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 15592
_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' . . . 15592 1
2 '3D 1H-15N TOCSY' . . . 15592 1
3 '3D 1H-15N NOESY' . . . 15592 1
4 '2D 1H-13C HSQC' . . . 15592 1
5 '3D HNCACB' . . . 15592 1
6 '3D CBCA(CO)NH' . . . 15592 1
7 '3D HCCH-TOCSY' . . . 15592 1
8 '3D 1H-13C NOESY' . . . 15592 1
9 '3D HNCO' . . . 15592 1
10 '3D HN(CA)CO' . . . 15592 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
3 $CcpNMR . . 15592 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA2 H 1 3.874 0.000 . 1 . . . . 1 GLY HA2 . 15592 1
2 . 1 1 1 1 GLY CA C 13 43.274 0.000 . 1 . . . . 1 GLY CA . 15592 1
3 . 1 1 2 2 SER HA H 1 4.833 0.002 . 1 . . . . 2 SER HA . 15592 1
4 . 1 1 2 2 SER HB2 H 1 3.739 0.034 . 2 . . . . 2 SER HB2 . 15592 1
5 . 1 1 2 2 SER HB3 H 1 3.911 0.010 . 2 . . . . 2 SER HB3 . 15592 1
6 . 1 1 2 2 SER CA C 13 56.726 0.157 . 1 . . . . 2 SER CA . 15592 1
7 . 1 1 2 2 SER CB C 13 62.829 0.008 . 1 . . . . 2 SER CB . 15592 1
8 . 1 1 3 3 PRO HA H 1 4.754 0.010 . 1 . . . . 3 PRO HA . 15592 1
9 . 1 1 3 3 PRO HB2 H 1 1.964 0.004 . 2 . . . . 3 PRO HB2 . 15592 1
10 . 1 1 3 3 PRO HB3 H 1 2.403 0.006 . 2 . . . . 3 PRO HB3 . 15592 1
11 . 1 1 3 3 PRO HD2 H 1 3.823 0.007 . 2 . . . . 3 PRO HD2 . 15592 1
12 . 1 1 3 3 PRO HD3 H 1 3.955 0.006 . 2 . . . . 3 PRO HD3 . 15592 1
13 . 1 1 3 3 PRO HG2 H 1 2.060 0.002 . 1 . . . . 3 PRO HG2 . 15592 1
14 . 1 1 3 3 PRO CA C 13 61.662 0.116 . 1 . . . . 3 PRO CA . 15592 1
15 . 1 1 3 3 PRO CB C 13 30.795 0.424 . 1 . . . . 3 PRO CB . 15592 1
16 . 1 1 3 3 PRO CD C 13 50.858 0.292 . 1 . . . . 3 PRO CD . 15592 1
17 . 1 1 3 3 PRO CG C 13 27.245 0.222 . 1 . . . . 3 PRO CG . 15592 1
18 . 1 1 4 4 PRO HA H 1 4.429 0.008 . 1 . . . . 4 PRO HA . 15592 1
19 . 1 1 4 4 PRO HB2 H 1 1.945 0.007 . 2 . . . . 4 PRO HB2 . 15592 1
20 . 1 1 4 4 PRO HB3 H 1 2.334 0.009 . 2 . . . . 4 PRO HB3 . 15592 1
21 . 1 1 4 4 PRO HD2 H 1 3.713 0.017 . 2 . . . . 4 PRO HD2 . 15592 1
22 . 1 1 4 4 PRO HD3 H 1 3.887 0.006 . 2 . . . . 4 PRO HD3 . 15592 1
23 . 1 1 4 4 PRO HG2 H 1 2.077 0.005 . 1 . . . . 4 PRO HG2 . 15592 1
24 . 1 1 4 4 PRO C C 13 177.069 0.020 . 1 . . . . 4 PRO C . 15592 1
25 . 1 1 4 4 PRO CA C 13 63.297 0.215 . 1 . . . . 4 PRO CA . 15592 1
26 . 1 1 4 4 PRO CB C 13 31.745 0.150 . 1 . . . . 4 PRO CB . 15592 1
27 . 1 1 4 4 PRO CD C 13 50.309 0.087 . 1 . . . . 4 PRO CD . 15592 1
28 . 1 1 4 4 PRO CG C 13 27.104 0.041 . 1 . . . . 4 PRO CG . 15592 1
29 . 1 1 5 5 GLU H H 1 8.560 0.010 . 1 . . . . 5 GLU H . 15592 1
30 . 1 1 5 5 GLU HA H 1 4.219 0.010 . 1 . . . . 5 GLU HA . 15592 1
31 . 1 1 5 5 GLU HB2 H 1 1.973 0.040 . 1 . . . . 5 GLU HB2 . 15592 1
32 . 1 1 5 5 GLU HG2 H 1 2.291 0.008 . 1 . . . . 5 GLU HG2 . 15592 1
33 . 1 1 5 5 GLU C C 13 175.967 0.034 . 1 . . . . 5 GLU C . 15592 1
34 . 1 1 5 5 GLU CA C 13 56.519 0.120 . 1 . . . . 5 GLU CA . 15592 1
35 . 1 1 5 5 GLU CB C 13 29.754 0.051 . 1 . . . . 5 GLU CB . 15592 1
36 . 1 1 5 5 GLU CG C 13 36.132 0.148 . 1 . . . . 5 GLU CG . 15592 1
37 . 1 1 5 5 GLU N N 15 120.085 0.094 . 1 . . . . 5 GLU N . 15592 1
38 . 1 1 6 6 ALA H H 1 8.147 0.011 . 1 . . . . 6 ALA H . 15592 1
39 . 1 1 6 6 ALA HA H 1 4.315 0.008 . 1 . . . . 6 ALA HA . 15592 1
40 . 1 1 6 6 ALA HB1 H 1 1.333 0.011 . 1 . . . . 6 ALA HB . 15592 1
41 . 1 1 6 6 ALA HB2 H 1 1.333 0.011 . 1 . . . . 6 ALA HB . 15592 1
42 . 1 1 6 6 ALA HB3 H 1 1.333 0.011 . 1 . . . . 6 ALA HB . 15592 1
43 . 1 1 6 6 ALA C C 13 176.456 0.031 . 1 . . . . 6 ALA C . 15592 1
44 . 1 1 6 6 ALA CA C 13 51.518 0.196 . 1 . . . . 6 ALA CA . 15592 1
45 . 1 1 6 6 ALA CB C 13 19.771 0.500 . 1 . . . . 6 ALA CB . 15592 1
46 . 1 1 6 6 ALA N N 15 124.343 0.168 . 1 . . . . 6 ALA N . 15592 1
47 . 1 1 7 7 ASP H H 1 8.302 0.010 . 1 . . . . 7 ASP H . 15592 1
48 . 1 1 7 7 ASP HA H 1 4.739 0.018 . 1 . . . . 7 ASP HA . 15592 1
49 . 1 1 7 7 ASP HB2 H 1 2.592 0.023 . 1 . . . . 7 ASP HB2 . 15592 1
50 . 1 1 7 7 ASP C C 13 175.588 0.000 . 1 . . . . 7 ASP C . 15592 1
51 . 1 1 7 7 ASP CA C 13 51.948 0.258 . 1 . . . . 7 ASP CA . 15592 1
52 . 1 1 7 7 ASP CB C 13 42.093 0.185 . 1 . . . . 7 ASP CB . 15592 1
53 . 1 1 7 7 ASP N N 15 123.019 0.090 . 1 . . . . 7 ASP N . 15592 1
54 . 1 1 8 8 PRO HA H 1 4.216 0.008 . 1 . . . . 8 PRO HA . 15592 1
55 . 1 1 8 8 PRO HB2 H 1 1.975 0.019 . 2 . . . . 8 PRO HB2 . 15592 1
56 . 1 1 8 8 PRO HB3 H 1 2.388 0.012 . 2 . . . . 8 PRO HB3 . 15592 1
57 . 1 1 8 8 PRO HD2 H 1 3.711 0.005 . 2 . . . . 8 PRO HD2 . 15592 1
58 . 1 1 8 8 PRO HD3 H 1 3.839 0.014 . 2 . . . . 8 PRO HD3 . 15592 1
59 . 1 1 8 8 PRO HG2 H 1 2.072 0.008 . 1 . . . . 8 PRO HG2 . 15592 1
60 . 1 1 8 8 PRO C C 13 178.721 0.015 . 1 . . . . 8 PRO C . 15592 1
61 . 1 1 8 8 PRO CA C 13 64.935 0.366 . 1 . . . . 8 PRO CA . 15592 1
62 . 1 1 8 8 PRO CB C 13 31.855 0.228 . 1 . . . . 8 PRO CB . 15592 1
63 . 1 1 8 8 PRO CD C 13 50.275 0.058 . 1 . . . . 8 PRO CD . 15592 1
64 . 1 1 8 8 PRO CG C 13 27.159 0.012 . 1 . . . . 8 PRO CG . 15592 1
65 . 1 1 9 9 ARG H H 1 8.749 0.010 . 1 . . . . 9 ARG H . 15592 1
66 . 1 1 9 9 ARG HA H 1 4.002 0.014 . 1 . . . . 9 ARG HA . 15592 1
67 . 1 1 9 9 ARG HB2 H 1 1.101 0.009 . 2 . . . . 9 ARG HB2 . 15592 1
68 . 1 1 9 9 ARG HB3 H 1 1.390 0.009 . 2 . . . . 9 ARG HB3 . 15592 1
69 . 1 1 9 9 ARG HD2 H 1 3.139 0.006 . 2 . . . . 9 ARG HD2 . 15592 1
70 . 1 1 9 9 ARG HD3 H 1 3.290 0.003 . 2 . . . . 9 ARG HD3 . 15592 1
71 . 1 1 9 9 ARG HE H 1 7.500 0.002 . 1 . . . . 9 ARG HE . 15592 1
72 . 1 1 9 9 ARG HG2 H 1 1.635 0.013 . 1 . . . . 9 ARG HG2 . 15592 1
73 . 1 1 9 9 ARG C C 13 179.679 0.022 . 1 . . . . 9 ARG C . 15592 1
74 . 1 1 9 9 ARG CA C 13 58.060 0.310 . 1 . . . . 9 ARG CA . 15592 1
75 . 1 1 9 9 ARG CB C 13 29.697 0.191 . 1 . . . . 9 ARG CB . 15592 1
76 . 1 1 9 9 ARG CD C 13 43.448 0.109 . 1 . . . . 9 ARG CD . 15592 1
77 . 1 1 9 9 ARG CG C 13 26.405 0.049 . 1 . . . . 9 ARG CG . 15592 1
78 . 1 1 9 9 ARG N N 15 117.151 0.153 . 1 . . . . 9 ARG N . 15592 1
79 . 1 1 9 9 ARG NE N 15 124.793 0.141 . 1 . . . . 9 ARG NE . 15592 1
80 . 1 1 10 10 LEU H H 1 7.240 0.013 . 1 . . . . 10 LEU H . 15592 1
81 . 1 1 10 10 LEU HA H 1 3.875 0.014 . 1 . . . . 10 LEU HA . 15592 1
82 . 1 1 10 10 LEU HB2 H 1 1.558 0.015 . 2 . . . . 10 LEU HB2 . 15592 1
83 . 1 1 10 10 LEU HB3 H 1 2.071 0.006 . 2 . . . . 10 LEU HB3 . 15592 1
84 . 1 1 10 10 LEU HD11 H 1 1.093 0.007 . 2 . . . . 10 LEU HD1 . 15592 1
85 . 1 1 10 10 LEU HD12 H 1 1.093 0.007 . 2 . . . . 10 LEU HD1 . 15592 1
86 . 1 1 10 10 LEU HD13 H 1 1.093 0.007 . 2 . . . . 10 LEU HD1 . 15592 1
87 . 1 1 10 10 LEU HD21 H 1 1.107 0.006 . 2 . . . . 10 LEU HD2 . 15592 1
88 . 1 1 10 10 LEU HD22 H 1 1.107 0.006 . 2 . . . . 10 LEU HD2 . 15592 1
89 . 1 1 10 10 LEU HD23 H 1 1.107 0.006 . 2 . . . . 10 LEU HD2 . 15592 1
90 . 1 1 10 10 LEU HG H 1 0.768 0.008 . 1 . . . . 10 LEU HG . 15592 1
91 . 1 1 10 10 LEU C C 13 176.907 0.042 . 1 . . . . 10 LEU C . 15592 1
92 . 1 1 10 10 LEU CA C 13 57.421 0.153 . 1 . . . . 10 LEU CA . 15592 1
93 . 1 1 10 10 LEU CB C 13 40.440 0.283 . 1 . . . . 10 LEU CB . 15592 1
94 . 1 1 10 10 LEU CD1 C 13 25.312 0.225 . 2 . . . . 10 LEU CD1 . 15592 1
95 . 1 1 10 10 LEU CD2 C 13 22.978 0.243 . 2 . . . . 10 LEU CD2 . 15592 1
96 . 1 1 10 10 LEU CG C 13 26.555 0.000 . 1 . . . . 10 LEU CG . 15592 1
97 . 1 1 10 10 LEU N N 15 121.323 0.144 . 1 . . . . 10 LEU N . 15592 1
98 . 1 1 11 11 ILE H H 1 7.405 0.013 . 1 . . . . 11 ILE H . 15592 1
99 . 1 1 11 11 ILE HA H 1 3.574 0.007 . 1 . . . . 11 ILE HA . 15592 1
100 . 1 1 11 11 ILE HB H 1 1.866 0.011 . 1 . . . . 11 ILE HB . 15592 1
101 . 1 1 11 11 ILE HD11 H 1 0.785 0.009 . 1 . . . . 11 ILE HD1 . 15592 1
102 . 1 1 11 11 ILE HD12 H 1 0.785 0.009 . 1 . . . . 11 ILE HD1 . 15592 1
103 . 1 1 11 11 ILE HD13 H 1 0.785 0.009 . 1 . . . . 11 ILE HD1 . 15592 1
104 . 1 1 11 11 ILE HG12 H 1 1.245 0.006 . 2 . . . . 11 ILE HG12 . 15592 1
105 . 1 1 11 11 ILE HG13 H 1 1.488 0.008 . 2 . . . . 11 ILE HG13 . 15592 1
106 . 1 1 11 11 ILE HG21 H 1 0.904 0.007 . 1 . . . . 11 ILE HG2 . 15592 1
107 . 1 1 11 11 ILE HG22 H 1 0.904 0.007 . 1 . . . . 11 ILE HG2 . 15592 1
108 . 1 1 11 11 ILE HG23 H 1 0.904 0.007 . 1 . . . . 11 ILE HG2 . 15592 1
109 . 1 1 11 11 ILE C C 13 179.095 0.029 . 1 . . . . 11 ILE C . 15592 1
110 . 1 1 11 11 ILE CA C 13 63.935 0.113 . 1 . . . . 11 ILE CA . 15592 1
111 . 1 1 11 11 ILE CB C 13 37.093 0.174 . 1 . . . . 11 ILE CB . 15592 1
112 . 1 1 11 11 ILE CD1 C 13 11.599 0.136 . 1 . . . . 11 ILE CD1 . 15592 1
113 . 1 1 11 11 ILE CG1 C 13 27.838 0.129 . 1 . . . . 11 ILE CG1 . 15592 1
114 . 1 1 11 11 ILE CG2 C 13 16.630 0.239 . 1 . . . . 11 ILE CG2 . 15592 1
115 . 1 1 11 11 ILE N N 15 117.083 0.195 . 1 . . . . 11 ILE N . 15592 1
116 . 1 1 12 12 GLU H H 1 7.861 0.007 . 1 . . . . 12 GLU H . 15592 1
117 . 1 1 12 12 GLU HA H 1 4.094 0.011 . 1 . . . . 12 GLU HA . 15592 1
118 . 1 1 12 12 GLU HB2 H 1 2.007 0.003 . 2 . . . . 12 GLU HB2 . 15592 1
119 . 1 1 12 12 GLU HB3 H 1 2.072 0.016 . 2 . . . . 12 GLU HB3 . 15592 1
120 . 1 1 12 12 GLU HG2 H 1 2.219 0.014 . 2 . . . . 12 GLU HG2 . 15592 1
121 . 1 1 12 12 GLU HG3 H 1 2.275 0.020 . 2 . . . . 12 GLU HG3 . 15592 1
122 . 1 1 12 12 GLU C C 13 178.343 0.052 . 1 . . . . 12 GLU C . 15592 1
123 . 1 1 12 12 GLU CA C 13 59.555 0.187 . 1 . . . . 12 GLU CA . 15592 1
124 . 1 1 12 12 GLU CB C 13 29.925 0.076 . 1 . . . . 12 GLU CB . 15592 1
125 . 1 1 12 12 GLU CG C 13 35.544 0.013 . 1 . . . . 12 GLU CG . 15592 1
126 . 1 1 12 12 GLU N N 15 119.217 0.068 . 1 . . . . 12 GLU N . 15592 1
127 . 1 1 13 13 SER H H 1 7.883 0.005 . 1 . . . . 13 SER H . 15592 1
128 . 1 1 13 13 SER HA H 1 4.335 0.009 . 1 . . . . 13 SER HA . 15592 1
129 . 1 1 13 13 SER HB2 H 1 3.841 0.014 . 1 . . . . 13 SER HB2 . 15592 1
130 . 1 1 13 13 SER C C 13 176.446 0.000 . 1 . . . . 13 SER C . 15592 1
131 . 1 1 13 13 SER CA C 13 61.969 0.155 . 1 . . . . 13 SER CA . 15592 1
132 . 1 1 13 13 SER CB C 13 63.484 0.114 . 1 . . . . 13 SER CB . 15592 1
133 . 1 1 13 13 SER N N 15 115.630 0.168 . 1 . . . . 13 SER N . 15592 1
134 . 1 1 14 14 LEU H H 1 8.937 0.010 . 1 . . . . 14 LEU H . 15592 1
135 . 1 1 14 14 LEU HA H 1 3.767 0.014 . 1 . . . . 14 LEU HA . 15592 1
136 . 1 1 14 14 LEU HB2 H 1 1.428 0.007 . 2 . . . . 14 LEU HB2 . 15592 1
137 . 1 1 14 14 LEU HB3 H 1 1.728 0.015 . 2 . . . . 14 LEU HB3 . 15592 1
138 . 1 1 14 14 LEU HD11 H 1 0.635 0.010 . 2 . . . . 14 LEU HD1 . 15592 1
139 . 1 1 14 14 LEU HD12 H 1 0.635 0.010 . 2 . . . . 14 LEU HD1 . 15592 1
140 . 1 1 14 14 LEU HD13 H 1 0.635 0.010 . 2 . . . . 14 LEU HD1 . 15592 1
141 . 1 1 14 14 LEU HD21 H 1 0.750 0.017 . 2 . . . . 14 LEU HD2 . 15592 1
142 . 1 1 14 14 LEU HD22 H 1 0.750 0.017 . 2 . . . . 14 LEU HD2 . 15592 1
143 . 1 1 14 14 LEU HD23 H 1 0.750 0.017 . 2 . . . . 14 LEU HD2 . 15592 1
144 . 1 1 14 14 LEU HG H 1 1.436 0.006 . 1 . . . . 14 LEU HG . 15592 1
145 . 1 1 14 14 LEU C C 13 178.649 0.000 . 1 . . . . 14 LEU C . 15592 1
146 . 1 1 14 14 LEU CA C 13 58.005 0.376 . 1 . . . . 14 LEU CA . 15592 1
147 . 1 1 14 14 LEU CB C 13 42.370 0.234 . 1 . . . . 14 LEU CB . 15592 1
148 . 1 1 14 14 LEU CD1 C 13 23.327 0.161 . 2 . . . . 14 LEU CD1 . 15592 1
149 . 1 1 14 14 LEU CD2 C 13 23.837 0.087 . 2 . . . . 14 LEU CD2 . 15592 1
150 . 1 1 14 14 LEU CG C 13 26.611 0.023 . 1 . . . . 14 LEU CG . 15592 1
151 . 1 1 14 14 LEU N N 15 124.219 0.099 . 1 . . . . 14 LEU N . 15592 1
152 . 1 1 15 15 SER H H 1 7.986 0.005 . 1 . . . . 15 SER H . 15592 1
153 . 1 1 15 15 SER HA H 1 4.076 0.007 . 1 . . . . 15 SER HA . 15592 1
154 . 1 1 15 15 SER HB2 H 1 4.034 0.007 . 1 . . . . 15 SER HB2 . 15592 1
155 . 1 1 15 15 SER C C 13 177.978 0.000 . 1 . . . . 15 SER C . 15592 1
156 . 1 1 15 15 SER CA C 13 61.733 0.000 . 1 . . . . 15 SER CA . 15592 1
157 . 1 1 15 15 SER CB C 13 62.549 0.000 . 1 . . . . 15 SER CB . 15592 1
158 . 1 1 15 15 SER N N 15 113.092 0.099 . 1 . . . . 15 SER N . 15592 1
159 . 1 1 16 16 GLN H H 1 7.950 0.012 . 1 . . . . 16 GLN H . 15592 1
160 . 1 1 16 16 GLN HA H 1 4.107 0.010 . 1 . . . . 16 GLN HA . 15592 1
161 . 1 1 16 16 GLN HB2 H 1 1.855 0.010 . 1 . . . . 16 GLN HB2 . 15592 1
162 . 1 1 16 16 GLN HE21 H 1 6.600 0.007 . 2 . . . . 16 GLN HE21 . 15592 1
163 . 1 1 16 16 GLN HE22 H 1 7.300 0.003 . 2 . . . . 16 GLN HE22 . 15592 1
164 . 1 1 16 16 GLN HG2 H 1 2.451 0.012 . 2 . . . . 16 GLN HG2 . 15592 1
165 . 1 1 16 16 GLN HG3 H 1 2.616 0.016 . 2 . . . . 16 GLN HG3 . 15592 1
166 . 1 1 16 16 GLN C C 13 179.396 0.012 . 1 . . . . 16 GLN C . 15592 1
167 . 1 1 16 16 GLN CA C 13 59.015 0.120 . 1 . . . . 16 GLN CA . 15592 1
168 . 1 1 16 16 GLN CB C 13 27.828 0.055 . 1 . . . . 16 GLN CB . 15592 1
169 . 1 1 16 16 GLN CG C 13 33.834 0.216 . 1 . . . . 16 GLN CG . 15592 1
170 . 1 1 16 16 GLN N N 15 120.855 0.092 . 1 . . . . 16 GLN N . 15592 1
171 . 1 1 16 16 GLN NE2 N 15 109.196 0.112 . 1 . . . . 16 GLN NE2 . 15592 1
172 . 1 1 17 17 MET H H 1 8.154 0.009 . 1 . . . . 17 MET H . 15592 1
173 . 1 1 17 17 MET HA H 1 4.307 0.006 . 1 . . . . 17 MET HA . 15592 1
174 . 1 1 17 17 MET HB2 H 1 2.063 0.016 . 1 . . . . 17 MET HB2 . 15592 1
175 . 1 1 17 17 MET HE1 H 1 1.075 0.006 . 1 . . . . 17 MET HE . 15592 1
176 . 1 1 17 17 MET HE2 H 1 1.075 0.006 . 1 . . . . 17 MET HE . 15592 1
177 . 1 1 17 17 MET HE3 H 1 1.075 0.006 . 1 . . . . 17 MET HE . 15592 1
178 . 1 1 17 17 MET HG2 H 1 2.246 0.008 . 2 . . . . 17 MET HG2 . 15592 1
179 . 1 1 17 17 MET HG3 H 1 2.676 0.006 . 2 . . . . 17 MET HG3 . 15592 1
180 . 1 1 17 17 MET C C 13 179.342 0.000 . 1 . . . . 17 MET C . 15592 1
181 . 1 1 17 17 MET CA C 13 59.714 0.216 . 1 . . . . 17 MET CA . 15592 1
182 . 1 1 17 17 MET CB C 13 31.821 0.108 . 1 . . . . 17 MET CB . 15592 1
183 . 1 1 17 17 MET CE C 13 16.331 0.038 . 1 . . . . 17 MET CE . 15592 1
184 . 1 1 17 17 MET CG C 13 34.021 0.172 . 1 . . . . 17 MET CG . 15592 1
185 . 1 1 17 17 MET N N 15 118.142 0.118 . 1 . . . . 17 MET N . 15592 1
186 . 1 1 18 18 LEU H H 1 9.103 0.012 . 1 . . . . 18 LEU H . 15592 1
187 . 1 1 18 18 LEU HA H 1 4.485 0.011 . 1 . . . . 18 LEU HA . 15592 1
188 . 1 1 18 18 LEU HB2 H 1 1.577 0.007 . 2 . . . . 18 LEU HB2 . 15592 1
189 . 1 1 18 18 LEU HB3 H 1 1.851 0.005 . 2 . . . . 18 LEU HB3 . 15592 1
190 . 1 1 18 18 LEU HD11 H 1 0.787 0.013 . 2 . . . . 18 LEU HD1 . 15592 1
191 . 1 1 18 18 LEU HD12 H 1 0.787 0.013 . 2 . . . . 18 LEU HD1 . 15592 1
192 . 1 1 18 18 LEU HD13 H 1 0.787 0.013 . 2 . . . . 18 LEU HD1 . 15592 1
193 . 1 1 18 18 LEU HD21 H 1 0.799 0.006 . 2 . . . . 18 LEU HD2 . 15592 1
194 . 1 1 18 18 LEU HD22 H 1 0.799 0.006 . 2 . . . . 18 LEU HD2 . 15592 1
195 . 1 1 18 18 LEU HD23 H 1 0.799 0.006 . 2 . . . . 18 LEU HD2 . 15592 1
196 . 1 1 18 18 LEU HG H 1 1.853 0.008 . 1 . . . . 18 LEU HG . 15592 1
197 . 1 1 18 18 LEU C C 13 182.237 0.030 . 1 . . . . 18 LEU C . 15592 1
198 . 1 1 18 18 LEU CA C 13 57.769 0.307 . 1 . . . . 18 LEU CA . 15592 1
199 . 1 1 18 18 LEU CB C 13 40.405 0.327 . 1 . . . . 18 LEU CB . 15592 1
200 . 1 1 18 18 LEU CD1 C 13 23.039 0.180 . 2 . . . . 18 LEU CD1 . 15592 1
201 . 1 1 18 18 LEU CD2 C 13 24.742 0.128 . 2 . . . . 18 LEU CD2 . 15592 1
202 . 1 1 18 18 LEU CG C 13 27.291 0.235 . 1 . . . . 18 LEU CG . 15592 1
203 . 1 1 18 18 LEU N N 15 122.650 0.120 . 1 . . . . 18 LEU N . 15592 1
204 . 1 1 19 19 SER H H 1 7.977 0.010 . 1 . . . . 19 SER H . 15592 1
205 . 1 1 19 19 SER HA H 1 4.303 0.009 . 1 . . . . 19 SER HA . 15592 1
206 . 1 1 19 19 SER HB2 H 1 4.062 0.021 . 1 . . . . 19 SER HB2 . 15592 1
207 . 1 1 19 19 SER C C 13 174.984 0.000 . 1 . . . . 19 SER C . 15592 1
208 . 1 1 19 19 SER CA C 13 61.463 0.058 . 1 . . . . 19 SER CA . 15592 1
209 . 1 1 19 19 SER CB C 13 62.723 0.181 . 1 . . . . 19 SER CB . 15592 1
210 . 1 1 19 19 SER N N 15 117.017 0.179 . 1 . . . . 19 SER N . 15592 1
211 . 1 1 20 20 MET H H 1 7.248 0.018 . 1 . . . . 20 MET H . 15592 1
212 . 1 1 20 20 MET HA H 1 3.682 0.003 . 1 . . . . 20 MET HA . 15592 1
213 . 1 1 20 20 MET HB2 H 1 1.980 0.006 . 2 . . . . 20 MET HB2 . 15592 1
214 . 1 1 20 20 MET HB3 H 1 2.300 0.016 . 2 . . . . 20 MET HB3 . 15592 1
215 . 1 1 20 20 MET HE1 H 1 1.957 0.004 . 1 . . . . 20 MET HE . 15592 1
216 . 1 1 20 20 MET HE2 H 1 1.957 0.004 . 1 . . . . 20 MET HE . 15592 1
217 . 1 1 20 20 MET HE3 H 1 1.957 0.004 . 1 . . . . 20 MET HE . 15592 1
218 . 1 1 20 20 MET HG2 H 1 1.661 0.006 . 2 . . . . 20 MET HG2 . 15592 1
219 . 1 1 20 20 MET HG3 H 1 2.602 0.015 . 2 . . . . 20 MET HG3 . 15592 1
220 . 1 1 20 20 MET C C 13 175.135 0.040 . 1 . . . . 20 MET C . 15592 1
221 . 1 1 20 20 MET CA C 13 56.116 0.136 . 1 . . . . 20 MET CA . 15592 1
222 . 1 1 20 20 MET CB C 13 33.349 0.019 . 1 . . . . 20 MET CB . 15592 1
223 . 1 1 20 20 MET CE C 13 18.047 0.303 . 1 . . . . 20 MET CE . 15592 1
224 . 1 1 20 20 MET CG C 13 31.582 0.268 . 1 . . . . 20 MET CG . 15592 1
225 . 1 1 20 20 MET N N 15 118.004 0.136 . 1 . . . . 20 MET N . 15592 1
226 . 1 1 21 21 GLY H H 1 7.665 0.006 . 1 . . . . 21 GLY H . 15592 1
227 . 1 1 21 21 GLY HA2 H 1 3.616 0.000 . 2 . . . . 21 GLY HA2 . 15592 1
228 . 1 1 21 21 GLY HA3 H 1 3.649 0.002 . 2 . . . . 21 GLY HA3 . 15592 1
229 . 1 1 21 21 GLY C C 13 174.935 0.041 . 1 . . . . 21 GLY C . 15592 1
230 . 1 1 21 21 GLY CA C 13 45.080 0.033 . 1 . . . . 21 GLY CA . 15592 1
231 . 1 1 21 21 GLY N N 15 103.618 0.128 . 1 . . . . 21 GLY N . 15592 1
232 . 1 1 22 22 PHE H H 1 7.411 0.008 . 1 . . . . 22 PHE H . 15592 1
233 . 1 1 22 22 PHE HA H 1 4.585 0.009 . 1 . . . . 22 PHE HA . 15592 1
234 . 1 1 22 22 PHE HB2 H 1 2.511 0.008 . 2 . . . . 22 PHE HB2 . 15592 1
235 . 1 1 22 22 PHE HB3 H 1 3.218 0.012 . 2 . . . . 22 PHE HB3 . 15592 1
236 . 1 1 22 22 PHE HD1 H 1 7.674 0.005 . 1 . . . . 22 PHE HD . 15592 1
237 . 1 1 22 22 PHE HD2 H 1 7.674 0.005 . 1 . . . . 22 PHE HD . 15592 1
238 . 1 1 22 22 PHE HE1 H 1 7.291 0.005 . 1 . . . . 22 PHE HE . 15592 1
239 . 1 1 22 22 PHE HE2 H 1 7.291 0.005 . 1 . . . . 22 PHE HE . 15592 1
240 . 1 1 22 22 PHE HZ H 1 6.885 0.007 . 1 . . . . 22 PHE HZ . 15592 1
241 . 1 1 22 22 PHE C C 13 173.072 0.035 . 1 . . . . 22 PHE C . 15592 1
242 . 1 1 22 22 PHE CA C 13 59.168 0.166 . 1 . . . . 22 PHE CA . 15592 1
243 . 1 1 22 22 PHE CB C 13 39.718 0.475 . 1 . . . . 22 PHE CB . 15592 1
244 . 1 1 22 22 PHE CD1 C 13 131.859 0.334 . 1 . . . . 22 PHE CD . 15592 1
245 . 1 1 22 22 PHE CD2 C 13 131.859 0.334 . 1 . . . . 22 PHE CD . 15592 1
246 . 1 1 22 22 PHE CE1 C 13 131.972 0.241 . 1 . . . . 22 PHE CE . 15592 1
247 . 1 1 22 22 PHE CE2 C 13 131.972 0.241 . 1 . . . . 22 PHE CE . 15592 1
248 . 1 1 22 22 PHE CZ C 13 129.008 0.292 . 1 . . . . 22 PHE CZ . 15592 1
249 . 1 1 22 22 PHE N N 15 118.245 0.163 . 1 . . . . 22 PHE N . 15592 1
250 . 1 1 23 23 SER H H 1 8.725 0.008 . 1 . . . . 23 SER H . 15592 1
251 . 1 1 23 23 SER HA H 1 4.671 0.007 . 1 . . . . 23 SER HA . 15592 1
252 . 1 1 23 23 SER HB2 H 1 3.940 0.015 . 2 . . . . 23 SER HB2 . 15592 1
253 . 1 1 23 23 SER HB3 H 1 4.115 0.009 . 2 . . . . 23 SER HB3 . 15592 1
254 . 1 1 23 23 SER C C 13 171.971 0.039 . 1 . . . . 23 SER C . 15592 1
255 . 1 1 23 23 SER CA C 13 56.839 0.125 . 1 . . . . 23 SER CA . 15592 1
256 . 1 1 23 23 SER CB C 13 65.509 0.159 . 1 . . . . 23 SER CB . 15592 1
257 . 1 1 23 23 SER N N 15 114.241 0.112 . 1 . . . . 23 SER N . 15592 1
258 . 1 1 24 24 ASP H H 1 8.604 0.014 . 1 . . . . 24 ASP H . 15592 1
259 . 1 1 24 24 ASP HA H 1 4.987 0.014 . 1 . . . . 24 ASP HA . 15592 1
260 . 1 1 24 24 ASP HB2 H 1 1.943 0.009 . 2 . . . . 24 ASP HB2 . 15592 1
261 . 1 1 24 24 ASP HB3 H 1 2.666 0.010 . 2 . . . . 24 ASP HB3 . 15592 1
262 . 1 1 24 24 ASP C C 13 177.661 0.013 . 1 . . . . 24 ASP C . 15592 1
263 . 1 1 24 24 ASP CA C 13 52.317 0.201 . 1 . . . . 24 ASP CA . 15592 1
264 . 1 1 24 24 ASP CB C 13 41.933 0.248 . 1 . . . . 24 ASP CB . 15592 1
265 . 1 1 24 24 ASP N N 15 119.298 0.149 . 1 . . . . 24 ASP N . 15592 1
266 . 1 1 25 25 GLU H H 1 8.951 0.011 . 1 . . . . 25 GLU H . 15592 1
267 . 1 1 25 25 GLU HA H 1 4.272 0.009 . 1 . . . . 25 GLU HA . 15592 1
268 . 1 1 25 25 GLU HB2 H 1 2.178 0.007 . 1 . . . . 25 GLU HB2 . 15592 1
269 . 1 1 25 25 GLU HG2 H 1 2.440 0.011 . 2 . . . . 25 GLU HG2 . 15592 1
270 . 1 1 25 25 GLU HG3 H 1 2.488 0.015 . 2 . . . . 25 GLU HG3 . 15592 1
271 . 1 1 25 25 GLU C C 13 179.579 0.027 . 1 . . . . 25 GLU C . 15592 1
272 . 1 1 25 25 GLU CA C 13 58.673 0.281 . 1 . . . . 25 GLU CA . 15592 1
273 . 1 1 25 25 GLU CB C 13 28.853 0.392 . 1 . . . . 25 GLU CB . 15592 1
274 . 1 1 25 25 GLU CG C 13 35.678 0.048 . 1 . . . . 25 GLU CG . 15592 1
275 . 1 1 25 25 GLU N N 15 124.061 0.133 . 1 . . . . 25 GLU N . 15592 1
276 . 1 1 26 26 GLY H H 1 9.327 0.006 . 1 . . . . 26 GLY H . 15592 1
277 . 1 1 26 26 GLY HA2 H 1 3.978 0.004 . 2 . . . . 26 GLY HA2 . 15592 1
278 . 1 1 26 26 GLY HA3 H 1 4.235 0.006 . 2 . . . . 26 GLY HA3 . 15592 1
279 . 1 1 26 26 GLY C C 13 175.244 0.000 . 1 . . . . 26 GLY C . 15592 1
280 . 1 1 26 26 GLY CA C 13 46.038 0.074 . 1 . . . . 26 GLY CA . 15592 1
281 . 1 1 26 26 GLY N N 15 116.154 0.094 . 1 . . . . 26 GLY N . 15592 1
282 . 1 1 27 27 GLY H H 1 8.453 0.008 . 1 . . . . 27 GLY H . 15592 1
283 . 1 1 27 27 GLY HA2 H 1 4.070 0.010 . 2 . . . . 27 GLY HA2 . 15592 1
284 . 1 1 27 27 GLY HA3 H 1 4.142 0.012 . 2 . . . . 27 GLY HA3 . 15592 1
285 . 1 1 27 27 GLY C C 13 176.144 0.031 . 1 . . . . 27 GLY C . 15592 1
286 . 1 1 27 27 GLY CA C 13 46.241 0.147 . 1 . . . . 27 GLY CA . 15592 1
287 . 1 1 27 27 GLY N N 15 108.403 0.176 . 1 . . . . 27 GLY N . 15592 1
288 . 1 1 28 28 TRP H H 1 7.113 0.013 . 1 . . . . 28 TRP H . 15592 1
289 . 1 1 28 28 TRP HA H 1 4.191 0.013 . 1 . . . . 28 TRP HA . 15592 1
290 . 1 1 28 28 TRP HB2 H 1 3.275 0.010 . 2 . . . . 28 TRP HB2 . 15592 1
291 . 1 1 28 28 TRP HB3 H 1 3.600 0.009 . 2 . . . . 28 TRP HB3 . 15592 1
292 . 1 1 28 28 TRP HD1 H 1 8.207 0.006 . 1 . . . . 28 TRP HD1 . 15592 1
293 . 1 1 28 28 TRP HE1 H 1 10.178 0.005 . 1 . . . . 28 TRP HE1 . 15592 1
294 . 1 1 28 28 TRP HE3 H 1 7.425 0.005 . 1 . . . . 28 TRP HE3 . 15592 1
295 . 1 1 28 28 TRP HH2 H 1 7.062 0.009 . 1 . . . . 28 TRP HH2 . 15592 1
296 . 1 1 28 28 TRP HZ2 H 1 7.899 0.010 . 1 . . . . 28 TRP HZ2 . 15592 1
297 . 1 1 28 28 TRP HZ3 H 1 6.917 0.014 . 1 . . . . 28 TRP HZ3 . 15592 1
298 . 1 1 28 28 TRP C C 13 176.546 0.046 . 1 . . . . 28 TRP C . 15592 1
299 . 1 1 28 28 TRP CA C 13 59.964 0.369 . 1 . . . . 28 TRP CA . 15592 1
300 . 1 1 28 28 TRP CB C 13 27.574 0.192 . 1 . . . . 28 TRP CB . 15592 1
301 . 1 1 28 28 TRP CD1 C 13 127.447 0.136 . 1 . . . . 28 TRP CD1 . 15592 1
302 . 1 1 28 28 TRP CE3 C 13 120.393 0.246 . 1 . . . . 28 TRP CE3 . 15592 1
303 . 1 1 28 28 TRP CH2 C 13 123.011 0.310 . 1 . . . . 28 TRP CH2 . 15592 1
304 . 1 1 28 28 TRP CZ2 C 13 115.933 0.255 . 1 . . . . 28 TRP CZ2 . 15592 1
305 . 1 1 28 28 TRP CZ3 C 13 119.201 0.000 . 1 . . . . 28 TRP CZ3 . 15592 1
306 . 1 1 28 28 TRP N N 15 118.507 0.102 . 1 . . . . 28 TRP N . 15592 1
307 . 1 1 28 28 TRP NE1 N 15 132.005 0.124 . 1 . . . . 28 TRP NE1 . 15592 1
308 . 1 1 29 29 LEU H H 1 7.671 0.013 . 1 . . . . 29 LEU H . 15592 1
309 . 1 1 29 29 LEU HA H 1 3.334 0.010 . 1 . . . . 29 LEU HA . 15592 1
310 . 1 1 29 29 LEU HB2 H 1 -0.049 0.018 . 2 . . . . 29 LEU HB2 . 15592 1
311 . 1 1 29 29 LEU HB3 H 1 1.132 0.012 . 2 . . . . 29 LEU HB3 . 15592 1
312 . 1 1 29 29 LEU HD11 H 1 0.353 0.009 . 2 . . . . 29 LEU HD1 . 15592 1
313 . 1 1 29 29 LEU HD12 H 1 0.353 0.009 . 2 . . . . 29 LEU HD1 . 15592 1
314 . 1 1 29 29 LEU HD13 H 1 0.353 0.009 . 2 . . . . 29 LEU HD1 . 15592 1
315 . 1 1 29 29 LEU HD21 H 1 0.369 0.006 . 2 . . . . 29 LEU HD2 . 15592 1
316 . 1 1 29 29 LEU HD22 H 1 0.369 0.006 . 2 . . . . 29 LEU HD2 . 15592 1
317 . 1 1 29 29 LEU HD23 H 1 0.369 0.006 . 2 . . . . 29 LEU HD2 . 15592 1
318 . 1 1 29 29 LEU HG H 1 0.960 0.015 . 1 . . . . 29 LEU HG . 15592 1
319 . 1 1 29 29 LEU C C 13 178.375 0.000 . 1 . . . . 29 LEU C . 15592 1
320 . 1 1 29 29 LEU CA C 13 56.638 0.225 . 1 . . . . 29 LEU CA . 15592 1
321 . 1 1 29 29 LEU CB C 13 40.420 0.252 . 1 . . . . 29 LEU CB . 15592 1
322 . 1 1 29 29 LEU CD1 C 13 22.595 0.367 . 2 . . . . 29 LEU CD1 . 15592 1
323 . 1 1 29 29 LEU CD2 C 13 25.230 0.222 . 2 . . . . 29 LEU CD2 . 15592 1
324 . 1 1 29 29 LEU CG C 13 25.987 0.327 . 1 . . . . 29 LEU CG . 15592 1
325 . 1 1 29 29 LEU N N 15 128.905 0.189 . 1 . . . . 29 LEU N . 15592 1
326 . 1 1 30 30 THR H H 1 8.824 0.011 . 1 . . . . 30 THR H . 15592 1
327 . 1 1 30 30 THR HA H 1 3.513 0.006 . 1 . . . . 30 THR HA . 15592 1
328 . 1 1 30 30 THR HB H 1 4.177 0.007 . 1 . . . . 30 THR HB . 15592 1
329 . 1 1 30 30 THR HG21 H 1 1.108 0.009 . 1 . . . . 30 THR HG2 . 15592 1
330 . 1 1 30 30 THR HG22 H 1 1.108 0.009 . 1 . . . . 30 THR HG2 . 15592 1
331 . 1 1 30 30 THR HG23 H 1 1.108 0.009 . 1 . . . . 30 THR HG2 . 15592 1
332 . 1 1 30 30 THR C C 13 176.236 0.000 . 1 . . . . 30 THR C . 15592 1
333 . 1 1 30 30 THR CA C 13 68.798 0.118 . 1 . . . . 30 THR CA . 15592 1
334 . 1 1 30 30 THR CB C 13 67.791 0.124 . 1 . . . . 30 THR CB . 15592 1
335 . 1 1 30 30 THR CG2 C 13 21.096 0.157 . 1 . . . . 30 THR CG2 . 15592 1
336 . 1 1 30 30 THR N N 15 121.253 0.127 . 1 . . . . 30 THR N . 15592 1
337 . 1 1 31 31 ARG H H 1 7.907 0.007 . 1 . . . . 31 ARG H . 15592 1
338 . 1 1 31 31 ARG HA H 1 4.145 0.008 . 1 . . . . 31 ARG HA . 15592 1
339 . 1 1 31 31 ARG HB2 H 1 1.832 0.005 . 2 . . . . 31 ARG HB2 . 15592 1
340 . 1 1 31 31 ARG HB3 H 1 1.921 0.013 . 2 . . . . 31 ARG HB3 . 15592 1
341 . 1 1 31 31 ARG HD2 H 1 3.216 0.006 . 2 . . . . 31 ARG HD2 . 15592 1
342 . 1 1 31 31 ARG HD3 H 1 3.381 0.017 . 2 . . . . 31 ARG HD3 . 15592 1
343 . 1 1 31 31 ARG HG2 H 1 1.567 0.027 . 1 . . . . 31 ARG HG2 . 15592 1
344 . 1 1 31 31 ARG C C 13 179.124 0.010 . 1 . . . . 31 ARG C . 15592 1
345 . 1 1 31 31 ARG CA C 13 59.395 0.132 . 1 . . . . 31 ARG CA . 15592 1
346 . 1 1 31 31 ARG CB C 13 29.645 0.025 . 1 . . . . 31 ARG CB . 15592 1
347 . 1 1 31 31 ARG CD C 13 43.201 0.131 . 1 . . . . 31 ARG CD . 15592 1
348 . 1 1 31 31 ARG CG C 13 26.937 0.000 . 1 . . . . 31 ARG CG . 15592 1
349 . 1 1 31 31 ARG N N 15 117.247 0.133 . 1 . . . . 31 ARG N . 15592 1
350 . 1 1 32 32 LEU H H 1 7.884 0.008 . 1 . . . . 32 LEU H . 15592 1
351 . 1 1 32 32 LEU HA H 1 4.138 0.007 . 1 . . . . 32 LEU HA . 15592 1
352 . 1 1 32 32 LEU HB2 H 1 1.660 0.012 . 2 . . . . 32 LEU HB2 . 15592 1
353 . 1 1 32 32 LEU HB3 H 1 1.838 0.010 . 2 . . . . 32 LEU HB3 . 15592 1
354 . 1 1 32 32 LEU HD11 H 1 0.980 0.012 . 2 . . . . 32 LEU HD1 . 15592 1
355 . 1 1 32 32 LEU HD12 H 1 0.980 0.012 . 2 . . . . 32 LEU HD1 . 15592 1
356 . 1 1 32 32 LEU HD13 H 1 0.980 0.012 . 2 . . . . 32 LEU HD1 . 15592 1
357 . 1 1 32 32 LEU HD21 H 1 0.991 0.010 . 2 . . . . 32 LEU HD2 . 15592 1
358 . 1 1 32 32 LEU HD22 H 1 0.991 0.010 . 2 . . . . 32 LEU HD2 . 15592 1
359 . 1 1 32 32 LEU HD23 H 1 0.991 0.010 . 2 . . . . 32 LEU HD2 . 15592 1
360 . 1 1 32 32 LEU HG H 1 1.248 0.012 . 1 . . . . 32 LEU HG . 15592 1
361 . 1 1 32 32 LEU C C 13 179.111 0.027 . 1 . . . . 32 LEU C . 15592 1
362 . 1 1 32 32 LEU CA C 13 58.069 0.290 . 1 . . . . 32 LEU CA . 15592 1
363 . 1 1 32 32 LEU CB C 13 41.495 0.238 . 1 . . . . 32 LEU CB . 15592 1
364 . 1 1 32 32 LEU CD1 C 13 23.240 0.140 . 2 . . . . 32 LEU CD1 . 15592 1
365 . 1 1 32 32 LEU CD2 C 13 24.974 0.360 . 2 . . . . 32 LEU CD2 . 15592 1
366 . 1 1 32 32 LEU CG C 13 27.027 0.088 . 1 . . . . 32 LEU CG . 15592 1
367 . 1 1 32 32 LEU N N 15 121.930 0.142 . 1 . . . . 32 LEU N . 15592 1
368 . 1 1 33 33 LEU H H 1 8.727 0.009 . 1 . . . . 33 LEU H . 15592 1
369 . 1 1 33 33 LEU HA H 1 3.529 0.010 . 1 . . . . 33 LEU HA . 15592 1
370 . 1 1 33 33 LEU HB2 H 1 1.057 0.008 . 2 . . . . 33 LEU HB2 . 15592 1
371 . 1 1 33 33 LEU HB3 H 1 1.979 0.017 . 2 . . . . 33 LEU HB3 . 15592 1
372 . 1 1 33 33 LEU HD11 H 1 0.568 0.012 . 2 . . . . 33 LEU HD1 . 15592 1
373 . 1 1 33 33 LEU HD12 H 1 0.568 0.012 . 2 . . . . 33 LEU HD1 . 15592 1
374 . 1 1 33 33 LEU HD13 H 1 0.568 0.012 . 2 . . . . 33 LEU HD1 . 15592 1
375 . 1 1 33 33 LEU HD21 H 1 0.643 0.013 . 2 . . . . 33 LEU HD2 . 15592 1
376 . 1 1 33 33 LEU HD22 H 1 0.643 0.013 . 2 . . . . 33 LEU HD2 . 15592 1
377 . 1 1 33 33 LEU HD23 H 1 0.643 0.013 . 2 . . . . 33 LEU HD2 . 15592 1
378 . 1 1 33 33 LEU HG H 1 1.410 0.010 . 1 . . . . 33 LEU HG . 15592 1
379 . 1 1 33 33 LEU C C 13 179.444 0.000 . 1 . . . . 33 LEU C . 15592 1
380 . 1 1 33 33 LEU CA C 13 58.603 0.265 . 1 . . . . 33 LEU CA . 15592 1
381 . 1 1 33 33 LEU CB C 13 41.774 0.139 . 1 . . . . 33 LEU CB . 15592 1
382 . 1 1 33 33 LEU CD1 C 13 22.172 0.371 . 2 . . . . 33 LEU CD1 . 15592 1
383 . 1 1 33 33 LEU CD2 C 13 24.684 0.236 . 2 . . . . 33 LEU CD2 . 15592 1
384 . 1 1 33 33 LEU CG C 13 27.407 0.096 . 1 . . . . 33 LEU CG . 15592 1
385 . 1 1 33 33 LEU N N 15 118.565 0.051 . 1 . . . . 33 LEU N . 15592 1
386 . 1 1 34 34 GLN H H 1 8.106 0.006 . 1 . . . . 34 GLN H . 15592 1
387 . 1 1 34 34 GLN HA H 1 3.550 0.006 . 1 . . . . 34 GLN HA . 15592 1
388 . 1 1 34 34 GLN HB2 H 1 2.051 0.009 . 2 . . . . 34 GLN HB2 . 15592 1
389 . 1 1 34 34 GLN HB3 H 1 2.395 0.005 . 2 . . . . 34 GLN HB3 . 15592 1
390 . 1 1 34 34 GLN HE21 H 1 6.827 0.009 . 2 . . . . 34 GLN HE21 . 15592 1
391 . 1 1 34 34 GLN HE22 H 1 7.329 0.011 . 2 . . . . 34 GLN HE22 . 15592 1
392 . 1 1 34 34 GLN HG2 H 1 2.529 0.009 . 2 . . . . 34 GLN HG2 . 15592 1
393 . 1 1 34 34 GLN HG3 H 1 2.739 0.005 . 2 . . . . 34 GLN HG3 . 15592 1
394 . 1 1 34 34 GLN C C 13 179.651 0.024 . 1 . . . . 34 GLN C . 15592 1
395 . 1 1 34 34 GLN CA C 13 59.363 0.224 . 1 . . . . 34 GLN CA . 15592 1
396 . 1 1 34 34 GLN CB C 13 28.230 0.394 . 1 . . . . 34 GLN CB . 15592 1
397 . 1 1 34 34 GLN CG C 13 34.374 0.142 . 1 . . . . 34 GLN CG . 15592 1
398 . 1 1 34 34 GLN N N 15 117.861 0.082 . 1 . . . . 34 GLN N . 15592 1
399 . 1 1 34 34 GLN NE2 N 15 110.699 0.130 . 1 . . . . 34 GLN NE2 . 15592 1
400 . 1 1 35 35 THR H H 1 8.146 0.009 . 1 . . . . 35 THR H . 15592 1
401 . 1 1 35 35 THR HA H 1 4.118 0.014 . 1 . . . . 35 THR HA . 15592 1
402 . 1 1 35 35 THR HB H 1 4.381 0.012 . 1 . . . . 35 THR HB . 15592 1
403 . 1 1 35 35 THR HG21 H 1 1.345 0.004 . 1 . . . . 35 THR HG2 . 15592 1
404 . 1 1 35 35 THR HG22 H 1 1.345 0.004 . 1 . . . . 35 THR HG2 . 15592 1
405 . 1 1 35 35 THR HG23 H 1 1.345 0.004 . 1 . . . . 35 THR HG2 . 15592 1
406 . 1 1 35 35 THR C C 13 175.364 0.020 . 1 . . . . 35 THR C . 15592 1
407 . 1 1 35 35 THR CA C 13 65.658 0.193 . 1 . . . . 35 THR CA . 15592 1
408 . 1 1 35 35 THR CB C 13 69.493 0.293 . 1 . . . . 35 THR CB . 15592 1
409 . 1 1 35 35 THR CG2 C 13 21.655 0.226 . 1 . . . . 35 THR CG2 . 15592 1
410 . 1 1 35 35 THR N N 15 114.352 0.178 . 1 . . . . 35 THR N . 15592 1
411 . 1 1 36 36 LYS H H 1 7.489 0.008 . 1 . . . . 36 LYS H . 15592 1
412 . 1 1 36 36 LYS HA H 1 4.526 0.011 . 1 . . . . 36 LYS HA . 15592 1
413 . 1 1 36 36 LYS HB2 H 1 1.549 0.010 . 2 . . . . 36 LYS HB2 . 15592 1
414 . 1 1 36 36 LYS HB3 H 1 2.220 0.013 . 2 . . . . 36 LYS HB3 . 15592 1
415 . 1 1 36 36 LYS HD2 H 1 1.373 0.022 . 2 . . . . 36 LYS HD2 . 15592 1
416 . 1 1 36 36 LYS HD3 H 1 1.568 0.008 . 2 . . . . 36 LYS HD3 . 15592 1
417 . 1 1 36 36 LYS HE2 H 1 2.746 0.004 . 2 . . . . 36 LYS HE2 . 15592 1
418 . 1 1 36 36 LYS HE3 H 1 2.935 0.014 . 2 . . . . 36 LYS HE3 . 15592 1
419 . 1 1 36 36 LYS HG2 H 1 0.954 0.013 . 1 . . . . 36 LYS HG2 . 15592 1
420 . 1 1 36 36 LYS C C 13 176.413 0.032 . 1 . . . . 36 LYS C . 15592 1
421 . 1 1 36 36 LYS CA C 13 52.616 0.141 . 1 . . . . 36 LYS CA . 15592 1
422 . 1 1 36 36 LYS CB C 13 30.131 0.094 . 1 . . . . 36 LYS CB . 15592 1
423 . 1 1 36 36 LYS CD C 13 27.129 0.021 . 1 . . . . 36 LYS CD . 15592 1
424 . 1 1 36 36 LYS CE C 13 42.552 0.249 . 1 . . . . 36 LYS CE . 15592 1
425 . 1 1 36 36 LYS CG C 13 24.775 0.000 . 1 . . . . 36 LYS CG . 15592 1
426 . 1 1 36 36 LYS N N 15 117.515 0.104 . 1 . . . . 36 LYS N . 15592 1
427 . 1 1 37 37 ASN H H 1 7.761 0.010 . 1 . . . . 37 ASN H . 15592 1
428 . 1 1 37 37 ASN HA H 1 3.699 0.009 . 1 . . . . 37 ASN HA . 15592 1
429 . 1 1 37 37 ASN HB2 H 1 2.550 0.009 . 2 . . . . 37 ASN HB2 . 15592 1
430 . 1 1 37 37 ASN HB3 H 1 3.051 0.006 . 2 . . . . 37 ASN HB3 . 15592 1
431 . 1 1 37 37 ASN HD21 H 1 6.836 0.008 . 2 . . . . 37 ASN HD21 . 15592 1
432 . 1 1 37 37 ASN HD22 H 1 7.542 0.008 . 2 . . . . 37 ASN HD22 . 15592 1
433 . 1 1 37 37 ASN C C 13 174.140 0.012 . 1 . . . . 37 ASN C . 15592 1
434 . 1 1 37 37 ASN CA C 13 54.551 0.155 . 1 . . . . 37 ASN CA . 15592 1
435 . 1 1 37 37 ASN CB C 13 36.855 0.228 . 1 . . . . 37 ASN CB . 15592 1
436 . 1 1 37 37 ASN N N 15 118.722 0.118 . 1 . . . . 37 ASN N . 15592 1
437 . 1 1 37 37 ASN ND2 N 15 111.875 0.194 . 1 . . . . 37 ASN ND2 . 15592 1
438 . 1 1 38 38 TYR H H 1 8.458 0.010 . 1 . . . . 38 TYR H . 15592 1
439 . 1 1 38 38 TYR HA H 1 3.475 0.009 . 1 . . . . 38 TYR HA . 15592 1
440 . 1 1 38 38 TYR HB2 H 1 3.115 0.007 . 1 . . . . 38 TYR HB2 . 15592 1
441 . 1 1 38 38 TYR HD1 H 1 6.678 0.008 . 1 . . . . 38 TYR HD . 15592 1
442 . 1 1 38 38 TYR HD2 H 1 6.678 0.008 . 1 . . . . 38 TYR HD . 15592 1
443 . 1 1 38 38 TYR HE1 H 1 6.715 0.009 . 1 . . . . 38 TYR HE . 15592 1
444 . 1 1 38 38 TYR HE2 H 1 6.715 0.009 . 1 . . . . 38 TYR HE . 15592 1
445 . 1 1 38 38 TYR C C 13 172.979 0.035 . 1 . . . . 38 TYR C . 15592 1
446 . 1 1 38 38 TYR CA C 13 58.784 0.244 . 1 . . . . 38 TYR CA . 15592 1
447 . 1 1 38 38 TYR CB C 13 34.780 0.152 . 1 . . . . 38 TYR CB . 15592 1
448 . 1 1 38 38 TYR CD1 C 13 132.685 0.509 . 1 . . . . 38 TYR CD . 15592 1
449 . 1 1 38 38 TYR CD2 C 13 132.685 0.509 . 1 . . . . 38 TYR CD . 15592 1
450 . 1 1 38 38 TYR CE1 C 13 118.142 0.190 . 1 . . . . 38 TYR CE . 15592 1
451 . 1 1 38 38 TYR CE2 C 13 118.142 0.190 . 1 . . . . 38 TYR CE . 15592 1
452 . 1 1 38 38 TYR N N 15 107.780 0.150 . 1 . . . . 38 TYR N . 15592 1
453 . 1 1 39 39 ASP H H 1 7.084 0.013 . 1 . . . . 39 ASP H . 15592 1
454 . 1 1 39 39 ASP HA H 1 4.681 0.007 . 1 . . . . 39 ASP HA . 15592 1
455 . 1 1 39 39 ASP HB2 H 1 2.547 0.007 . 2 . . . . 39 ASP HB2 . 15592 1
456 . 1 1 39 39 ASP HB3 H 1 3.070 0.017 . 2 . . . . 39 ASP HB3 . 15592 1
457 . 1 1 39 39 ASP C C 13 175.564 0.014 . 1 . . . . 39 ASP C . 15592 1
458 . 1 1 39 39 ASP CA C 13 53.222 0.220 . 1 . . . . 39 ASP CA . 15592 1
459 . 1 1 39 39 ASP CB C 13 41.917 0.301 . 1 . . . . 39 ASP CB . 15592 1
460 . 1 1 39 39 ASP N N 15 119.860 0.075 . 1 . . . . 39 ASP N . 15592 1
461 . 1 1 40 40 ILE H H 1 8.502 0.009 . 1 . . . . 40 ILE H . 15592 1
462 . 1 1 40 40 ILE HA H 1 3.510 0.009 . 1 . . . . 40 ILE HA . 15592 1
463 . 1 1 40 40 ILE HB H 1 1.819 0.016 . 1 . . . . 40 ILE HB . 15592 1
464 . 1 1 40 40 ILE HD11 H 1 0.958 0.006 . 1 . . . . 40 ILE HD1 . 15592 1
465 . 1 1 40 40 ILE HD12 H 1 0.958 0.006 . 1 . . . . 40 ILE HD1 . 15592 1
466 . 1 1 40 40 ILE HD13 H 1 0.958 0.006 . 1 . . . . 40 ILE HD1 . 15592 1
467 . 1 1 40 40 ILE HG12 H 1 1.163 0.014 . 2 . . . . 40 ILE HG12 . 15592 1
468 . 1 1 40 40 ILE HG13 H 1 1.702 0.008 . 2 . . . . 40 ILE HG13 . 15592 1
469 . 1 1 40 40 ILE HG21 H 1 0.886 0.012 . 1 . . . . 40 ILE HG2 . 15592 1
470 . 1 1 40 40 ILE HG22 H 1 0.886 0.012 . 1 . . . . 40 ILE HG2 . 15592 1
471 . 1 1 40 40 ILE HG23 H 1 0.886 0.012 . 1 . . . . 40 ILE HG2 . 15592 1
472 . 1 1 40 40 ILE C C 13 177.537 0.020 . 1 . . . . 40 ILE C . 15592 1
473 . 1 1 40 40 ILE CA C 13 65.154 0.364 . 1 . . . . 40 ILE CA . 15592 1
474 . 1 1 40 40 ILE CB C 13 38.092 0.295 . 1 . . . . 40 ILE CB . 15592 1
475 . 1 1 40 40 ILE CD1 C 13 14.223 0.264 . 1 . . . . 40 ILE CD1 . 15592 1
476 . 1 1 40 40 ILE CG1 C 13 28.064 0.151 . 1 . . . . 40 ILE CG1 . 15592 1
477 . 1 1 40 40 ILE CG2 C 13 16.536 0.141 . 1 . . . . 40 ILE CG2 . 15592 1
478 . 1 1 40 40 ILE N N 15 127.024 0.219 . 1 . . . . 40 ILE N . 15592 1
479 . 1 1 41 41 GLY H H 1 8.330 0.006 . 1 . . . . 41 GLY H . 15592 1
480 . 1 1 41 41 GLY HA2 H 1 3.460 0.008 . 2 . . . . 41 GLY HA2 . 15592 1
481 . 1 1 41 41 GLY HA3 H 1 3.895 0.005 . 2 . . . . 41 GLY HA3 . 15592 1
482 . 1 1 41 41 GLY C C 13 174.993 0.027 . 1 . . . . 41 GLY C . 15592 1
483 . 1 1 41 41 GLY CA C 13 47.711 0.092 . 1 . . . . 41 GLY CA . 15592 1
484 . 1 1 41 41 GLY N N 15 107.981 0.093 . 1 . . . . 41 GLY N . 15592 1
485 . 1 1 42 42 ALA H H 1 8.031 0.008 . 1 . . . . 42 ALA H . 15592 1
486 . 1 1 42 42 ALA HA H 1 4.207 0.007 . 1 . . . . 42 ALA HA . 15592 1
487 . 1 1 42 42 ALA HB1 H 1 1.509 0.006 . 1 . . . . 42 ALA HB . 15592 1
488 . 1 1 42 42 ALA HB2 H 1 1.509 0.006 . 1 . . . . 42 ALA HB . 15592 1
489 . 1 1 42 42 ALA HB3 H 1 1.509 0.006 . 1 . . . . 42 ALA HB . 15592 1
490 . 1 1 42 42 ALA C C 13 181.505 0.024 . 1 . . . . 42 ALA C . 15592 1
491 . 1 1 42 42 ALA CA C 13 54.333 0.360 . 1 . . . . 42 ALA CA . 15592 1
492 . 1 1 42 42 ALA CB C 13 18.495 0.192 . 1 . . . . 42 ALA CB . 15592 1
493 . 1 1 42 42 ALA N N 15 123.653 0.082 . 1 . . . . 42 ALA N . 15592 1
494 . 1 1 43 43 ALA H H 1 8.249 0.006 . 1 . . . . 43 ALA H . 15592 1
495 . 1 1 43 43 ALA HA H 1 3.835 0.010 . 1 . . . . 43 ALA HA . 15592 1
496 . 1 1 43 43 ALA HB1 H 1 1.202 0.006 . 1 . . . . 43 ALA HB . 15592 1
497 . 1 1 43 43 ALA HB2 H 1 1.202 0.006 . 1 . . . . 43 ALA HB . 15592 1
498 . 1 1 43 43 ALA HB3 H 1 1.202 0.006 . 1 . . . . 43 ALA HB . 15592 1
499 . 1 1 43 43 ALA C C 13 179.108 0.000 . 1 . . . . 43 ALA C . 15592 1
500 . 1 1 43 43 ALA CA C 13 55.583 0.190 . 1 . . . . 43 ALA CA . 15592 1
501 . 1 1 43 43 ALA CB C 13 16.699 0.109 . 1 . . . . 43 ALA CB . 15592 1
502 . 1 1 43 43 ALA N N 15 121.737 0.106 . 1 . . . . 43 ALA N . 15592 1
503 . 1 1 44 44 LEU H H 1 8.733 0.012 . 1 . . . . 44 LEU H . 15592 1
504 . 1 1 44 44 LEU HA H 1 3.845 0.016 . 1 . . . . 44 LEU HA . 15592 1
505 . 1 1 44 44 LEU HB2 H 1 1.403 0.015 . 2 . . . . 44 LEU HB2 . 15592 1
506 . 1 1 44 44 LEU HB3 H 1 2.014 0.011 . 2 . . . . 44 LEU HB3 . 15592 1
507 . 1 1 44 44 LEU HD11 H 1 0.654 0.009 . 2 . . . . 44 LEU HD1 . 15592 1
508 . 1 1 44 44 LEU HD12 H 1 0.654 0.009 . 2 . . . . 44 LEU HD1 . 15592 1
509 . 1 1 44 44 LEU HD13 H 1 0.654 0.009 . 2 . . . . 44 LEU HD1 . 15592 1
510 . 1 1 44 44 LEU HD21 H 1 0.740 0.009 . 2 . . . . 44 LEU HD2 . 15592 1
511 . 1 1 44 44 LEU HD22 H 1 0.740 0.009 . 2 . . . . 44 LEU HD2 . 15592 1
512 . 1 1 44 44 LEU HD23 H 1 0.740 0.009 . 2 . . . . 44 LEU HD2 . 15592 1
513 . 1 1 44 44 LEU HG H 1 0.775 0.012 . 1 . . . . 44 LEU HG . 15592 1
514 . 1 1 44 44 LEU C C 13 179.526 0.000 . 1 . . . . 44 LEU C . 15592 1
515 . 1 1 44 44 LEU CA C 13 57.784 0.143 . 1 . . . . 44 LEU CA . 15592 1
516 . 1 1 44 44 LEU CB C 13 41.013 0.238 . 1 . . . . 44 LEU CB . 15592 1
517 . 1 1 44 44 LEU CD1 C 13 24.941 0.089 . 2 . . . . 44 LEU CD1 . 15592 1
518 . 1 1 44 44 LEU CD2 C 13 25.034 0.042 . 2 . . . . 44 LEU CD2 . 15592 1
519 . 1 1 44 44 LEU CG C 13 26.935 0.104 . 1 . . . . 44 LEU CG . 15592 1
520 . 1 1 44 44 LEU N N 15 118.513 0.079 . 1 . . . . 44 LEU N . 15592 1
521 . 1 1 45 45 ASP H H 1 8.215 0.008 . 1 . . . . 45 ASP H . 15592 1
522 . 1 1 45 45 ASP HA H 1 4.463 0.004 . 1 . . . . 45 ASP HA . 15592 1
523 . 1 1 45 45 ASP HB2 H 1 2.786 0.012 . 2 . . . . 45 ASP HB2 . 15592 1
524 . 1 1 45 45 ASP HB3 H 1 2.875 0.018 . 2 . . . . 45 ASP HB3 . 15592 1
525 . 1 1 45 45 ASP C C 13 177.961 0.054 . 1 . . . . 45 ASP C . 15592 1
526 . 1 1 45 45 ASP CA C 13 57.089 0.191 . 1 . . . . 45 ASP CA . 15592 1
527 . 1 1 45 45 ASP CB C 13 39.851 0.017 . 1 . . . . 45 ASP CB . 15592 1
528 . 1 1 45 45 ASP N N 15 119.693 0.121 . 1 . . . . 45 ASP N . 15592 1
529 . 1 1 46 46 THR H H 1 7.739 0.011 . 1 . . . . 46 THR H . 15592 1
530 . 1 1 46 46 THR HA H 1 4.124 0.007 . 1 . . . . 46 THR HA . 15592 1
531 . 1 1 46 46 THR HB H 1 4.354 0.012 . 1 . . . . 46 THR HB . 15592 1
532 . 1 1 46 46 THR HG21 H 1 1.313 0.011 . 1 . . . . 46 THR HG2 . 15592 1
533 . 1 1 46 46 THR HG22 H 1 1.313 0.011 . 1 . . . . 46 THR HG2 . 15592 1
534 . 1 1 46 46 THR HG23 H 1 1.313 0.011 . 1 . . . . 46 THR HG2 . 15592 1
535 . 1 1 46 46 THR C C 13 176.258 0.024 . 1 . . . . 46 THR C . 15592 1
536 . 1 1 46 46 THR CA C 13 66.229 0.147 . 1 . . . . 46 THR CA . 15592 1
537 . 1 1 46 46 THR CB C 13 69.255 0.212 . 1 . . . . 46 THR CB . 15592 1
538 . 1 1 46 46 THR CG2 C 13 21.646 0.269 . 1 . . . . 46 THR CG2 . 15592 1
539 . 1 1 46 46 THR N N 15 116.302 0.179 . 1 . . . . 46 THR N . 15592 1
540 . 1 1 47 47 ILE H H 1 8.061 0.012 . 1 . . . . 47 ILE H . 15592 1
541 . 1 1 47 47 ILE HA H 1 3.805 0.011 . 1 . . . . 47 ILE HA . 15592 1
542 . 1 1 47 47 ILE HB H 1 1.895 0.006 . 1 . . . . 47 ILE HB . 15592 1
543 . 1 1 47 47 ILE HD11 H 1 0.647 0.010 . 1 . . . . 47 ILE HD1 . 15592 1
544 . 1 1 47 47 ILE HD12 H 1 0.647 0.010 . 1 . . . . 47 ILE HD1 . 15592 1
545 . 1 1 47 47 ILE HD13 H 1 0.647 0.010 . 1 . . . . 47 ILE HD1 . 15592 1
546 . 1 1 47 47 ILE HG12 H 1 1.230 0.011 . 2 . . . . 47 ILE HG12 . 15592 1
547 . 1 1 47 47 ILE HG13 H 1 1.839 0.022 . 2 . . . . 47 ILE HG13 . 15592 1
548 . 1 1 47 47 ILE HG21 H 1 1.094 0.011 . 1 . . . . 47 ILE HG2 . 15592 1
549 . 1 1 47 47 ILE HG22 H 1 1.094 0.011 . 1 . . . . 47 ILE HG2 . 15592 1
550 . 1 1 47 47 ILE HG23 H 1 1.094 0.011 . 1 . . . . 47 ILE HG2 . 15592 1
551 . 1 1 47 47 ILE C C 13 177.292 0.016 . 1 . . . . 47 ILE C . 15592 1
552 . 1 1 47 47 ILE CA C 13 64.508 0.229 . 1 . . . . 47 ILE CA . 15592 1
553 . 1 1 47 47 ILE CB C 13 38.789 0.216 . 1 . . . . 47 ILE CB . 15592 1
554 . 1 1 47 47 ILE CD1 C 13 13.974 0.110 . 1 . . . . 47 ILE CD1 . 15592 1
555 . 1 1 47 47 ILE CG1 C 13 28.978 0.141 . 1 . . . . 47 ILE CG1 . 15592 1
556 . 1 1 47 47 ILE CG2 C 13 17.512 0.366 . 1 . . . . 47 ILE CG2 . 15592 1
557 . 1 1 47 47 ILE N N 15 122.781 0.138 . 1 . . . . 47 ILE N . 15592 1
558 . 1 1 48 48 GLN H H 1 8.064 0.008 . 1 . . . . 48 GLN H . 15592 1
559 . 1 1 48 48 GLN HA H 1 4.132 0.011 . 1 . . . . 48 GLN HA . 15592 1
560 . 1 1 48 48 GLN HB2 H 1 1.840 0.007 . 2 . . . . 48 GLN HB2 . 15592 1
561 . 1 1 48 48 GLN HB3 H 1 1.964 0.012 . 2 . . . . 48 GLN HB3 . 15592 1
562 . 1 1 48 48 GLN HE21 H 1 6.824 0.012 . 2 . . . . 48 GLN HE21 . 15592 1
563 . 1 1 48 48 GLN HE22 H 1 7.389 0.001 . 2 . . . . 48 GLN HE22 . 15592 1
564 . 1 1 48 48 GLN HG2 H 1 2.179 0.015 . 1 . . . . 48 GLN HG2 . 15592 1
565 . 1 1 48 48 GLN C C 13 176.764 0.031 . 1 . . . . 48 GLN C . 15592 1
566 . 1 1 48 48 GLN CA C 13 57.630 0.159 . 1 . . . . 48 GLN CA . 15592 1
567 . 1 1 48 48 GLN CB C 13 28.129 0.127 . 1 . . . . 48 GLN CB . 15592 1
568 . 1 1 48 48 GLN CG C 13 32.942 0.000 . 1 . . . . 48 GLN CG . 15592 1
569 . 1 1 48 48 GLN N N 15 119.090 0.071 . 1 . . . . 48 GLN N . 15592 1
570 . 1 1 48 48 GLN NE2 N 15 111.106 0.062 . 1 . . . . 48 GLN NE2 . 15592 1
571 . 1 1 49 49 TYR H H 1 7.976 0.010 . 1 . . . . 49 TYR H . 15592 1
572 . 1 1 49 49 TYR HA H 1 4.703 0.011 . 1 . . . . 49 TYR HA . 15592 1
573 . 1 1 49 49 TYR HB2 H 1 3.044 0.008 . 2 . . . . 49 TYR HB2 . 15592 1
574 . 1 1 49 49 TYR HB3 H 1 3.287 0.004 . 2 . . . . 49 TYR HB3 . 15592 1
575 . 1 1 49 49 TYR HD1 H 1 7.241 0.013 . 1 . . . . 49 TYR HD . 15592 1
576 . 1 1 49 49 TYR HD2 H 1 7.241 0.013 . 1 . . . . 49 TYR HD . 15592 1
577 . 1 1 49 49 TYR HE1 H 1 6.867 0.015 . 1 . . . . 49 TYR HE . 15592 1
578 . 1 1 49 49 TYR HE2 H 1 6.867 0.015 . 1 . . . . 49 TYR HE . 15592 1
579 . 1 1 49 49 TYR C C 13 176.283 0.000 . 1 . . . . 49 TYR C . 15592 1
580 . 1 1 49 49 TYR CA C 13 58.333 0.267 . 1 . . . . 49 TYR CA . 15592 1
581 . 1 1 49 49 TYR CB C 13 38.525 0.231 . 1 . . . . 49 TYR CB . 15592 1
582 . 1 1 49 49 TYR CD1 C 13 133.820 0.143 . 1 . . . . 49 TYR CD . 15592 1
583 . 1 1 49 49 TYR CD2 C 13 133.820 0.143 . 1 . . . . 49 TYR CD . 15592 1
584 . 1 1 49 49 TYR CE1 C 13 118.050 0.161 . 1 . . . . 49 TYR CE . 15592 1
585 . 1 1 49 49 TYR CE2 C 13 118.050 0.161 . 1 . . . . 49 TYR CE . 15592 1
586 . 1 1 49 49 TYR N N 15 118.029 0.172 . 1 . . . . 49 TYR N . 15592 1
587 . 1 1 50 50 SER H H 1 7.988 0.008 . 1 . . . . 50 SER H . 15592 1
588 . 1 1 50 50 SER HA H 1 4.468 0.029 . 1 . . . . 50 SER HA . 15592 1
589 . 1 1 50 50 SER HB2 H 1 3.956 0.015 . 1 . . . . 50 SER HB2 . 15592 1
590 . 1 1 50 50 SER C C 13 173.958 0.009 . 1 . . . . 50 SER C . 15592 1
591 . 1 1 50 50 SER CA C 13 62.940 0.142 . 1 . . . . 50 SER CA . 15592 1
592 . 1 1 50 50 SER CB C 13 63.809 0.255 . 1 . . . . 50 SER CB . 15592 1
593 . 1 1 50 50 SER N N 15 115.687 0.036 . 1 . . . . 50 SER N . 15592 1
594 . 1 1 51 51 LYS H H 1 8.137 0.011 . 1 . . . . 51 LYS H . 15592 1
595 . 1 1 51 51 LYS HA H 1 4.355 0.006 . 1 . . . . 51 LYS HA . 15592 1
596 . 1 1 51 51 LYS HB2 H 1 1.761 0.007 . 2 . . . . 51 LYS HB2 . 15592 1
597 . 1 1 51 51 LYS HB3 H 1 1.864 0.004 . 2 . . . . 51 LYS HB3 . 15592 1
598 . 1 1 51 51 LYS HD2 H 1 1.693 0.007 . 1 . . . . 51 LYS HD2 . 15592 1
599 . 1 1 51 51 LYS HE2 H 1 2.991 0.007 . 1 . . . . 51 LYS HE2 . 15592 1
600 . 1 1 51 51 LYS HG2 H 1 1.447 0.006 . 1 . . . . 51 LYS HG2 . 15592 1
601 . 1 1 51 51 LYS C C 13 175.367 0.000 . 1 . . . . 51 LYS C . 15592 1
602 . 1 1 51 51 LYS CA C 13 56.199 0.283 . 1 . . . . 51 LYS CA . 15592 1
603 . 1 1 51 51 LYS CB C 13 32.611 0.038 . 1 . . . . 51 LYS CB . 15592 1
604 . 1 1 51 51 LYS CD C 13 28.716 0.042 . 1 . . . . 51 LYS CD . 15592 1
605 . 1 1 51 51 LYS CE C 13 41.871 0.040 . 1 . . . . 51 LYS CE . 15592 1
606 . 1 1 51 51 LYS CG C 13 24.354 0.051 . 1 . . . . 51 LYS CG . 15592 1
607 . 1 1 51 51 LYS N N 15 122.927 0.067 . 1 . . . . 51 LYS N . 15592 1
608 . 1 1 52 52 HIS H H 1 7.972 0.007 . 1 . . . . 52 HIS H . 15592 1
609 . 1 1 52 52 HIS HA H 1 4.407 0.033 . 1 . . . . 52 HIS HA . 15592 1
610 . 1 1 52 52 HIS HB2 H 1 3.001 0.033 . 2 . . . . 52 HIS HB2 . 15592 1
611 . 1 1 52 52 HIS HB3 H 1 3.162 0.003 . 2 . . . . 52 HIS HB3 . 15592 1
612 . 1 1 52 52 HIS HD2 H 1 7.065 0.016 . 1 . . . . 52 HIS HD2 . 15592 1
613 . 1 1 52 52 HIS HE1 H 1 8.126 0.000 . 1 . . . . 52 HIS HE1 . 15592 1
614 . 1 1 52 52 HIS C C 13 179.261 0.000 . 1 . . . . 52 HIS C . 15592 1
615 . 1 1 52 52 HIS CA C 13 56.949 0.117 . 1 . . . . 52 HIS CA . 15592 1
616 . 1 1 52 52 HIS CB C 13 30.217 0.045 . 1 . . . . 52 HIS CB . 15592 1
617 . 1 1 52 52 HIS CD2 C 13 120.089 0.219 . 1 . . . . 52 HIS CD2 . 15592 1
618 . 1 1 52 52 HIS CE1 C 13 136.633 0.000 . 1 . . . . 52 HIS CE1 . 15592 1
619 . 1 1 52 52 HIS N N 15 125.281 0.083 . 1 . . . . 52 HIS N . 15592 1
stop_
save_