
453 . 1 1 52 52 ARG HA H 1 4.882 0.008 . 1 . . . A 52 ARG HA . 25605 1
454 . 1 1 52 52 ARG HB2 H 1 1.977 0.003 . 1 . . . A 52 ARG HB2 . 25605 1
455 . 1 1 52 52 ARG HB3 H 1 1.851 0.001 . 1 . . . A 52 ARG HB3 . 25605 1
456 . 1 1 52 52 ARG HG2 H 1 1.563 0.006 . 2 . . . A 52 ARG HG2 . 25605 1
457 . 1 1 52 52 ARG HG3 H 1 1.596 0.011 . 2 . . . A 52 ARG HG3 . 25605 1
458 . 1 1 52 52 ARG HD2 H 1 3.213 0.006 . 2 . . . A 52 ARG HD2 . 25605 1
459 . 1 1 52 52 ARG HD3 H 1 3.230 0.012 . 2 . . . A 52 ARG HD3 . 25605 1
460 . 1 1 52 52 ARG HE H 1 7.198 0.001 . 1 . . . A 52 ARG HE . 25605 1
461 . 1 1 52 52 ARG CG C 13 26.069 0.050 . 1 . . . A 52 ARG CG . 25605 1
462 . 1 1 52 52 ARG N N 15 119.315 0.010 . 1 . . . A 52 ARG N . 25605 1
463 . 1 1 53 53 GLN H H 1 9.035 0.002 . 1 . . . A 53 GLN H . 25605 1
464 . 1 1 53 53 GLN HA H 1 4.538 0.005 . 1 . . . A 53 GLN HA . 25605 1
465 . 1 1 53 53 GLN HB2 H 1 2.045 0.004 . 2 . . . A 53 GLN HB2 . 25605 1
466 . 1 1 53 53 GLN HB3 H 1 2.158 0.002 . 2 . . . A 53 GLN HB3 . 25605 1
467 . 1 1 53 53 GLN HG2 H 1 2.430 0.002 . 1 . . . A 53 GLN HG2 . 25605 1
468 . 1 1 53 53 GLN HG3 H 1 2.430 0.002 . 1 . . . A 53 GLN HG3 . 25605 1
469 . 1 1 53 53 GLN HE21 H 1 7.066 0.005 . 2 . . . A 53 GLN HE21 . 25605 1
470 . 1 1 53 53 GLN HE22 H 1 7.701 0.005 . 2 . . . A 53 GLN HE22 . 25605 1
471 . 1 1 54 54 CYS H H 1 8.507 0.008 . 1 . . . A 54 CYS H . 25605 1
472 . 1 1 54 54 CYS HA H 1 4.578 0.002 . 1 . . . A 54 CYS HA . 25605 1
473 . 1 1 54 54 CYS HB2 H 1 3.156 0.005 . 1 . . . A 54 CYS HB2 . 25605 1
474 . 1 1 54 54 CYS HB3 H 1 3.156 0.005 . 1 . . . A 54 CYS HB3 . 25605 1
475 . 1 1 54 54 CYS N N 15 121.414 0.010 . 1 . . . A 54 CYS N . 25605 1
stop_
save_