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 25102
_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 .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H COSY' . . . 25102 1
2 '2D 1H-1H TOCSY' . . . 25102 1
4 '2D 1H-15N HSQC' . . . 25102 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $SPARKY . . 25102 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 GLY HA2 H 1 4.220 0.006 . 2 . . . . 1 GLY HA2 . 25102 1
2 . 1 1 1 1 GLY HA3 H 1 3.872 0.006 . 2 . . . . 1 GLY HA3 . 25102 1
3 . 1 1 2 2 PRO HA H 1 4.475 0.004 . 1 . . . . 2 PRO HA . 25102 1
4 . 1 1 2 2 PRO HB2 H 1 2.153 0.004 . 2 . . . . 2 PRO HB2 . 25102 1
5 . 1 1 2 2 PRO HB3 H 1 2.048 0.008 . 2 . . . . 2 PRO HB3 . 25102 1
6 . 1 1 2 2 PRO HG2 H 1 1.808 0.004 . 2 . . . . 2 PRO HG2 . 25102 1
7 . 1 1 2 2 PRO HG3 H 1 1.907 0.003 . 2 . . . . 2 PRO HG3 . 25102 1
8 . 1 1 2 2 PRO HD2 H 1 3.675 0.006 . 1 . . . . 2 PRO HD2 . 25102 1
9 . 1 1 2 2 PRO HD3 H 1 3.491 0.010 . 1 . . . . 2 PRO HD3 . 25102 1
10 . 1 1 3 3 ARG H H 1 8.107 0.007 . 1 . . . . 3 ARG HN . 25102 1
11 . 1 1 3 3 ARG HA H 1 4.625 0.005 . 1 . . . . 3 ARG HA . 25102 1
12 . 1 1 3 3 ARG HB2 H 1 1.699 0.009 . 1 . . . . 3 ARG HB2 . 25102 1
13 . 1 1 3 3 ARG HB3 H 1 1.484 0.012 . 1 . . . . 3 ARG HB3 . 25102 1
14 . 1 1 3 3 ARG HG2 H 1 1.922 0.011 . 2 . . . . 3 ARG HG2 . 25102 1
15 . 1 1 3 3 ARG HG3 H 1 1.491 0.014 . 2 . . . . 3 ARG HG3 . 25102 1
16 . 1 1 3 3 ARG HD2 H 1 3.109 0.006 . 2 . . . . 3 ARG HD2 . 25102 1
17 . 1 1 3 3 ARG HD3 H 1 2.856 0.008 . 2 . . . . 3 ARG HD3 . 25102 1
18 . 1 1 3 3 ARG N N 15 117.071 0.102 . 1 . . . . 3 ARG N . 25102 1
19 . 1 1 4 4 MET H H 1 8.381 0.006 . 1 . . . . 4 MET HN . 25102 1
20 . 1 1 4 4 MET HA H 1 5.110 0.007 . 1 . . . . 4 MET HA . 25102 1
21 . 1 1 4 4 MET HB2 H 1 1.799 0.008 . 2 . . . . 4 MET HB2 . 25102 1
22 . 1 1 4 4 MET HB3 H 1 0.933 0.010 . 2 . . . . 4 MET HB3 . 25102 1
23 . 1 1 4 4 MET HG2 H 1 1.001 0.005 . 2 . . . . 4 MET HG2 . 25102 1
24 . 1 1 4 4 MET HG3 H 1 0.808 0.009 . 2 . . . . 4 MET HG3 . 25102 1
25 . 1 1 4 4 MET HE1 H 1 1.221 0.004 . 1 . . . . 4 MET QE . 25102 1
26 . 1 1 4 4 MET HE2 H 1 1.221 0.004 . 1 . . . . 4 MET QE . 25102 1
27 . 1 1 4 4 MET HE3 H 1 1.221 0.004 . 1 . . . . 4 MET QE . 25102 1
28 . 1 1 4 4 MET N N 15 117.614 0.240 . 1 . . . . 4 MET N . 25102 1
29 . 1 1 5 5 GLN H H 1 9.675 0.008 . 1 . . . . 5 GLN HN . 25102 1
30 . 1 1 5 5 GLN HA H 1 5.037 0.005 . 1 . . . . 5 GLN HA . 25102 1
31 . 1 1 5 5 GLN HB2 H 1 1.865 0.013 . 2 . . . . 5 GLN HB2 . 25102 1
32 . 1 1 5 5 GLN HG2 H 1 1.770 0.007 . 2 . . . . 5 GLN HG2 . 25102 1
33 . 1 1 5 5 GLN HG3 H 1 1.409 0.009 . 2 . . . . 5 GLN HG3 . 25102 1
34 . 1 1 5 5 GLN HE21 H 1 7.107 0.008 . 1 . . . . 5 GLN HE21 . 25102 1
35 . 1 1 5 5 GLN HE22 H 1 6.193 0.011 . 1 . . . . 5 GLN HE22 . 25102 1
36 . 1 1 5 5 GLN N N 15 122.654 0.178 . 1 . . . . 5 GLN N . 25102 1
37 . 1 1 5 5 GLN NE2 N 15 112.079 0.043 . 1 . . . . 5 GLN NE2 . 25102 1
38 . 1 1 6 6 CYS H H 1 9.415 0.006 . 1 . . . . 6 CYS HN . 25102 1
39 . 1 1 6 6 CYS HA H 1 2.658 0.009 . 1 . . . . 6 CYS HA . 25102 1
40 . 1 1 6 6 CYS HB2 H 1 2.920 0.007 . 2 . . . . 6 CYS HB2 . 25102 1
41 . 1 1 6 6 CYS HB3 H 1 2.431 0.005 . 2 . . . . 6 CYS HB3 . 25102 1
42 . 1 1 6 6 CYS N N 15 135.155 0.033 . 1 . . . . 6 CYS N . 25102 1
43 . 1 1 7 7 SER H H 1 8.147 0.007 . 1 . . . . 7 SER HN . 25102 1
44 . 1 1 7 7 SER HA H 1 4.167 0.006 . 1 . . . . 7 SER HA . 25102 1
45 . 1 1 7 7 SER HB2 H 1 3.927 0.010 . 2 . . . . 7 SER HB2 . 25102 1
46 . 1 1 7 7 SER HB3 H 1 3.811 0.005 . 2 . . . . 7 SER HB3 . 25102 1
47 . 1 1 7 7 SER HG H 1 6.046 0.002 . 1 . . . . 7 SER HG . 25102 1
48 . 1 1 7 7 SER N N 15 125.596 0.041 . 1 . . . . 7 SER N . 25102 1
49 . 1 1 8 8 VAL H H 1 9.074 0.008 . 1 . . . . 8 VAL HN . 25102 1
50 . 1 1 8 8 VAL HA H 1 3.867 0.006 . 1 . . . . 8 VAL HA . 25102 1
51 . 1 1 8 8 VAL HB H 1 2.422 0.009 . 1 . . . . 8 VAL HB . 25102 1
52 . 1 1 8 8 VAL HG11 H 1 0.790 0.007 . 1 . . . . 8 VAL QG1 . 25102 1
53 . 1 1 8 8 VAL HG12 H 1 0.790 0.007 . 1 . . . . 8 VAL QG1 . 25102 1
54 . 1 1 8 8 VAL HG13 H 1 0.790 0.007 . 1 . . . . 8 VAL QG1 . 25102 1
55 . 1 1 8 8 VAL HG21 H 1 0.768 0.005 . 1 . . . . 8 VAL QG2 . 25102 1
56 . 1 1 8 8 VAL HG22 H 1 0.768 0.005 . 1 . . . . 8 VAL QG2 . 25102 1
57 . 1 1 8 8 VAL HG23 H 1 0.768 0.005 . 1 . . . . 8 VAL QG2 . 25102 1
58 . 1 1 8 8 VAL N N 15 128.046 0.060 . 1 . . . . 8 VAL N . 25102 1
59 . 1 1 9 9 CYS H H 1 9.443 0.011 . 1 . . . . 9 CYS HN . 25102 1
60 . 1 1 9 9 CYS HA H 1 4.877 0.008 . 1 . . . . 9 CYS HA . 25102 1
61 . 1 1 9 9 CYS HB2 H 1 3.187 0.009 . 2 . . . . 9 CYS HB2 . 25102 1
62 . 1 1 9 9 CYS HB3 H 1 2.360 0.007 . 2 . . . . 9 CYS HB3 . 25102 1
63 . 1 1 9 9 CYS N N 15 124.350 0.048 . 1 . . . . 9 CYS N . 25102 1
64 . 1 1 10 10 GLN H H 1 7.596 0.009 . 1 . . . . 10 GLN HN . 25102 1
65 . 1 1 10 10 GLN HA H 1 3.992 0.007 . 1 . . . . 10 GLN HA . 25102 1
66 . 1 1 10 10 GLN HB2 H 1 2.617 0.007 . 2 . . . . 10 GLN HB2 . 25102 1
67 . 1 1 10 10 GLN HB3 H 1 2.111 0.006 . 2 . . . . 10 GLN HB3 . 25102 1
68 . 1 1 10 10 GLN HG2 H 1 2.083 0.006 . 2 . . . . 10 GLN HG2 . 25102 1
69 . 1 1 10 10 GLN HE21 H 1 6.781 0.005 . 1 . . . . 10 GLN HE21 . 25102 1
70 . 1 1 10 10 GLN HE22 H 1 7.468 0.006 . 1 . . . . 10 GLN HE22 . 25102 1
71 . 1 1 10 10 GLN N N 15 115.176 0.116 . 1 . . . . 10 GLN N . 25102 1
72 . 1 1 10 10 GLN NE2 N 15 112.099 0.016 . 1 . . . . 10 GLN NE2 . 25102 1
73 . 1 1 11 11 TRP H H 1 9.200 0.010 . 1 . . . . 11 TRP HN . 25102 1
74 . 1 1 11 11 TRP HA H 1 4.098 0.012 . 1 . . . . 11 TRP HA . 25102 1
75 . 1 1 11 11 TRP HB2 H 1 3.464 0.008 . 2 . . . . 11 TRP HB2 . 25102 1
76 . 1 1 11 11 TRP HB3 H 1 3.310 0.007 . 2 . . . . 11 TRP HB3 . 25102 1
77 . 1 1 11 11 TRP HD1 H 1 7.376 0.007 . 1 . . . . 11 TRP HD1 . 25102 1
78 . 1 1 11 11 TRP HE1 H 1 10.094 0.009 . 1 . . . . 11 TRP HE1 . 25102 1
79 . 1 1 11 11 TRP HE3 H 1 8.062 0.003 . 1 . . . . 11 TRP HE3 . 25102 1
80 . 1 1 11 11 TRP HZ2 H 1 7.693 0.003 . 1 . . . . 11 TRP HZ2 . 25102 1
81 . 1 1 11 11 TRP HZ3 H 1 7.430 0.004 . 1 . . . . 11 TRP HZ3 . 25102 1
82 . 1 1 11 11 TRP HH2 H 1 7.345 0.004 . 1 . . . . 11 TRP HH2 . 25102 1
83 . 1 1 11 11 TRP N N 15 128.644 0.098 . 1 . . . . 11 TRP N . 25102 1
84 . 1 1 11 11 TRP NE1 N 15 129.231 0.134 . 1 . . . . 11 TRP NE1 . 25102 1
85 . 1 1 12 12 ILE H H 1 6.788 0.008 . 1 . . . . 12 ILE HN . 25102 1
86 . 1 1 12 12 ILE HA H 1 4.314 0.008 . 1 . . . . 12 ILE HA . 25102 1
87 . 1 1 12 12 ILE HB H 1 1.146 0.010 . 1 . . . . 12 ILE HB . 25102 1
88 . 1 1 12 12 ILE HG12 H 1 1.751 0.005 . 2 . . . . 12 ILE HG12 . 25102 1
89 . 1 1 12 12 ILE HG13 H 1 0.447 0.005 . 2 . . . . 12 ILE HG13 . 25102 1
90 . 1 1 12 12 ILE HG21 H 1 0.408 0.008 . 1 . . . . 12 ILE QG2 . 25102 1
91 . 1 1 12 12 ILE HG22 H 1 0.408 0.008 . 1 . . . . 12 ILE QG2 . 25102 1
92 . 1 1 12 12 ILE HG23 H 1 0.408 0.008 . 1 . . . . 12 ILE QG2 . 25102 1
93 . 1 1 12 12 ILE HD11 H 1 0.647 0.007 . 1 . . . . 12 ILE QD1 . 25102 1
94 . 1 1 12 12 ILE HD12 H 1 0.647 0.007 . 1 . . . . 12 ILE QD1 . 25102 1
95 . 1 1 12 12 ILE HD13 H 1 0.647 0.007 . 1 . . . . 12 ILE QD1 . 25102 1
96 . 1 1 12 12 ILE N N 15 125.601 0.064 . 1 . . . . 12 ILE N . 25102 1
97 . 1 1 13 13 TYR H H 1 8.986 0.006 . 1 . . . . 13 TYR HN . 25102 1
98 . 1 1 13 13 TYR HA H 1 3.877 0.010 . 1 . . . . 13 TYR HA . 25102 1
99 . 1 1 13 13 TYR HB2 H 1 2.799 0.007 . 2 . . . . 13 TYR HB2 . 25102 1
100 . 1 1 13 13 TYR HB3 H 1 2.468 0.007 . 2 . . . . 13 TYR HB3 . 25102 1
101 . 1 1 13 13 TYR HD1 H 1 7.006 0.005 . 1 . . . . 13 TYR HD1 . 25102 1
102 . 1 1 13 13 TYR HD2 H 1 7.006 0.005 . 1 . . . . 13 TYR HD2 . 25102 1
103 . 1 1 13 13 TYR HE1 H 1 6.447 0.003 . 1 . . . . 13 TYR HE1 . 25102 1
104 . 1 1 13 13 TYR HE2 H 1 6.447 0.003 . 1 . . . . 13 TYR HE2 . 25102 1
105 . 1 1 13 13 TYR HH H 1 9.125 0.005 . 1 . . . . 13 TYR HH . 25102 1
106 . 1 1 13 13 TYR N N 15 126.171 0.060 . 1 . . . . 13 TYR N . 25102 1
107 . 1 1 14 14 ASP H H 1 8.569 0.005 . 1 . . . . 14 ASP HN . 25102 1
108 . 1 1 14 14 ASP HA H 1 4.835 0.009 . 1 . . . . 14 ASP HA . 25102 1
109 . 1 1 14 14 ASP HB2 H 1 2.629 0.007 . 2 . . . . 14 ASP HB2 . 25102 1
110 . 1 1 14 14 ASP HB3 H 1 2.044 0.007 . 2 . . . . 14 ASP HB3 . 25102 1
111 . 1 1 14 14 ASP N N 15 129.316 0.020 . 1 . . . . 14 ASP N . 25102 1
112 . 1 1 15 15 PRO HA H 1 3.972 0.010 . 1 . . . . 15 PRO HA . 25102 1
113 . 1 1 15 15 PRO HB2 H 1 1.763 0.005 . 1 . . . . 15 PRO HB2 . 25102 1
114 . 1 1 15 15 PRO HB3 H 1 2.336 0.005 . 1 . . . . 15 PRO HB3 . 25102 1
115 . 1 1 15 15 PRO HG2 H 1 1.880 0.006 . 2 . . . . 15 PRO HG2 . 25102 1
116 . 1 1 15 15 PRO HD2 H 1 3.852 0.007 . 2 . . . . 15 PRO HD2 . 25102 1
117 . 1 1 15 15 PRO HD3 H 1 3.694 0.003 . 2 . . . . 15 PRO HD3 . 25102 1
118 . 1 1 16 16 ALA H H 1 7.923 0.013 . 1 . . . . 16 ALA HN . 25102 1
119 . 1 1 16 16 ALA HA H 1 3.848 0.006 . 1 . . . . 16 ALA HA . 25102 1
120 . 1 1 16 16 ALA HB1 H 1 1.229 0.008 . 1 . . . . 16 ALA QB . 25102 1
121 . 1 1 16 16 ALA HB2 H 1 1.229 0.008 . 1 . . . . 16 ALA QB . 25102 1
122 . 1 1 16 16 ALA HB3 H 1 1.229 0.008 . 1 . . . . 16 ALA QB . 25102 1
123 . 1 1 16 16 ALA N N 15 117.037 0.125 . 1 . . . . 16 ALA N . 25102 1
124 . 1 1 17 17 LYS H H 1 7.635 0.009 . 1 . . . . 17 LYS HN . 25102 1
125 . 1 1 17 17 LYS HA H 1 4.254 0.009 . 1 . . . . 17 LYS HA . 25102 1
126 . 1 1 17 17 LYS HB2 H 1 1.663 0.006 . 2 . . . . 17 LYS HB2 . 25102 1
127 . 1 1 17 17 LYS HG2 H 1 1.943 0.009 . 2 . . . . 17 LYS HG2 . 25102 1
128 . 1 1 17 17 LYS HG3 H 1 1.841 0.007 . 2 . . . . 17 LYS HG3 . 25102 1
129 . 1 1 17 17 LYS HD2 H 1 1.238 0.008 . 2 . . . . 17 LYS HD2 . 25102 1
130 . 1 1 17 17 LYS HD3 H 1 1.307 0.019 . 2 . . . . 17 LYS HD3 . 25102 1
131 . 1 1 17 17 LYS HE2 H 1 2.678 0.523 . 2 . . . . 17 LYS HE2 . 25102 1
132 . 1 1 17 17 LYS N N 15 115.236 0.007 . 1 . . . . 17 LYS N . 25102 1
133 . 1 1 18 18 GLY H H 1 7.865 0.008 . 1 . . . . 18 GLY HN . 25102 1
134 . 1 1 18 18 GLY HA2 H 1 3.678 0.007 . 1 . . . . 18 GLY HA2 . 25102 1
135 . 1 1 18 18 GLY HA3 H 1 3.678 0.007 . 1 . . . . 18 GLY HA3 . 25102 1
136 . 1 1 18 18 GLY N N 15 105.765 0.133 . 1 . . . . 18 GLY N . 25102 1
137 . 1 1 19 19 GLU H H 1 9.072 0.007 . 1 . . . . 19 GLU HN . 25102 1
138 . 1 1 19 19 GLU HA H 1 5.079 0.008 . 1 . . . . 19 GLU HA . 25102 1
139 . 1 1 19 19 GLU HB2 H 1 2.914 0.008 . 2 . . . . 19 GLU HB2 . 25102 1
140 . 1 1 19 19 GLU HB3 H 1 2.163 0.008 . 2 . . . . 19 GLU HB3 . 25102 1
141 . 1 1 19 19 GLU HG2 H 1 2.751 0.010 . 2 . . . . 19 GLU HG2 . 25102 1
142 . 1 1 19 19 GLU HG3 H 1 2.293 0.011 . 2 . . . . 19 GLU HG3 . 25102 1
143 . 1 1 19 19 GLU N N 15 122.724 0.023 . 1 . . . . 19 GLU N . 25102 1
144 . 1 1 20 20 PRO HA H 1 4.198 0.003 . 1 . . . . 20 PRO HA . 25102 1
145 . 1 1 20 20 PRO HB2 H 1 2.441 0.006 . 2 . . . . 20 PRO HB2 . 25102 1
146 . 1 1 20 20 PRO HB3 H 1 1.986 0.004 . 2 . . . . 20 PRO HB3 . 25102 1
147 . 1 1 20 20 PRO HG2 H 1 2.141 0.006 . 2 . . . . 20 PRO HG2 . 25102 1
148 . 1 1 20 20 PRO HG3 H 1 2.060 0.004 . 2 . . . . 20 PRO HG3 . 25102 1
149 . 1 1 20 20 PRO HD2 H 1 4.007 0.006 . 2 . . . . 20 PRO HD2 . 25102 1
150 . 1 1 20 20 PRO HD3 H 1 3.782 0.004 . 2 . . . . 20 PRO HD3 . 25102 1
151 . 1 1 21 21 MET H H 1 9.643 0.010 . 1 . . . . 21 MET HN . 25102 1
152 . 1 1 21 21 MET HA H 1 4.259 0.007 . 1 . . . . 21 MET HA . 25102 1
153 . 1 1 21 21 MET HB2 H 1 2.889 0.005 . 2 . . . . 21 MET HB2 . 25102 1
154 . 1 1 21 21 MET HB3 H 1 2.687 0.009 . 2 . . . . 21 MET HB3 . 25102 1
155 . 1 1 21 21 MET HG2 H 1 2.510 0.006 . 2 . . . . 21 MET HG2 . 25102 1
156 . 1 1 21 21 MET HG3 H 1 2.058 0.006 . 2 . . . . 21 MET HG3 . 25102 1
157 . 1 1 21 21 MET HE1 H 1 0.661 0.003 . 1 . . . . 21 MET QE . 25102 1
158 . 1 1 21 21 MET HE2 H 1 0.661 0.003 . 1 . . . . 21 MET QE . 25102 1
159 . 1 1 21 21 MET HE3 H 1 0.661 0.003 . 1 . . . . 21 MET QE . 25102 1
160 . 1 1 21 21 MET N N 15 120.818 0.099 . 1 . . . . 21 MET N . 25102 1
161 . 1 1 22 22 GLN H H 1 7.656 0.011 . 1 . . . . 22 GLN HN . 25102 1
162 . 1 1 22 22 GLN HA H 1 4.455 0.004 . 1 . . . . 22 GLN HA . 25102 1
163 . 1 1 22 22 GLN HB2 H 1 2.414 0.007 . 1 . . . . 22 GLN HB2 . 25102 1
164 . 1 1 22 22 GLN HB3 H 1 2.262 0.006 . 1 . . . . 22 GLN HB3 . 25102 1
165 . 1 1 22 22 GLN HG2 H 1 1.893 0.009 . 2 . . . . 22 GLN HG2 . 25102 1
166 . 1 1 22 22 GLN HG3 H 1 1.700 0.006 . 2 . . . . 22 GLN HG3 . 25102 1
167 . 1 1 22 22 GLN HE21 H 1 6.711 0.012 . 2 . . . . 22 GLN HE21 . 25102 1
168 . 1 1 22 22 GLN HE22 H 1 8.883 0.004 . 2 . . . . 22 GLN HE22 . 25102 1
169 . 1 1 22 22 GLN N N 15 118.335 0.059 . 1 . . . . 22 GLN N . 25102 1
170 . 1 1 22 22 GLN NE2 N 15 116.345 0.196 . 1 . . . . 22 GLN NE2 . 25102 1
171 . 1 1 23 23 ASP H H 1 7.757 0.011 . 1 . . . . 23 ASP HN . 25102 1
172 . 1 1 23 23 ASP HA H 1 4.164 0.006 . 1 . . . . 23 ASP HA . 25102 1
173 . 1 1 23 23 ASP HB2 H 1 2.970 0.009 . 2 . . . . 23 ASP HB2 . 25102 1
174 . 1 1 23 23 ASP HB3 H 1 2.582 0.010 . 2 . . . . 23 ASP HB3 . 25102 1
175 . 1 1 23 23 ASP N N 15 115.262 0.056 . 1 . . . . 23 ASP N . 25102 1
176 . 1 1 24 24 VAL H H 1 7.534 0.011 . 1 . . . . 24 VAL HN . 25102 1
177 . 1 1 24 24 VAL HA H 1 4.163 0.007 . 1 . . . . 24 VAL HA . 25102 1
178 . 1 1 24 24 VAL HB H 1 2.161 0.006 . 1 . . . . 24 VAL HB . 25102 1
179 . 1 1 24 24 VAL HG11 H 1 1.051 0.008 . 1 . . . . 24 VAL QG1 . 25102 1
180 . 1 1 24 24 VAL HG12 H 1 1.051 0.008 . 1 . . . . 24 VAL QG1 . 25102 1
181 . 1 1 24 24 VAL HG13 H 1 1.051 0.008 . 1 . . . . 24 VAL QG1 . 25102 1
182 . 1 1 24 24 VAL HG21 H 1 0.970 0.010 . 1 . . . . 24 VAL QG2 . 25102 1
183 . 1 1 24 24 VAL HG22 H 1 0.970 0.010 . 1 . . . . 24 VAL QG2 . 25102 1
184 . 1 1 24 24 VAL HG23 H 1 0.970 0.010 . 1 . . . . 24 VAL QG2 . 25102 1
185 . 1 1 24 24 VAL N N 15 119.478 0.263 . 1 . . . . 24 VAL N . 25102 1
186 . 1 1 25 25 ALA H H 1 8.565 0.007 . 1 . . . . 25 ALA HN . 25102 1
187 . 1 1 25 25 ALA HA H 1 4.400 0.007 . 1 . . . . 25 ALA HA . 25102 1
188 . 1 1 25 25 ALA HB1 H 1 1.233 0.007 . 1 . . . . 25 ALA QB . 25102 1
189 . 1 1 25 25 ALA HB2 H 1 1.233 0.007 . 1 . . . . 25 ALA QB . 25102 1
190 . 1 1 25 25 ALA HB3 H 1 1.233 0.007 . 1 . . . . 25 ALA QB . 25102 1
191 . 1 1 25 25 ALA N N 15 132.445 0.091 . 1 . . . . 25 ALA N . 25102 1
192 . 1 1 26 26 PRO HA H 1 3.664 0.006 . 1 . . . . 26 PRO HA . 25102 1
193 . 1 1 26 26 PRO HB2 H 1 2.290 0.003 . 2 . . . . 26 PRO HB2 . 25102 1
194 . 1 1 26 26 PRO HB3 H 1 1.691 0.002 . 2 . . . . 26 PRO HB3 . 25102 1
195 . 1 1 26 26 PRO HG2 H 1 1.902 0.000 . 2 . . . . 26 PRO HG2 . 25102 1
196 . 1 1 26 26 PRO HD2 H 1 3.835 0.005 . 1 . . . . 26 PRO HD2 . 25102 1
197 . 1 1 26 26 PRO HD3 H 1 3.507 0.004 . 1 . . . . 26 PRO HD3 . 25102 1
198 . 1 1 27 27 GLY H H 1 8.200 0.008 . 1 . . . . 27 GLY HN . 25102 1
199 . 1 1 27 27 GLY HA2 H 1 4.209 0.015 . 2 . . . . 27 GLY HA2 . 25102 1
200 . 1 1 27 27 GLY HA3 H 1 3.798 0.016 . 2 . . . . 27 GLY HA3 . 25102 1
201 . 1 1 27 27 GLY N N 15 106.448 0.063 . 1 . . . . 27 GLY N . 25102 1
202 . 1 1 28 28 THR H H 1 7.251 0.009 . 1 . . . . 28 THR HN . 25102 1
203 . 1 1 28 28 THR HA H 1 4.355 0.009 . 1 . . . . 28 THR HA . 25102 1
204 . 1 1 28 28 THR HB H 1 3.937 0.008 . 1 . . . . 28 THR HB . 25102 1
205 . 1 1 28 28 THR HG1 H 1 6.855 0.006 . 1 . . . . 28 THR HG1 . 25102 1
206 . 1 1 28 28 THR HG21 H 1 1.078 0.009 . 1 . . . . 28 THR QG2 . 25102 1
207 . 1 1 28 28 THR HG22 H 1 1.078 0.009 . 1 . . . . 28 THR QG2 . 25102 1
208 . 1 1 28 28 THR HG23 H 1 1.078 0.009 . 1 . . . . 28 THR QG2 . 25102 1
209 . 1 1 28 28 THR N N 15 118.305 0.121 . 1 . . . . 28 THR N . 25102 1
210 . 1 1 29 29 PRO HA H 1 4.684 0.008 . 1 . . . . 29 PRO HA . 25102 1
211 . 1 1 29 29 PRO HB2 H 1 2.220 0.006 . 2 . . . . 29 PRO HB2 . 25102 1
212 . 1 1 29 29 PRO HG2 H 1 1.873 0.004 . 2 . . . . 29 PRO HG2 . 25102 1
213 . 1 1 29 29 PRO HG3 H 1 1.789 0.006 . 2 . . . . 29 PRO HG3 . 25102 1
214 . 1 1 29 29 PRO HD2 H 1 3.557 0.007 . 1 . . . . 29 PRO HD2 . 25102 1
215 . 1 1 29 29 PRO HD3 H 1 4.171 0.002 . 1 . . . . 29 PRO HD3 . 25102 1
216 . 1 1 30 30 TRP H H 1 9.563 0.008 . 1 . . . . 30 TRP HN . 25102 1
217 . 1 1 30 30 TRP HA H 1 3.957 0.009 . 1 . . . . 30 TRP HA . 25102 1
218 . 1 1 30 30 TRP HB2 H 1 2.976 0.004 . 1 . . . . 30 TRP HB2 . 25102 1
219 . 1 1 30 30 TRP HB3 H 1 2.988 0.012 . 1 . . . . 30 TRP HB3 . 25102 1
220 . 1 1 30 30 TRP HD1 H 1 6.922 0.005 . 1 . . . . 30 TRP HD1 . 25102 1
221 . 1 1 30 30 TRP HE1 H 1 10.172 0.005 . 1 . . . . 30 TRP HE1 . 25102 1
222 . 1 1 30 30 TRP HE3 H 1 6.005 0.004 . 1 . . . . 30 TRP HE3 . 25102 1
223 . 1 1 30 30 TRP HZ2 H 1 7.133 0.004 . 1 . . . . 30 TRP HZ2 . 25102 1
224 . 1 1 30 30 TRP HZ3 H 1 5.266 0.004 . 1 . . . . 30 TRP HZ3 . 25102 1
225 . 1 1 30 30 TRP HH2 H 1 5.364 0.004 . 1 . . . . 30 TRP HH2 . 25102 1
226 . 1 1 30 30 TRP N N 15 123.786 0.121 . 1 . . . . 30 TRP N . 25102 1
227 . 1 1 30 30 TRP NE1 N 15 127.562 0.111 . 1 . . . . 30 TRP NE1 . 25102 1
228 . 1 1 31 31 SER H H 1 8.443 0.008 . 1 . . . . 31 SER HN . 25102 1
229 . 1 1 31 31 SER HA H 1 3.859 0.005 . 1 . . . . 31 SER HA . 25102 1
230 . 1 1 31 31 SER HB2 H 1 3.768 0.004 . 2 . . . . 31 SER HB2 . 25102 1
231 . 1 1 31 31 SER HB3 H 1 3.878 0.009 . 2 . . . . 31 SER HB3 . 25102 1
232 . 1 1 31 31 SER N N 15 111.431 0.075 . 1 . . . . 31 SER N . 25102 1
233 . 1 1 32 32 GLU H H 1 7.594 0.008 . 1 . . . . 32 GLU HN . 25102 1
234 . 1 1 32 32 GLU HA H 1 4.169 0.008 . 1 . . . . 32 GLU HA . 25102 1
235 . 1 1 32 32 GLU HB2 H 1 1.547 0.009 . 2 . . . . 32 GLU HB2 . 25102 1
236 . 1 1 32 32 GLU HG2 H 1 2.128 0.019 . 2 . . . . 32 GLU HG2 . 25102 1
237 . 1 1 32 32 GLU HG3 H 1 2.048 0.007 . 2 . . . . 32 GLU HG3 . 25102 1
238 . 1 1 32 32 GLU N N 15 119.555 0.121 . 1 . . . . 32 GLU N . 25102 1
239 . 1 1 33 33 VAL H H 1 7.063 0.009 . 1 . . . . 33 VAL HN . 25102 1
240 . 1 1 33 33 VAL HA H 1 3.537 0.007 . 1 . . . . 33 VAL HA . 25102 1
241 . 1 1 33 33 VAL HB H 1 0.832 0.007 . 1 . . . . 33 VAL HB . 25102 1
242 . 1 1 33 33 VAL HG11 H 1 -0.139 0.004 . 1 . . . . 33 VAL QG1 . 25102 1
243 . 1 1 33 33 VAL HG12 H 1 -0.139 0.004 . 1 . . . . 33 VAL QG1 . 25102 1
244 . 1 1 33 33 VAL HG13 H 1 -0.139 0.004 . 1 . . . . 33 VAL QG1 . 25102 1
245 . 1 1 33 33 VAL HG21 H 1 0.238 0.005 . 1 . . . . 33 VAL QG2 . 25102 1
246 . 1 1 33 33 VAL HG22 H 1 0.238 0.005 . 1 . . . . 33 VAL QG2 . 25102 1
247 . 1 1 33 33 VAL HG23 H 1 0.238 0.005 . 1 . . . . 33 VAL QG2 . 25102 1
248 . 1 1 33 33 VAL N N 15 125.616 0.025 . 1 . . . . 33 VAL N . 25102 1
249 . 1 1 34 34 PRO HA H 1 4.155 0.004 . 1 . . . . 34 PRO HA . 25102 1
250 . 1 1 34 34 PRO HB2 H 1 2.280 0.003 . 2 . . . . 34 PRO HB2 . 25102 1
251 . 1 1 34 34 PRO HG2 H 1 2.020 0.007 . 2 . . . . 34 PRO HG2 . 25102 1
252 . 1 1 34 34 PRO HG3 H 1 1.945 0.003 . 2 . . . . 34 PRO HG3 . 25102 1
253 . 1 1 34 34 PRO HD2 H 1 3.289 0.004 . 1 . . . . 34 PRO HD2 . 25102 1
254 . 1 1 34 34 PRO HD3 H 1 3.849 0.004 . 1 . . . . 34 PRO HD3 . 25102 1
255 . 1 1 35 35 ASP H H 1 8.381 0.006 . 1 . . . . 35 ASP HN . 25102 1
256 . 1 1 35 35 ASP HA H 1 4.053 0.008 . 1 . . . . 35 ASP HA . 25102 1
257 . 1 1 35 35 ASP HB2 H 1 2.571 0.009 . 2 . . . . 35 ASP HB2 . 25102 1
258 . 1 1 35 35 ASP HB3 H 1 2.469 0.010 . 2 . . . . 35 ASP HB3 . 25102 1
259 . 1 1 35 35 ASP N N 15 118.884 0.201 . 1 . . . . 35 ASP N . 25102 1
260 . 1 1 36 36 ASN H H 1 7.864 0.011 . 1 . . . . 36 ASN HN . 25102 1
261 . 1 1 36 36 ASN HA H 1 4.554 0.008 . 1 . . . . 36 ASN HA . 25102 1
262 . 1 1 36 36 ASN HB2 H 1 3.003 0.006 . 1 . . . . 36 ASN HB2 . 25102 1
263 . 1 1 36 36 ASN HB3 H 1 2.613 0.008 . 1 . . . . 36 ASN HB3 . 25102 1
264 . 1 1 36 36 ASN HD21 H 1 7.423 0.009 . 2 . . . . 36 ASN HD21 . 25102 1
265 . 1 1 36 36 ASN HD22 H 1 6.701 0.007 . 2 . . . . 36 ASN HD22 . 25102 1
266 . 1 1 36 36 ASN N N 15 115.350 0.156 . 1 . . . . 36 ASN N . 25102 1
267 . 1 1 36 36 ASN ND2 N 15 111.412 0.102 . 1 . . . . 36 ASN ND2 . 25102 1
268 . 1 1 37 37 PHE H H 1 7.397 0.007 . 1 . . . . 37 PHE HN . 25102 1
269 . 1 1 37 37 PHE HA H 1 3.864 0.007 . 1 . . . . 37 PHE HA . 25102 1
270 . 1 1 37 37 PHE HB2 H 1 2.800 0.004 . 2 . . . . 37 PHE HB2 . 25102 1
271 . 1 1 37 37 PHE HB3 H 1 2.242 0.006 . 2 . . . . 37 PHE HB3 . 25102 1
272 . 1 1 37 37 PHE HD1 H 1 6.623 0.003 . 1 . . . . 37 PHE HD1 . 25102 1
273 . 1 1 37 37 PHE HD2 H 1 6.623 0.003 . 1 . . . . 37 PHE HD2 . 25102 1
274 . 1 1 37 37 PHE HE1 H 1 7.102 0.003 . 1 . . . . 37 PHE HE1 . 25102 1
275 . 1 1 37 37 PHE HE2 H 1 7.102 0.003 . 1 . . . . 37 PHE HE2 . 25102 1
276 . 1 1 37 37 PHE HZ H 1 7.405 0.006 . 1 . . . . 37 PHE HZ . 25102 1
277 . 1 1 37 37 PHE N N 15 122.004 0.182 . 1 . . . . 37 PHE N . 25102 1
278 . 1 1 38 38 LEU H H 1 7.907 0.011 . 1 . . . . 38 LEU HN . 25102 1
279 . 1 1 38 38 LEU HA H 1 4.724 0.009 . 1 . . . . 38 LEU HA . 25102 1
280 . 1 1 38 38 LEU HB2 H 1 0.690 0.011 . 2 . . . . 38 LEU HB2 . 25102 1
281 . 1 1 38 38 LEU HB3 H 1 1.085 0.007 . 2 . . . . 38 LEU HB3 . 25102 1
282 . 1 1 38 38 LEU HG H 1 1.482 0.007 . 1 . . . . 38 LEU HG . 25102 1
283 . 1 1 38 38 LEU HD11 H 1 0.654 0.007 . 2 . . . . 38 LEU QD1 . 25102 1
284 . 1 1 38 38 LEU HD12 H 1 0.654 0.007 . 2 . . . . 38 LEU QD1 . 25102 1
285 . 1 1 38 38 LEU HD13 H 1 0.654 0.007 . 2 . . . . 38 LEU QD1 . 25102 1
286 . 1 1 38 38 LEU HD21 H 1 0.583 0.004 . 2 . . . . 38 LEU QD2 . 25102 1
287 . 1 1 38 38 LEU HD22 H 1 0.583 0.004 . 2 . . . . 38 LEU QD2 . 25102 1
288 . 1 1 38 38 LEU HD23 H 1 0.583 0.004 . 2 . . . . 38 LEU QD2 . 25102 1
289 . 1 1 38 38 LEU N N 15 127.420 0.070 . 1 . . . . 38 LEU N . 25102 1
290 . 1 1 39 39 CYS H H 1 9.568 0.006 . 1 . . . . 39 CYS HN . 25102 1
291 . 1 1 39 39 CYS HA H 1 4.054 0.007 . 1 . . . . 39 CYS HA . 25102 1
292 . 1 1 39 39 CYS HB2 H 1 3.138 0.008 . 2 . . . . 39 CYS HB2 . 25102 1
293 . 1 1 39 39 CYS HB3 H 1 3.060 0.004 . 2 . . . . 39 CYS HB3 . 25102 1
294 . 1 1 39 39 CYS N N 15 125.807 0.258 . 1 . . . . 39 CYS N . 25102 1
295 . 1 1 40 40 PRO HA H 1 3.879 0.004 . 1 . . . . 40 PRO HA . 25102 1
296 . 1 1 40 40 PRO HB2 H 1 1.761 0.006 . 2 . . . . 40 PRO HB2 . 25102 1
297 . 1 1 40 40 PRO HB3 H 1 1.279 0.004 . 2 . . . . 40 PRO HB3 . 25102 1
298 . 1 1 40 40 PRO HG2 H 1 0.926 0.002 . 2 . . . . 40 PRO HG2 . 25102 1
299 . 1 1 40 40 PRO HG3 H 1 0.525 0.006 . 2 . . . . 40 PRO HG3 . 25102 1
300 . 1 1 40 40 PRO HD2 H 1 2.329 0.004 . 1 . . . . 40 PRO HD2 . 25102 1
301 . 1 1 40 40 PRO HD3 H 1 2.689 0.005 . 1 . . . . 40 PRO HD3 . 25102 1
302 . 1 1 41 41 GLU H H 1 8.422 0.011 . 1 . . . . 41 GLU HN . 25102 1
303 . 1 1 41 41 GLU HA H 1 4.324 0.007 . 1 . . . . 41 GLU HA . 25102 1
304 . 1 1 41 41 GLU HB2 H 1 2.377 0.008 . 2 . . . . 41 GLU HB2 . 25102 1
305 . 1 1 41 41 GLU HB3 H 1 2.244 0.005 . 2 . . . . 41 GLU HB3 . 25102 1
306 . 1 1 41 41 GLU HG2 H 1 2.149 0.011 . 2 . . . . 41 GLU HG2 . 25102 1
307 . 1 1 41 41 GLU HG3 H 1 1.918 0.008 . 2 . . . . 41 GLU HG3 . 25102 1
308 . 1 1 41 41 GLU N N 15 120.864 0.010 . 1 . . . . 41 GLU N . 25102 1
309 . 1 1 42 42 CYS H H 1 8.562 0.008 . 1 . . . . 42 CYS HN . 25102 1
310 . 1 1 42 42 CYS HA H 1 4.774 0.010 . 1 . . . . 42 CYS HA . 25102 1
311 . 1 1 42 42 CYS HB2 H 1 3.043 0.010 . 1 . . . . 42 CYS HB2 . 25102 1
312 . 1 1 42 42 CYS HB3 H 1 2.544 0.009 . 1 . . . . 42 CYS HB3 . 25102 1
313 . 1 1 42 42 CYS N N 15 121.478 0.012 . 1 . . . . 42 CYS N . 25102 1
314 . 1 1 43 43 SER H H 1 7.905 0.009 . 1 . . . . 43 SER HN . 25102 1
315 . 1 1 43 43 SER HA H 1 4.048 0.005 . 1 . . . . 43 SER HA . 25102 1
316 . 1 1 43 43 SER HB2 H 1 3.953 0.004 . 1 . . . . 43 SER HB2 . 25102 1
317 . 1 1 43 43 SER HB3 H 1 3.953 0.004 . 1 . . . . 43 SER HB3 . 25102 1
318 . 1 1 43 43 SER N N 15 114.585 0.042 . 1 . . . . 43 SER N . 25102 1
319 . 1 1 44 44 LEU H H 1 7.920 0.003 . 1 . . . . 44 LEU HN . 25102 1
320 . 1 1 44 44 LEU HA H 1 4.627 0.002 . 1 . . . . 44 LEU HA . 25102 1
321 . 1 1 44 44 LEU HB2 H 1 2.073 0.006 . 2 . . . . 44 LEU HB2 . 25102 1
322 . 1 1 44 44 LEU HB3 H 1 1.542 0.003 . 2 . . . . 44 LEU HB3 . 25102 1
323 . 1 1 44 44 LEU HG H 1 1.779 0.005 . 1 . . . . 44 LEU HG . 25102 1
324 . 1 1 44 44 LEU HD11 H 1 0.992 0.004 . 2 . . . . 44 LEU QD1 . 25102 1
325 . 1 1 44 44 LEU HD12 H 1 0.992 0.004 . 2 . . . . 44 LEU QD1 . 25102 1
326 . 1 1 44 44 LEU HD13 H 1 0.992 0.004 . 2 . . . . 44 LEU QD1 . 25102 1
327 . 1 1 44 44 LEU HD21 H 1 0.857 0.005 . 2 . . . . 44 LEU QD2 . 25102 1
328 . 1 1 44 44 LEU HD22 H 1 0.857 0.005 . 2 . . . . 44 LEU QD2 . 25102 1
329 . 1 1 44 44 LEU HD23 H 1 0.857 0.005 . 2 . . . . 44 LEU QD2 . 25102 1
330 . 1 1 45 45 GLY H H 1 8.158 0.006 . 1 . . . . 45 GLY HN . 25102 1
331 . 1 1 45 45 GLY HA2 H 1 4.761 0.007 . 2 . . . . 45 GLY HA2 . 25102 1
332 . 1 1 45 45 GLY HA3 H 1 3.855 0.010 . 2 . . . . 45 GLY HA3 . 25102 1
333 . 1 1 45 45 GLY N N 15 103.239 0.208 . 1 . . . . 45 GLY N . 25102 1
334 . 1 1 46 46 LYS H H 1 8.269 0.007 . 1 . . . . 46 LYS HN . 25102 1
335 . 1 1 46 46 LYS HA H 1 4.114 0.004 . 1 . . . . 46 LYS HA . 25102 1
336 . 1 1 46 46 LYS HB2 H 1 1.849 0.005 . 2 . . . . 46 LYS HB2 . 25102 1
337 . 1 1 46 46 LYS HB3 H 1 1.746 0.010 . 2 . . . . 46 LYS HB3 . 25102 1
338 . 1 1 46 46 LYS HG2 H 1 1.357 0.006 . 2 . . . . 46 LYS HG2 . 25102 1
339 . 1 1 46 46 LYS HG3 H 1 0.773 0.004 . 2 . . . . 46 LYS HG3 . 25102 1
340 . 1 1 46 46 LYS HD2 H 1 1.969 0.007 . 2 . . . . 46 LYS HD2 . 25102 1
341 . 1 1 46 46 LYS HD3 H 1 0.726 0.004 . 2 . . . . 46 LYS HD3 . 25102 1
342 . 1 1 46 46 LYS HE2 H 1 3.444 0.003 . 2 . . . . 46 LYS HE2 . 25102 1
343 . 1 1 46 46 LYS HE3 H 1 2.487 0.008 . 2 . . . . 46 LYS HE3 . 25102 1
344 . 1 1 46 46 LYS N N 15 113.276 0.144 . 1 . . . . 46 LYS N . 25102 1
345 . 1 1 47 47 ASP H H 1 8.910 0.009 . 1 . . . . 47 ASP HN . 25102 1
346 . 1 1 47 47 ASP HA H 1 4.493 0.008 . 1 . . . . 47 ASP HA . 25102 1
347 . 1 1 47 47 ASP HB2 H 1 2.712 0.006 . 2 . . . . 47 ASP HB2 . 25102 1
348 . 1 1 47 47 ASP HB3 H 1 2.705 0.000 . 2 . . . . 47 ASP HB3 . 25102 1
349 . 1 1 47 47 ASP N N 15 115.186 0.084 . 1 . . . . 47 ASP N . 25102 1
350 . 1 1 48 48 VAL H H 1 7.756 0.011 . 1 . . . . 48 VAL HN . 25102 1
351 . 1 1 48 48 VAL HA H 1 4.607 0.007 . 1 . . . . 48 VAL HA . 25102 1
352 . 1 1 48 48 VAL HB H 1 2.381 0.008 . 1 . . . . 48 VAL HB . 25102 1
353 . 1 1 48 48 VAL HG11 H 1 1.214 0.006 . 2 . . . . 48 VAL QG1 . 25102 1
354 . 1 1 48 48 VAL HG12 H 1 1.214 0.006 . 2 . . . . 48 VAL QG1 . 25102 1
355 . 1 1 48 48 VAL HG13 H 1 1.214 0.006 . 2 . . . . 48 VAL QG1 . 25102 1
356 . 1 1 48 48 VAL HG21 H 1 0.906 0.007 . 2 . . . . 48 VAL QG2 . 25102 1
357 . 1 1 48 48 VAL HG22 H 1 0.906 0.007 . 2 . . . . 48 VAL QG2 . 25102 1
358 . 1 1 48 48 VAL HG23 H 1 0.906 0.007 . 2 . . . . 48 VAL QG2 . 25102 1
359 . 1 1 48 48 VAL N N 15 110.836 0.052 . 1 . . . . 48 VAL N . 25102 1
360 . 1 1 49 49 PHE H H 1 8.064 0.007 . 1 . . . . 49 PHE HN . 25102 1
361 . 1 1 49 49 PHE HA H 1 4.869 0.007 . 1 . . . . 49 PHE HA . 25102 1
362 . 1 1 49 49 PHE HB2 H 1 3.377 0.006 . 2 . . . . 49 PHE HB2 . 25102 1
363 . 1 1 49 49 PHE HB3 H 1 1.949 0.009 . 2 . . . . 49 PHE HB3 . 25102 1
364 . 1 1 49 49 PHE HD1 H 1 7.030 0.005 . 1 . . . . 49 PHE HD1 . 25102 1
365 . 1 1 49 49 PHE HD2 H 1 7.030 0.005 . 1 . . . . 49 PHE HD2 . 25102 1
366 . 1 1 49 49 PHE HE1 H 1 7.514 0.004 . 1 . . . . 49 PHE HE1 . 25102 1
367 . 1 1 49 49 PHE HE2 H 1 7.514 0.004 . 1 . . . . 49 PHE HE2 . 25102 1
368 . 1 1 49 49 PHE HZ H 1 7.808 0.004 . 1 . . . . 49 PHE HZ . 25102 1
369 . 1 1 49 49 PHE N N 15 124.366 0.080 . 1 . . . . 49 PHE N . 25102 1
370 . 1 1 50 50 GLU H H 1 8.729 0.012 . 1 . . . . 50 GLU HN . 25102 1
371 . 1 1 50 50 GLU HA H 1 4.619 0.008 . 1 . . . . 50 GLU HA . 25102 1
372 . 1 1 50 50 GLU HB2 H 1 1.822 0.016 . 1 . . . . 50 GLU HB2 . 25102 1
373 . 1 1 50 50 GLU HB3 H 1 1.822 0.016 . 1 . . . . 50 GLU HB3 . 25102 1
374 . 1 1 50 50 GLU HG2 H 1 1.981 0.007 . 2 . . . . 50 GLU HG2 . 25102 1
375 . 1 1 50 50 GLU HG3 H 1 2.131 0.009 . 2 . . . . 50 GLU HG3 . 25102 1
376 . 1 1 50 50 GLU N N 15 120.147 0.194 . 1 . . . . 50 GLU N . 25102 1
377 . 1 1 51 51 GLU H H 1 8.739 0.011 . 1 . . . . 51 GLU HN . 25102 1
378 . 1 1 51 51 GLU HA H 1 4.753 0.007 . 1 . . . . 51 GLU HA . 25102 1
379 . 1 1 51 51 GLU HB2 H 1 1.788 0.009 . 1 . . . . 51 GLU HB2 . 25102 1
380 . 1 1 51 51 GLU HB3 H 1 1.788 0.009 . 1 . . . . 51 GLU HB3 . 25102 1
381 . 1 1 51 51 GLU HG2 H 1 2.056 0.006 . 2 . . . . 51 GLU HG2 . 25102 1
382 . 1 1 51 51 GLU HG3 H 1 2.155 0.008 . 2 . . . . 51 GLU HG3 . 25102 1
383 . 1 1 51 51 GLU N N 15 123.941 0.097 . 1 . . . . 51 GLU N . 25102 1
384 . 1 1 52 52 LEU H H 1 8.207 0.008 . 1 . . . . 52 LEU HN . 25102 1
385 . 1 1 52 52 LEU HA H 1 4.312 0.010 . 1 . . . . 52 LEU HA . 25102 1
386 . 1 1 52 52 LEU HB2 H 1 1.361 0.010 . 2 . . . . 52 LEU HB2 . 25102 1
387 . 1 1 52 52 LEU HB3 H 1 1.142 0.008 . 2 . . . . 52 LEU HB3 . 25102 1
388 . 1 1 52 52 LEU HD11 H 1 0.651 0.006 . 2 . . . . 52 LEU QD1 . 25102 1
389 . 1 1 52 52 LEU HD12 H 1 0.651 0.006 . 2 . . . . 52 LEU QD1 . 25102 1
390 . 1 1 52 52 LEU HD13 H 1 0.651 0.006 . 2 . . . . 52 LEU QD1 . 25102 1
391 . 1 1 52 52 LEU HD21 H 1 0.639 0.005 . 2 . . . . 52 LEU QD2 . 25102 1
392 . 1 1 52 52 LEU HD22 H 1 0.639 0.005 . 2 . . . . 52 LEU QD2 . 25102 1
393 . 1 1 52 52 LEU HD23 H 1 0.639 0.005 . 2 . . . . 52 LEU QD2 . 25102 1
394 . 1 1 52 52 LEU N N 15 126.863 0.082 . 1 . . . . 52 LEU N . 25102 1
395 . 1 1 53 53 ALA H H 1 8.494 0.005 . 1 . . . . 53 ALA HN . 25102 1
396 . 1 1 53 53 ALA HA H 1 4.259 0.005 . 1 . . . . 53 ALA HA . 25102 1
397 . 1 1 53 53 ALA HB1 H 1 1.321 0.009 . 1 . . . . 53 ALA QB . 25102 1
398 . 1 1 53 53 ALA HB2 H 1 1.321 0.009 . 1 . . . . 53 ALA QB . 25102 1
399 . 1 1 53 53 ALA HB3 H 1 1.321 0.009 . 1 . . . . 53 ALA QB . 25102 1
400 . 1 1 53 53 ALA N N 15 128.679 0.039 . 1 . . . . 53 ALA N . 25102 1
401 . 1 1 54 54 SER H H 1 8.893 0.010 . 1 . . . . 54 SER HN . 25102 1
402 . 1 1 54 54 SER HA H 1 4.706 0.000 . 1 . . . . 54 SER HA . 25102 1
403 . 1 1 54 54 SER HB2 H 1 3.463 0.004 . 2 . . . . 54 SER HB2 . 25102 1
404 . 1 1 54 54 SER HB3 H 1 4.158 0.007 . 2 . . . . 54 SER HB3 . 25102 1
405 . 1 1 54 54 SER N N 15 113.369 0.017 . 1 . . . . 54 SER N . 25102 1
406 . 1 1 55 55 GLU H H 1 8.296 0.009 . 1 . . . . 55 GLU HN . 25102 1
407 . 1 1 55 55 GLU HA H 1 3.776 0.008 . 1 . . . . 55 GLU HA . 25102 1
408 . 1 1 55 55 GLU N N 15 115.612 0.035 . 1 . . . . 55 GLU N . 25102 1
409 . 1 1 56 56 ALA H H 1 8.185 0.006 . 1 . . . . 56 ALA HN . 25102 1
410 . 1 1 56 56 ALA HA H 1 4.223 0.008 . 1 . . . . 56 ALA HA . 25102 1
411 . 1 1 56 56 ALA HB1 H 1 1.280 0.008 . 1 . . . . 56 ALA QB . 25102 1
412 . 1 1 56 56 ALA HB2 H 1 1.280 0.008 . 1 . . . . 56 ALA QB . 25102 1
413 . 1 1 56 56 ALA HB3 H 1 1.280 0.008 . 1 . . . . 56 ALA QB . 25102 1
414 . 1 1 56 56 ALA N N 15 125.675 0.171 . 1 . . . . 56 ALA N . 25102 1
415 . 1 1 57 57 LYS H H 1 7.841 0.009 . 1 . . . . 57 LYS HN . 25102 1
416 . 1 1 57 57 LYS HA H 1 4.054 0.008 . 1 . . . . 57 LYS HA . 25102 1
417 . 1 1 57 57 LYS HB2 H 1 1.592 0.008 . 2 . . . . 57 LYS HB2 . 25102 1
418 . 1 1 57 57 LYS HB3 H 1 1.565 0.003 . 2 . . . . 57 LYS HB3 . 25102 1
419 . 1 1 57 57 LYS HG2 H 1 1.728 0.009 . 2 . . . . 57 LYS HG2 . 25102 1
420 . 1 1 57 57 LYS HD2 H 1 1.290 0.009 . 2 . . . . 57 LYS HD2 . 25102 1
421 . 1 1 57 57 LYS HE2 H 1 2.890 0.004 . 2 . . . . 57 LYS HE2 . 25102 1
422 . 1 1 57 57 LYS N N 15 126.791 0.087 . 1 . . . . 57 LYS N . 25102 1
stop_
save_