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 34102
_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 34102 1
2 '2D 1H-13C HSQC' . . . 34102 1
3 '3D CBCA(CO)NH' . . . 34102 1
4 '3D HNCACB' . . . 34102 1
5 '3D HBHA(CO)NH' . . . 34102 1
6 '3D HNCO' . . . 34102 1
7 '3D HCCH-TOCSY' . . . 34102 1
8 '3D 1H-15N NOESY' . . . 34102 1
9 '3D 1H-13C NOESY aliphatic' . . . 34102 1
10 '3D filtered/edited 1H-13C NOESY aliphatic' . . . 34102 1
11 '3D 1H-13C NOESY aromatic' . . . 34102 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.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 MET HA H 1 4.577 0.000 . 1 . . . . A 1 MET HA . 34102 1
2 . 1 1 2 2 MET HB2 H 1 2.184 0.001 . 2 . . . . A 1 MET HB2 . 34102 1
3 . 1 1 2 2 MET HB3 H 1 2.090 0.002 . 2 . . . . A 1 MET HB3 . 34102 1
4 . 1 1 2 2 MET HG2 H 1 2.664 0.001 . 2 . . . . A 1 MET HG2 . 34102 1
5 . 1 1 2 2 MET HG3 H 1 2.625 0.001 . 2 . . . . A 1 MET HG3 . 34102 1
6 . 1 1 2 2 MET HE1 H 1 2.163 0.000 . 1 . . . . A 1 MET HE1 . 34102 1
7 . 1 1 2 2 MET HE2 H 1 2.163 0.000 . 1 . . . . A 1 MET HE2 . 34102 1
8 . 1 1 2 2 MET HE3 H 1 2.163 0.000 . 1 . . . . A 1 MET HE3 . 34102 1
9 . 1 1 2 2 MET CA C 13 55.873 0.000 . 1 . . . . A 1 MET CA . 34102 1
10 . 1 1 2 2 MET CB C 13 32.962 0.003 . 1 . . . . A 1 MET CB . 34102 1
11 . 1 1 2 2 MET CG C 13 32.131 0.002 . 1 . . . . A 1 MET CG . 34102 1
12 . 1 1 2 2 MET CE C 13 17.042 0.000 . 1 . . . . A 1 MET CE . 34102 1
13 . 1 1 3 3 ASP H H 1 8.435 0.000 . 1 . . . . A 2 ASP H . 34102 1
14 . 1 1 3 3 ASP HA H 1 4.645 0.011 . 1 . . . . A 2 ASP HA . 34102 1
15 . 1 1 3 3 ASP HB2 H 1 2.781 0.004 . 2 . . . . A 2 ASP HB2 . 34102 1
16 . 1 1 3 3 ASP HB3 H 1 2.656 0.000 . 2 . . . . A 2 ASP HB3 . 34102 1
17 . 1 1 3 3 ASP CA C 13 54.637 0.007 . 1 . . . . A 2 ASP CA . 34102 1
18 . 1 1 3 3 ASP CB C 13 41.364 0.011 . 1 . . . . A 2 ASP CB . 34102 1
19 . 1 1 3 3 ASP N N 15 122.319 0.000 . 1 . . . . A 2 ASP N . 34102 1
20 . 1 1 4 4 GLU H H 1 8.481 0.000 . 1 . . . . A 3 GLU H . 34102 1
21 . 1 1 4 4 GLU HA H 1 4.377 0.005 . 1 . . . . A 3 GLU HA . 34102 1
22 . 1 1 4 4 GLU HB2 H 1 2.158 0.015 . 2 . . . . A 3 GLU HB2 . 34102 1
23 . 1 1 4 4 GLU HB3 H 1 2.024 0.006 . 2 . . . . A 3 GLU HB3 . 34102 1
24 . 1 1 4 4 GLU HG2 H 1 2.344 0.005 . 2 . . . . A 3 GLU HG2 . 34102 1
25 . 1 1 4 4 GLU HG3 H 1 2.297 0.000 . 2 . . . . A 3 GLU HG3 . 34102 1
26 . 1 1 4 4 GLU CA C 13 57.043 0.001 . 1 . . . . A 3 GLU CA . 34102 1
27 . 1 1 4 4 GLU CB C 13 30.337 0.004 . 1 . . . . A 3 GLU CB . 34102 1
28 . 1 1 4 4 GLU CG C 13 36.441 0.058 . 1 . . . . A 3 GLU CG . 34102 1
29 . 1 1 4 4 GLU N N 15 122.383 0.000 . 1 . . . . A 3 GLU N . 34102 1
30 . 1 1 5 5 THR H H 1 8.317 0.000 . 1 . . . . A 4 THR H . 34102 1
31 . 1 1 5 5 THR HA H 1 4.313 0.004 . 1 . . . . A 4 THR HA . 34102 1
32 . 1 1 5 5 THR HB H 1 4.253 0.001 . 1 . . . . A 4 THR HB . 34102 1
33 . 1 1 5 5 THR HG21 H 1 1.274 0.007 . 1 . . . . A 4 THR HG21 . 34102 1
34 . 1 1 5 5 THR HG22 H 1 1.274 0.007 . 1 . . . . A 4 THR HG22 . 34102 1
35 . 1 1 5 5 THR HG23 H 1 1.274 0.007 . 1 . . . . A 4 THR HG23 . 34102 1
36 . 1 1 5 5 THR CA C 13 62.890 0.008 . 1 . . . . A 4 THR CA . 34102 1
37 . 1 1 5 5 THR CB C 13 69.827 0.000 . 1 . . . . A 4 THR CB . 34102 1
38 . 1 1 5 5 THR CG2 C 13 22.074 0.004 . 1 . . . . A 4 THR CG2 . 34102 1
39 . 1 1 5 5 THR N N 15 115.756 0.000 . 1 . . . . A 4 THR N . 34102 1
40 . 1 1 6 6 VAL H H 1 8.017 0.008 . 1 . . . . A 5 VAL H . 34102 1
41 . 1 1 6 6 VAL HA H 1 4.120 0.003 . 1 . . . . A 5 VAL HA . 34102 1
42 . 1 1 6 6 VAL HB H 1 2.104 0.004 . 1 . . . . A 5 VAL HB . 34102 1
43 . 1 1 6 6 VAL HG11 H 1 0.999 0.001 . 2 . . . . A 5 VAL HG11 . 34102 1
44 . 1 1 6 6 VAL HG12 H 1 0.999 0.001 . 2 . . . . A 5 VAL HG12 . 34102 1
45 . 1 1 6 6 VAL HG13 H 1 0.999 0.001 . 2 . . . . A 5 VAL HG13 . 34102 1
46 . 1 1 6 6 VAL HG21 H 1 0.963 0.014 . 2 . . . . A 5 VAL HG21 . 34102 1
47 . 1 1 6 6 VAL HG22 H 1 0.963 0.014 . 2 . . . . A 5 VAL HG22 . 34102 1
48 . 1 1 6 6 VAL HG23 H 1 0.963 0.014 . 2 . . . . A 5 VAL HG23 . 34102 1
49 . 1 1 6 6 VAL CA C 13 62.737 0.026 . 1 . . . . A 5 VAL CA . 34102 1
50 . 1 1 6 6 VAL CB C 13 32.697 0.002 . 1 . . . . A 5 VAL CB . 34102 1
51 . 1 1 6 6 VAL CG1 C 13 20.931 0.026 . 2 . . . . A 5 VAL CG1 . 34102 1
52 . 1 1 6 6 VAL CG2 C 13 21.128 0.073 . 2 . . . . A 5 VAL CG2 . 34102 1
53 . 1 1 6 6 VAL N N 15 123.369 0.000 . 1 . . . . A 5 VAL N . 34102 1
54 . 1 1 7 7 LYS H H 1 8.314 0.001 . 1 . . . . A 6 LYS H . 34102 1
55 . 1 1 7 7 LYS HA H 1 4.359 0.004 . 1 . . . . A 6 LYS HA . 34102 1
56 . 1 1 7 7 LYS HB2 H 1 1.820 0.002 . 2 . . . . A 6 LYS HB2 . 34102 1
57 . 1 1 7 7 LYS HB3 H 1 1.752 0.006 . 2 . . . . A 6 LYS HB3 . 34102 1
58 . 1 1 7 7 LYS HG2 H 1 1.474 0.006 . 2 . . . . A 6 LYS HG2 . 34102 1
59 . 1 1 7 7 LYS HG3 H 1 1.392 0.005 . 2 . . . . A 6 LYS HG3 . 34102 1
60 . 1 1 7 7 LYS HD2 H 1 1.705 0.002 . 2 . . . . A 6 LYS HD2 . 34102 1
61 . 1 1 7 7 LYS HE2 H 1 3.014 0.009 . 2 . . . . A 6 LYS HE2 . 34102 1
62 . 1 1 7 7 LYS CA C 13 56.053 0.058 . 1 . . . . A 6 LYS CA . 34102 1
63 . 1 1 7 7 LYS CB C 13 33.044 0.009 . 1 . . . . A 6 LYS CB . 34102 1
64 . 1 1 7 7 LYS CG C 13 24.822 0.019 . 1 . . . . A 6 LYS CG . 34102 1
65 . 1 1 7 7 LYS CD C 13 29.008 0.097 . 1 . . . . A 6 LYS CD . 34102 1
66 . 1 1 7 7 LYS CE C 13 42.281 0.000 . 1 . . . . A 6 LYS CE . 34102 1
67 . 1 1 7 7 LYS N N 15 126.188 0.000 . 1 . . . . A 6 LYS N . 34102 1
68 . 1 1 8 8 LEU H H 1 8.190 0.003 . 1 . . . . A 7 LEU H . 34102 1
69 . 1 1 8 8 LEU HA H 1 4.305 0.003 . 1 . . . . A 7 LEU HA . 34102 1
70 . 1 1 8 8 LEU HB2 H 1 1.566 0.005 . 2 . . . . A 7 LEU HB2 . 34102 1
71 . 1 1 8 8 LEU HB3 H 1 1.425 0.007 . 2 . . . . A 7 LEU HB3 . 34102 1
72 . 1 1 8 8 LEU HG H 1 1.572 0.004 . 1 . . . . A 7 LEU HG . 34102 1
73 . 1 1 8 8 LEU HD11 H 1 0.896 0.006 . 2 . . . . A 7 LEU HD11 . 34102 1
74 . 1 1 8 8 LEU HD12 H 1 0.896 0.006 . 2 . . . . A 7 LEU HD12 . 34102 1
75 . 1 1 8 8 LEU HD13 H 1 0.896 0.006 . 2 . . . . A 7 LEU HD13 . 34102 1
76 . 1 1 8 8 LEU HD21 H 1 0.838 0.002 . 2 . . . . A 7 LEU HD21 . 34102 1
77 . 1 1 8 8 LEU HD22 H 1 0.838 0.002 . 2 . . . . A 7 LEU HD22 . 34102 1
78 . 1 1 8 8 LEU HD23 H 1 0.838 0.002 . 2 . . . . A 7 LEU HD23 . 34102 1
79 . 1 1 8 8 LEU CA C 13 55.072 0.004 . 1 . . . . A 7 LEU CA . 34102 1
80 . 1 1 8 8 LEU CB C 13 42.761 0.027 . 1 . . . . A 7 LEU CB . 34102 1
81 . 1 1 8 8 LEU CG C 13 26.945 0.011 . 1 . . . . A 7 LEU CG . 34102 1
82 . 1 1 8 8 LEU CD1 C 13 24.805 0.003 . 2 . . . . A 7 LEU CD1 . 34102 1
83 . 1 1 8 8 LEU CD2 C 13 23.445 0.071 . 2 . . . . A 7 LEU CD2 . 34102 1
84 . 1 1 8 8 LEU N N 15 124.450 0.001 . 1 . . . . A 7 LEU N . 34102 1
85 . 1 1 9 9 ASN H H 1 8.077 0.005 . 1 . . . . A 8 ASN H . 34102 1
86 . 1 1 9 9 ASN HA H 1 4.725 0.020 . 1 . . . . A 8 ASN HA . 34102 1
87 . 1 1 9 9 ASN HB2 H 1 2.620 0.005 . 2 . . . . A 8 ASN HB2 . 34102 1
88 . 1 1 9 9 ASN HB3 H 1 2.530 0.008 . 2 . . . . A 8 ASN HB3 . 34102 1
89 . 1 1 9 9 ASN HD21 H 1 7.508 0.009 . 1 . . . . A 8 ASN HD21 . 34102 1
90 . 1 1 9 9 ASN HD22 H 1 6.801 0.008 . 1 . . . . A 8 ASN HD22 . 34102 1
91 . 1 1 9 9 ASN CA C 13 52.486 0.022 . 1 . . . . A 8 ASN CA . 34102 1
92 . 1 1 9 9 ASN CB C 13 40.003 0.072 . 1 . . . . A 8 ASN CB . 34102 1
93 . 1 1 9 9 ASN N N 15 119.041 0.000 . 1 . . . . A 8 ASN N . 34102 1
94 . 1 1 9 9 ASN ND2 N 15 113.028 0.036 . 1 . . . . A 8 ASN ND2 . 34102 1
95 . 1 1 10 10 HIS H H 1 8.272 0.018 . 1 . . . . A 9 HIS H . 34102 1
96 . 1 1 10 10 HIS HA H 1 4.283 0.009 . 1 . . . . A 9 HIS HA . 34102 1
97 . 1 1 10 10 HIS HB2 H 1 2.558 0.007 . 2 . . . . A 9 HIS HB2 . 34102 1
98 . 1 1 10 10 HIS HB3 H 1 1.456 0.010 . 2 . . . . A 9 HIS HB3 . 34102 1
99 . 1 1 10 10 HIS HD2 H 1 6.615 0.014 . 1 . . . . A 9 HIS HD2 . 34102 1
100 . 1 1 10 10 HIS CA C 13 55.138 0.024 . 1 . . . . A 9 HIS CA . 34102 1
101 . 1 1 10 10 HIS CB C 13 31.290 0.043 . 1 . . . . A 9 HIS CB . 34102 1
102 . 1 1 10 10 HIS CD2 C 13 121.286 0.151 . 1 . . . . A 9 HIS CD2 . 34102 1
103 . 1 1 10 10 HIS N N 15 119.948 0.000 . 1 . . . . A 9 HIS N . 34102 1
104 . 1 1 11 11 THR H H 1 8.376 0.019 . 1 . . . . A 10 THR H . 34102 1
105 . 1 1 11 11 THR HA H 1 4.497 0.004 . 1 . . . . A 10 THR HA . 34102 1
106 . 1 1 11 11 THR HB H 1 4.013 0.007 . 1 . . . . A 10 THR HB . 34102 1
107 . 1 1 11 11 THR HG21 H 1 1.059 0.006 . 1 . . . . A 10 THR HG21 . 34102 1
108 . 1 1 11 11 THR HG22 H 1 1.059 0.006 . 1 . . . . A 10 THR HG22 . 34102 1
109 . 1 1 11 11 THR HG23 H 1 1.059 0.006 . 1 . . . . A 10 THR HG23 . 34102 1
110 . 1 1 11 11 THR CA C 13 62.684 0.003 . 1 . . . . A 10 THR CA . 34102 1
111 . 1 1 11 11 THR CB C 13 69.236 0.046 . 1 . . . . A 10 THR CB . 34102 1
112 . 1 1 11 11 THR CG2 C 13 21.725 0.011 . 1 . . . . A 10 THR CG2 . 34102 1
113 . 1 1 11 11 THR N N 15 117.806 0.010 . 1 . . . . A 10 THR N . 34102 1
114 . 1 1 12 12 CYS H H 1 8.903 0.005 . 1 . . . . A 11 CYS H . 34102 1
115 . 1 1 12 12 CYS HA H 1 4.709 0.015 . 1 . . . . A 11 CYS HA . 34102 1
116 . 1 1 12 12 CYS HB2 H 1 3.782 0.005 . 2 . . . . A 11 CYS HB2 . 34102 1
117 . 1 1 12 12 CYS HB3 H 1 2.761 0.008 . 2 . . . . A 11 CYS HB3 . 34102 1
118 . 1 1 12 12 CYS CA C 13 59.536 0.003 . 1 . . . . A 11 CYS CA . 34102 1
119 . 1 1 12 12 CYS CB C 13 32.114 0.087 . 1 . . . . A 11 CYS CB . 34102 1
120 . 1 1 12 12 CYS N N 15 132.201 0.032 . 1 . . . . A 11 CYS N . 34102 1
121 . 1 1 13 13 VAL H H 1 9.210 0.010 . 1 . . . . A 12 VAL H . 34102 1
122 . 1 1 13 13 VAL HA H 1 4.387 0.003 . 1 . . . . A 12 VAL HA . 34102 1
123 . 1 1 13 13 VAL HB H 1 2.615 0.009 . 1 . . . . A 12 VAL HB . 34102 1
124 . 1 1 13 13 VAL HG11 H 1 1.263 0.008 . 2 . . . . A 12 VAL HG11 . 34102 1
125 . 1 1 13 13 VAL HG12 H 1 1.263 0.008 . 2 . . . . A 12 VAL HG12 . 34102 1
126 . 1 1 13 13 VAL HG13 H 1 1.263 0.008 . 2 . . . . A 12 VAL HG13 . 34102 1
127 . 1 1 13 13 VAL HG21 H 1 1.148 0.004 . 2 . . . . A 12 VAL HG21 . 34102 1
128 . 1 1 13 13 VAL HG22 H 1 1.148 0.004 . 2 . . . . A 12 VAL HG22 . 34102 1
129 . 1 1 13 13 VAL HG23 H 1 1.148 0.004 . 2 . . . . A 12 VAL HG23 . 34102 1
130 . 1 1 13 13 VAL CA C 13 63.460 0.009 . 1 . . . . A 12 VAL CA . 34102 1
131 . 1 1 13 13 VAL CB C 13 32.066 0.067 . 1 . . . . A 12 VAL CB . 34102 1
132 . 1 1 13 13 VAL CG1 C 13 21.851 0.079 . 2 . . . . A 12 VAL CG1 . 34102 1
133 . 1 1 13 13 VAL CG2 C 13 20.792 0.057 . 2 . . . . A 12 VAL CG2 . 34102 1
134 . 1 1 13 13 VAL N N 15 127.205 0.026 . 1 . . . . A 12 VAL N . 34102 1
135 . 1 1 14 14 ILE H H 1 9.353 0.009 . 1 . . . . A 13 ILE H . 34102 1
136 . 1 1 14 14 ILE HA H 1 4.260 0.009 . 1 . . . . A 13 ILE HA . 34102 1
137 . 1 1 14 14 ILE HB H 1 2.786 0.009 . 1 . . . . A 13 ILE HB . 34102 1
138 . 1 1 14 14 ILE HG12 H 1 1.555 0.008 . 2 . . . . A 13 ILE HG12 . 34102 1
139 . 1 1 14 14 ILE HG13 H 1 1.068 0.011 . 2 . . . . A 13 ILE HG13 . 34102 1
140 . 1 1 14 14 ILE HG21 H 1 1.049 0.008 . 1 . . . . A 13 ILE HG21 . 34102 1
141 . 1 1 14 14 ILE HG22 H 1 1.049 0.008 . 1 . . . . A 13 ILE HG22 . 34102 1
142 . 1 1 14 14 ILE HG23 H 1 1.049 0.008 . 1 . . . . A 13 ILE HG23 . 34102 1
143 . 1 1 14 14 ILE HD11 H 1 0.733 0.009 . 1 . . . . A 13 ILE HD11 . 34102 1
144 . 1 1 14 14 ILE HD12 H 1 0.733 0.009 . 1 . . . . A 13 ILE HD12 . 34102 1
145 . 1 1 14 14 ILE HD13 H 1 0.733 0.009 . 1 . . . . A 13 ILE HD13 . 34102 1
146 . 1 1 14 14 ILE CA C 13 63.893 0.107 . 1 . . . . A 13 ILE CA . 34102 1
147 . 1 1 14 14 ILE CB C 13 36.536 0.021 . 1 . . . . A 13 ILE CB . 34102 1
148 . 1 1 14 14 ILE CG1 C 13 28.301 0.035 . 1 . . . . A 13 ILE CG1 . 34102 1
149 . 1 1 14 14 ILE CG2 C 13 19.081 0.077 . 1 . . . . A 13 ILE CG2 . 34102 1
150 . 1 1 14 14 ILE CD1 C 13 12.961 0.079 . 1 . . . . A 13 ILE CD1 . 34102 1
151 . 1 1 14 14 ILE N N 15 123.871 0.044 . 1 . . . . A 13 ILE N . 34102 1
152 . 1 1 15 15 CYS H H 1 8.344 0.006 . 1 . . . . A 14 CYS H . 34102 1
153 . 1 1 15 15 CYS HA H 1 4.310 0.005 . 1 . . . . A 14 CYS HA . 34102 1
154 . 1 1 15 15 CYS HB2 H 1 2.917 0.004 . 2 . . . . A 14 CYS HB2 . 34102 1
155 . 1 1 15 15 CYS HB3 H 1 2.463 0.006 . 2 . . . . A 14 CYS HB3 . 34102 1
156 . 1 1 15 15 CYS CA C 13 59.338 0.207 . 1 . . . . A 14 CYS CA . 34102 1
157 . 1 1 15 15 CYS CB C 13 31.525 0.036 . 1 . . . . A 14 CYS CB . 34102 1
158 . 1 1 15 15 CYS N N 15 118.511 0.026 . 1 . . . . A 14 CYS N . 34102 1
159 . 1 1 16 16 ASP H H 1 7.822 0.007 . 1 . . . . A 15 ASP H . 34102 1
160 . 1 1 16 16 ASP HA H 1 4.649 0.013 . 1 . . . . A 15 ASP HA . 34102 1
161 . 1 1 16 16 ASP HB2 H 1 2.980 0.014 . 2 . . . . A 15 ASP HB2 . 34102 1
162 . 1 1 16 16 ASP HB3 H 1 2.961 0.009 . 2 . . . . A 15 ASP HB3 . 34102 1
163 . 1 1 16 16 ASP CA C 13 56.706 0.011 . 1 . . . . A 15 ASP CA . 34102 1
164 . 1 1 16 16 ASP CB C 13 39.626 0.000 . 1 . . . . A 15 ASP CB . 34102 1
165 . 1 1 16 16 ASP N N 15 118.284 0.058 . 1 . . . . A 15 ASP N . 34102 1
166 . 1 1 17 17 GLN H H 1 7.976 0.006 . 1 . . . . A 16 GLN H . 34102 1
167 . 1 1 17 17 GLN HA H 1 4.699 0.003 . 1 . . . . A 16 GLN HA . 34102 1
168 . 1 1 17 17 GLN HB2 H 1 2.300 0.005 . 2 . . . . A 16 GLN HB2 . 34102 1
169 . 1 1 17 17 GLN HB3 H 1 2.159 0.004 . 2 . . . . A 16 GLN HB3 . 34102 1
170 . 1 1 17 17 GLN HG2 H 1 2.515 0.005 . 2 . . . . A 16 GLN HG2 . 34102 1
171 . 1 1 17 17 GLN HG3 H 1 2.456 0.005 . 2 . . . . A 16 GLN HG3 . 34102 1
172 . 1 1 17 17 GLN HE21 H 1 7.496 0.003 . 1 . . . . A 16 GLN HE21 . 34102 1
173 . 1 1 17 17 GLN HE22 H 1 6.907 0.003 . 1 . . . . A 16 GLN HE22 . 34102 1
174 . 1 1 17 17 GLN CA C 13 54.733 0.003 . 1 . . . . A 16 GLN CA . 34102 1
175 . 1 1 17 17 GLN CB C 13 31.500 0.019 . 1 . . . . A 16 GLN CB . 34102 1
176 . 1 1 17 17 GLN CG C 13 34.138 0.015 . 1 . . . . A 16 GLN CG . 34102 1
177 . 1 1 17 17 GLN N N 15 117.701 0.052 . 1 . . . . A 16 GLN N . 34102 1
178 . 1 1 17 17 GLN NE2 N 15 113.815 0.026 . 1 . . . . A 16 GLN NE2 . 34102 1
179 . 1 1 18 18 GLU H H 1 8.625 0.009 . 1 . . . . A 17 GLU H . 34102 1
180 . 1 1 18 18 GLU HA H 1 4.928 0.005 . 1 . . . . A 17 GLU HA . 34102 1
181 . 1 1 18 18 GLU HB2 H 1 1.964 0.005 . 2 . . . . A 17 GLU HB2 . 34102 1
182 . 1 1 18 18 GLU HB3 H 1 1.846 0.005 . 2 . . . . A 17 GLU HB3 . 34102 1
183 . 1 1 18 18 GLU HG2 H 1 2.219 0.004 . 2 . . . . A 17 GLU HG2 . 34102 1
184 . 1 1 18 18 GLU HG3 H 1 2.107 0.006 . 2 . . . . A 17 GLU HG3 . 34102 1
185 . 1 1 18 18 GLU CA C 13 56.176 0.012 . 1 . . . . A 17 GLU CA . 34102 1
186 . 1 1 18 18 GLU CB C 13 30.038 0.008 . 1 . . . . A 17 GLU CB . 34102 1
187 . 1 1 18 18 GLU CG C 13 36.840 0.001 . 1 . . . . A 17 GLU CG . 34102 1
188 . 1 1 18 18 GLU N N 15 122.913 0.133 . 1 . . . . A 17 GLU N . 34102 1
189 . 1 1 19 19 LYS H H 1 8.826 0.007 . 1 . . . . A 18 LYS H . 34102 1
190 . 1 1 19 19 LYS HA H 1 4.983 0.012 . 1 . . . . A 18 LYS HA . 34102 1
191 . 1 1 19 19 LYS HB2 H 1 2.436 0.012 . 2 . . . . A 18 LYS HB2 . 34102 1
192 . 1 1 19 19 LYS HB3 H 1 1.930 0.013 . 2 . . . . A 18 LYS HB3 . 34102 1
193 . 1 1 19 19 LYS HG2 H 1 1.914 0.014 . 2 . . . . A 18 LYS HG2 . 34102 1
194 . 1 1 19 19 LYS HG3 H 1 1.475 0.013 . 2 . . . . A 18 LYS HG3 . 34102 1
195 . 1 1 19 19 LYS HD2 H 1 2.100 0.006 . 2 . . . . A 18 LYS HD2 . 34102 1
196 . 1 1 19 19 LYS HD3 H 1 1.936 0.011 . 2 . . . . A 18 LYS HD3 . 34102 1
197 . 1 1 19 19 LYS HE2 H 1 3.273 0.009 . 2 . . . . A 18 LYS HE2 . 34102 1
198 . 1 1 19 19 LYS HE3 H 1 3.149 0.025 . 2 . . . . A 18 LYS HE3 . 34102 1
199 . 1 1 19 19 LYS CA C 13 54.014 0.008 . 1 . . . . A 18 LYS CA . 34102 1
200 . 1 1 19 19 LYS CB C 13 38.277 0.033 . 1 . . . . A 18 LYS CB . 34102 1
201 . 1 1 19 19 LYS CG C 13 23.875 0.007 . 1 . . . . A 18 LYS CG . 34102 1
202 . 1 1 19 19 LYS CD C 13 28.491 0.003 . 1 . . . . A 18 LYS CD . 34102 1
203 . 1 1 19 19 LYS CE C 13 42.598 0.004 . 1 . . . . A 18 LYS CE . 34102 1
204 . 1 1 19 19 LYS N N 15 126.089 0.011 . 1 . . . . A 18 LYS N . 34102 1
205 . 1 1 20 20 ASN HA H 1 4.990 0.005 . 1 . . . . A 19 ASN HA . 34102 1
206 . 1 1 20 20 ASN HB2 H 1 3.041 0.003 . 2 . . . . A 19 ASN HB2 . 34102 1
207 . 1 1 20 20 ASN HB3 H 1 2.895 0.006 . 2 . . . . A 19 ASN HB3 . 34102 1
208 . 1 1 20 20 ASN HD21 H 1 7.649 0.002 . 1 . . . . A 19 ASN HD21 . 34102 1
209 . 1 1 20 20 ASN HD22 H 1 6.945 0.004 . 1 . . . . A 19 ASN HD22 . 34102 1
210 . 1 1 20 20 ASN CA C 13 54.014 0.006 . 1 . . . . A 19 ASN CA . 34102 1
211 . 1 1 20 20 ASN CB C 13 39.935 0.001 . 1 . . . . A 19 ASN CB . 34102 1
212 . 1 1 20 20 ASN ND2 N 15 112.541 0.036 . 1 . . . . A 19 ASN ND2 . 34102 1
213 . 1 1 21 21 ARG H H 1 7.755 0.001 . 1 . . . . A 20 ARG H . 34102 1
214 . 1 1 21 21 ARG HA H 1 5.025 0.004 . 1 . . . . A 20 ARG HA . 34102 1
215 . 1 1 21 21 ARG HB2 H 1 1.931 0.013 . 2 . . . . A 20 ARG HB2 . 34102 1
216 . 1 1 21 21 ARG HG2 H 1 1.864 0.001 . 2 . . . . A 20 ARG HG2 . 34102 1
217 . 1 1 21 21 ARG HG3 H 1 1.768 0.007 . 2 . . . . A 20 ARG HG3 . 34102 1
218 . 1 1 21 21 ARG HD2 H 1 3.324 0.006 . 2 . . . . A 20 ARG HD2 . 34102 1
219 . 1 1 21 21 ARG CA C 13 55.188 0.011 . 1 . . . . A 20 ARG CA . 34102 1
220 . 1 1 21 21 ARG CB C 13 33.540 0.000 . 1 . . . . A 20 ARG CB . 34102 1
221 . 1 1 21 21 ARG CG C 13 27.276 0.142 . 1 . . . . A 20 ARG CG . 34102 1
222 . 1 1 21 21 ARG CD C 13 43.651 0.053 . 1 . . . . A 20 ARG CD . 34102 1
223 . 1 1 21 21 ARG N N 15 118.436 0.038 . 1 . . . . A 20 ARG N . 34102 1
224 . 1 1 22 22 GLY H H 1 8.473 0.012 . 1 . . . . A 21 GLY H . 34102 1
225 . 1 1 22 22 GLY HA2 H 1 4.179 0.009 . 2 . . . . A 21 GLY HA2 . 34102 1
226 . 1 1 22 22 GLY HA3 H 1 3.835 0.010 . 2 . . . . A 21 GLY HA3 . 34102 1
227 . 1 1 22 22 GLY CA C 13 46.237 0.038 . 1 . . . . A 21 GLY CA . 34102 1
228 . 1 1 22 22 GLY N N 15 112.947 0.064 . 1 . . . . A 21 GLY N . 34102 1
229 . 1 1 23 23 ILE H H 1 8.666 0.006 . 1 . . . . A 22 ILE H . 34102 1
230 . 1 1 23 23 ILE HA H 1 4.731 0.005 . 1 . . . . A 22 ILE HA . 34102 1
231 . 1 1 23 23 ILE HB H 1 1.788 0.003 . 1 . . . . A 22 ILE HB . 34102 1
232 . 1 1 23 23 ILE HG12 H 1 1.248 0.004 . 2 . . . . A 22 ILE HG12 . 34102 1
233 . 1 1 23 23 ILE HG13 H 1 0.891 0.010 . 2 . . . . A 22 ILE HG13 . 34102 1
234 . 1 1 23 23 ILE HG21 H 1 0.865 0.013 . 1 . . . . A 22 ILE HG21 . 34102 1
235 . 1 1 23 23 ILE HG22 H 1 0.865 0.013 . 1 . . . . A 22 ILE HG22 . 34102 1
236 . 1 1 23 23 ILE HG23 H 1 0.865 0.013 . 1 . . . . A 22 ILE HG23 . 34102 1
237 . 1 1 23 23 ILE HD11 H 1 0.775 0.007 . 1 . . . . A 22 ILE HD11 . 34102 1
238 . 1 1 23 23 ILE HD12 H 1 0.775 0.007 . 1 . . . . A 22 ILE HD12 . 34102 1
239 . 1 1 23 23 ILE HD13 H 1 0.775 0.007 . 1 . . . . A 22 ILE HD13 . 34102 1
240 . 1 1 23 23 ILE CA C 13 59.525 0.030 . 1 . . . . A 22 ILE CA . 34102 1
241 . 1 1 23 23 ILE CB C 13 42.453 0.005 . 1 . . . . A 22 ILE CB . 34102 1
242 . 1 1 23 23 ILE CG1 C 13 26.117 0.005 . 1 . . . . A 22 ILE CG1 . 34102 1
243 . 1 1 23 23 ILE CG2 C 13 18.257 0.015 . 1 . . . . A 22 ILE CG2 . 34102 1
244 . 1 1 23 23 ILE CD1 C 13 14.597 0.056 . 1 . . . . A 22 ILE CD1 . 34102 1
245 . 1 1 23 23 ILE N N 15 117.154 0.044 . 1 . . . . A 22 ILE N . 34102 1
246 . 1 1 24 24 HIS H H 1 8.240 0.008 . 1 . . . . A 23 HIS H . 34102 1
247 . 1 1 24 24 HIS HA H 1 5.604 0.004 . 1 . . . . A 23 HIS HA . 34102 1
248 . 1 1 24 24 HIS HB2 H 1 2.842 0.004 . 2 . . . . A 23 HIS HB2 . 34102 1
249 . 1 1 24 24 HIS HD2 H 1 6.855 0.002 . 1 . . . . A 23 HIS HD2 . 34102 1
250 . 1 1 24 24 HIS CA C 13 55.728 0.024 . 1 . . . . A 23 HIS CA . 34102 1
251 . 1 1 24 24 HIS CB C 13 32.547 0.030 . 1 . . . . A 23 HIS CB . 34102 1
252 . 1 1 24 24 HIS CD2 C 13 120.684 0.101 . 1 . . . . A 23 HIS CD2 . 34102 1
253 . 1 1 24 24 HIS N N 15 118.929 0.019 . 1 . . . . A 23 HIS N . 34102 1
254 . 1 1 25 25 LEU H H 1 8.798 0.005 . 1 . . . . A 24 LEU H . 34102 1
255 . 1 1 25 25 LEU HA H 1 4.406 0.002 . 1 . . . . A 24 LEU HA . 34102 1
256 . 1 1 25 25 LEU HB2 H 1 1.303 0.018 . 2 . . . . A 24 LEU HB2 . 34102 1
257 . 1 1 25 25 LEU HB3 H 1 1.300 0.022 . 2 . . . . A 24 LEU HB3 . 34102 1
258 . 1 1 25 25 LEU HG H 1 1.302 0.012 . 1 . . . . A 24 LEU HG . 34102 1
259 . 1 1 25 25 LEU HD11 H 1 0.780 0.011 . 2 . . . . A 24 LEU HD11 . 34102 1
260 . 1 1 25 25 LEU HD12 H 1 0.780 0.011 . 2 . . . . A 24 LEU HD12 . 34102 1
261 . 1 1 25 25 LEU HD13 H 1 0.780 0.011 . 2 . . . . A 24 LEU HD13 . 34102 1
262 . 1 1 25 25 LEU HD21 H 1 0.642 0.004 . 2 . . . . A 24 LEU HD21 . 34102 1
263 . 1 1 25 25 LEU HD22 H 1 0.642 0.004 . 2 . . . . A 24 LEU HD22 . 34102 1
264 . 1 1 25 25 LEU HD23 H 1 0.642 0.004 . 2 . . . . A 24 LEU HD23 . 34102 1
265 . 1 1 25 25 LEU CA C 13 54.251 0.008 . 1 . . . . A 24 LEU CA . 34102 1
266 . 1 1 25 25 LEU CB C 13 45.257 0.010 . 1 . . . . A 24 LEU CB . 34102 1
267 . 1 1 25 25 LEU CG C 13 27.349 0.023 . 1 . . . . A 24 LEU CG . 34102 1
268 . 1 1 25 25 LEU CD1 C 13 25.762 0.077 . 2 . . . . A 24 LEU CD1 . 34102 1
269 . 1 1 25 25 LEU CD2 C 13 25.007 0.088 . 2 . . . . A 24 LEU CD2 . 34102 1
270 . 1 1 25 25 LEU N N 15 125.431 0.013 . 1 . . . . A 24 LEU N . 34102 1
271 . 1 1 26 26 TYR H H 1 9.018 0.008 . 1 . . . . A 25 TYR H . 34102 1
272 . 1 1 26 26 TYR HA H 1 4.316 0.006 . 1 . . . . A 25 TYR HA . 34102 1
273 . 1 1 26 26 TYR HB2 H 1 3.389 0.003 . 2 . . . . A 25 TYR HB2 . 34102 1
274 . 1 1 26 26 TYR HB3 H 1 3.317 0.002 . 2 . . . . A 25 TYR HB3 . 34102 1
275 . 1 1 26 26 TYR HD1 H 1 7.083 0.010 . 3 . . . . A 25 TYR HD1 . 34102 1
276 . 1 1 26 26 TYR HD2 H 1 7.083 0.010 . 3 . . . . A 25 TYR HD2 . 34102 1
277 . 1 1 26 26 TYR HE1 H 1 6.963 0.004 . 3 . . . . A 25 TYR HE1 . 34102 1
278 . 1 1 26 26 TYR HE2 H 1 6.963 0.004 . 3 . . . . A 25 TYR HE2 . 34102 1
279 . 1 1 26 26 TYR CA C 13 59.197 0.234 . 1 . . . . A 25 TYR CA . 34102 1
280 . 1 1 26 26 TYR CB C 13 35.188 0.093 . 1 . . . . A 25 TYR CB . 34102 1
281 . 1 1 26 26 TYR CD1 C 13 133.117 0.057 . 3 . . . . A 25 TYR CD1 . 34102 1
282 . 1 1 26 26 TYR CD2 C 13 133.117 0.057 . 3 . . . . A 25 TYR CD2 . 34102 1
283 . 1 1 26 26 TYR CE1 C 13 118.149 0.116 . 3 . . . . A 25 TYR CE1 . 34102 1
284 . 1 1 26 26 TYR CE2 C 13 118.149 0.116 . 3 . . . . A 25 TYR CE2 . 34102 1
285 . 1 1 26 26 TYR N N 15 122.442 0.044 . 1 . . . . A 25 TYR N . 34102 1
286 . 1 1 27 27 THR HA H 1 4.251 0.016 . 1 . . . . A 26 THR HA . 34102 1
287 . 1 1 27 27 THR HB H 1 4.678 0.003 . 1 . . . . A 26 THR HB . 34102 1
288 . 1 1 27 27 THR HG21 H 1 1.296 0.017 . 1 . . . . A 26 THR HG21 . 34102 1
289 . 1 1 27 27 THR HG22 H 1 1.296 0.017 . 1 . . . . A 26 THR HG22 . 34102 1
290 . 1 1 27 27 THR HG23 H 1 1.296 0.017 . 1 . . . . A 26 THR HG23 . 34102 1
291 . 1 1 27 27 THR CA C 13 64.053 0.183 . 1 . . . . A 26 THR CA . 34102 1
292 . 1 1 27 27 THR CB C 13 69.579 0.000 . 1 . . . . A 26 THR CB . 34102 1
293 . 1 1 27 27 THR CG2 C 13 21.956 0.082 . 1 . . . . A 26 THR CG2 . 34102 1
294 . 1 1 28 28 LYS H H 1 8.629 0.006 . 1 . . . . A 27 LYS H . 34102 1
295 . 1 1 28 28 LYS HA H 1 4.745 0.023 . 1 . . . . A 27 LYS HA . 34102 1
296 . 1 1 28 28 LYS HB2 H 1 2.354 0.006 . 2 . . . . A 27 LYS HB2 . 34102 1
297 . 1 1 28 28 LYS HB3 H 1 1.927 0.006 . 2 . . . . A 27 LYS HB3 . 34102 1
298 . 1 1 28 28 LYS HG2 H 1 2.006 0.004 . 2 . . . . A 27 LYS HG2 . 34102 1
299 . 1 1 28 28 LYS HG3 H 1 1.780 0.003 . 2 . . . . A 27 LYS HG3 . 34102 1
300 . 1 1 28 28 LYS HD2 H 1 1.935 0.014 . 2 . . . . A 27 LYS HD2 . 34102 1
301 . 1 1 28 28 LYS HE2 H 1 3.268 0.012 . 2 . . . . A 27 LYS HE2 . 34102 1
302 . 1 1 28 28 LYS HE3 H 1 3.244 0.014 . 2 . . . . A 27 LYS HE3 . 34102 1
303 . 1 1 28 28 LYS CA C 13 54.823 0.102 . 1 . . . . A 27 LYS CA . 34102 1
304 . 1 1 28 28 LYS CB C 13 33.727 0.103 . 1 . . . . A 27 LYS CB . 34102 1
305 . 1 1 28 28 LYS CG C 13 25.753 0.017 . 1 . . . . A 27 LYS CG . 34102 1
306 . 1 1 28 28 LYS CD C 13 29.247 0.039 . 1 . . . . A 27 LYS CD . 34102 1
307 . 1 1 28 28 LYS CE C 13 42.707 0.024 . 1 . . . . A 27 LYS CE . 34102 1
308 . 1 1 28 28 LYS N N 15 123.850 0.024 . 1 . . . . A 27 LYS N . 34102 1
309 . 1 1 29 29 PHE H H 1 8.551 0.004 . 1 . . . . A 28 PHE H . 34102 1
310 . 1 1 29 29 PHE HA H 1 4.887 0.009 . 1 . . . . A 28 PHE HA . 34102 1
311 . 1 1 29 29 PHE HB2 H 1 2.945 0.006 . 2 . . . . A 28 PHE HB2 . 34102 1
312 . 1 1 29 29 PHE HB3 H 1 2.660 0.011 . 2 . . . . A 28 PHE HB3 . 34102 1
313 . 1 1 29 29 PHE HD1 H 1 6.159 0.008 . 3 . . . . A 28 PHE HD1 . 34102 1
314 . 1 1 29 29 PHE HD2 H 1 6.159 0.008 . 3 . . . . A 28 PHE HD2 . 34102 1
315 . 1 1 29 29 PHE HE1 H 1 6.748 0.008 . 3 . . . . A 28 PHE HE1 . 34102 1
316 . 1 1 29 29 PHE HE2 H 1 6.748 0.008 . 3 . . . . A 28 PHE HE2 . 34102 1
317 . 1 1 29 29 PHE HZ H 1 6.611 0.006 . 1 . . . . A 28 PHE HZ . 34102 1
318 . 1 1 29 29 PHE CA C 13 56.392 0.002 . 1 . . . . A 28 PHE CA . 34102 1
319 . 1 1 29 29 PHE CB C 13 40.786 0.000 . 1 . . . . A 28 PHE CB . 34102 1
320 . 1 1 29 29 PHE CD1 C 13 132.239 0.177 . 3 . . . . A 28 PHE CD1 . 34102 1
321 . 1 1 29 29 PHE CD2 C 13 132.239 0.177 . 3 . . . . A 28 PHE CD2 . 34102 1
322 . 1 1 29 29 PHE CE1 C 13 130.215 0.099 . 3 . . . . A 28 PHE CE1 . 34102 1
323 . 1 1 29 29 PHE CE2 C 13 130.215 0.099 . 3 . . . . A 28 PHE CE2 . 34102 1
324 . 1 1 29 29 PHE CZ C 13 128.451 0.077 . 1 . . . . A 28 PHE CZ . 34102 1
325 . 1 1 29 29 PHE N N 15 124.084 0.054 . 1 . . . . A 28 PHE N . 34102 1
326 . 1 1 30 30 ILE H H 1 8.340 0.007 . 1 . . . . A 29 ILE H . 34102 1
327 . 1 1 30 30 ILE HA H 1 4.894 0.009 . 1 . . . . A 29 ILE HA . 34102 1
328 . 1 1 30 30 ILE HB H 1 1.436 0.008 . 1 . . . . A 29 ILE HB . 34102 1
329 . 1 1 30 30 ILE HG12 H 1 1.443 0.007 . 2 . . . . A 29 ILE HG12 . 34102 1
330 . 1 1 30 30 ILE HG13 H 1 0.852 0.006 . 2 . . . . A 29 ILE HG13 . 34102 1
331 . 1 1 30 30 ILE HG21 H 1 0.748 0.007 . 1 . . . . A 29 ILE HG21 . 34102 1
332 . 1 1 30 30 ILE HG22 H 1 0.748 0.007 . 1 . . . . A 29 ILE HG22 . 34102 1
333 . 1 1 30 30 ILE HG23 H 1 0.748 0.007 . 1 . . . . A 29 ILE HG23 . 34102 1
334 . 1 1 30 30 ILE HD11 H 1 0.744 0.006 . 1 . . . . A 29 ILE HD11 . 34102 1
335 . 1 1 30 30 ILE HD12 H 1 0.744 0.006 . 1 . . . . A 29 ILE HD12 . 34102 1
336 . 1 1 30 30 ILE HD13 H 1 0.744 0.006 . 1 . . . . A 29 ILE HD13 . 34102 1
337 . 1 1 30 30 ILE CA C 13 59.484 0.002 . 1 . . . . A 29 ILE CA . 34102 1
338 . 1 1 30 30 ILE CB C 13 40.593 0.048 . 1 . . . . A 29 ILE CB . 34102 1
339 . 1 1 30 30 ILE CG1 C 13 28.654 0.053 . 1 . . . . A 29 ILE CG1 . 34102 1
340 . 1 1 30 30 ILE CG2 C 13 18.426 0.030 . 1 . . . . A 29 ILE CG2 . 34102 1
341 . 1 1 30 30 ILE CD1 C 13 15.663 0.111 . 1 . . . . A 29 ILE CD1 . 34102 1
342 . 1 1 30 30 ILE N N 15 128.341 0.024 . 1 . . . . A 29 ILE N . 34102 1
343 . 1 1 31 31 CYS H H 1 9.751 0.007 . 1 . . . . A 30 CYS H . 34102 1
344 . 1 1 31 31 CYS HA H 1 4.522 0.009 . 1 . . . . A 30 CYS HA . 34102 1
345 . 1 1 31 31 CYS HB2 H 1 3.554 0.007 . 2 . . . . A 30 CYS HB2 . 34102 1
346 . 1 1 31 31 CYS HB3 H 1 2.805 0.007 . 2 . . . . A 30 CYS HB3 . 34102 1
347 . 1 1 31 31 CYS CA C 13 58.258 0.029 . 1 . . . . A 30 CYS CA . 34102 1
348 . 1 1 31 31 CYS CB C 13 33.574 0.049 . 1 . . . . A 30 CYS CB . 34102 1
349 . 1 1 31 31 CYS N N 15 128.735 0.032 . 1 . . . . A 30 CYS N . 34102 1
350 . 1 1 32 32 LEU H H 1 8.070 0.008 . 1 . . . . A 31 LEU H . 34102 1
351 . 1 1 32 32 LEU HA H 1 4.308 0.008 . 1 . . . . A 31 LEU HA . 34102 1
352 . 1 1 32 32 LEU HB2 H 1 1.657 0.002 . 2 . . . . A 31 LEU HB2 . 34102 1
353 . 1 1 32 32 LEU HB3 H 1 1.524 0.007 . 2 . . . . A 31 LEU HB3 . 34102 1
354 . 1 1 32 32 LEU HG H 1 1.522 0.004 . 1 . . . . A 31 LEU HG . 34102 1
355 . 1 1 32 32 LEU HD11 H 1 0.938 0.012 . 2 . . . . A 31 LEU HD11 . 34102 1
356 . 1 1 32 32 LEU HD12 H 1 0.938 0.012 . 2 . . . . A 31 LEU HD12 . 34102 1
357 . 1 1 32 32 LEU HD13 H 1 0.938 0.012 . 2 . . . . A 31 LEU HD13 . 34102 1
358 . 1 1 32 32 LEU HD21 H 1 0.905 0.014 . 2 . . . . A 31 LEU HD21 . 34102 1
359 . 1 1 32 32 LEU HD22 H 1 0.905 0.014 . 2 . . . . A 31 LEU HD22 . 34102 1
360 . 1 1 32 32 LEU HD23 H 1 0.905 0.014 . 2 . . . . A 31 LEU HD23 . 34102 1
361 . 1 1 32 32 LEU CA C 13 57.478 0.000 . 1 . . . . A 31 LEU CA . 34102 1
362 . 1 1 32 32 LEU CB C 13 42.539 0.022 . 1 . . . . A 31 LEU CB . 34102 1
363 . 1 1 32 32 LEU CG C 13 27.095 0.005 . 1 . . . . A 31 LEU CG . 34102 1
364 . 1 1 32 32 LEU CD1 C 13 24.763 0.042 . 2 . . . . A 31 LEU CD1 . 34102 1
365 . 1 1 32 32 LEU CD2 C 13 24.866 0.032 . 2 . . . . A 31 LEU CD2 . 34102 1
366 . 1 1 32 32 LEU N N 15 120.592 0.039 . 1 . . . . A 31 LEU N . 34102 1
367 . 1 1 33 33 ASP H H 1 7.947 0.009 . 1 . . . . A 32 ASP H . 34102 1
368 . 1 1 33 33 ASP HA H 1 4.503 0.008 . 1 . . . . A 32 ASP HA . 34102 1
369 . 1 1 33 33 ASP HB2 H 1 2.915 0.004 . 2 . . . . A 32 ASP HB2 . 34102 1
370 . 1 1 33 33 ASP HB3 H 1 2.787 0.004 . 2 . . . . A 32 ASP HB3 . 34102 1
371 . 1 1 33 33 ASP CA C 13 58.586 0.001 . 1 . . . . A 32 ASP CA . 34102 1
372 . 1 1 33 33 ASP CB C 13 41.596 0.173 . 1 . . . . A 32 ASP CB . 34102 1
373 . 1 1 33 33 ASP N N 15 119.627 0.002 . 1 . . . . A 32 ASP N . 34102 1
374 . 1 1 34 34 CYS H H 1 9.068 0.010 . 1 . . . . A 33 CYS H . 34102 1
375 . 1 1 34 34 CYS HA H 1 3.999 0.004 . 1 . . . . A 33 CYS HA . 34102 1
376 . 1 1 34 34 CYS HB2 H 1 3.041 0.008 . 2 . . . . A 33 CYS HB2 . 34102 1
377 . 1 1 34 34 CYS HB3 H 1 2.642 0.009 . 2 . . . . A 33 CYS HB3 . 34102 1
378 . 1 1 34 34 CYS CA C 13 66.225 0.022 . 1 . . . . A 33 CYS CA . 34102 1
379 . 1 1 34 34 CYS CB C 13 28.768 0.149 . 1 . . . . A 33 CYS CB . 34102 1
380 . 1 1 34 34 CYS N N 15 127.717 0.058 . 1 . . . . A 33 CYS N . 34102 1
381 . 1 1 35 35 GLU H H 1 9.151 0.013 . 1 . . . . A 34 GLU H . 34102 1
382 . 1 1 35 35 GLU HA H 1 3.462 0.007 . 1 . . . . A 34 GLU HA . 34102 1
383 . 1 1 35 35 GLU HB2 H 1 2.347 0.005 . 2 . . . . A 34 GLU HB2 . 34102 1
384 . 1 1 35 35 GLU HB3 H 1 1.922 0.006 . 2 . . . . A 34 GLU HB3 . 34102 1
385 . 1 1 35 35 GLU HG2 H 1 2.116 0.009 . 2 . . . . A 34 GLU HG2 . 34102 1
386 . 1 1 35 35 GLU HG3 H 1 1.917 0.005 . 2 . . . . A 34 GLU HG3 . 34102 1
387 . 1 1 35 35 GLU CA C 13 60.571 0.080 . 1 . . . . A 34 GLU CA . 34102 1
388 . 1 1 35 35 GLU CB C 13 29.415 0.105 . 1 . . . . A 34 GLU CB . 34102 1
389 . 1 1 35 35 GLU CG C 13 35.056 0.081 . 1 . . . . A 34 GLU CG . 34102 1
390 . 1 1 35 35 GLU N N 15 123.159 0.080 . 1 . . . . A 34 GLU N . 34102 1
391 . 1 1 36 36 ARG H H 1 7.958 0.005 . 1 . . . . A 35 ARG H . 34102 1
392 . 1 1 36 36 ARG HA H 1 3.943 0.007 . 1 . . . . A 35 ARG HA . 34102 1
393 . 1 1 36 36 ARG HB2 H 1 2.020 0.020 . 2 . . . . A 35 ARG HB2 . 34102 1
394 . 1 1 36 36 ARG HB3 H 1 2.002 0.016 . 2 . . . . A 35 ARG HB3 . 34102 1
395 . 1 1 36 36 ARG HG2 H 1 1.932 0.005 . 2 . . . . A 35 ARG HG2 . 34102 1
396 . 1 1 36 36 ARG HG3 H 1 1.745 0.012 . 2 . . . . A 35 ARG HG3 . 34102 1
397 . 1 1 36 36 ARG HD2 H 1 3.220 0.003 . 2 . . . . A 35 ARG HD2 . 34102 1
398 . 1 1 36 36 ARG CA C 13 59.454 0.000 . 1 . . . . A 35 ARG CA . 34102 1
399 . 1 1 36 36 ARG CB C 13 30.375 0.215 . 1 . . . . A 35 ARG CB . 34102 1
400 . 1 1 36 36 ARG CG C 13 27.659 0.047 . 1 . . . . A 35 ARG CG . 34102 1
401 . 1 1 36 36 ARG CD C 13 43.506 0.031 . 1 . . . . A 35 ARG CD . 34102 1
402 . 1 1 36 36 ARG N N 15 116.728 0.081 . 1 . . . . A 35 ARG N . 34102 1
403 . 1 1 37 37 LYS H H 1 7.754 0.006 . 1 . . . . A 36 LYS H . 34102 1
404 . 1 1 37 37 LYS HA H 1 4.164 0.006 . 1 . . . . A 36 LYS HA . 34102 1
405 . 1 1 37 37 LYS HB2 H 1 2.060 0.007 . 2 . . . . A 36 LYS HB2 . 34102 1
406 . 1 1 37 37 LYS HB3 H 1 1.934 0.005 . 2 . . . . A 36 LYS HB3 . 34102 1
407 . 1 1 37 37 LYS HG2 H 1 1.673 0.012 . 2 . . . . A 36 LYS HG2 . 34102 1
408 . 1 1 37 37 LYS HG3 H 1 1.484 0.007 . 2 . . . . A 36 LYS HG3 . 34102 1
409 . 1 1 37 37 LYS HD2 H 1 1.688 0.011 . 2 . . . . A 36 LYS HD2 . 34102 1
410 . 1 1 37 37 LYS HE2 H 1 2.987 0.001 . 2 . . . . A 36 LYS HE2 . 34102 1
411 . 1 1 37 37 LYS CA C 13 59.211 0.015 . 1 . . . . A 36 LYS CA . 34102 1
412 . 1 1 37 37 LYS CB C 13 32.819 0.081 . 1 . . . . A 36 LYS CB . 34102 1
413 . 1 1 37 37 LYS CG C 13 25.627 0.056 . 1 . . . . A 36 LYS CG . 34102 1
414 . 1 1 37 37 LYS CD C 13 29.223 0.114 . 1 . . . . A 36 LYS CD . 34102 1
415 . 1 1 37 37 LYS CE C 13 42.285 0.000 . 1 . . . . A 36 LYS CE . 34102 1
416 . 1 1 37 37 LYS N N 15 121.561 0.018 . 1 . . . . A 36 LYS N . 34102 1
417 . 1 1 38 38 VAL H H 1 8.600 0.016 . 1 . . . . A 37 VAL H . 34102 1
418 . 1 1 38 38 VAL HA H 1 3.418 0.009 . 1 . . . . A 37 VAL HA . 34102 1
419 . 1 1 38 38 VAL HB H 1 2.289 0.009 . 1 . . . . A 37 VAL HB . 34102 1
420 . 1 1 38 38 VAL HG11 H 1 0.890 0.006 . 2 . . . . A 37 VAL HG11 . 34102 1
421 . 1 1 38 38 VAL HG12 H 1 0.890 0.006 . 2 . . . . A 37 VAL HG12 . 34102 1
422 . 1 1 38 38 VAL HG13 H 1 0.890 0.006 . 2 . . . . A 37 VAL HG13 . 34102 1
423 . 1 1 38 38 VAL HG21 H 1 0.836 0.004 . 2 . . . . A 37 VAL HG21 . 34102 1
424 . 1 1 38 38 VAL HG22 H 1 0.836 0.004 . 2 . . . . A 37 VAL HG22 . 34102 1
425 . 1 1 38 38 VAL HG23 H 1 0.836 0.004 . 2 . . . . A 37 VAL HG23 . 34102 1
426 . 1 1 38 38 VAL CA C 13 67.076 0.090 . 1 . . . . A 37 VAL CA . 34102 1
427 . 1 1 38 38 VAL CB C 13 31.485 0.071 . 1 . . . . A 37 VAL CB . 34102 1
428 . 1 1 38 38 VAL CG1 C 13 23.153 0.123 . 2 . . . . A 37 VAL CG1 . 34102 1
429 . 1 1 38 38 VAL CG2 C 13 21.828 0.034 . 2 . . . . A 37 VAL CG2 . 34102 1
430 . 1 1 38 38 VAL N N 15 123.426 0.194 . 1 . . . . A 37 VAL N . 34102 1
431 . 1 1 39 39 ILE H H 1 8.045 0.007 . 1 . . . . A 38 ILE H . 34102 1
432 . 1 1 39 39 ILE HA H 1 3.641 0.011 . 1 . . . . A 38 ILE HA . 34102 1
433 . 1 1 39 39 ILE HB H 1 1.908 0.008 . 1 . . . . A 38 ILE HB . 34102 1
434 . 1 1 39 39 ILE HG12 H 1 1.728 0.009 . 2 . . . . A 38 ILE HG12 . 34102 1
435 . 1 1 39 39 ILE HG13 H 1 1.106 0.005 . 2 . . . . A 38 ILE HG13 . 34102 1
436 . 1 1 39 39 ILE HG21 H 1 0.937 0.007 . 1 . . . . A 38 ILE HG21 . 34102 1
437 . 1 1 39 39 ILE HG22 H 1 0.937 0.007 . 1 . . . . A 38 ILE HG22 . 34102 1
438 . 1 1 39 39 ILE HG23 H 1 0.937 0.007 . 1 . . . . A 38 ILE HG23 . 34102 1
439 . 1 1 39 39 ILE HD11 H 1 0.877 0.009 . 1 . . . . A 38 ILE HD11 . 34102 1
440 . 1 1 39 39 ILE HD12 H 1 0.877 0.009 . 1 . . . . A 38 ILE HD12 . 34102 1
441 . 1 1 39 39 ILE HD13 H 1 0.877 0.009 . 1 . . . . A 38 ILE HD13 . 34102 1
442 . 1 1 39 39 ILE CA C 13 65.419 0.059 . 1 . . . . A 38 ILE CA . 34102 1
443 . 1 1 39 39 ILE CB C 13 38.486 0.044 . 1 . . . . A 38 ILE CB . 34102 1
444 . 1 1 39 39 ILE CG1 C 13 29.596 0.085 . 1 . . . . A 38 ILE CG1 . 34102 1
445 . 1 1 39 39 ILE CG2 C 13 17.405 0.055 . 1 . . . . A 38 ILE CG2 . 34102 1
446 . 1 1 39 39 ILE CD1 C 13 14.222 0.055 . 1 . . . . A 38 ILE CD1 . 34102 1
447 . 1 1 39 39 ILE N N 15 118.406 0.025 . 1 . . . . A 38 ILE N . 34102 1
448 . 1 1 40 40 SER H H 1 8.240 0.009 . 1 . . . . A 39 SER H . 34102 1
449 . 1 1 40 40 SER HA H 1 4.355 0.007 . 1 . . . . A 39 SER HA . 34102 1
450 . 1 1 40 40 SER HB2 H 1 4.048 0.009 . 2 . . . . A 39 SER HB2 . 34102 1
451 . 1 1 40 40 SER HB3 H 1 4.029 0.012 . 2 . . . . A 39 SER HB3 . 34102 1
452 . 1 1 40 40 SER CA C 13 60.817 0.035 . 1 . . . . A 39 SER CA . 34102 1
453 . 1 1 40 40 SER CB C 13 63.595 0.004 . 1 . . . . A 39 SER CB . 34102 1
454 . 1 1 40 40 SER N N 15 114.856 0.068 . 1 . . . . A 39 SER N . 34102 1
455 . 1 1 41 41 THR H H 1 7.811 0.009 . 1 . . . . A 40 THR H . 34102 1
456 . 1 1 41 41 THR HA H 1 4.285 0.003 . 1 . . . . A 40 THR HA . 34102 1
457 . 1 1 41 41 THR HB H 1 4.289 0.006 . 1 . . . . A 40 THR HB . 34102 1
458 . 1 1 41 41 THR HG21 H 1 1.308 0.022 . 1 . . . . A 40 THR HG21 . 34102 1
459 . 1 1 41 41 THR HG22 H 1 1.308 0.022 . 1 . . . . A 40 THR HG22 . 34102 1
460 . 1 1 41 41 THR HG23 H 1 1.308 0.022 . 1 . . . . A 40 THR HG23 . 34102 1
461 . 1 1 41 41 THR CA C 13 64.372 0.007 . 1 . . . . A 40 THR CA . 34102 1
462 . 1 1 41 41 THR CB C 13 69.582 0.005 . 1 . . . . A 40 THR CB . 34102 1
463 . 1 1 41 41 THR CG2 C 13 21.623 0.109 . 1 . . . . A 40 THR CG2 . 34102 1
464 . 1 1 41 41 THR N N 15 116.409 0.044 . 1 . . . . A 40 THR N . 34102 1
465 . 1 1 42 42 SER H H 1 7.964 0.015 . 1 . . . . A 41 SER H . 34102 1
466 . 1 1 42 42 SER HA H 1 4.396 0.005 . 1 . . . . A 41 SER HA . 34102 1
467 . 1 1 42 42 SER HB2 H 1 3.904 0.008 . 2 . . . . A 41 SER HB2 . 34102 1
468 . 1 1 42 42 SER CA C 13 59.718 0.032 . 1 . . . . A 41 SER CA . 34102 1
469 . 1 1 42 42 SER CB C 13 63.910 0.147 . 1 . . . . A 41 SER CB . 34102 1
470 . 1 1 42 42 SER N N 15 117.810 0.084 . 1 . . . . A 41 SER N . 34102 1
471 . 1 1 43 43 THR H H 1 8.322 0.006 . 1 . . . . A 42 THR H . 34102 1
472 . 1 1 43 43 THR HA H 1 4.457 0.001 . 1 . . . . A 42 THR HA . 34102 1
473 . 1 1 43 43 THR HB H 1 4.396 0.007 . 1 . . . . A 42 THR HB . 34102 1
474 . 1 1 43 43 THR HG21 H 1 1.266 0.003 . 1 . . . . A 42 THR HG21 . 34102 1
475 . 1 1 43 43 THR HG22 H 1 1.266 0.003 . 1 . . . . A 42 THR HG22 . 34102 1
476 . 1 1 43 43 THR HG23 H 1 1.266 0.003 . 1 . . . . A 42 THR HG23 . 34102 1
477 . 1 1 43 43 THR CA C 13 62.053 0.000 . 1 . . . . A 42 THR CA . 34102 1
478 . 1 1 43 43 THR CB C 13 69.812 0.000 . 1 . . . . A 42 THR CB . 34102 1
479 . 1 1 43 43 THR CG2 C 13 21.630 0.115 . 1 . . . . A 42 THR CG2 . 34102 1
480 . 1 1 43 43 THR N N 15 115.911 0.000 . 1 . . . . A 42 THR N . 34102 1
481 . 1 1 44 44 SER H H 1 8.165 0.000 . 1 . . . . A 43 SER H . 34102 1
482 . 1 1 44 44 SER HA H 1 4.500 0.011 . 1 . . . . A 43 SER HA . 34102 1
483 . 1 1 44 44 SER HB2 H 1 3.910 0.003 . 2 . . . . A 43 SER HB2 . 34102 1
484 . 1 1 44 44 SER HB3 H 1 3.901 0.015 . 2 . . . . A 43 SER HB3 . 34102 1
485 . 1 1 44 44 SER CA C 13 58.747 0.114 . 1 . . . . A 43 SER CA . 34102 1
486 . 1 1 44 44 SER CB C 13 63.910 0.104 . 1 . . . . A 43 SER CB . 34102 1
487 . 1 1 44 44 SER N N 15 118.641 0.000 . 1 . . . . A 43 SER N . 34102 1
488 . 1 1 45 45 ASP H H 1 8.262 0.002 . 1 . . . . A 44 ASP H . 34102 1
489 . 1 1 45 45 ASP HA H 1 4.947 0.006 . 1 . . . . A 44 ASP HA . 34102 1
490 . 1 1 45 45 ASP HB2 H 1 2.849 0.009 . 2 . . . . A 44 ASP HB2 . 34102 1
491 . 1 1 45 45 ASP HB3 H 1 2.594 0.009 . 2 . . . . A 44 ASP HB3 . 34102 1
492 . 1 1 45 45 ASP CA C 13 52.540 0.007 . 1 . . . . A 44 ASP CA . 34102 1
493 . 1 1 45 45 ASP CB C 13 41.585 0.075 . 1 . . . . A 44 ASP CB . 34102 1
494 . 1 1 45 45 ASP N N 15 124.303 0.000 . 1 . . . . A 44 ASP N . 34102 1
495 . 1 1 46 46 PRO HA H 1 4.419 0.007 . 1 . . . . A 45 PRO HA . 34102 1
496 . 1 1 46 46 PRO HB2 H 1 2.269 0.002 . 2 . . . . A 45 PRO HB2 . 34102 1
497 . 1 1 46 46 PRO HB3 H 1 1.868 0.004 . 2 . . . . A 45 PRO HB3 . 34102 1
498 . 1 1 46 46 PRO HG2 H 1 2.026 0.009 . 2 . . . . A 45 PRO HG2 . 34102 1
499 . 1 1 46 46 PRO HD2 H 1 3.890 0.015 . 2 . . . . A 45 PRO HD2 . 34102 1
500 . 1 1 46 46 PRO HD3 H 1 3.834 0.008 . 2 . . . . A 45 PRO HD3 . 34102 1
501 . 1 1 46 46 PRO CA C 13 63.747 0.002 . 1 . . . . A 45 PRO CA . 34102 1
502 . 1 1 46 46 PRO CB C 13 32.220 0.014 . 1 . . . . A 45 PRO CB . 34102 1
503 . 1 1 46 46 PRO CG C 13 27.233 0.017 . 1 . . . . A 45 PRO CG . 34102 1
504 . 1 1 46 46 PRO CD C 13 50.893 0.059 . 1 . . . . A 45 PRO CD . 34102 1
505 . 1 1 47 47 ASP H H 1 8.414 0.006 . 1 . . . . A 46 ASP H . 34102 1
506 . 1 1 47 47 ASP HA H 1 4.614 0.008 . 1 . . . . A 46 ASP HA . 34102 1
507 . 1 1 47 47 ASP HB2 H 1 2.648 0.008 . 2 . . . . A 46 ASP HB2 . 34102 1
508 . 1 1 47 47 ASP HB3 H 1 2.586 0.008 . 2 . . . . A 46 ASP HB3 . 34102 1
509 . 1 1 47 47 ASP CA C 13 54.691 0.003 . 1 . . . . A 46 ASP CA . 34102 1
510 . 1 1 47 47 ASP CB C 13 41.238 0.044 . 1 . . . . A 46 ASP CB . 34102 1
511 . 1 1 47 47 ASP N N 15 119.792 0.061 . 1 . . . . A 46 ASP N . 34102 1
512 . 1 1 48 48 TYR H H 1 7.858 0.009 . 1 . . . . A 47 TYR H . 34102 1
513 . 1 1 48 48 TYR HA H 1 4.561 0.007 . 1 . . . . A 47 TYR HA . 34102 1
514 . 1 1 48 48 TYR HB2 H 1 3.176 0.004 . 2 . . . . A 47 TYR HB2 . 34102 1
515 . 1 1 48 48 TYR HB3 H 1 2.993 0.007 . 2 . . . . A 47 TYR HB3 . 34102 1
516 . 1 1 48 48 TYR HD1 H 1 7.171 0.005 . 3 . . . . A 47 TYR HD1 . 34102 1
517 . 1 1 48 48 TYR HD2 H 1 7.171 0.005 . 3 . . . . A 47 TYR HD2 . 34102 1
518 . 1 1 48 48 TYR HE1 H 1 6.872 0.009 . 3 . . . . A 47 TYR HE1 . 34102 1
519 . 1 1 48 48 TYR HE2 H 1 6.872 0.009 . 3 . . . . A 47 TYR HE2 . 34102 1
520 . 1 1 48 48 TYR CA C 13 58.099 0.004 . 1 . . . . A 47 TYR CA . 34102 1
521 . 1 1 48 48 TYR CB C 13 39.000 0.040 . 1 . . . . A 47 TYR CB . 34102 1
522 . 1 1 48 48 TYR CD1 C 13 133.342 0.100 . 3 . . . . A 47 TYR CD1 . 34102 1
523 . 1 1 48 48 TYR CD2 C 13 133.342 0.100 . 3 . . . . A 47 TYR CD2 . 34102 1
524 . 1 1 48 48 TYR CE1 C 13 118.312 0.079 . 3 . . . . A 47 TYR CE1 . 34102 1
525 . 1 1 48 48 TYR CE2 C 13 118.312 0.079 . 3 . . . . A 47 TYR CE2 . 34102 1
526 . 1 1 48 48 TYR N N 15 121.017 0.000 . 1 . . . . A 47 TYR N . 34102 1
527 . 1 1 49 49 ALA H H 1 7.663 0.010 . 1 . . . . A 48 ALA H . 34102 1
528 . 1 1 49 49 ALA HA H 1 4.123 0.014 . 1 . . . . A 48 ALA HA . 34102 1
529 . 1 1 49 49 ALA HB1 H 1 1.359 0.002 . 1 . . . . A 48 ALA HB1 . 34102 1
530 . 1 1 49 49 ALA HB2 H 1 1.359 0.002 . 1 . . . . A 48 ALA HB2 . 34102 1
531 . 1 1 49 49 ALA HB3 H 1 1.359 0.002 . 1 . . . . A 48 ALA HB3 . 34102 1
532 . 1 1 49 49 ALA CA C 13 54.014 0.047 . 1 . . . . A 48 ALA CA . 34102 1
533 . 1 1 49 49 ALA CB C 13 20.502 0.000 . 1 . . . . A 48 ALA CB . 34102 1
534 . 1 1 49 49 ALA N N 15 131.601 0.000 . 1 . . . . A 48 ALA N . 34102 1
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