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 16676
_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-15N HSQC' . . . 16676 1
3 '3D C(CO)NH' . . . 16676 1
4 '3D HNCO' . . . 16676 1
5 '3D HNCA' . . . 16676 1
6 '3D HNCACB' . . . 16676 1
7 '3D HN(CO)CA' . . . 16676 1
8 '3D H(CCO)NH' . . . 16676 1
9 '3D HCCH-TOCSY' . . . 16676 1
10 '3D 1H-15N NOESY' . . . 16676 1
11 '3D HCCH-COSY' . . . 16676 1
12 '3D 1H-13C NOESY' . . . 16676 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 VAL H H 1 8.296 0.006 . . . . . . 1 VAL HN . 16676 1
2 . 1 1 1 1 VAL HA H 1 4.398 0 . . . . . . 1 VAL HA . 16676 1
3 . 1 1 1 1 VAL CA C 13 59.967 0 . . . . . . 1 VAL CA . 16676 1
4 . 1 1 1 1 VAL CB C 13 32.772 0 . . . . . . 1 VAL CB . 16676 1
5 . 1 1 1 1 VAL N N 15 123.741 0.02 . . . . . . 1 VAL N . 16676 1
6 . 1 1 2 2 PRO HA H 1 4.46 0.001 . . . . . . 2 PRO HA . 16676 1
7 . 1 1 2 2 PRO HD2 H 1 3.91 0 . . . . . . 2 PRO HD2 . 16676 1
8 . 1 1 2 2 PRO HD3 H 1 3.706 0.001 . . . . . . 2 PRO HD3 . 16676 1
9 . 1 1 2 2 PRO CA C 13 63.792 0 . . . . . . 2 PRO CA . 16676 1
10 . 1 1 2 2 PRO CB C 13 32.255 0.003 . . . . . . 2 PRO CB . 16676 1
11 . 1 1 2 2 PRO CD C 13 51.096 0 . . . . . . 2 PRO CD . 16676 1
12 . 1 1 2 2 PRO CG C 13 27.519 0 . . . . . . 2 PRO CG . 16676 1
13 . 1 1 3 3 VAL H H 1 8.385 0.009 . . . . . . 3 VAL HN . 16676 1
14 . 1 1 3 3 VAL HA H 1 4.104 0.008 . . . . . . 3 VAL HA . 16676 1
15 . 1 1 3 3 VAL HB H 1 2.079 0.007 . . . . . . 3 VAL HB . 16676 1
16 . 1 1 3 3 VAL HG11 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
17 . 1 1 3 3 VAL HG12 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
18 . 1 1 3 3 VAL HG13 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
19 . 1 1 3 3 VAL HG21 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
20 . 1 1 3 3 VAL HG22 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
21 . 1 1 3 3 VAL HG23 H 1 0.997 0.01 . . . . . . 3 VAL QQG . 16676 1
22 . 1 1 3 3 VAL CA C 13 62.606 0.087 . . . . . . 3 VAL CA . 16676 1
23 . 1 1 3 3 VAL CB C 13 32.856 0.081 . . . . . . 3 VAL CB . 16676 1
24 . 1 1 3 3 VAL N N 15 121.067 0.024 . . . . . . 3 VAL N . 16676 1
25 . 1 1 4 4 GLY H H 1 8.633 0.01 . . . . . . 4 GLY HN . 16676 1
26 . 1 1 4 4 GLY HA2 H 1 4.024 0.007 . . . . . . 4 GLY QA . 16676 1
27 . 1 1 4 4 GLY HA3 H 1 4.024 0.007 . . . . . . 4 GLY QA . 16676 1
28 . 1 1 4 4 GLY CA C 13 45.355 0.008 . . . . . . 4 GLY CA . 16676 1
29 . 1 1 4 4 GLY N N 15 113.013 0.015 . . . . . . 4 GLY N . 16676 1
30 . 1 1 5 5 SER H H 1 8.333 0.006 . . . . . . 5 SER HN . 16676 1
31 . 1 1 5 5 SER HA H 1 4.456 0.011 . . . . . . 5 SER HA . 16676 1
32 . 1 1 5 5 SER HB2 H 1 3.941 0 . . . . . . 5 SER HB2 . 16676 1
33 . 1 1 5 5 SER HB3 H 1 3.863 0 . . . . . . 5 SER HB3 . 16676 1
34 . 1 1 5 5 SER C C 13 174.537 0 . . . . . . 5 SER CO . 16676 1
35 . 1 1 5 5 SER CA C 13 58.715 0.033 . . . . . . 5 SER CA . 16676 1
36 . 1 1 5 5 SER CB C 13 63.939 0.046 . . . . . . 5 SER CB . 16676 1
37 . 1 1 5 5 SER N N 15 115.999 0.034 . . . . . . 5 SER N . 16676 1
38 . 1 1 6 6 ASP H H 1 8.512 0.001 . . . . . . 6 ASP HN . 16676 1
39 . 1 1 6 6 ASP HA H 1 4.575 0.002 . . . . . . 6 ASP HA . 16676 1
40 . 1 1 6 6 ASP HB2 H 1 2.741 0.01 . . . . . . 6 ASP HB2 . 16676 1
41 . 1 1 6 6 ASP HB3 H 1 2.697 0 . . . . . . 6 ASP HB3 . 16676 1
42 . 1 1 6 6 ASP C C 13 176.533 0 . . . . . . 6 ASP CO . 16676 1
43 . 1 1 6 6 ASP CA C 13 54.739 0.173 . . . . . . 6 ASP CA . 16676 1
44 . 1 1 6 6 ASP CB C 13 40.74 0.07 . . . . . . 6 ASP CB . 16676 1
45 . 1 1 6 6 ASP N N 15 122.023 0.015 . . . . . . 6 ASP N . 16676 1
46 . 1 1 7 7 CYS H H 1 8.464 0.011 . . . . . . 7 CYS HN . 16676 1
47 . 1 1 7 7 CYS HA H 1 4.719 0.013 . . . . . . 7 CYS HA . 16676 1
48 . 1 1 7 7 CYS HB2 H 1 3.421 0.017 . . . . . . 7 CYS HB2 . 16676 1
49 . 1 1 7 7 CYS HB3 H 1 2.872 0.011 . . . . . . 7 CYS HB3 . 16676 1
50 . 1 1 7 7 CYS C C 13 174.999 0 . . . . . . 7 CYS CO . 16676 1
51 . 1 1 7 7 CYS CA C 13 53.953 0.127 . . . . . . 7 CYS CA . 16676 1
52 . 1 1 7 7 CYS CB C 13 37.68 0.038 . . . . . . 7 CYS CB . 16676 1
53 . 1 1 7 7 CYS N N 15 116.694 0.038 . . . . . . 7 CYS N . 16676 1
54 . 1 1 8 8 GLU H H 1 8.046 0.009 . . . . . . 8 GLU HN . 16676 1
55 . 1 1 8 8 GLU HA H 1 4.499 0.002 . . . . . . 8 GLU HA . 16676 1
56 . 1 1 8 8 GLU HB2 H 1 1.974 0.013 . . . . . . 8 GLU QB . 16676 1
57 . 1 1 8 8 GLU HB3 H 1 1.974 0.013 . . . . . . 8 GLU QB . 16676 1
58 . 1 1 8 8 GLU HG2 H 1 2.255 0.009 . . . . . . 8 GLU QG . 16676 1
59 . 1 1 8 8 GLU HG3 H 1 2.255 0.009 . . . . . . 8 GLU QG . 16676 1
60 . 1 1 8 8 GLU CA C 13 54.235 0.027 . . . . . . 8 GLU CA . 16676 1
61 . 1 1 8 8 GLU CB C 13 29.292 0 . . . . . . 8 GLU CB . 16676 1
62 . 1 1 8 8 GLU N N 15 122.639 0.033 . . . . . . 8 GLU N . 16676 1
63 . 1 1 9 9 PRO HA H 1 4.498 0.005 . . . . . . 9 PRO HA . 16676 1
64 . 1 1 9 9 PRO HD2 H 1 3.925 0.003 . . . . . . 9 PRO HD2 . 16676 1
65 . 1 1 9 9 PRO HD3 H 1 3.777 0.001 . . . . . . 9 PRO HD3 . 16676 1
66 . 1 1 9 9 PRO C C 13 176.63 0 . . . . . . 9 PRO CO . 16676 1
67 . 1 1 9 9 PRO CA C 13 62.865 0 . . . . . . 9 PRO CA . 16676 1
68 . 1 1 9 9 PRO CB C 13 32.4 0 . . . . . . 9 PRO CB . 16676 1
69 . 1 1 9 9 PRO CD C 13 50.758 0 . . . . . . 9 PRO CD . 16676 1
70 . 1 1 9 9 PRO CG C 13 27.818 0 . . . . . . 9 PRO CG . 16676 1
71 . 1 1 10 10 LYS H H 1 8.504 0.009 . . . . . . 10 LYS HN . 16676 1
72 . 1 1 10 10 LYS HA H 1 4.378 0 . . . . . . 10 LYS HA . 16676 1
73 . 1 1 10 10 LYS HB2 H 1 1.77 0.003 . . . . . . 10 LYS QB . 16676 1
74 . 1 1 10 10 LYS HB3 H 1 1.77 0.003 . . . . . . 10 LYS QB . 16676 1
75 . 1 1 10 10 LYS HD2 H 1 1.697 0 . . . . . . 10 LYS QD . 16676 1
76 . 1 1 10 10 LYS HD3 H 1 1.697 0 . . . . . . 10 LYS QD . 16676 1
77 . 1 1 10 10 LYS HE2 H 1 3.004 0 . . . . . . 10 LYS QE . 16676 1
78 . 1 1 10 10 LYS HE3 H 1 3.004 0 . . . . . . 10 LYS QE . 16676 1
79 . 1 1 10 10 LYS HG2 H 1 1.469 0.003 . . . . . . 10 LYS QG . 16676 1
80 . 1 1 10 10 LYS HG3 H 1 1.469 0.003 . . . . . . 10 LYS QG . 16676 1
81 . 1 1 10 10 LYS C C 13 176.121 0 . . . . . . 10 LYS CO . 16676 1
82 . 1 1 10 10 LYS CA C 13 56.332 0.018 . . . . . . 10 LYS CA . 16676 1
83 . 1 1 10 10 LYS CB C 13 33.806 0.003 . . . . . . 10 LYS CB . 16676 1
84 . 1 1 10 10 LYS CD C 13 28.823 0 . . . . . . 10 LYS CD . 16676 1
85 . 1 1 10 10 LYS CE C 13 42.268 0 . . . . . . 10 LYS CE . 16676 1
86 . 1 1 10 10 LYS CG C 13 24.824 0 . . . . . . 10 LYS CG . 16676 1
87 . 1 1 10 10 LYS N N 15 121.465 0.034 . . . . . . 10 LYS N . 16676 1
88 . 1 1 11 11 LEU H H 1 8.234 0.009 . . . . . . 11 LEU HN . 16676 1
89 . 1 1 11 11 LEU HA H 1 4.436 0.013 . . . . . . 11 LEU HA . 16676 1
90 . 1 1 11 11 LEU HB2 H 1 1.607 0.012 . . . . . . 11 LEU QB . 16676 1
91 . 1 1 11 11 LEU HB3 H 1 1.607 0.012 . . . . . . 11 LEU QB . 16676 1
92 . 1 1 11 11 LEU HD11 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
93 . 1 1 11 11 LEU HD12 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
94 . 1 1 11 11 LEU HD13 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
95 . 1 1 11 11 LEU HD21 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
96 . 1 1 11 11 LEU HD22 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
97 . 1 1 11 11 LEU HD23 H 1 0.922 0.005 . . . . . . 11 LEU QQD . 16676 1
98 . 1 1 11 11 LEU C C 13 175.345 0 . . . . . . 11 LEU CO . 16676 1
99 . 1 1 11 11 LEU CA C 13 54.858 0.08 . . . . . . 11 LEU CA . 16676 1
100 . 1 1 11 11 LEU CB C 13 41.677 0.004 . . . . . . 11 LEU CB . 16676 1
101 . 1 1 11 11 LEU CD1 C 13 24.503 0 . . . . . . 11 LEU CD . 16676 1
102 . 1 1 11 11 LEU CD2 C 13 24.503 0 . . . . . . 11 LEU CD . 16676 1
103 . 1 1 11 11 LEU CG C 13 27.01 0 . . . . . . 11 LEU CG . 16676 1
104 . 1 1 11 11 LEU N N 15 120.05 0.052 . . . . . . 11 LEU N . 16676 1
105 . 1 1 12 12 CYS H H 1 8.249 0.006 . . . . . . 12 CYS HN . 16676 1
106 . 1 1 12 12 CYS HA H 1 4.963 0.019 . . . . . . 12 CYS HA . 16676 1
107 . 1 1 12 12 CYS HB2 H 1 3.494 0.007 . . . . . . 12 CYS HB2 . 16676 1
108 . 1 1 12 12 CYS HB3 H 1 2.772 0.01 . . . . . . 12 CYS HB3 . 16676 1
109 . 1 1 12 12 CYS C C 13 173.181 0 . . . . . . 12 CYS CO . 16676 1
110 . 1 1 12 12 CYS CA C 13 54.088 0.083 . . . . . . 12 CYS CA . 16676 1
111 . 1 1 12 12 CYS CB C 13 45.97 0.027 . . . . . . 12 CYS CB . 16676 1
112 . 1 1 12 12 CYS N N 15 117.625 0.014 . . . . . . 12 CYS N . 16676 1
113 . 1 1 13 13 THR H H 1 8.786 0.009 . . . . . . 13 THR HN . 16676 1
114 . 1 1 13 13 THR HA H 1 4.503 0.008 . . . . . . 13 THR HA . 16676 1
115 . 1 1 13 13 THR HB H 1 4.321 0.047 . . . . . . 13 THR HB . 16676 1
116 . 1 1 13 13 THR HG21 H 1 1.286 0.005 . . . . . . 13 THR QG2 . 16676 1
117 . 1 1 13 13 THR HG22 H 1 1.286 0.005 . . . . . . 13 THR QG2 . 16676 1
118 . 1 1 13 13 THR HG23 H 1 1.286 0.005 . . . . . . 13 THR QG2 . 16676 1
119 . 1 1 13 13 THR C C 13 173.856 0 . . . . . . 13 THR CO . 16676 1
120 . 1 1 13 13 THR CA C 13 61.097 0.057 . . . . . . 13 THR CA . 16676 1
121 . 1 1 13 13 THR CB C 13 70.226 0.053 . . . . . . 13 THR CB . 16676 1
122 . 1 1 13 13 THR CG2 C 13 22.033 0 . . . . . . 13 THR CG2 . 16676 1
123 . 1 1 13 13 THR N N 15 114.603 0.021 . . . . . . 13 THR N . 16676 1
124 . 1 1 14 14 MET H H 1 8.792 0.008 . . . . . . 14 MET HN . 16676 1
125 . 1 1 14 14 MET HA H 1 5.014 0.009 . . . . . . 14 MET HA . 16676 1
126 . 1 1 14 14 MET HB2 H 1 2.335 0.004 . . . . . . 14 MET HB2 . 16676 1
127 . 1 1 14 14 MET HB3 H 1 2.026 0.003 . . . . . . 14 MET HB3 . 16676 1
128 . 1 1 14 14 MET HG2 H 1 2.768 0.005 . . . . . . 14 MET HG2 . 16676 1
129 . 1 1 14 14 MET HG3 H 1 2.64 0.004 . . . . . . 14 MET HG3 . 16676 1
130 . 1 1 14 14 MET C C 13 175.966 0 . . . . . . 14 MET CO . 16676 1
131 . 1 1 14 14 MET CA C 13 53.485 0 . . . . . . 14 MET CA . 16676 1
132 . 1 1 14 14 MET CB C 13 30.017 0.011 . . . . . . 14 MET CB . 16676 1
133 . 1 1 14 14 MET CG C 13 32.38 0.015 . . . . . . 14 MET CG . 16676 1
134 . 1 1 14 14 MET N N 15 126.067 0.008 . . . . . . 14 MET N . 16676 1
135 . 1 1 15 15 ASP H H 1 8.176 0.007 . . . . . . 15 ASP HN . 16676 1
136 . 1 1 15 15 ASP HA H 1 4.797 0.009 . . . . . . 15 ASP HA . 16676 1
137 . 1 1 15 15 ASP HB2 H 1 3.07 0.011 . . . . . . 15 ASP HB2 . 16676 1
138 . 1 1 15 15 ASP HB3 H 1 2.75 0.008 . . . . . . 15 ASP HB3 . 16676 1
139 . 1 1 15 15 ASP C C 13 174.333 0 . . . . . . 15 ASP CO . 16676 1
140 . 1 1 15 15 ASP CA C 13 53.527 0 . . . . . . 15 ASP CA . 16676 1
141 . 1 1 15 15 ASP CB C 13 42.157 0.094 . . . . . . 15 ASP CB . 16676 1
142 . 1 1 15 15 ASP N N 15 119.37 0.035 . . . . . . 15 ASP N . 16676 1
143 . 1 1 16 16 LEU H H 1 8.537 0.008 . . . . . . 16 LEU HN . 16676 1
144 . 1 1 16 16 LEU HA H 1 4.531 0.007 . . . . . . 16 LEU HA . 16676 1
145 . 1 1 16 16 LEU HB2 H 1 1.831 0.004 . . . . . . 16 LEU HB2 . 16676 1
146 . 1 1 16 16 LEU HB3 H 1 1.593 0.007 . . . . . . 16 LEU HB3 . 16676 1
147 . 1 1 16 16 LEU HD11 H 1 0.907 0 . . . . . . 16 LEU QD1 . 16676 1
148 . 1 1 16 16 LEU HD12 H 1 0.907 0 . . . . . . 16 LEU QD1 . 16676 1
149 . 1 1 16 16 LEU HD13 H 1 0.907 0 . . . . . . 16 LEU QD1 . 16676 1
150 . 1 1 16 16 LEU HD21 H 1 0.834 0 . . . . . . 16 LEU QD2 . 16676 1
151 . 1 1 16 16 LEU HD22 H 1 0.834 0 . . . . . . 16 LEU QD2 . 16676 1
152 . 1 1 16 16 LEU HD23 H 1 0.834 0 . . . . . . 16 LEU QD2 . 16676 1
153 . 1 1 16 16 LEU C C 13 177.003 0 . . . . . . 16 LEU CO . 16676 1
154 . 1 1 16 16 LEU CA C 13 54.094 0.072 . . . . . . 16 LEU CA . 16676 1
155 . 1 1 16 16 LEU CB C 13 42.45 0.094 . . . . . . 16 LEU CB . 16676 1
156 . 1 1 16 16 LEU CD1 C 13 23.02 0 . . . . . . 16 LEU CD . 16676 1
157 . 1 1 16 16 LEU CD2 C 13 23.02 0 . . . . . . 16 LEU CD . 16676 1
158 . 1 1 16 16 LEU CG C 13 25.514 0 . . . . . . 16 LEU CG . 16676 1
159 . 1 1 16 16 LEU N N 15 117.078 0.024 . . . . . . 16 LEU N . 16676 1
160 . 1 1 17 17 VAL H H 1 8.031 0.008 . . . . . . 17 VAL HN . 16676 1
161 . 1 1 17 17 VAL HA H 1 4.011 0.004 . . . . . . 17 VAL HA . 16676 1
162 . 1 1 17 17 VAL HB H 1 2.172 0.006 . . . . . . 17 VAL HB . 16676 1
163 . 1 1 17 17 VAL HG11 H 1 1.1 0.007 . . . . . . 17 VAL QG1 . 16676 1
164 . 1 1 17 17 VAL HG12 H 1 1.1 0.007 . . . . . . 17 VAL QG1 . 16676 1
165 . 1 1 17 17 VAL HG13 H 1 1.1 0.007 . . . . . . 17 VAL QG1 . 16676 1
166 . 1 1 17 17 VAL HG21 H 1 0.723 0.007 . . . . . . 17 VAL QG2 . 16676 1
167 . 1 1 17 17 VAL HG22 H 1 0.723 0.007 . . . . . . 17 VAL QG2 . 16676 1
168 . 1 1 17 17 VAL HG23 H 1 0.723 0.007 . . . . . . 17 VAL QG2 . 16676 1
169 . 1 1 17 17 VAL CA C 13 61.959 0.038 . . . . . . 17 VAL CA . 16676 1
170 . 1 1 17 17 VAL CB C 13 32.217 0.017 . . . . . . 17 VAL CB . 16676 1
171 . 1 1 17 17 VAL CG1 C 13 22.499 0 . . . . . . 17 VAL CG1 . 16676 1
172 . 1 1 17 17 VAL N N 15 124.649 0.014 . . . . . . 17 VAL N . 16676 1
173 . 1 1 18 18 PRO HA H 1 4.832 0.004 . . . . . . 18 PRO HA . 16676 1
174 . 1 1 18 18 PRO HB2 H 1 1.86 0.01 . . . . . . 18 PRO HB2 . 16676 1
175 . 1 1 18 18 PRO HB3 H 1 1.562 0.009 . . . . . . 18 PRO HB3 . 16676 1
176 . 1 1 18 18 PRO HD2 H 1 3.968 0.019 . . . . . . 18 PRO HD2 . 16676 1
177 . 1 1 18 18 PRO HD3 H 1 3.728 0.013 . . . . . . 18 PRO HD3 . 16676 1
178 . 1 1 18 18 PRO HG2 H 1 2.134 0.007 . . . . . . 18 PRO QG . 16676 1
179 . 1 1 18 18 PRO HG3 H 1 2.134 0.007 . . . . . . 18 PRO QG . 16676 1
180 . 1 1 18 18 PRO C C 13 175.541 0 . . . . . . 18 PRO CO . 16676 1
181 . 1 1 18 18 PRO CA C 13 61.724 0.032 . . . . . . 18 PRO CA . 16676 1
182 . 1 1 18 18 PRO CB C 13 32.794 0.034 . . . . . . 18 PRO CB . 16676 1
183 . 1 1 18 18 PRO CD C 13 50.547 0.072 . . . . . . 18 PRO CD . 16676 1
184 . 1 1 18 18 PRO CG C 13 27.389 0 . . . . . . 18 PRO CG . 16676 1
185 . 1 1 19 19 HIS H H 1 8.864 0.007 . . . . . . 19 HIS HN . 16676 1
186 . 1 1 19 19 HIS HA H 1 4.56 0.007 . . . . . . 19 HIS HA . 16676 1
187 . 1 1 19 19 HIS HB2 H 1 2.761 0.008 . . . . . . 19 HIS HB2 . 16676 1
188 . 1 1 19 19 HIS HB3 H 1 2.595 0.006 . . . . . . 19 HIS HB3 . 16676 1
189 . 1 1 19 19 HIS C C 13 174.177 0 . . . . . . 19 HIS CO . 16676 1
190 . 1 1 19 19 HIS CA C 13 55.516 0.039 . . . . . . 19 HIS CA . 16676 1
191 . 1 1 19 19 HIS CB C 13 35.073 0.002 . . . . . . 19 HIS CB . 16676 1
192 . 1 1 19 19 HIS N N 15 118.012 0.022 . . . . . . 19 HIS N . 16676 1
193 . 1 1 20 20 CYS H H 1 8.931 0.007 . . . . . . 20 CYS HN . 16676 1
194 . 1 1 20 20 CYS HA H 1 5.122 0.009 . . . . . . 20 CYS HA . 16676 1
195 . 1 1 20 20 CYS HB2 H 1 3.393 0.011 . . . . . . 20 CYS HB2 . 16676 1
196 . 1 1 20 20 CYS HB3 H 1 2.706 0.008 . . . . . . 20 CYS HB3 . 16676 1
197 . 1 1 20 20 CYS C C 13 173.087 0 . . . . . . 20 CYS CO . 16676 1
198 . 1 1 20 20 CYS CA C 13 54.516 0.09 . . . . . . 20 CYS CA . 16676 1
199 . 1 1 20 20 CYS CB C 13 49.909 0.038 . . . . . . 20 CYS CB . 16676 1
200 . 1 1 20 20 CYS N N 15 118.054 0.02 . . . . . . 20 CYS N . 16676 1
201 . 1 1 21 21 PHE H H 1 9.246 0.009 . . . . . . 21 PHE HN . 16676 1
202 . 1 1 21 21 PHE HA H 1 5.221 0.007 . . . . . . 21 PHE HA . 16676 1
203 . 1 1 21 21 PHE HB2 H 1 2.729 0.008 . . . . . . 21 PHE HB2 . 16676 1
204 . 1 1 21 21 PHE HB3 H 1 2.381 0.007 . . . . . . 21 PHE HB3 . 16676 1
205 . 1 1 21 21 PHE HD1 H 1 6.771 0.009 . . . . . . 21 PHE QD . 16676 1
206 . 1 1 21 21 PHE HD2 H 1 6.771 0.009 . . . . . . 21 PHE QD . 16676 1
207 . 1 1 21 21 PHE C C 13 174.28 0 . . . . . . 21 PHE CO . 16676 1
208 . 1 1 21 21 PHE CA C 13 56.413 0.037 . . . . . . 21 PHE CA . 16676 1
209 . 1 1 21 21 PHE CB C 13 44.497 0.032 . . . . . . 21 PHE CB . 16676 1
210 . 1 1 21 21 PHE N N 15 120.356 0.024 . . . . . . 21 PHE N . 16676 1
211 . 1 1 22 22 LEU H H 1 9.059 0.009 . . . . . . 22 LEU HN . 16676 1
212 . 1 1 22 22 LEU HA H 1 4.572 0.005 . . . . . . 22 LEU HA . 16676 1
213 . 1 1 22 22 LEU HB2 H 1 1.971 0.006 . . . . . . 22 LEU HB2 . 16676 1
214 . 1 1 22 22 LEU HB3 H 1 1.278 0.01 . . . . . . 22 LEU HB3 . 16676 1
215 . 1 1 22 22 LEU HD11 H 1 0.866 0 . . . . . . 22 LEU QD1 . 16676 1
216 . 1 1 22 22 LEU HD12 H 1 0.866 0 . . . . . . 22 LEU QD1 . 16676 1
217 . 1 1 22 22 LEU HD13 H 1 0.866 0 . . . . . . 22 LEU QD1 . 16676 1
218 . 1 1 22 22 LEU HD21 H 1 0.799 0 . . . . . . 22 LEU QD2 . 16676 1
219 . 1 1 22 22 LEU HD22 H 1 0.799 0 . . . . . . 22 LEU QD2 . 16676 1
220 . 1 1 22 22 LEU HD23 H 1 0.799 0 . . . . . . 22 LEU QD2 . 16676 1
221 . 1 1 22 22 LEU C C 13 174.89 0 . . . . . . 22 LEU CO . 16676 1
222 . 1 1 22 22 LEU CA C 13 53.49 0.005 . . . . . . 22 LEU CA . 16676 1
223 . 1 1 22 22 LEU CB C 13 43.094 0.05 . . . . . . 22 LEU CB . 16676 1
224 . 1 1 22 22 LEU CD1 C 13 25.09 0 . . . . . . 22 LEU CD1 . 16676 1
225 . 1 1 22 22 LEU CD2 C 13 23.278 0 . . . . . . 22 LEU CD2 . 16676 1
226 . 1 1 22 22 LEU CG C 13 27.653 0 . . . . . . 22 LEU CG . 16676 1
227 . 1 1 22 22 LEU N N 15 121.84 0.016 . . . . . . 22 LEU N . 16676 1
228 . 1 1 23 23 ASN H H 1 8.415 0.006 . . . . . . 23 ASN HN . 16676 1
229 . 1 1 23 23 ASN HA H 1 4.149 0.004 . . . . . . 23 ASN HA . 16676 1
230 . 1 1 23 23 ASN HB2 H 1 3.204 0.005 . . . . . . 23 ASN HB2 . 16676 1
231 . 1 1 23 23 ASN HB3 H 1 2.586 0.005 . . . . . . 23 ASN HB3 . 16676 1
232 . 1 1 23 23 ASN HD21 H 1 7.777 0.01 . . . . . . 23 ASN HD21 . 16676 1
233 . 1 1 23 23 ASN HD22 H 1 8.165 0.009 . . . . . . 23 ASN HD22 . 16676 1
234 . 1 1 23 23 ASN CA C 13 49.395 0.046 . . . . . . 23 ASN CA . 16676 1
235 . 1 1 23 23 ASN CB C 13 39.68 0.092 . . . . . . 23 ASN CB . 16676 1
236 . 1 1 23 23 ASN N N 15 127.324 0.012 . . . . . . 23 ASN N . 16676 1
237 . 1 1 23 23 ASN ND2 N 15 115.418 0.039 . . . . . . 23 ASN ND2 . 16676 1
238 . 1 1 24 24 PRO HA H 1 4.133 0.009 . . . . . . 24 PRO HA . 16676 1
239 . 1 1 24 24 PRO HB2 H 1 2.386 0.004 . . . . . . 24 PRO HB2 . 16676 1
240 . 1 1 24 24 PRO HB3 H 1 2.01 0.006 . . . . . . 24 PRO HB3 . 16676 1
241 . 1 1 24 24 PRO HD2 H 1 3.532 0.011 . . . . . . 24 PRO HD2 . 16676 1
242 . 1 1 24 24 PRO HD3 H 1 3.306 0.009 . . . . . . 24 PRO HD3 . 16676 1
243 . 1 1 24 24 PRO HG2 H 1 2.124 0.002 . . . . . . 24 PRO HG2 . 16676 1
244 . 1 1 24 24 PRO HG3 H 1 1.99 0.001 . . . . . . 24 PRO HG3 . 16676 1
245 . 1 1 24 24 PRO C C 13 177.097 0 . . . . . . 24 PRO CO . 16676 1
246 . 1 1 24 24 PRO CA C 13 65.222 0.036 . . . . . . 24 PRO CA . 16676 1
247 . 1 1 24 24 PRO CB C 13 31.914 0 . . . . . . 24 PRO CB . 16676 1
248 . 1 1 24 24 PRO CD C 13 50.424 0.063 . . . . . . 24 PRO CD . 16676 1
249 . 1 1 24 24 PRO CG C 13 27.512 0 . . . . . . 24 PRO CG . 16676 1
250 . 1 1 25 25 GLU H H 1 7.832 0.006 . . . . . . 25 GLU HN . 16676 1
251 . 1 1 25 25 GLU HA H 1 4.347 0.01 . . . . . . 25 GLU HA . 16676 1
252 . 1 1 25 25 GLU HB2 H 1 2.126 0 . . . . . . 25 GLU HB2 . 16676 1
253 . 1 1 25 25 GLU HB3 H 1 2.052 0 . . . . . . 25 GLU HB3 . 16676 1
254 . 1 1 25 25 GLU HG2 H 1 2.29 0.009 . . . . . . 25 GLU QG . 16676 1
255 . 1 1 25 25 GLU HG3 H 1 2.29 0.009 . . . . . . 25 GLU QG . 16676 1
256 . 1 1 25 25 GLU C C 13 177.007 0 . . . . . . 25 GLU CO . 16676 1
257 . 1 1 25 25 GLU CA C 13 57.499 0.048 . . . . . . 25 GLU CA . 16676 1
258 . 1 1 25 25 GLU CB C 13 30.852 0.014 . . . . . . 25 GLU CB . 16676 1
259 . 1 1 25 25 GLU CG C 13 36.914 0 . . . . . . 25 GLU CG . 16676 1
260 . 1 1 25 25 GLU N N 15 113.946 0.017 . . . . . . 25 GLU N . 16676 1
261 . 1 1 26 26 LYS H H 1 7.596 0.006 . . . . . . 26 LYS HN . 16676 1
262 . 1 1 26 26 LYS HA H 1 4.436 0.01 . . . . . . 26 LYS HA . 16676 1
263 . 1 1 26 26 LYS HB2 H 1 1.887 0.004 . . . . . . 26 LYS HB2 . 16676 1
264 . 1 1 26 26 LYS HB3 H 1 1.423 0.008 . . . . . . 26 LYS HB3 . 16676 1
265 . 1 1 26 26 LYS HD2 H 1 1.655 0.004 . . . . . . 26 LYS QD . 16676 1
266 . 1 1 26 26 LYS HD3 H 1 1.655 0.004 . . . . . . 26 LYS QD . 16676 1
267 . 1 1 26 26 LYS HE2 H 1 3.004 0.01 . . . . . . 26 LYS QE . 16676 1
268 . 1 1 26 26 LYS HE3 H 1 3.004 0.01 . . . . . . 26 LYS QE . 16676 1
269 . 1 1 26 26 LYS HG2 H 1 1.331 0.024 . . . . . . 26 LYS QG . 16676 1
270 . 1 1 26 26 LYS HG3 H 1 1.331 0.024 . . . . . . 26 LYS QG . 16676 1
271 . 1 1 26 26 LYS C C 13 175.995 0 . . . . . . 26 LYS CO . 16676 1
272 . 1 1 26 26 LYS CA C 13 56.611 0.055 . . . . . . 26 LYS CA . 16676 1
273 . 1 1 26 26 LYS CB C 13 35.094 0.025 . . . . . . 26 LYS CB . 16676 1
274 . 1 1 26 26 LYS CD C 13 28.963 0 . . . . . . 26 LYS CD . 16676 1
275 . 1 1 26 26 LYS CE C 13 42.107 0 . . . . . . 26 LYS CE . 16676 1
276 . 1 1 26 26 LYS CG C 13 25.03 0 . . . . . . 26 LYS CG . 16676 1
277 . 1 1 26 26 LYS N N 15 116.247 0.035 . . . . . . 26 LYS N . 16676 1
278 . 1 1 27 27 GLY H H 1 8.742 0.006 . . . . . . 27 GLY HN . 16676 1
279 . 1 1 27 27 GLY HA2 H 1 4.38 0.005 . . . . . . 27 GLY HA2 . 16676 1
280 . 1 1 27 27 GLY HA3 H 1 3.728 0.005 . . . . . . 27 GLY HA3 . 16676 1
281 . 1 1 27 27 GLY C C 13 173.043 0 . . . . . . 27 GLY CO . 16676 1
282 . 1 1 27 27 GLY CA C 13 44.193 0.025 . . . . . . 27 GLY CA . 16676 1
283 . 1 1 27 27 GLY N N 15 110.53 0.024 . . . . . . 27 GLY N . 16676 1
284 . 1 1 28 28 ILE H H 1 8.55 0.008 . . . . . . 28 ILE HN . 16676 1
285 . 1 1 28 28 ILE HA H 1 4.574 0.005 . . . . . . 28 ILE HA . 16676 1
286 . 1 1 28 28 ILE HB H 1 1.649 0.012 . . . . . . 28 ILE HB . 16676 1
287 . 1 1 28 28 ILE HD11 H 1 0.667 0.003 . . . . . . 28 ILE QD1 . 16676 1
288 . 1 1 28 28 ILE HD12 H 1 0.667 0.003 . . . . . . 28 ILE QD1 . 16676 1
289 . 1 1 28 28 ILE HD13 H 1 0.667 0.003 . . . . . . 28 ILE QD1 . 16676 1
290 . 1 1 28 28 ILE HG12 H 1 1.687 0.003 . . . . . . 28 ILE HG12 . 16676 1
291 . 1 1 28 28 ILE HG13 H 1 0.805 0.011 . . . . . . 28 ILE HG13 . 16676 1
292 . 1 1 28 28 ILE HG21 H 1 0.746 0.002 . . . . . . 28 ILE QG2 . 16676 1
293 . 1 1 28 28 ILE HG22 H 1 0.746 0.002 . . . . . . 28 ILE QG2 . 16676 1
294 . 1 1 28 28 ILE HG23 H 1 0.746 0.002 . . . . . . 28 ILE QG2 . 16676 1
295 . 1 1 28 28 ILE C C 13 176.33 0 . . . . . . 28 ILE CO . 16676 1
296 . 1 1 28 28 ILE CA C 13 62.384 0.014 . . . . . . 28 ILE CA . 16676 1
297 . 1 1 28 28 ILE CB C 13 37.946 0.013 . . . . . . 28 ILE CB . 16676 1
298 . 1 1 28 28 ILE CD1 C 13 13.768 0.033 . . . . . . 28 ILE CD1 . 16676 1
299 . 1 1 28 28 ILE CG1 C 13 28.954 0.073 . . . . . . 28 ILE CG1 . 16676 1
300 . 1 1 28 28 ILE CG2 C 13 17.867 0 . . . . . . 28 ILE CG2 . 16676 1
301 . 1 1 28 28 ILE N N 15 121.939 0.032 . . . . . . 28 ILE N . 16676 1
302 . 1 1 29 29 VAL H H 1 9.449 0.01 . . . . . . 29 VAL HN . 16676 1
303 . 1 1 29 29 VAL HA H 1 4.306 0.004 . . . . . . 29 VAL HA . 16676 1
304 . 1 1 29 29 VAL HB H 1 1.898 0.003 . . . . . . 29 VAL HB . 16676 1
305 . 1 1 29 29 VAL HG11 H 1 1.038 0.004 . . . . . . 29 VAL QG1 . 16676 1
306 . 1 1 29 29 VAL HG12 H 1 1.038 0.004 . . . . . . 29 VAL QG1 . 16676 1
307 . 1 1 29 29 VAL HG13 H 1 1.038 0.004 . . . . . . 29 VAL QG1 . 16676 1
308 . 1 1 29 29 VAL HG21 H 1 0.9 0.013 . . . . . . 29 VAL QG2 . 16676 1
309 . 1 1 29 29 VAL HG22 H 1 0.9 0.013 . . . . . . 29 VAL QG2 . 16676 1
310 . 1 1 29 29 VAL HG23 H 1 0.9 0.013 . . . . . . 29 VAL QG2 . 16676 1
311 . 1 1 29 29 VAL C C 13 174.178 0 . . . . . . 29 VAL CO . 16676 1
312 . 1 1 29 29 VAL CA C 13 60.923 0.066 . . . . . . 29 VAL CA . 16676 1
313 . 1 1 29 29 VAL CB C 13 34.904 0.033 . . . . . . 29 VAL CB . 16676 1
314 . 1 1 29 29 VAL CG1 C 13 21.049 0 . . . . . . 29 VAL CG1 . 16676 1
315 . 1 1 29 29 VAL N N 15 129.929 0.02 . . . . . . 29 VAL N . 16676 1
316 . 1 1 30 30 VAL H H 1 8.454 0.008 . . . . . . 30 VAL HN . 16676 1
317 . 1 1 30 30 VAL HA H 1 4.896 0.007 . . . . . . 30 VAL HA . 16676 1
318 . 1 1 30 30 VAL HB H 1 1.81 0.007 . . . . . . 30 VAL HB . 16676 1
319 . 1 1 30 30 VAL HG11 H 1 0.751 0.005 . . . . . . 30 VAL QG1 . 16676 1
320 . 1 1 30 30 VAL HG12 H 1 0.751 0.005 . . . . . . 30 VAL QG1 . 16676 1
321 . 1 1 30 30 VAL HG13 H 1 0.751 0.005 . . . . . . 30 VAL QG1 . 16676 1
322 . 1 1 30 30 VAL HG21 H 1 0.499 0.007 . . . . . . 30 VAL QG2 . 16676 1
323 . 1 1 30 30 VAL HG22 H 1 0.499 0.007 . . . . . . 30 VAL QG2 . 16676 1
324 . 1 1 30 30 VAL HG23 H 1 0.499 0.007 . . . . . . 30 VAL QG2 . 16676 1
325 . 1 1 30 30 VAL C C 13 176.215 0 . . . . . . 30 VAL CO . 16676 1
326 . 1 1 30 30 VAL CA C 13 60.728 0 . . . . . . 30 VAL CA . 16676 1
327 . 1 1 30 30 VAL CB C 13 33.558 0.058 . . . . . . 30 VAL CB . 16676 1
328 . 1 1 30 30 VAL CG1 C 13 22.165 0 . . . . . . 30 VAL CG1 . 16676 1
329 . 1 1 30 30 VAL N N 15 125.677 0.026 . . . . . . 30 VAL N . 16676 1
330 . 1 1 31 31 VAL H H 1 8.84 0.007 . . . . . . 31 VAL HN . 16676 1
331 . 1 1 31 31 VAL HA H 1 4.663 0.007 . . . . . . 31 VAL HA . 16676 1
332 . 1 1 31 31 VAL HB H 1 2.088 0.006 . . . . . . 31 VAL HB . 16676 1
333 . 1 1 31 31 VAL HG11 H 1 0.802 0.003 . . . . . . 31 VAL QG1 . 16676 1
334 . 1 1 31 31 VAL HG12 H 1 0.802 0.003 . . . . . . 31 VAL QG1 . 16676 1
335 . 1 1 31 31 VAL HG13 H 1 0.802 0.003 . . . . . . 31 VAL QG1 . 16676 1
336 . 1 1 31 31 VAL HG21 H 1 0.732 0 . . . . . . 31 VAL QG2 . 16676 1
337 . 1 1 31 31 VAL HG22 H 1 0.732 0 . . . . . . 31 VAL QG2 . 16676 1
338 . 1 1 31 31 VAL HG23 H 1 0.732 0 . . . . . . 31 VAL QG2 . 16676 1
339 . 1 1 31 31 VAL C C 13 174.178 0 . . . . . . 31 VAL CO . 16676 1
340 . 1 1 31 31 VAL CA C 13 59.077 0.03 . . . . . . 31 VAL CA . 16676 1
341 . 1 1 31 31 VAL CB C 13 34.398 0.03 . . . . . . 31 VAL CB . 16676 1
342 . 1 1 31 31 VAL CG1 C 13 28.616 0 . . . . . . 31 VAL CG1 . 16676 1
343 . 1 1 31 31 VAL N N 15 122.501 0.037 . . . . . . 31 VAL N . 16676 1
344 . 1 1 32 32 HIS H H 1 8.778 0.009 . . . . . . 32 HIS HN . 16676 1
345 . 1 1 32 32 HIS HA H 1 5.058 0.006 . . . . . . 32 HIS HA . 16676 1
346 . 1 1 32 32 HIS HB2 H 1 2.975 0.008 . . . . . . 32 HIS HB2 . 16676 1
347 . 1 1 32 32 HIS HB3 H 1 2.707 0.009 . . . . . . 32 HIS HB3 . 16676 1
348 . 1 1 32 32 HIS C C 13 176.104 0 . . . . . . 32 HIS CO . 16676 1
349 . 1 1 32 32 HIS CA C 13 56.925 0.02 . . . . . . 32 HIS CA . 16676 1
350 . 1 1 32 32 HIS CB C 13 32.399 0.006 . . . . . . 32 HIS CB . 16676 1
351 . 1 1 32 32 HIS N N 15 120.921 0.01 . . . . . . 32 HIS N . 16676 1
352 . 1 1 33 33 GLY H H 1 9.313 0.008 . . . . . . 33 GLY HN . 16676 1
353 . 1 1 33 33 GLY HA2 H 1 4.629 0.007 . . . . . . 33 GLY HA2 . 16676 1
354 . 1 1 33 33 GLY HA3 H 1 4.244 0.007 . . . . . . 33 GLY HA3 . 16676 1
355 . 1 1 33 33 GLY C C 13 174.554 0 . . . . . . 33 GLY CO . 16676 1
356 . 1 1 33 33 GLY CA C 13 45.424 0.021 . . . . . . 33 GLY CA . 16676 1
357 . 1 1 33 33 GLY N N 15 112.799 0.017 . . . . . . 33 GLY N . 16676 1
358 . 1 1 34 34 GLY H H 1 9.06 0.009 . . . . . . 34 GLY HN . 16676 1
359 . 1 1 34 34 GLY HA2 H 1 4.357 0.009 . . . . . . 34 GLY HA2 . 16676 1
360 . 1 1 34 34 GLY HA3 H 1 3.886 0.004 . . . . . . 34 GLY HA3 . 16676 1
361 . 1 1 34 34 GLY C C 13 177.916 0 . . . . . . 34 GLY CO . 16676 1
362 . 1 1 34 34 GLY CA C 13 47.976 0.024 . . . . . . 34 GLY CA . 16676 1
363 . 1 1 34 34 GLY N N 15 108.535 0.015 . . . . . . 34 GLY N . 16676 1
364 . 1 1 35 35 CYS H H 1 8.529 0.01 . . . . . . 35 CYS HN . 16676 1
365 . 1 1 35 35 CYS HA H 1 4.511 0.009 . . . . . . 35 CYS HA . 16676 1
366 . 1 1 35 35 CYS HB2 H 1 3.195 0.001 . . . . . . 35 CYS HB2 . 16676 1
367 . 1 1 35 35 CYS HB3 H 1 3.087 0.008 . . . . . . 35 CYS HB3 . 16676 1
368 . 1 1 35 35 CYS C C 13 176.423 0 . . . . . . 35 CYS CO . 16676 1
369 . 1 1 35 35 CYS CA C 13 57.926 0 . . . . . . 35 CYS CA . 16676 1
370 . 1 1 35 35 CYS CB C 13 40.052 0 . . . . . . 35 CYS CB . 16676 1
371 . 1 1 35 35 CYS N N 15 122.047 0.041 . . . . . . 35 CYS N . 16676 1
372 . 1 1 36 36 ALA H H 1 8.927 0.009 . . . . . . 36 ALA HN . 16676 1
373 . 1 1 36 36 ALA HA H 1 4.171 0.007 . . . . . . 36 ALA HA . 16676 1
374 . 1 1 36 36 ALA HB1 H 1 1.542 0.009 . . . . . . 36 ALA QB . 16676 1
375 . 1 1 36 36 ALA HB2 H 1 1.542 0.009 . . . . . . 36 ALA QB . 16676 1
376 . 1 1 36 36 ALA HB3 H 1 1.542 0.009 . . . . . . 36 ALA QB . 16676 1
377 . 1 1 36 36 ALA C C 13 180.907 0 . . . . . . 36 ALA CO . 16676 1
378 . 1 1 36 36 ALA CA C 13 55.005 0.077 . . . . . . 36 ALA CA . 16676 1
379 . 1 1 36 36 ALA CB C 13 18.851 0.039 . . . . . . 36 ALA CB . 16676 1
380 . 1 1 36 36 ALA N N 15 125.01 0.015 . . . . . . 36 ALA N . 16676 1
381 . 1 1 37 37 LEU H H 1 8.56 0.008 . . . . . . 37 LEU HN . 16676 1
382 . 1 1 37 37 LEU HA H 1 3.973 0.007 . . . . . . 37 LEU HA . 16676 1
383 . 1 1 37 37 LEU HB2 H 1 1.99 0.006 . . . . . . 37 LEU HB2 . 16676 1
384 . 1 1 37 37 LEU HB3 H 1 1.399 0.01 . . . . . . 37 LEU HB3 . 16676 1
385 . 1 1 37 37 LEU HD11 H 1 0.582 0.003 . . . . . . 37 LEU QD1 . 16676 1
386 . 1 1 37 37 LEU HD12 H 1 0.582 0.003 . . . . . . 37 LEU QD1 . 16676 1
387 . 1 1 37 37 LEU HD13 H 1 0.582 0.003 . . . . . . 37 LEU QD1 . 16676 1
388 . 1 1 37 37 LEU HD21 H 1 0.51 0.004 . . . . . . 37 LEU QD2 . 16676 1
389 . 1 1 37 37 LEU HD22 H 1 0.51 0.004 . . . . . . 37 LEU QD2 . 16676 1
390 . 1 1 37 37 LEU HD23 H 1 0.51 0.004 . . . . . . 37 LEU QD2 . 16676 1
391 . 1 1 37 37 LEU HG H 1 1.511 0.013 . . . . . . 37 LEU HG . 16676 1
392 . 1 1 37 37 LEU C C 13 177.418 0 . . . . . . 37 LEU CO . 16676 1
393 . 1 1 37 37 LEU CA C 13 59.396 0.073 . . . . . . 37 LEU CA . 16676 1
394 . 1 1 37 37 LEU CB C 13 41.779 0.004 . . . . . . 37 LEU CB . 16676 1
395 . 1 1 37 37 LEU CD1 C 13 24.59 0 . . . . . . 37 LEU CD1 . 16676 1
396 . 1 1 37 37 LEU CG C 13 26.819 0.056 . . . . . . 37 LEU CG . 16676 1
397 . 1 1 37 37 LEU N N 15 121.5 0.016 . . . . . . 37 LEU N . 16676 1
398 . 1 1 38 38 SER H H 1 8.028 0.007 . . . . . . 38 SER HN . 16676 1
399 . 1 1 38 38 SER HA H 1 4.078 0.006 . . . . . . 38 SER HA . 16676 1
400 . 1 1 38 38 SER HB2 H 1 3.804 0 . . . . . . 38 SER QB . 16676 1
401 . 1 1 38 38 SER HB3 H 1 3.804 0 . . . . . . 38 SER QB . 16676 1
402 . 1 1 38 38 SER C C 13 177.477 0 . . . . . . 38 SER CO . 16676 1
403 . 1 1 38 38 SER CA C 13 61.763 0.012 . . . . . . 38 SER CA . 16676 1
404 . 1 1 38 38 SER CB C 13 62.98 0.019 . . . . . . 38 SER CB . 16676 1
405 . 1 1 38 38 SER N N 15 113.637 0.014 . . . . . . 38 SER N . 16676 1
406 . 1 1 39 39 LYS H H 1 8.188 0.007 . . . . . . 39 LYS HN . 16676 1
407 . 1 1 39 39 LYS HA H 1 4.078 0.007 . . . . . . 39 LYS HA . 16676 1
408 . 1 1 39 39 LYS HB2 H 1 1.79 0.002 . . . . . . 39 LYS QB . 16676 1
409 . 1 1 39 39 LYS HB3 H 1 1.79 0.002 . . . . . . 39 LYS QB . 16676 1
410 . 1 1 39 39 LYS HE2 H 1 2.882 0.016 . . . . . . 39 LYS QE . 16676 1
411 . 1 1 39 39 LYS HE3 H 1 2.882 0.016 . . . . . . 39 LYS QE . 16676 1
412 . 1 1 39 39 LYS C C 13 177.453 0 . . . . . . 39 LYS CO . 16676 1
413 . 1 1 39 39 LYS CA C 13 60.04 0.042 . . . . . . 39 LYS CA . 16676 1
414 . 1 1 39 39 LYS CB C 13 33.079 0.028 . . . . . . 39 LYS CB . 16676 1
415 . 1 1 39 39 LYS CD C 13 29.821 0 . . . . . . 39 LYS CD . 16676 1
416 . 1 1 39 39 LYS CE C 13 42.132 0 . . . . . . 39 LYS CE . 16676 1
417 . 1 1 39 39 LYS CG C 13 24.922 0 . . . . . . 39 LYS CG . 16676 1
418 . 1 1 39 39 LYS N N 15 121.501 0.098 . . . . . . 39 LYS N . 16676 1
419 . 1 1 40 40 TYR H H 1 8.534 0.006 . . . . . . 40 TYR HN . 16676 1
420 . 1 1 40 40 TYR HA H 1 3.68 0.006 . . . . . . 40 TYR HA . 16676 1
421 . 1 1 40 40 TYR HB2 H 1 2.912 0.011 . . . . . . 40 TYR HB2 . 16676 1
422 . 1 1 40 40 TYR HB3 H 1 2.656 0.008 . . . . . . 40 TYR HB3 . 16676 1
423 . 1 1 40 40 TYR HD1 H 1 6.078 0.001 . . . . . . 40 TYR QD . 16676 1
424 . 1 1 40 40 TYR HD2 H 1 6.078 0.001 . . . . . . 40 TYR QD . 16676 1
425 . 1 1 40 40 TYR C C 13 178.374 0 . . . . . . 40 TYR CO . 16676 1
426 . 1 1 40 40 TYR CA C 13 62.785 0.032 . . . . . . 40 TYR CA . 16676 1
427 . 1 1 40 40 TYR CB C 13 38.688 0.042 . . . . . . 40 TYR CB . 16676 1
428 . 1 1 40 40 TYR N N 15 120.474 0.044 . . . . . . 40 TYR N . 16676 1
429 . 1 1 41 41 LYS H H 1 8.183 0.006 . . . . . . 41 LYS HN . 16676 1
430 . 1 1 41 41 LYS HA H 1 3.808 0.007 . . . . . . 41 LYS HA . 16676 1
431 . 1 1 41 41 LYS HB2 H 1 1.882 0.006 . . . . . . 41 LYS QB . 16676 1
432 . 1 1 41 41 LYS HB3 H 1 1.882 0.006 . . . . . . 41 LYS QB . 16676 1
433 . 1 1 41 41 LYS HE2 H 1 3.058 0.004 . . . . . . 41 LYS QE . 16676 1
434 . 1 1 41 41 LYS HE3 H 1 3.058 0.004 . . . . . . 41 LYS QE . 16676 1
435 . 1 1 41 41 LYS C C 13 177.883 0 . . . . . . 41 LYS CO . 16676 1
436 . 1 1 41 41 LYS CA C 13 58.942 0.009 . . . . . . 41 LYS CA . 16676 1
437 . 1 1 41 41 LYS CB C 13 32.545 0.006 . . . . . . 41 LYS CB . 16676 1
438 . 1 1 41 41 LYS CD C 13 29.446 0 . . . . . . 41 LYS CD . 16676 1
439 . 1 1 41 41 LYS CE C 13 41.574 0 . . . . . . 41 LYS CE . 16676 1
440 . 1 1 41 41 LYS CG C 13 25.021 0 . . . . . . 41 LYS CG . 16676 1
441 . 1 1 41 41 LYS N N 15 117.121 0.014 . . . . . . 41 LYS N . 16676 1
442 . 1 1 42 42 CYS H H 1 7.479 0.009 . . . . . . 42 CYS HN . 16676 1
443 . 1 1 42 42 CYS HA H 1 4.142 0.008 . . . . . . 42 CYS HA . 16676 1
444 . 1 1 42 42 CYS HB2 H 1 3.22 0.025 . . . . . . 42 CYS HB2 . 16676 1
445 . 1 1 42 42 CYS HB3 H 1 3.068 0.007 . . . . . . 42 CYS HB3 . 16676 1
446 . 1 1 42 42 CYS C C 13 176.303 0 . . . . . . 42 CYS CO . 16676 1
447 . 1 1 42 42 CYS CA C 13 58.604 0.037 . . . . . . 42 CYS CA . 16676 1
448 . 1 1 42 42 CYS CB C 13 36.748 0.015 . . . . . . 42 CYS CB . 16676 1
449 . 1 1 42 42 CYS N N 15 116.747 0.009 . . . . . . 42 CYS N . 16676 1
450 . 1 1 43 43 GLN H H 1 8.034 0.008 . . . . . . 43 GLN HN . 16676 1
451 . 1 1 43 43 GLN HA H 1 3.879 0.013 . . . . . . 43 GLN HA . 16676 1
452 . 1 1 43 43 GLN HB2 H 1 1.83 0.01 . . . . . . 43 GLN HB2 . 16676 1
453 . 1 1 43 43 GLN HB3 H 1 1.701 0.006 . . . . . . 43 GLN HB3 . 16676 1
454 . 1 1 43 43 GLN HE21 H 1 6.831 0.008 . . . . . . 43 GLN HE21 . 16676 1
455 . 1 1 43 43 GLN HE22 H 1 7.449 0.006 . . . . . . 43 GLN HE22 . 16676 1
456 . 1 1 43 43 GLN HG2 H 1 2.485 0.006 . . . . . . 43 GLN HG2 . 16676 1
457 . 1 1 43 43 GLN HG3 H 1 2.157 0.005 . . . . . . 43 GLN HG3 . 16676 1
458 . 1 1 43 43 GLN C C 13 175.885 0 . . . . . . 43 GLN CO . 16676 1
459 . 1 1 43 43 GLN CA C 13 58.105 0.054 . . . . . . 43 GLN CA . 16676 1
460 . 1 1 43 43 GLN CB C 13 29.87 0.017 . . . . . . 43 GLN CB . 16676 1
461 . 1 1 43 43 GLN CG C 13 35.051 0.024 . . . . . . 43 GLN CG . 16676 1
462 . 1 1 43 43 GLN N N 15 117.758 0.011 . . . . . . 43 GLN N . 16676 1
463 . 1 1 43 43 GLN NE2 N 15 111.844 0.054 . . . . . . 43 GLN NE2 . 16676 1
464 . 1 1 44 44 ASN H H 1 7.815 0.006 . . . . . . 44 ASN HN . 16676 1
465 . 1 1 44 44 ASN HA H 1 4.823 0.009 . . . . . . 44 ASN HA . 16676 1
466 . 1 1 44 44 ASN HB2 H 1 1.867 0.005 . . . . . . 44 ASN HB2 . 16676 1
467 . 1 1 44 44 ASN HB3 H 1 0.471 0.006 . . . . . . 44 ASN HB3 . 16676 1
468 . 1 1 44 44 ASN CA C 13 50.059 0.103 . . . . . . 44 ASN CA . 16676 1
469 . 1 1 44 44 ASN CB C 13 38.642 0.025 . . . . . . 44 ASN CB . 16676 1
470 . 1 1 44 44 ASN N N 15 114.927 0.049 . . . . . . 44 ASN N . 16676 1
471 . 1 1 45 45 PRO HA H 1 4.534 0.009 . . . . . . 45 PRO HA . 16676 1
472 . 1 1 45 45 PRO HB2 H 1 2.39 0.005 . . . . . . 45 PRO HB2 . 16676 1
473 . 1 1 45 45 PRO HB3 H 1 1.953 0.008 . . . . . . 45 PRO HB3 . 16676 1
474 . 1 1 45 45 PRO HD2 H 1 3.473 0.01 . . . . . . 45 PRO HD2 . 16676 1
475 . 1 1 45 45 PRO HD3 H 1 3.275 0.006 . . . . . . 45 PRO HD3 . 16676 1
476 . 1 1 45 45 PRO C C 13 177.197 0 . . . . . . 45 PRO CO . 16676 1
477 . 1 1 45 45 PRO CA C 13 65.013 0.02 . . . . . . 45 PRO CA . 16676 1
478 . 1 1 45 45 PRO CB C 13 32.183 0.03 . . . . . . 45 PRO CB . 16676 1
479 . 1 1 45 45 PRO CD C 13 50.232 0 . . . . . . 45 PRO CD . 16676 1
480 . 1 1 45 45 PRO CG C 13 27.254 0 . . . . . . 45 PRO CG . 16676 1
481 . 1 1 46 46 ASN H H 1 8.456 0.008 . . . . . . 46 ASN HN . 16676 1
482 . 1 1 46 46 ASN HA H 1 4.998 0.004 . . . . . . 46 ASN HA . 16676 1
483 . 1 1 46 46 ASN HB2 H 1 3.022 0.013 . . . . . . 46 ASN HB2 . 16676 1
484 . 1 1 46 46 ASN HB3 H 1 2.932 0.002 . . . . . . 46 ASN HB3 . 16676 1
485 . 1 1 46 46 ASN HD21 H 1 7.085 0.007 . . . . . . 46 ASN HD21 . 16676 1
486 . 1 1 46 46 ASN HD22 H 1 7.749 0.008 . . . . . . 46 ASN HD22 . 16676 1
487 . 1 1 46 46 ASN C C 13 176.069 0 . . . . . . 46 ASN CO . 16676 1
488 . 1 1 46 46 ASN CA C 13 52.745 0.005 . . . . . . 46 ASN CA . 16676 1
489 . 1 1 46 46 ASN CB C 13 38.424 0.005 . . . . . . 46 ASN CB . 16676 1
490 . 1 1 46 46 ASN N N 15 112.95 0.013 . . . . . . 46 ASN N . 16676 1
491 . 1 1 46 46 ASN ND2 N 15 113.413 0.035 . . . . . . 46 ASN ND2 . 16676 1
492 . 1 1 47 47 HIS H H 1 7.575 0.007 . . . . . . 47 HIS HN . 16676 1
493 . 1 1 47 47 HIS HA H 1 5.101 0.011 . . . . . . 47 HIS HA . 16676 1
494 . 1 1 47 47 HIS HB2 H 1 3.366 0.014 . . . . . . 47 HIS HB2 . 16676 1
495 . 1 1 47 47 HIS HB3 H 1 3.204 0.007 . . . . . . 47 HIS HB3 . 16676 1
496 . 1 1 47 47 HIS C C 13 175.237 0 . . . . . . 47 HIS CO . 16676 1
497 . 1 1 47 47 HIS CA C 13 55.176 0.018 . . . . . . 47 HIS CA . 16676 1
498 . 1 1 47 47 HIS CB C 13 32.207 0.12 . . . . . . 47 HIS CB . 16676 1
499 . 1 1 47 47 HIS N N 15 121.252 0.017 . . . . . . 47 HIS N . 16676 1
500 . 1 1 48 48 GLU H H 1 9.066 0.009 . . . . . . 48 GLU HN . 16676 1
501 . 1 1 48 48 GLU HA H 1 4.287 0.007 . . . . . . 48 GLU HA . 16676 1
502 . 1 1 48 48 GLU HB2 H 1 2.1 0.017 . . . . . . 48 GLU QB . 16676 1
503 . 1 1 48 48 GLU HB3 H 1 2.1 0.017 . . . . . . 48 GLU QB . 16676 1
504 . 1 1 48 48 GLU HG2 H 1 2.366 0.009 . . . . . . 48 GLU QG . 16676 1
505 . 1 1 48 48 GLU HG3 H 1 2.366 0.009 . . . . . . 48 GLU QG . 16676 1
506 . 1 1 48 48 GLU C C 13 175.092 0 . . . . . . 48 GLU CO . 16676 1
507 . 1 1 48 48 GLU CA C 13 56.774 0.047 . . . . . . 48 GLU CA . 16676 1
508 . 1 1 48 48 GLU CB C 13 31.508 0.129 . . . . . . 48 GLU CB . 16676 1
509 . 1 1 48 48 GLU CG C 13 35.885 0 . . . . . . 48 GLU CG . 16676 1
510 . 1 1 48 48 GLU N N 15 126.461 0.018 . . . . . . 48 GLU N . 16676 1
511 . 1 1 49 49 LYS H H 1 8.795 0.009 . . . . . . 49 LYS HN . 16676 1
512 . 1 1 49 49 LYS HA H 1 3.952 0.009 . . . . . . 49 LYS HA . 16676 1
513 . 1 1 49 49 LYS HB2 H 1 1.741 0.007 . . . . . . 49 LYS HB2 . 16676 1
514 . 1 1 49 49 LYS HB3 H 1 1.441 0.012 . . . . . . 49 LYS HB3 . 16676 1
515 . 1 1 49 49 LYS HE2 H 1 2.862 0.017 . . . . . . 49 LYS HE2 . 16676 1
516 . 1 1 49 49 LYS HE3 H 1 2.701 0.008 . . . . . . 49 LYS HE3 . 16676 1
517 . 1 1 49 49 LYS HG2 H 1 1.044 0.007 . . . . . . 49 LYS HG2 . 16676 1
518 . 1 1 49 49 LYS HG3 H 1 0.593 0.007 . . . . . . 49 LYS HG3 . 16676 1
519 . 1 1 49 49 LYS C C 13 176.566 0 . . . . . . 49 LYS CO . 16676 1
520 . 1 1 49 49 LYS CA C 13 56.011 0.035 . . . . . . 49 LYS CA . 16676 1
521 . 1 1 49 49 LYS CB C 13 32.578 0.041 . . . . . . 49 LYS CB . 16676 1
522 . 1 1 49 49 LYS CD C 13 28.705 0 . . . . . . 49 LYS CD . 16676 1
523 . 1 1 49 49 LYS CE C 13 42.463 0.005 . . . . . . 49 LYS CE . 16676 1
524 . 1 1 49 49 LYS CG C 13 24.972 0 . . . . . . 49 LYS CG . 16676 1
525 . 1 1 49 49 LYS N N 15 127.4 0.014 . . . . . . 49 LYS N . 16676 1
526 . 1 1 50 50 LEU H H 1 8.265 0.006 . . . . . . 50 LEU HN . 16676 1
527 . 1 1 50 50 LEU HA H 1 4.463 0.006 . . . . . . 50 LEU HA . 16676 1
528 . 1 1 50 50 LEU HB2 H 1 1.752 0.008 . . . . . . 50 LEU HB2 . 16676 1
529 . 1 1 50 50 LEU HB3 H 1 1.439 0.006 . . . . . . 50 LEU HB3 . 16676 1
530 . 1 1 50 50 LEU HD11 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
531 . 1 1 50 50 LEU HD12 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
532 . 1 1 50 50 LEU HD13 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
533 . 1 1 50 50 LEU HD21 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
534 . 1 1 50 50 LEU HD22 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
535 . 1 1 50 50 LEU HD23 H 1 0.788 0.008 . . . . . . 50 LEU QQD . 16676 1
536 . 1 1 50 50 LEU HG H 1 1.531 0 . . . . . . 50 LEU HG . 16676 1
537 . 1 1 50 50 LEU C C 13 178.693 0 . . . . . . 50 LEU CO . 16676 1
538 . 1 1 50 50 LEU CA C 13 54.067 0.012 . . . . . . 50 LEU CA . 16676 1
539 . 1 1 50 50 LEU CB C 13 44.493 0.04 . . . . . . 50 LEU CB . 16676 1
540 . 1 1 50 50 LEU CD1 C 13 22.594 0 . . . . . . 50 LEU CD1 . 16676 1
541 . 1 1 50 50 LEU CG C 13 26.179 0 . . . . . . 50 LEU CG . 16676 1
542 . 1 1 50 50 LEU N N 15 129.102 0.022 . . . . . . 50 LEU N . 16676 1
543 . 1 1 51 51 GLY H H 1 8.471 0.008 . . . . . . 51 GLY HN . 16676 1
544 . 1 1 51 51 GLY HA2 H 1 4.146 0.005 . . . . . . 51 GLY HA2 . 16676 1
545 . 1 1 51 51 GLY HA3 H 1 3.625 0.004 . . . . . . 51 GLY HA3 . 16676 1
546 . 1 1 51 51 GLY C C 13 172.958 0 . . . . . . 51 GLY CO . 16676 1
547 . 1 1 51 51 GLY CA C 13 43.998 0.055 . . . . . . 51 GLY CA . 16676 1
548 . 1 1 51 51 GLY N N 15 108.561 0.014 . . . . . . 51 GLY N . 16676 1
549 . 1 1 52 52 TYR H H 1 8.483 0.009 . . . . . . 52 TYR HN . 16676 1
550 . 1 1 52 52 TYR HA H 1 4.421 0.006 . . . . . . 52 TYR HA . 16676 1
551 . 1 1 52 52 TYR HB2 H 1 3.108 0.007 . . . . . . 52 TYR HB2 . 16676 1
552 . 1 1 52 52 TYR HB3 H 1 2.744 0.008 . . . . . . 52 TYR HB3 . 16676 1
553 . 1 1 52 52 TYR HD1 H 1 7.113 0 . . . . . . 52 TYR QD . 16676 1
554 . 1 1 52 52 TYR HD2 H 1 7.113 0 . . . . . . 52 TYR QD . 16676 1
555 . 1 1 52 52 TYR C C 13 176.914 0 . . . . . . 52 TYR CO . 16676 1
556 . 1 1 52 52 TYR CA C 13 57.795 0.014 . . . . . . 52 TYR CA . 16676 1
557 . 1 1 52 52 TYR CB C 13 35.447 0.022 . . . . . . 52 TYR CB . 16676 1
558 . 1 1 52 52 TYR N N 15 119.944 0.013 . . . . . . 52 TYR N . 16676 1
559 . 1 1 53 53 THR H H 1 7.978 0.008 . . . . . . 53 THR HN . 16676 1
560 . 1 1 53 53 THR HA H 1 4.402 0.004 . . . . . . 53 THR HA . 16676 1
561 . 1 1 53 53 THR HB H 1 4.721 0.007 . . . . . . 53 THR HB . 16676 1
562 . 1 1 53 53 THR HG21 H 1 1.214 0.004 . . . . . . 53 THR QG2 . 16676 1
563 . 1 1 53 53 THR HG22 H 1 1.214 0.004 . . . . . . 53 THR QG2 . 16676 1
564 . 1 1 53 53 THR HG23 H 1 1.214 0.004 . . . . . . 53 THR QG2 . 16676 1
565 . 1 1 53 53 THR C C 13 175.257 0 . . . . . . 53 THR CO . 16676 1
566 . 1 1 53 53 THR CA C 13 60.167 0.082 . . . . . . 53 THR CA . 16676 1
567 . 1 1 53 53 THR CB C 13 71.475 0.069 . . . . . . 53 THR CB . 16676 1
568 . 1 1 53 53 THR CG2 C 13 22.278 0 . . . . . . 53 THR CG2 . 16676 1
569 . 1 1 53 53 THR N N 15 113.853 0.032 . . . . . . 53 THR N . 16676 1
570 . 1 1 54 54 HIS H H 1 9.342 0.012 . . . . . . 54 HIS HN . 16676 1
571 . 1 1 54 54 HIS HA H 1 4.403 0.003 . . . . . . 54 HIS HA . 16676 1
572 . 1 1 54 54 HIS HB2 H 1 3.32 0.017 . . . . . . 54 HIS HB2 . 16676 1
573 . 1 1 54 54 HIS HB3 H 1 3.144 0.005 . . . . . . 54 HIS HB3 . 16676 1
574 . 1 1 54 54 HIS C C 13 177.225 0 . . . . . . 54 HIS CO . 16676 1
575 . 1 1 54 54 HIS CA C 13 59.905 0.051 . . . . . . 54 HIS CA . 16676 1
576 . 1 1 54 54 HIS CB C 13 28.982 0.099 . . . . . . 54 HIS CB . 16676 1
577 . 1 1 54 54 HIS N N 15 120.827 0.023 . . . . . . 54 HIS N . 16676 1
578 . 1 1 55 55 GLU H H 1 8.863 0.01 . . . . . . 55 GLU HN . 16676 1
579 . 1 1 55 55 GLU HA H 1 3.927 0.008 . . . . . . 55 GLU HA . 16676 1
580 . 1 1 55 55 GLU HB2 H 1 1.917 0.007 . . . . . . 55 GLU QB . 16676 1
581 . 1 1 55 55 GLU HB3 H 1 1.917 0.007 . . . . . . 55 GLU QB . 16676 1
582 . 1 1 55 55 GLU HG2 H 1 2.52 0.015 . . . . . . 55 GLU HG2 . 16676 1
583 . 1 1 55 55 GLU HG3 H 1 2.285 0.014 . . . . . . 55 GLU HG3 . 16676 1
584 . 1 1 55 55 GLU C C 13 179.653 0 . . . . . . 55 GLU CO . 16676 1
585 . 1 1 55 55 GLU CA C 13 60.303 0.057 . . . . . . 55 GLU CA . 16676 1
586 . 1 1 55 55 GLU CB C 13 28.643 0.062 . . . . . . 55 GLU CB . 16676 1
587 . 1 1 55 55 GLU CG C 13 37.352 0.034 . . . . . . 55 GLU CG . 16676 1
588 . 1 1 55 55 GLU N N 15 116.814 0.012 . . . . . . 55 GLU N . 16676 1
589 . 1 1 56 56 CYS H H 1 7.737 0.008 . . . . . . 56 CYS HN . 16676 1
590 . 1 1 56 56 CYS HA H 1 4.545 0.009 . . . . . . 56 CYS HA . 16676 1
591 . 1 1 56 56 CYS HB2 H 1 3.149 0.013 . . . . . . 56 CYS QB . 16676 1
592 . 1 1 56 56 CYS HB3 H 1 3.149 0.013 . . . . . . 56 CYS QB . 16676 1
593 . 1 1 56 56 CYS C C 13 174.872 0 . . . . . . 56 CYS CO . 16676 1
594 . 1 1 56 56 CYS CA C 13 57.641 0.06 . . . . . . 56 CYS CA . 16676 1
595 . 1 1 56 56 CYS CB C 13 38.26 0.003 . . . . . . 56 CYS CB . 16676 1
596 . 1 1 56 56 CYS N N 15 119.558 0.019 . . . . . . 56 CYS N . 16676 1
597 . 1 1 57 57 GLU H H 1 8.79 0.009 . . . . . . 57 GLU HN . 16676 1
598 . 1 1 57 57 GLU HA H 1 3.881 0.005 . . . . . . 57 GLU HA . 16676 1
599 . 1 1 57 57 GLU HB2 H 1 2.032 0.005 . . . . . . 57 GLU QB . 16676 1
600 . 1 1 57 57 GLU HB3 H 1 2.032 0.005 . . . . . . 57 GLU QB . 16676 1
601 . 1 1 57 57 GLU HG2 H 1 2.336 0.005 . . . . . . 57 GLU QG . 16676 1
602 . 1 1 57 57 GLU HG3 H 1 2.336 0.005 . . . . . . 57 GLU QG . 16676 1
603 . 1 1 57 57 GLU C C 13 179.797 0 . . . . . . 57 GLU CO . 16676 1
604 . 1 1 57 57 GLU CA C 13 60.386 0.053 . . . . . . 57 GLU CA . 16676 1
605 . 1 1 57 57 GLU CB C 13 29.349 0 . . . . . . 57 GLU CB . 16676 1
606 . 1 1 57 57 GLU N N 15 119.294 0.038 . . . . . . 57 GLU N . 16676 1
607 . 1 1 58 58 GLU H H 1 8.167 0.008 . . . . . . 58 GLU HN . 16676 1
608 . 1 1 58 58 GLU HA H 1 3.927 0.004 . . . . . . 58 GLU HA . 16676 1
609 . 1 1 58 58 GLU C C 13 177.814 0 . . . . . . 58 GLU CO . 16676 1
610 . 1 1 58 58 GLU CA C 13 59.062 0.007 . . . . . . 58 GLU CA . 16676 1
611 . 1 1 58 58 GLU CB C 13 29.727 0 . . . . . . 58 GLU CB . 16676 1
612 . 1 1 58 58 GLU CG C 13 36.213 0 . . . . . . 58 GLU CG . 16676 1
613 . 1 1 58 58 GLU N N 15 119.035 0.062 . . . . . . 58 GLU N . 16676 1
614 . 1 1 59 59 ALA H H 1 7.668 0.008 . . . . . . 59 ALA HN . 16676 1
615 . 1 1 59 59 ALA HA H 1 4.159 0.011 . . . . . . 59 ALA HA . 16676 1
616 . 1 1 59 59 ALA HB1 H 1 1.484 0.006 . . . . . . 59 ALA QB . 16676 1
617 . 1 1 59 59 ALA HB2 H 1 1.484 0.006 . . . . . . 59 ALA QB . 16676 1
618 . 1 1 59 59 ALA HB3 H 1 1.484 0.006 . . . . . . 59 ALA QB . 16676 1
619 . 1 1 59 59 ALA C C 13 181.145 0 . . . . . . 59 ALA CO . 16676 1
620 . 1 1 59 59 ALA CA C 13 55.129 0.072 . . . . . . 59 ALA CA . 16676 1
621 . 1 1 59 59 ALA CB C 13 18.178 0.024 . . . . . . 59 ALA CB . 16676 1
622 . 1 1 59 59 ALA N N 15 122.778 0.009 . . . . . . 59 ALA N . 16676 1
623 . 1 1 60 60 ILE H H 1 8.663 0.007 . . . . . . 60 ILE HN . 16676 1
624 . 1 1 60 60 ILE HA H 1 3.547 0.009 . . . . . . 60 ILE HA . 16676 1
625 . 1 1 60 60 ILE HB H 1 1.915 0.009 . . . . . . 60 ILE HB . 16676 1
626 . 1 1 60 60 ILE HD11 H 1 0.891 0.009 . . . . . . 60 ILE QD1 . 16676 1
627 . 1 1 60 60 ILE HD12 H 1 0.891 0.009 . . . . . . 60 ILE QD1 . 16676 1
628 . 1 1 60 60 ILE HD13 H 1 0.891 0.009 . . . . . . 60 ILE QD1 . 16676 1
629 . 1 1 60 60 ILE HG12 H 1 1.902 0.003 . . . . . . 60 ILE HG12 . 16676 1
630 . 1 1 60 60 ILE HG13 H 1 0.733 0.008 . . . . . . 60 ILE HG13 . 16676 1
631 . 1 1 60 60 ILE HG21 H 1 0.94 0.01 . . . . . . 60 ILE QG2 . 16676 1
632 . 1 1 60 60 ILE HG22 H 1 0.94 0.01 . . . . . . 60 ILE QG2 . 16676 1
633 . 1 1 60 60 ILE HG23 H 1 0.94 0.01 . . . . . . 60 ILE QG2 . 16676 1
634 . 1 1 60 60 ILE C C 13 178.763 0 . . . . . . 60 ILE CO . 16676 1
635 . 1 1 60 60 ILE CA C 13 66.028 0.005 . . . . . . 60 ILE CA . 16676 1
636 . 1 1 60 60 ILE CB C 13 38.484 0.047 . . . . . . 60 ILE CB . 16676 1
637 . 1 1 60 60 ILE CD1 C 13 15.473 0 . . . . . . 60 ILE CD1 . 16676 1
638 . 1 1 60 60 ILE CG1 C 13 30.669 0.069 . . . . . . 60 ILE CG1 . 16676 1
639 . 1 1 60 60 ILE CG2 C 13 17.562 0 . . . . . . 60 ILE CG2 . 16676 1
640 . 1 1 60 60 ILE N N 15 119.77 0.043 . . . . . . 60 ILE N . 16676 1
641 . 1 1 61 61 LYS H H 1 7.816 0.006 . . . . . . 61 LYS HN . 16676 1
642 . 1 1 61 61 LYS HA H 1 4.067 0.006 . . . . . . 61 LYS HA . 16676 1
643 . 1 1 61 61 LYS HB2 H 1 1.925 0.009 . . . . . . 61 LYS QB . 16676 1
644 . 1 1 61 61 LYS HB3 H 1 1.925 0.009 . . . . . . 61 LYS QB . 16676 1
645 . 1 1 61 61 LYS HE2 H 1 2.95 0.01 . . . . . . 61 LYS QE . 16676 1
646 . 1 1 61 61 LYS HE3 H 1 2.95 0.01 . . . . . . 61 LYS QE . 16676 1
647 . 1 1 61 61 LYS HG2 H 1 1.6 0.001 . . . . . . 61 LYS HG2 . 16676 1
648 . 1 1 61 61 LYS HG3 H 1 1.459 0.012 . . . . . . 61 LYS HG3 . 16676 1
649 . 1 1 61 61 LYS C C 13 177.802 0 . . . . . . 61 LYS CO . 16676 1
650 . 1 1 61 61 LYS CA C 13 59.166 0.047 . . . . . . 61 LYS CA . 16676 1
651 . 1 1 61 61 LYS CB C 13 32.498 0.011 . . . . . . 61 LYS CB . 16676 1
652 . 1 1 61 61 LYS CD C 13 29.497 0 . . . . . . 61 LYS CD . 16676 1
653 . 1 1 61 61 LYS CE C 13 42.057 0 . . . . . . 61 LYS CE . 16676 1
654 . 1 1 61 61 LYS CG C 13 25.07 0 . . . . . . 61 LYS CG . 16676 1
655 . 1 1 61 61 LYS N N 15 119.669 0.026 . . . . . . 61 LYS N . 16676 1
656 . 1 1 62 62 ASN H H 1 7.512 0.008 . . . . . . 62 ASN HN . 16676 1
657 . 1 1 62 62 ASN HA H 1 4.792 0.007 . . . . . . 62 ASN HA . 16676 1
658 . 1 1 62 62 ASN HB2 H 1 2.991 0.008 . . . . . . 62 ASN HB2 . 16676 1
659 . 1 1 62 62 ASN HB3 H 1 2.677 0.004 . . . . . . 62 ASN HB3 . 16676 1
660 . 1 1 62 62 ASN HD21 H 1 7.114 0.008 . . . . . . 62 ASN HD21 . 16676 1
661 . 1 1 62 62 ASN HD22 H 1 7.578 0.01 . . . . . . 62 ASN HD22 . 16676 1
662 . 1 1 62 62 ASN C C 13 174.357 0 . . . . . . 62 ASN CO . 16676 1
663 . 1 1 62 62 ASN CA C 13 53.307 0.005 . . . . . . 62 ASN CA . 16676 1
664 . 1 1 62 62 ASN CB C 13 39.857 0.028 . . . . . . 62 ASN CB . 16676 1
665 . 1 1 62 62 ASN N N 15 114.492 0.02 . . . . . . 62 ASN N . 16676 1
666 . 1 1 62 62 ASN ND2 N 15 114.351 0.013 . . . . . . 62 ASN ND2 . 16676 1
667 . 1 1 63 63 ALA H H 1 7.579 0.006 . . . . . . 63 ALA HN . 16676 1
668 . 1 1 63 63 ALA HA H 1 4.742 0.01 . . . . . . 63 ALA HA . 16676 1
669 . 1 1 63 63 ALA HB1 H 1 1.561 0.005 . . . . . . 63 ALA QB . 16676 1
670 . 1 1 63 63 ALA HB2 H 1 1.561 0.005 . . . . . . 63 ALA QB . 16676 1
671 . 1 1 63 63 ALA HB3 H 1 1.561 0.005 . . . . . . 63 ALA QB . 16676 1
672 . 1 1 63 63 ALA CA C 13 50.89 0.034 . . . . . . 63 ALA CA . 16676 1
673 . 1 1 63 63 ALA CB C 13 17.813 0.073 . . . . . . 63 ALA CB . 16676 1
674 . 1 1 63 63 ALA N N 15 125.843 0.027 . . . . . . 63 ALA N . 16676 1
675 . 1 1 64 64 PRO CA C 13 62.932 0 . . . . . . 64 PRO CA . 16676 1
676 . 1 1 64 64 PRO CB C 13 32.121 0 . . . . . . 64 PRO CB . 16676 1
677 . 1 1 64 64 PRO CD C 13 50.482 0 . . . . . . 64 PRO CD . 16676 1
678 . 1 1 64 64 PRO CG C 13 27.544 0 . . . . . . 64 PRO CG . 16676 1
679 . 1 1 65 65 ARG H H 1 8.477 0.007 . . . . . . 65 ARG HN . 16676 1
680 . 1 1 65 65 ARG HA H 1 4.348 0.013 . . . . . . 65 ARG HA . 16676 1
681 . 1 1 65 65 ARG HE H 1 6.687 0.007 . . . . . . 65 ARG HE . 16676 1
682 . 1 1 65 65 ARG N N 15 123.305 0.013 . . . . . . 65 ARG N . 16676 1
683 . 1 1 65 65 ARG NE N 15 116.737 0.032 . . . . . . 65 ARG NE . 16676 1
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