Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50688
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'mN4BP1 CUE domain'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50688 1
2 '3D HCCH-TOCSY' . . . 50688 1
3 '3D HBHA(CO)NH' . . . 50688 1
4 '3D HNCA' . . . 50688 1
5 '3D HN(CO)CA' . . . 50688 1
6 '3D HNCACO' . . . 50688 1
7 '3D HNCO' . . . 50688 1
8 '3D HNCACB' . . . 50688 1
9 '3D CBCA(CO)NH' . . . 50688 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
1 $software_1 . . 50688 1
2 $software_2 . . 50688 1
3 $software_3 . . 50688 1
4 $software_4 . . 50688 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 GLU H H 1 8.096 0.005 . 1 . . . . . 1 GLU H . 50688 1
2 . 1 . 1 1 1 GLU HA H 1 4.441 0.003 . 1 . . . . . 1 GLU HA . 50688 1
3 . 1 . 1 1 1 GLU HB2 H 1 2.119 0.001 . 2 . . . . . 1 GLU HB2 . 50688 1
4 . 1 . 1 1 1 GLU HB3 H 1 2.183 0.003 . 2 . . . . . 1 GLU HB3 . 50688 1
5 . 1 . 1 1 1 GLU HG2 H 1 2.333 0.001 . 1 . . . . . 1 GLU HG2 . 50688 1
6 . 1 . 1 1 1 GLU HG3 H 1 2.333 0.001 . 1 . . . . . 1 GLU HG3 . 50688 1
7 . 1 . 1 1 1 GLU C C 13 177.391 0.024 . 1 . . . . . 1 GLU C . 50688 1
8 . 1 . 1 1 1 GLU CA C 13 57.041 0.105 . 1 . . . . . 1 GLU CA . 50688 1
9 . 1 . 1 1 1 GLU CB C 13 30.236 0.021 . 1 . . . . . 1 GLU CB . 50688 1
10 . 1 . 1 1 1 GLU CG C 13 36.82 0 . 1 . . . . . 1 GLU CG . 50688 1
11 . 1 . 1 1 1 GLU N N 15 120.314 0.066 . 1 . . . . . 1 GLU N . 50688 1
12 . 1 . 1 2 2 THR H H 1 8.264 0.006 . 1 . . . . . 2 THR H . 50688 1
13 . 1 . 1 2 2 THR HA H 1 4.32 0.001 . 1 . . . . . 2 THR HA . 50688 1
14 . 1 . 1 2 2 THR HB H 1 4.29 0 . 1 . . . . . 2 THR HB . 50688 1
15 . 1 . 1 2 2 THR C C 13 174.999 0.027 . 1 . . . . . 2 THR C . 50688 1
16 . 1 . 1 2 2 THR CA C 13 63.391 0.041 . 1 . . . . . 2 THR CA . 50688 1
17 . 1 . 1 2 2 THR CB C 13 69.326 0.078 . 1 . . . . . 2 THR CB . 50688 1
18 . 1 . 1 2 2 THR N N 15 115.121 0.028 . 1 . . . . . 2 THR N . 50688 1
19 . 1 . 1 3 3 SER H H 1 8.337 0.007 . 1 . . . . . 3 SER H . 50688 1
20 . 1 . 1 3 3 SER HA H 1 4.424 0.005 . 1 . . . . . 3 SER HA . 50688 1
21 . 1 . 1 3 3 SER HB2 H 1 4.053 0.01 . 2 . . . . . 3 SER HB2 . 50688 1
22 . 1 . 1 3 3 SER HB3 H 1 3.978 0.004 . 2 . . . . . 3 SER HB3 . 50688 1
23 . 1 . 1 3 3 SER C C 13 175.598 0 . 1 . . . . . 3 SER C . 50688 1
24 . 1 . 1 3 3 SER CA C 13 59.933 0.043 . 1 . . . . . 3 SER CA . 50688 1
25 . 1 . 1 3 3 SER CB C 13 63.214 0.083 . 1 . . . . . 3 SER CB . 50688 1
26 . 1 . 1 3 3 SER N N 15 117.209 0.049 . 1 . . . . . 3 SER N . 50688 1
27 . 1 . 1 4 4 GLU H H 1 8.37 0.005 . 1 . . . . . 4 GLU H . 50688 1
28 . 1 . 1 4 4 GLU HA H 1 4.219 0.004 . 1 . . . . . 4 GLU HA . 50688 1
29 . 1 . 1 4 4 GLU HB2 H 1 2.137 0.003 . 1 . . . . . 4 GLU HB2 . 50688 1
30 . 1 . 1 4 4 GLU HB3 H 1 2.137 0.003 . 1 . . . . . 4 GLU HB3 . 50688 1
31 . 1 . 1 4 4 GLU HG2 H 1 2.403 0.001 . 2 . . . . . 4 GLU HG2 . 50688 1
32 . 1 . 1 4 4 GLU HG3 H 1 2.335 0.005 . 2 . . . . . 4 GLU HG3 . 50688 1
33 . 1 . 1 4 4 GLU C C 13 178.749 0.019 . 1 . . . . . 4 GLU C . 50688 1
34 . 1 . 1 4 4 GLU CA C 13 58.834 0.076 . 1 . . . . . 4 GLU CA . 50688 1
35 . 1 . 1 4 4 GLU CB C 13 29.834 0.062 . 1 . . . . . 4 GLU CB . 50688 1
36 . 1 . 1 4 4 GLU CG C 13 36.647 0 . 1 . . . . . 4 GLU CG . 50688 1
37 . 1 . 1 4 4 GLU N N 15 123.128 0.075 . 1 . . . . . 4 GLU N . 50688 1
38 . 1 . 1 5 5 LEU H H 1 7.988 0.004 . 1 . . . . . 5 LEU H . 50688 1
39 . 1 . 1 5 5 LEU HA H 1 4.183 0.004 . 1 . . . . . 5 LEU HA . 50688 1
40 . 1 . 1 5 5 LEU HB2 H 1 1.8 0.005 . 2 . . . . . 5 LEU HB2 . 50688 1
41 . 1 . 1 5 5 LEU HB3 H 1 1.517 0.011 . 2 . . . . . 5 LEU HB3 . 50688 1
42 . 1 . 1 5 5 LEU HG H 1 1.682 0.007 . 1 . . . . . 5 LEU HG . 50688 1
43 . 1 . 1 5 5 LEU HD11 H 1 0.878 0.002 . 2 . . . . . 5 LEU HD11 . 50688 1
44 . 1 . 1 5 5 LEU HD12 H 1 0.878 0.002 . 2 . . . . . 5 LEU HD12 . 50688 1
45 . 1 . 1 5 5 LEU HD13 H 1 0.878 0.002 . 2 . . . . . 5 LEU HD13 . 50688 1
46 . 1 . 1 5 5 LEU HD21 H 1 0.922 0.003 . 2 . . . . . 5 LEU HD21 . 50688 1
47 . 1 . 1 5 5 LEU HD22 H 1 0.922 0.003 . 2 . . . . . 5 LEU HD22 . 50688 1
48 . 1 . 1 5 5 LEU HD23 H 1 0.922 0.003 . 2 . . . . . 5 LEU HD23 . 50688 1
49 . 1 . 1 5 5 LEU C C 13 177.947 0.065 . 1 . . . . . 5 LEU C . 50688 1
50 . 1 . 1 5 5 LEU CA C 13 57.481 0.033 . 1 . . . . . 5 LEU CA . 50688 1
51 . 1 . 1 5 5 LEU CB C 13 42.216 0.027 . 1 . . . . . 5 LEU CB . 50688 1
52 . 1 . 1 5 5 LEU CG C 13 26.86 0 . 1 . . . . . 5 LEU CG . 50688 1
53 . 1 . 1 5 5 LEU CD1 C 13 24.152 0 . 2 . . . . . 5 LEU CD1 . 50688 1
54 . 1 . 1 5 5 LEU CD2 C 13 24.894 0 . 2 . . . . . 5 LEU CD2 . 50688 1
55 . 1 . 1 5 5 LEU N N 15 121.616 0.046 . 1 . . . . . 5 LEU N . 50688 1
56 . 1 . 1 6 6 ARG H H 1 8.13 0.006 . 1 . . . . . 6 ARG H . 50688 1
57 . 1 . 1 6 6 ARG HA H 1 3.802 0.003 . 1 . . . . . 6 ARG HA . 50688 1
58 . 1 . 1 6 6 ARG HB2 H 1 1.954 0.002 . 2 . . . . . 6 ARG HB2 . 50688 1
59 . 1 . 1 6 6 ARG HB3 H 1 1.819 0.002 . 2 . . . . . 6 ARG HB3 . 50688 1
60 . 1 . 1 6 6 ARG HG2 H 1 1.59 0.002 . 2 . . . . . 6 ARG HG2 . 50688 1
61 . 1 . 1 6 6 ARG HG3 H 1 1.48 0.002 . 2 . . . . . 6 ARG HG3 . 50688 1
62 . 1 . 1 6 6 ARG HD2 H 1 3.296 0.001 . 2 . . . . . 6 ARG HD2 . 50688 1
63 . 1 . 1 6 6 ARG HD3 H 1 3.164 0.002 . 2 . . . . . 6 ARG HD3 . 50688 1
64 . 1 . 1 6 6 ARG C C 13 177.61 0.012 . 1 . . . . . 6 ARG C . 50688 1
65 . 1 . 1 6 6 ARG CA C 13 60.23 0.1 . 1 . . . . . 6 ARG CA . 50688 1
66 . 1 . 1 6 6 ARG CB C 13 30.146 0.009 . 1 . . . . . 6 ARG CB . 50688 1
67 . 1 . 1 6 6 ARG CG C 13 27.956 0 . 1 . . . . . 6 ARG CG . 50688 1
68 . 1 . 1 6 6 ARG CD C 13 43.546 0 . 1 . . . . . 6 ARG CD . 50688 1
69 . 1 . 1 6 6 ARG N N 15 119.054 0.058 . 1 . . . . . 6 ARG N . 50688 1
70 . 1 . 1 7 7 GLU H H 1 7.971 0.005 . 1 . . . . . 7 GLU H . 50688 1
71 . 1 . 1 7 7 GLU HA H 1 3.998 0.002 . 1 . . . . . 7 GLU HA . 50688 1
72 . 1 . 1 7 7 GLU HB2 H 1 2.109 0.002 . 1 . . . . . 7 GLU HB2 . 50688 1
73 . 1 . 1 7 7 GLU HB3 H 1 2.108 0.002 . 1 . . . . . 7 GLU HB3 . 50688 1
74 . 1 . 1 7 7 GLU HG2 H 1 2.412 0.002 . 2 . . . . . 7 GLU HG2 . 50688 1
75 . 1 . 1 7 7 GLU HG3 H 1 2.383 0.001 . 2 . . . . . 7 GLU HG3 . 50688 1
76 . 1 . 1 7 7 GLU C C 13 178.792 0.025 . 1 . . . . . 7 GLU C . 50688 1
77 . 1 . 1 7 7 GLU CA C 13 59.146 0.056 . 1 . . . . . 7 GLU CA . 50688 1
78 . 1 . 1 7 7 GLU CB C 13 29.507 0.09 . 1 . . . . . 7 GLU CB . 50688 1
79 . 1 . 1 7 7 GLU CG C 13 36.292 0 . 1 . . . . . 7 GLU CG . 50688 1
80 . 1 . 1 7 7 GLU N N 15 116.217 0.061 . 1 . . . . . 7 GLU N . 50688 1
81 . 1 . 1 8 8 ALA H H 1 7.801 0.002 . 1 . . . . . 8 ALA H . 50688 1
82 . 1 . 1 8 8 ALA HA H 1 4.167 0.002 . 1 . . . . . 8 ALA HA . 50688 1
83 . 1 . 1 8 8 ALA HB1 H 1 1.578 0.003 . 1 . . . . . 8 ALA HB1 . 50688 1
84 . 1 . 1 8 8 ALA HB2 H 1 1.578 0.003 . 1 . . . . . 8 ALA HB2 . 50688 1
85 . 1 . 1 8 8 ALA HB3 H 1 1.578 0.003 . 1 . . . . . 8 ALA HB3 . 50688 1
86 . 1 . 1 8 8 ALA C C 13 180.704 0.03 . 1 . . . . . 8 ALA C . 50688 1
87 . 1 . 1 8 8 ALA CA C 13 54.954 0.03 . 1 . . . . . 8 ALA CA . 50688 1
88 . 1 . 1 8 8 ALA CB C 13 18.789 0.053 . 1 . . . . . 8 ALA CB . 50688 1
89 . 1 . 1 8 8 ALA N N 15 121.094 0.053 . 1 . . . . . 8 ALA N . 50688 1
90 . 1 . 1 9 9 LEU H H 1 8.201 0.005 . 1 . . . . . 9 LEU H . 50688 1
91 . 1 . 1 9 9 LEU HA H 1 4.189 0.004 . 1 . . . . . 9 LEU HA . 50688 1
92 . 1 . 1 9 9 LEU HB2 H 1 2.087 0.005 . 2 . . . . . 9 LEU HB2 . 50688 1
93 . 1 . 1 9 9 LEU HB3 H 1 1.538 0.002 . 2 . . . . . 9 LEU HB3 . 50688 1
94 . 1 . 1 9 9 LEU HG H 1 1.903 0.008 . 1 . . . . . 9 LEU HG . 50688 1
95 . 1 . 1 9 9 LEU HD11 H 1 0.987 0.002 . 2 . . . . . 9 LEU HD11 . 50688 1
96 . 1 . 1 9 9 LEU HD12 H 1 0.987 0.002 . 2 . . . . . 9 LEU HD12 . 50688 1
97 . 1 . 1 9 9 LEU HD13 H 1 0.987 0.002 . 2 . . . . . 9 LEU HD13 . 50688 1
98 . 1 . 1 9 9 LEU HD21 H 1 0.927 0.003 . 2 . . . . . 9 LEU HD21 . 50688 1
99 . 1 . 1 9 9 LEU HD22 H 1 0.927 0.003 . 2 . . . . . 9 LEU HD22 . 50688 1
100 . 1 . 1 9 9 LEU HD23 H 1 0.927 0.003 . 2 . . . . . 9 LEU HD23 . 50688 1
101 . 1 . 1 9 9 LEU C C 13 178.644 0.012 . 1 . . . . . 9 LEU C . 50688 1
102 . 1 . 1 9 9 LEU CA C 13 57.755 0.06 . 1 . . . . . 9 LEU CA . 50688 1
103 . 1 . 1 9 9 LEU CB C 13 42.622 0.011 . 1 . . . . . 9 LEU CB . 50688 1
104 . 1 . 1 9 9 LEU CG C 13 26.894 0 . 1 . . . . . 9 LEU CG . 50688 1
105 . 1 . 1 9 9 LEU CD1 C 13 24.043 0 . 2 . . . . . 9 LEU CD1 . 50688 1
106 . 1 . 1 9 9 LEU CD2 C 13 26.665 0 . 2 . . . . . 9 LEU CD2 . 50688 1
107 . 1 . 1 9 9 LEU N N 15 118.795 0.019 . 1 . . . . . 9 LEU N . 50688 1
108 . 1 . 1 10 10 LEU H H 1 8.264 0.009 . 1 . . . . . 10 LEU H . 50688 1
109 . 1 . 1 10 10 LEU HA H 1 4.155 0.002 . 1 . . . . . 10 LEU HA . 50688 1
110 . 1 . 1 10 10 LEU HB2 H 1 1.884 0.007 . 2 . . . . . 10 LEU HB2 . 50688 1
111 . 1 . 1 10 10 LEU HB3 H 1 1.525 0.006 . 2 . . . . . 10 LEU HB3 . 50688 1
112 . 1 . 1 10 10 LEU HD11 H 1 0.946 0.001 . 2 . . . . . 10 LEU HD11 . 50688 1
113 . 1 . 1 10 10 LEU HD12 H 1 0.946 0.001 . 2 . . . . . 10 LEU HD12 . 50688 1
114 . 1 . 1 10 10 LEU HD13 H 1 0.946 0.001 . 2 . . . . . 10 LEU HD13 . 50688 1
115 . 1 . 1 10 10 LEU HD21 H 1 0.911 0.002 . 2 . . . . . 10 LEU HD21 . 50688 1
116 . 1 . 1 10 10 LEU HD22 H 1 0.911 0.002 . 2 . . . . . 10 LEU HD22 . 50688 1
117 . 1 . 1 10 10 LEU HD23 H 1 0.911 0.002 . 2 . . . . . 10 LEU HD23 . 50688 1
118 . 1 . 1 10 10 LEU C C 13 178.638 0.002 . 1 . . . . . 10 LEU C . 50688 1
119 . 1 . 1 10 10 LEU CA C 13 56.792 0.164 . 1 . . . . . 10 LEU CA . 50688 1
120 . 1 . 1 10 10 LEU CB C 13 41.806 0.039 . 1 . . . . . 10 LEU CB . 50688 1
121 . 1 . 1 10 10 LEU CD1 C 13 23.147 0 . 2 . . . . . 10 LEU CD1 . 50688 1
122 . 1 . 1 10 10 LEU CD2 C 13 25.601 0 . 2 . . . . . 10 LEU CD2 . 50688 1
123 . 1 . 1 10 10 LEU N N 15 119.22 0.05 . 1 . . . . . 10 LEU N . 50688 1
124 . 1 . 1 11 11 LYS H H 1 7.299 0.004 . 1 . . . . . 11 LYS H . 50688 1
125 . 1 . 1 11 11 LYS HA H 1 4.123 0.004 . 1 . . . . . 11 LYS HA . 50688 1
126 . 1 . 1 11 11 LYS HB2 H 1 1.916 0.004 . 2 . . . . . 11 LYS HB2 . 50688 1
127 . 1 . 1 11 11 LYS HB3 H 1 1.915 0.004 . 2 . . . . . 11 LYS HB3 . 50688 1
128 . 1 . 1 11 11 LYS HG2 H 1 1.647 0.001 . 2 . . . . . 11 LYS HG2 . 50688 1
129 . 1 . 1 11 11 LYS HG3 H 1 1.476 0.005 . 2 . . . . . 11 LYS HG3 . 50688 1
130 . 1 . 1 11 11 LYS HD2 H 1 1.72 0.004 . 1 . . . . . 11 LYS HD2 . 50688 1
131 . 1 . 1 11 11 LYS HD3 H 1 1.72 0.004 . 1 . . . . . 11 LYS HD3 . 50688 1
132 . 1 . 1 11 11 LYS HE2 H 1 3.036 0.003 . 1 . . . . . 11 LYS HE2 . 50688 1
133 . 1 . 1 11 11 LYS HE3 H 1 3.036 0.003 . 1 . . . . . 11 LYS HE3 . 50688 1
134 . 1 . 1 11 11 LYS C C 13 177.84 0.006 . 1 . . . . . 11 LYS C . 50688 1
135 . 1 . 1 11 11 LYS CA C 13 57.933 0.082 . 1 . . . . . 11 LYS CA . 50688 1
136 . 1 . 1 11 11 LYS CB C 13 32.776 0 . 1 . . . . . 11 LYS CB . 50688 1
137 . 1 . 1 11 11 LYS CG C 13 25.276 0 . 1 . . . . . 11 LYS CG . 50688 1
138 . 1 . 1 11 11 LYS CD C 13 28.893 0 . 1 . . . . . 11 LYS CD . 50688 1
139 . 1 . 1 11 11 LYS CE C 13 42.213 0.008 . 1 . . . . . 11 LYS CE . 50688 1
140 . 1 . 1 11 11 LYS N N 15 116.238 0.056 . 1 . . . . . 11 LYS N . 50688 1
141 . 1 . 1 12 12 ILE H H 1 7.201 0.003 . 1 . . . . . 12 ILE H . 50688 1
142 . 1 . 1 12 12 ILE HA H 1 3.802 0.006 . 1 . . . . . 12 ILE HA . 50688 1
143 . 1 . 1 12 12 ILE HB H 1 1.597 0.002 . 1 . . . . . 12 ILE HB . 50688 1
144 . 1 . 1 12 12 ILE HG12 H 1 1.493 0.002 . 2 . . . . . 12 ILE HG12 . 50688 1
145 . 1 . 1 12 12 ILE HG13 H 1 1.004 0.003 . 2 . . . . . 12 ILE HG13 . 50688 1
146 . 1 . 1 12 12 ILE HG21 H 1 0.273 0.002 . 1 . . . . . 12 ILE HG21 . 50688 1
147 . 1 . 1 12 12 ILE HG22 H 1 0.273 0.002 . 1 . . . . . 12 ILE HG22 . 50688 1
148 . 1 . 1 12 12 ILE HG23 H 1 0.273 0.002 . 1 . . . . . 12 ILE HG23 . 50688 1
149 . 1 . 1 12 12 ILE HD11 H 1 0.766 0.002 . 1 . . . . . 12 ILE HD11 . 50688 1
150 . 1 . 1 12 12 ILE HD12 H 1 0.766 0.002 . 1 . . . . . 12 ILE HD12 . 50688 1
151 . 1 . 1 12 12 ILE HD13 H 1 0.766 0.002 . 1 . . . . . 12 ILE HD13 . 50688 1
152 . 1 . 1 12 12 ILE C C 13 175.432 0.002 . 1 . . . . . 12 ILE C . 50688 1
153 . 1 . 1 12 12 ILE CA C 13 62.981 0.056 . 1 . . . . . 12 ILE CA . 50688 1
154 . 1 . 1 12 12 ILE CB C 13 39.049 0.02 . 1 . . . . . 12 ILE CB . 50688 1
155 . 1 . 1 12 12 ILE CG1 C 13 27.581 0.003 . 1 . . . . . 12 ILE CG1 . 50688 1
156 . 1 . 1 12 12 ILE CG2 C 13 17.295 0.015 . 1 . . . . . 12 ILE CG2 . 50688 1
157 . 1 . 1 12 12 ILE CD1 C 13 13.525 0.021 . 1 . . . . . 12 ILE CD1 . 50688 1
158 . 1 . 1 12 12 ILE N N 15 117.623 0.021 . 1 . . . . . 12 ILE N . 50688 1
159 . 1 . 1 13 13 PHE H H 1 7.869 0.007 . 1 . . . . . 13 PHE H . 50688 1
160 . 1 . 1 13 13 PHE HA H 1 5.053 0.001 . 1 . . . . . 13 PHE HA . 50688 1
161 . 1 . 1 13 13 PHE HB2 H 1 3.019 0 . 2 . . . . . 13 PHE HB2 . 50688 1
162 . 1 . 1 13 13 PHE HB3 H 1 2.986 0.004 . 2 . . . . . 13 PHE HB3 . 50688 1
163 . 1 . 1 13 13 PHE C C 13 172.737 0 . 1 . . . . . 13 PHE C . 50688 1
164 . 1 . 1 13 13 PHE CA C 13 55.204 0.019 . 1 . . . . . 13 PHE CA . 50688 1
165 . 1 . 1 13 13 PHE CB C 13 39.137 0 . 1 . . . . . 13 PHE CB . 50688 1
166 . 1 . 1 13 13 PHE N N 15 119.783 0.061 . 1 . . . . . 13 PHE N . 50688 1
167 . 1 . 1 14 14 PRO HA H 1 4.688 0.004 . 1 . . . . . 14 PRO HA . 50688 1
168 . 1 . 1 14 14 PRO HB2 H 1 2.279 0.004 . 2 . . . . . 14 PRO HB2 . 50688 1
169 . 1 . 1 14 14 PRO HB3 H 1 2.081 0.004 . 2 . . . . . 14 PRO HB3 . 50688 1
170 . 1 . 1 14 14 PRO HG2 H 1 1.981 0.002 . 1 . . . . . 14 PRO HG2 . 50688 1
171 . 1 . 1 14 14 PRO HG3 H 1 1.981 0.002 . 1 . . . . . 14 PRO HG3 . 50688 1
172 . 1 . 1 14 14 PRO HD2 H 1 3.759 0.003 . 2 . . . . . 14 PRO HD2 . 50688 1
173 . 1 . 1 14 14 PRO HD3 H 1 3.5 0.001 . 2 . . . . . 14 PRO HD3 . 50688 1
174 . 1 . 1 14 14 PRO C C 13 177.901 0 . 1 . . . . . 14 PRO C . 50688 1
175 . 1 . 1 14 14 PRO CA C 13 63.676 0.103 . 1 . . . . . 14 PRO CA . 50688 1
176 . 1 . 1 14 14 PRO CB C 13 32.91 0 . 1 . . . . . 14 PRO CB . 50688 1
177 . 1 . 1 14 14 PRO CG C 13 26.351 0 . 1 . . . . . 14 PRO CG . 50688 1
178 . 1 . 1 14 14 PRO CD C 13 50.188 0.015 . 1 . . . . . 14 PRO CD . 50688 1
179 . 1 . 1 15 15 ASP H H 1 8.168 0.004 . 1 . . . . . 15 ASP H . 50688 1
180 . 1 . 1 15 15 ASP HA H 1 4.738 0.001 . 1 . . . . . 15 ASP HA . 50688 1
181 . 1 . 1 15 15 ASP HB2 H 1 2.873 0.003 . 2 . . . . . 15 ASP HB2 . 50688 1
182 . 1 . 1 15 15 ASP HB3 H 1 2.78 0.005 . 2 . . . . . 15 ASP HB3 . 50688 1
183 . 1 . 1 15 15 ASP C C 13 177.907 0 . 1 . . . . . 15 ASP C . 50688 1
184 . 1 . 1 15 15 ASP CA C 13 54.743 0.034 . 1 . . . . . 15 ASP CA . 50688 1
185 . 1 . 1 15 15 ASP CB C 13 42.13 0.067 . 1 . . . . . 15 ASP CB . 50688 1
186 . 1 . 1 15 15 ASP N N 15 120.531 0.067 . 1 . . . . . 15 ASP N . 50688 1
187 . 1 . 1 16 16 SER HA H 1 4.206 0.005 . 1 . . . . . 16 SER HA . 50688 1
188 . 1 . 1 16 16 SER HB2 H 1 4.023 0.005 . 1 . . . . . 16 SER HB2 . 50688 1
189 . 1 . 1 16 16 SER HB3 H 1 4.023 0.005 . 1 . . . . . 16 SER HB3 . 50688 1
190 . 1 . 1 16 16 SER C C 13 176.299 0 . 1 . . . . . 16 SER C . 50688 1
191 . 1 . 1 16 16 SER CA C 13 61.864 0 . 1 . . . . . 16 SER CA . 50688 1
192 . 1 . 1 16 16 SER CB C 13 63.485 0 . 1 . . . . . 16 SER CB . 50688 1
193 . 1 . 1 17 17 GLU H H 1 8.863 0.014 . 1 . . . . . 17 GLU H . 50688 1
194 . 1 . 1 17 17 GLU HA H 1 4.208 0 . 1 . . . . . 17 GLU HA . 50688 1
195 . 1 . 1 17 17 GLU HB2 H 1 2.113 0 . 1 . . . . . 17 GLU HB2 . 50688 1
196 . 1 . 1 17 17 GLU HB3 H 1 2.113 0 . 1 . . . . . 17 GLU HB3 . 50688 1
197 . 1 . 1 17 17 GLU C C 13 178.499 0.013 . 1 . . . . . 17 GLU C . 50688 1
198 . 1 . 1 17 17 GLU CA C 13 58.904 0.059 . 1 . . . . . 17 GLU CA . 50688 1
199 . 1 . 1 17 17 GLU CB C 13 29.286 0.181 . 1 . . . . . 17 GLU CB . 50688 1
200 . 1 . 1 17 17 GLU N N 15 121.114 0.039 . 1 . . . . . 17 GLU N . 50688 1
201 . 1 . 1 18 18 GLN H H 1 7.762 0.004 . 1 . . . . . 18 GLN H . 50688 1
202 . 1 . 1 18 18 GLN HA H 1 4.218 0.001 . 1 . . . . . 18 GLN HA . 50688 1
203 . 1 . 1 18 18 GLN HB2 H 1 2.243 0.003 . 2 . . . . . 18 GLN HB2 . 50688 1
204 . 1 . 1 18 18 GLN HB3 H 1 1.942 0.003 . 2 . . . . . 18 GLN HB3 . 50688 1
205 . 1 . 1 18 18 GLN HG2 H 1 2.412 0.002 . 2 . . . . . 18 GLN HG2 . 50688 1
206 . 1 . 1 18 18 GLN HG3 H 1 2.331 0.002 . 2 . . . . . 18 GLN HG3 . 50688 1
207 . 1 . 1 18 18 GLN C C 13 176.949 0.026 . 1 . . . . . 18 GLN C . 50688 1
208 . 1 . 1 18 18 GLN CA C 13 57.476 0.158 . 1 . . . . . 18 GLN CA . 50688 1
209 . 1 . 1 18 18 GLN CB C 13 28.496 0.07 . 1 . . . . . 18 GLN CB . 50688 1
210 . 1 . 1 18 18 GLN CG C 13 34.469 0 . 1 . . . . . 18 GLN CG . 50688 1
211 . 1 . 1 18 18 GLN N N 15 117.75 0.059 . 1 . . . . . 18 GLN N . 50688 1
212 . 1 . 1 19 19 LYS H H 1 7.757 0.006 . 1 . . . . . 19 LYS H . 50688 1
213 . 1 . 1 19 19 LYS HA H 1 3.943 0.002 . 1 . . . . . 19 LYS HA . 50688 1
214 . 1 . 1 19 19 LYS HB2 H 1 1.912 0.002 . 2 . . . . . 19 LYS HB2 . 50688 1
215 . 1 . 1 19 19 LYS HB3 H 1 1.954 0.002 . 2 . . . . . 19 LYS HB3 . 50688 1
216 . 1 . 1 19 19 LYS HG2 H 1 1.465 0.005 . 2 . . . . . 19 LYS HG2 . 50688 1
217 . 1 . 1 19 19 LYS HG3 H 1 1.554 0.006 . 2 . . . . . 19 LYS HG3 . 50688 1
218 . 1 . 1 19 19 LYS HD2 H 1 1.734 0.003 . 1 . . . . . 19 LYS HD2 . 50688 1
219 . 1 . 1 19 19 LYS HD3 H 1 1.733 0.003 . 1 . . . . . 19 LYS HD3 . 50688 1
220 . 1 . 1 19 19 LYS HE2 H 1 3.034 0.003 . 1 . . . . . 19 LYS HE2 . 50688 1
221 . 1 . 1 19 19 LYS HE3 H 1 3.035 0.003 . 1 . . . . . 19 LYS HE3 . 50688 1
222 . 1 . 1 19 19 LYS C C 13 177.807 0.042 . 1 . . . . . 19 LYS C . 50688 1
223 . 1 . 1 19 19 LYS CA C 13 59.955 0.1 . 1 . . . . . 19 LYS CA . 50688 1
224 . 1 . 1 19 19 LYS CB C 13 32.44 0.047 . 1 . . . . . 19 LYS CB . 50688 1
225 . 1 . 1 19 19 LYS CG C 13 25.276 0 . 1 . . . . . 19 LYS CG . 50688 1
226 . 1 . 1 19 19 LYS CD C 13 29.674 0 . 1 . . . . . 19 LYS CD . 50688 1
227 . 1 . 1 19 19 LYS CE C 13 42.224 0 . 1 . . . . . 19 LYS CE . 50688 1
228 . 1 . 1 19 19 LYS N N 15 120.152 0.024 . 1 . . . . . 19 LYS N . 50688 1
229 . 1 . 1 20 20 LEU H H 1 7.578 0.004 . 1 . . . . . 20 LEU H . 50688 1
230 . 1 . 1 20 20 LEU HA H 1 4.238 0.002 . 1 . . . . . 20 LEU HA . 50688 1
231 . 1 . 1 20 20 LEU HB2 H 1 1.787 0.002 . 2 . . . . . 20 LEU HB2 . 50688 1
232 . 1 . 1 20 20 LEU HB3 H 1 1.648 0.005 . 2 . . . . . 20 LEU HB3 . 50688 1
233 . 1 . 1 20 20 LEU HG H 1 1.739 0.003 . 1 . . . . . 20 LEU HG . 50688 1
234 . 1 . 1 20 20 LEU HD11 H 1 0.99 0.001 . 2 . . . . . 20 LEU HD11 . 50688 1
235 . 1 . 1 20 20 LEU HD12 H 1 0.99 0.001 . 2 . . . . . 20 LEU HD12 . 50688 1
236 . 1 . 1 20 20 LEU HD13 H 1 0.99 0.001 . 2 . . . . . 20 LEU HD13 . 50688 1
237 . 1 . 1 20 20 LEU HD21 H 1 0.938 0.001 . 2 . . . . . 20 LEU HD21 . 50688 1
238 . 1 . 1 20 20 LEU HD22 H 1 0.938 0.001 . 2 . . . . . 20 LEU HD22 . 50688 1
239 . 1 . 1 20 20 LEU HD23 H 1 0.938 0.001 . 2 . . . . . 20 LEU HD23 . 50688 1
240 . 1 . 1 20 20 LEU C C 13 179.013 0.007 . 1 . . . . . 20 LEU C . 50688 1
241 . 1 . 1 20 20 LEU CA C 13 57.452 0.153 . 1 . . . . . 20 LEU CA . 50688 1
242 . 1 . 1 20 20 LEU CB C 13 41.701 0.032 . 1 . . . . . 20 LEU CB . 50688 1
243 . 1 . 1 20 20 LEU CG C 13 27.05 0 . 1 . . . . . 20 LEU CG . 50688 1
244 . 1 . 1 20 20 LEU CD1 C 13 24.355 0 . 2 . . . . . 20 LEU CD1 . 50688 1
245 . 1 . 1 20 20 LEU CD2 C 13 24.009 0 . 2 . . . . . 20 LEU CD2 . 50688 1
246 . 1 . 1 20 20 LEU N N 15 117.685 0.078 . 1 . . . . . 20 LEU N . 50688 1
247 . 1 . 1 21 21 LYS H H 1 7.432 0.005 . 1 . . . . . 21 LYS H . 50688 1
248 . 1 . 1 21 21 LYS HA H 1 4.182 0.004 . 1 . . . . . 21 LYS HA . 50688 1
249 . 1 . 1 21 21 LYS HB2 H 1 1.932 0.005 . 1 . . . . . 21 LYS HB2 . 50688 1
250 . 1 . 1 21 21 LYS HB3 H 1 1.932 0.005 . 1 . . . . . 21 LYS HB3 . 50688 1
251 . 1 . 1 21 21 LYS HG2 H 1 1.537 0.001 . 1 . . . . . 21 LYS HG2 . 50688 1
252 . 1 . 1 21 21 LYS HG3 H 1 1.538 0.001 . 1 . . . . . 21 LYS HG3 . 50688 1
253 . 1 . 1 21 21 LYS HD2 H 1 1.786 0.005 . 1 . . . . . 21 LYS HD2 . 50688 1
254 . 1 . 1 21 21 LYS HD3 H 1 1.786 0.005 . 1 . . . . . 21 LYS HD3 . 50688 1
255 . 1 . 1 21 21 LYS HE2 H 1 3.039 0.001 . 1 . . . . . 21 LYS HE2 . 50688 1
256 . 1 . 1 21 21 LYS HE3 H 1 3.039 0.001 . 1 . . . . . 21 LYS HE3 . 50688 1
257 . 1 . 1 21 21 LYS C C 13 178.294 0.009 . 1 . . . . . 21 LYS C . 50688 1
258 . 1 . 1 21 21 LYS CA C 13 58.166 0.135 . 1 . . . . . 21 LYS CA . 50688 1
259 . 1 . 1 21 21 LYS CB C 13 32.591 0.058 . 1 . . . . . 21 LYS CB . 50688 1
260 . 1 . 1 21 21 LYS CG C 13 24.964 0 . 1 . . . . . 21 LYS CG . 50688 1
261 . 1 . 1 21 21 LYS CD C 13 29.049 0 . 1 . . . . . 21 LYS CD . 50688 1
262 . 1 . 1 21 21 LYS N N 15 119.745 0.058 . 1 . . . . . 21 LYS N . 50688 1
263 . 1 . 1 22 22 ILE H H 1 8.159 0.006 . 1 . . . . . 22 ILE H . 50688 1
264 . 1 . 1 22 22 ILE HA H 1 3.523 0.004 . 1 . . . . . 22 ILE HA . 50688 1
265 . 1 . 1 22 22 ILE HB H 1 2.026 0.004 . 1 . . . . . 22 ILE HB . 50688 1
266 . 1 . 1 22 22 ILE HG12 H 1 0.978 0.004 . 2 . . . . . 22 ILE HG12 . 50688 1
267 . 1 . 1 22 22 ILE HG13 H 1 1.703 0.001 . 2 . . . . . 22 ILE HG13 . 50688 1
268 . 1 . 1 22 22 ILE HG21 H 1 0.93 0.004 . 1 . . . . . 22 ILE HG21 . 50688 1
269 . 1 . 1 22 22 ILE HG22 H 1 0.93 0.004 . 1 . . . . . 22 ILE HG22 . 50688 1
270 . 1 . 1 22 22 ILE HG23 H 1 0.93 0.004 . 1 . . . . . 22 ILE HG23 . 50688 1
271 . 1 . 1 22 22 ILE HD11 H 1 0.926 0.006 . 1 . . . . . 22 ILE HD11 . 50688 1
272 . 1 . 1 22 22 ILE HD12 H 1 0.926 0.006 . 1 . . . . . 22 ILE HD12 . 50688 1
273 . 1 . 1 22 22 ILE HD13 H 1 0.926 0.006 . 1 . . . . . 22 ILE HD13 . 50688 1
274 . 1 . 1 22 22 ILE C C 13 176.878 0.007 . 1 . . . . . 22 ILE C . 50688 1
275 . 1 . 1 22 22 ILE CA C 13 65.572 0.148 . 1 . . . . . 22 ILE CA . 50688 1
276 . 1 . 1 22 22 ILE CB C 13 38.072 0.056 . 1 . . . . . 22 ILE CB . 50688 1
277 . 1 . 1 22 22 ILE CG1 C 13 30.542 0.02 . 1 . . . . . 22 ILE CG1 . 50688 1
278 . 1 . 1 22 22 ILE CG2 C 13 17.487 0.033 . 1 . . . . . 22 ILE CG2 . 50688 1
279 . 1 . 1 22 22 ILE CD1 C 13 14.137 0.022 . 1 . . . . . 22 ILE CD1 . 50688 1
280 . 1 . 1 22 22 ILE N N 15 119.766 0.059 . 1 . . . . . 22 ILE N . 50688 1
281 . 1 . 1 23 23 ASP H H 1 7.876 0.008 . 1 . . . . . 23 ASP H . 50688 1
282 . 1 . 1 23 23 ASP HA H 1 4.495 0.002 . 1 . . . . . 23 ASP HA . 50688 1
283 . 1 . 1 23 23 ASP HB2 H 1 2.759 0 . 2 . . . . . 23 ASP HB2 . 50688 1
284 . 1 . 1 23 23 ASP HB3 H 1 2.677 0.006 . 2 . . . . . 23 ASP HB3 . 50688 1
285 . 1 . 1 23 23 ASP C C 13 179.439 0.024 . 1 . . . . . 23 ASP C . 50688 1
286 . 1 . 1 23 23 ASP CA C 13 57.655 0.063 . 1 . . . . . 23 ASP CA . 50688 1
287 . 1 . 1 23 23 ASP CB C 13 40.121 0.014 . 1 . . . . . 23 ASP CB . 50688 1
288 . 1 . 1 23 23 ASP N N 15 118.717 0.06 . 1 . . . . . 23 ASP N . 50688 1
289 . 1 . 1 24 24 GLN H H 1 7.901 0.008 . 1 . . . . . 24 GLN H . 50688 1
290 . 1 . 1 24 24 GLN HA H 1 4.136 0.004 . 1 . . . . . 24 GLN HA . 50688 1
291 . 1 . 1 24 24 GLN HB2 H 1 2.329 0.005 . 2 . . . . . 24 GLN HB2 . 50688 1
292 . 1 . 1 24 24 GLN HB3 H 1 2.185 0.002 . 2 . . . . . 24 GLN HB3 . 50688 1
293 . 1 . 1 24 24 GLN HG2 H 1 2.599 0.001 . 2 . . . . . 24 GLN HG2 . 50688 1
294 . 1 . 1 24 24 GLN HG3 H 1 2.416 0.001 . 2 . . . . . 24 GLN HG3 . 50688 1
295 . 1 . 1 24 24 GLN C C 13 178.979 0.004 . 1 . . . . . 24 GLN C . 50688 1
296 . 1 . 1 24 24 GLN CA C 13 58.793 0.08 . 1 . . . . . 24 GLN CA . 50688 1
297 . 1 . 1 24 24 GLN CB C 13 28.642 0.087 . 1 . . . . . 24 GLN CB . 50688 1
298 . 1 . 1 24 24 GLN CG C 13 33.844 0 . 1 . . . . . 24 GLN CG . 50688 1
299 . 1 . 1 24 24 GLN N N 15 119.765 0.053 . 1 . . . . . 24 GLN N . 50688 1
300 . 1 . 1 25 25 ILE H H 1 8.418 0.019 . 1 . . . . . 25 ILE H . 50688 1
301 . 1 . 1 25 25 ILE HA H 1 3.956 0.002 . 1 . . . . . 25 ILE HA . 50688 1
302 . 1 . 1 25 25 ILE HB H 1 2.034 0.004 . 1 . . . . . 25 ILE HB . 50688 1
303 . 1 . 1 25 25 ILE HG12 H 1 1.639 0.001 . 2 . . . . . 25 ILE HG12 . 50688 1
304 . 1 . 1 25 25 ILE HG13 H 1 1.36 0.001 . 2 . . . . . 25 ILE HG13 . 50688 1
305 . 1 . 1 25 25 ILE HG21 H 1 0.929 0.001 . 1 . . . . . 25 ILE HG21 . 50688 1
306 . 1 . 1 25 25 ILE HG22 H 1 0.929 0.001 . 1 . . . . . 25 ILE HG22 . 50688 1
307 . 1 . 1 25 25 ILE HG23 H 1 0.929 0.001 . 1 . . . . . 25 ILE HG23 . 50688 1
308 . 1 . 1 25 25 ILE HD11 H 1 0.8 0.001 . 1 . . . . . 25 ILE HD11 . 50688 1
309 . 1 . 1 25 25 ILE HD12 H 1 0.8 0.001 . 1 . . . . . 25 ILE HD12 . 50688 1
310 . 1 . 1 25 25 ILE HD13 H 1 0.8 0.001 . 1 . . . . . 25 ILE HD13 . 50688 1
311 . 1 . 1 25 25 ILE C C 13 178.391 0.031 . 1 . . . . . 25 ILE C . 50688 1
312 . 1 . 1 25 25 ILE CA C 13 64.369 0.03 . 1 . . . . . 25 ILE CA . 50688 1
313 . 1 . 1 25 25 ILE CB C 13 37.49 0.009 . 1 . . . . . 25 ILE CB . 50688 1
314 . 1 . 1 25 25 ILE CG1 C 13 28.675 0 . 1 . . . . . 25 ILE CG1 . 50688 1
315 . 1 . 1 25 25 ILE CG2 C 13 18.246 0 . 1 . . . . . 25 ILE CG2 . 50688 1
316 . 1 . 1 25 25 ILE CD1 C 13 13.847 0 . 1 . . . . . 25 ILE CD1 . 50688 1
317 . 1 . 1 25 25 ILE N N 15 121.613 0.034 . 1 . . . . . 25 ILE N . 50688 1
318 . 1 . 1 26 26 LEU H H 1 8.361 0.007 . 1 . . . . . 26 LEU H . 50688 1
319 . 1 . 1 26 26 LEU HA H 1 4.065 0.005 . 1 . . . . . 26 LEU HA . 50688 1
320 . 1 . 1 26 26 LEU HB2 H 1 1.865 0.007 . 2 . . . . . 26 LEU HB2 . 50688 1
321 . 1 . 1 26 26 LEU HB3 H 1 1.479 0.005 . 2 . . . . . 26 LEU HB3 . 50688 1
322 . 1 . 1 26 26 LEU HG H 1 1.875 0.003 . 1 . . . . . 26 LEU HG . 50688 1
323 . 1 . 1 26 26 LEU HD11 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD11 . 50688 1
324 . 1 . 1 26 26 LEU HD12 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD12 . 50688 1
325 . 1 . 1 26 26 LEU HD13 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD13 . 50688 1
326 . 1 . 1 26 26 LEU HD21 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD21 . 50688 1
327 . 1 . 1 26 26 LEU HD22 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD22 . 50688 1
328 . 1 . 1 26 26 LEU HD23 H 1 0.874 0.002 . 2 . . . . . 26 LEU HD23 . 50688 1
329 . 1 . 1 26 26 LEU C C 13 179.28 0.041 . 1 . . . . . 26 LEU C . 50688 1
330 . 1 . 1 26 26 LEU CA C 13 57.541 0.056 . 1 . . . . . 26 LEU CA . 50688 1
331 . 1 . 1 26 26 LEU CB C 13 41.084 0.07 . 1 . . . . . 26 LEU CB . 50688 1
332 . 1 . 1 26 26 LEU CG C 13 26.582 0 . 1 . . . . . 26 LEU CG . 50688 1
333 . 1 . 1 26 26 LEU CD1 C 13 22.949 0 . 2 . . . . . 26 LEU CD1 . 50688 1
334 . 1 . 1 26 26 LEU CD2 C 13 25.883 0 . 2 . . . . . 26 LEU CD2 . 50688 1
335 . 1 . 1 26 26 LEU N N 15 119.913 0.038 . 1 . . . . . 26 LEU N . 50688 1
336 . 1 . 1 27 27 ALA H H 1 7.517 0.008 . 1 . . . . . 27 ALA H . 50688 1
337 . 1 . 1 27 27 ALA HA H 1 4.153 0.002 . 1 . . . . . 27 ALA HA . 50688 1
338 . 1 . 1 27 27 ALA HB1 H 1 1.479 0.002 . 1 . . . . . 27 ALA HB1 . 50688 1
339 . 1 . 1 27 27 ALA HB2 H 1 1.479 0.002 . 1 . . . . . 27 ALA HB2 . 50688 1
340 . 1 . 1 27 27 ALA HB3 H 1 1.479 0.002 . 1 . . . . . 27 ALA HB3 . 50688 1
341 . 1 . 1 27 27 ALA C C 13 178.916 0.031 . 1 . . . . . 27 ALA C . 50688 1
342 . 1 . 1 27 27 ALA CA C 13 53.919 0.084 . 1 . . . . . 27 ALA CA . 50688 1
343 . 1 . 1 27 27 ALA CB C 13 18.291 0.165 . 1 . . . . . 27 ALA CB . 50688 1
344 . 1 . 1 27 27 ALA N N 15 119.165 0.06 . 1 . . . . . 27 ALA N . 50688 1
345 . 1 . 1 28 28 ALA H H 1 7.547 0.008 . 1 . . . . . 28 ALA H . 50688 1
346 . 1 . 1 28 28 ALA HA H 1 4.223 0.005 . 1 . . . . . 28 ALA HA . 50688 1
347 . 1 . 1 28 28 ALA HB1 H 1 1.315 0.001 . 1 . . . . . 28 ALA HB1 . 50688 1
348 . 1 . 1 28 28 ALA HB2 H 1 1.315 0.001 . 1 . . . . . 28 ALA HB2 . 50688 1
349 . 1 . 1 28 28 ALA HB3 H 1 1.315 0.001 . 1 . . . . . 28 ALA HB3 . 50688 1
350 . 1 . 1 28 28 ALA C C 13 177.305 0.01 . 1 . . . . . 28 ALA C . 50688 1
351 . 1 . 1 28 28 ALA CA C 13 52.841 0.063 . 1 . . . . . 28 ALA CA . 50688 1
352 . 1 . 1 28 28 ALA CB C 13 19.213 0.013 . 1 . . . . . 28 ALA CB . 50688 1
353 . 1 . 1 28 28 ALA N N 15 118.421 0.078 . 1 . . . . . 28 ALA N . 50688 1
354 . 1 . 1 29 29 HIS H H 1 7.628 0.003 . 1 . . . . . 29 HIS H . 50688 1
355 . 1 . 1 29 29 HIS HA H 1 4.93 0.001 . 1 . . . . . 29 HIS HA . 50688 1
356 . 1 . 1 29 29 HIS HB2 H 1 3.016 0.002 . 2 . . . . . 29 HIS HB2 . 50688 1
357 . 1 . 1 29 29 HIS HB3 H 1 2.9 0.001 . 2 . . . . . 29 HIS HB3 . 50688 1
358 . 1 . 1 29 29 HIS C C 13 173.164 0 . 1 . . . . . 29 HIS C . 50688 1
359 . 1 . 1 29 29 HIS CA C 13 53.704 0.07 . 1 . . . . . 29 HIS CA . 50688 1
360 . 1 . 1 29 29 HIS CB C 13 29.664 0.048 . 1 . . . . . 29 HIS CB . 50688 1
361 . 1 . 1 29 29 HIS N N 15 115.8 0.114 . 1 . . . . . 29 HIS N . 50688 1
362 . 1 . 1 30 30 PRO HA H 1 4.44 0.002 . 1 . . . . . 30 PRO HA . 50688 1
363 . 1 . 1 30 30 PRO HB2 H 1 2.229 0.003 . 2 . . . . . 30 PRO HB2 . 50688 1
364 . 1 . 1 30 30 PRO HB3 H 1 1.701 0.002 . 2 . . . . . 30 PRO HB3 . 50688 1
365 . 1 . 1 30 30 PRO HG2 H 1 1.948 0.002 . 2 . . . . . 30 PRO HG2 . 50688 1
366 . 1 . 1 30 30 PRO HG3 H 1 1.698 0.003 . 2 . . . . . 30 PRO HG3 . 50688 1
367 . 1 . 1 30 30 PRO HD2 H 1 3.453 0.011 . 2 . . . . . 30 PRO HD2 . 50688 1
368 . 1 . 1 30 30 PRO HD3 H 1 3.433 0.007 . 2 . . . . . 30 PRO HD3 . 50688 1
369 . 1 . 1 30 30 PRO C C 13 176.573 0 . 1 . . . . . 30 PRO C . 50688 1
370 . 1 . 1 30 30 PRO CA C 13 64.585 0.063 . 1 . . . . . 30 PRO CA . 50688 1
371 . 1 . 1 30 30 PRO CB C 13 31.471 0 . 1 . . . . . 30 PRO CB . 50688 1
372 . 1 . 1 30 30 PRO CG C 13 27.253 0 . 1 . . . . . 30 PRO CG . 50688 1
373 . 1 . 1 30 30 PRO CD C 13 50.06 0 . 1 . . . . . 30 PRO CD . 50688 1
374 . 1 . 1 31 31 TYR H H 1 7.727 0.017 . 1 . . . . . 31 TYR H . 50688 1
375 . 1 . 1 31 31 TYR HA H 1 4.693 0.005 . 1 . . . . . 31 TYR HA . 50688 1
376 . 1 . 1 31 31 TYR HB2 H 1 3.251 0.004 . 2 . . . . . 31 TYR HB2 . 50688 1
377 . 1 . 1 31 31 TYR HB3 H 1 3.081 0.005 . 2 . . . . . 31 TYR HB3 . 50688 1
378 . 1 . 1 31 31 TYR C C 13 175.726 0.033 . 1 . . . . . 31 TYR C . 50688 1
379 . 1 . 1 31 31 TYR CA C 13 56.387 0.032 . 1 . . . . . 31 TYR CA . 50688 1
380 . 1 . 1 31 31 TYR CB C 13 37.863 0.052 . 1 . . . . . 31 TYR CB . 50688 1
381 . 1 . 1 31 31 TYR N N 15 115.455 0.104 . 1 . . . . . 31 TYR N . 50688 1
382 . 1 . 1 32 32 MET H H 1 7.387 0.016 . 1 . . . . . 32 MET H . 50688 1
383 . 1 . 1 32 32 MET HA H 1 4.392 0.002 . 1 . . . . . 32 MET HA . 50688 1
384 . 1 . 1 32 32 MET HB2 H 1 2.101 0.001 . 2 . . . . . 32 MET HB2 . 50688 1
385 . 1 . 1 32 32 MET HB3 H 1 2.001 0.002 . 2 . . . . . 32 MET HB3 . 50688 1
386 . 1 . 1 32 32 MET HG2 H 1 2.499 0.001 . 2 . . . . . 32 MET HG2 . 50688 1
387 . 1 . 1 32 32 MET HG3 H 1 2.376 0.003 . 2 . . . . . 32 MET HG3 . 50688 1
388 . 1 . 1 32 32 MET C C 13 175.16 0 . 1 . . . . . 32 MET C . 50688 1
389 . 1 . 1 32 32 MET CA C 13 56.177 0 . 1 . . . . . 32 MET CA . 50688 1
390 . 1 . 1 32 32 MET CB C 13 33.792 0.001 . 1 . . . . . 32 MET CB . 50688 1
391 . 1 . 1 32 32 MET CG C 13 32.386 0 . 1 . . . . . 32 MET CG . 50688 1
392 . 1 . 1 32 32 MET N N 15 122.519 0.012 . 1 . . . . . 32 MET N . 50688 1
393 . 1 . 1 33 33 LYS HA H 1 4.476 0.003 . 1 . . . . . 33 LYS HA . 50688 1
394 . 1 . 1 33 33 LYS HB2 H 1 1.994 0.003 . 2 . . . . . 33 LYS HB2 . 50688 1
395 . 1 . 1 33 33 LYS HB3 H 1 1.769 0.003 . 2 . . . . . 33 LYS HB3 . 50688 1
396 . 1 . 1 33 33 LYS HG2 H 1 1.478 0.002 . 2 . . . . . 33 LYS HG2 . 50688 1
397 . 1 . 1 33 33 LYS HG3 H 1 1.412 0.002 . 2 . . . . . 33 LYS HG3 . 50688 1
398 . 1 . 1 33 33 LYS HD2 H 1 1.714 0.002 . 1 . . . . . 33 LYS HD2 . 50688 1
399 . 1 . 1 33 33 LYS HD3 H 1 1.714 0.002 . 1 . . . . . 33 LYS HD3 . 50688 1
400 . 1 . 1 33 33 LYS HE2 H 1 3.055 0.002 . 1 . . . . . 33 LYS HE2 . 50688 1
401 . 1 . 1 33 33 LYS HE3 H 1 3.056 0.002 . 1 . . . . . 33 LYS HE3 . 50688 1
402 . 1 . 1 33 33 LYS C C 13 175.105 0 . 1 . . . . . 33 LYS C . 50688 1
403 . 1 . 1 33 33 LYS CA C 13 55.327 0.06 . 1 . . . . . 33 LYS CA . 50688 1
404 . 1 . 1 33 33 LYS CB C 13 33.25 0.018 . 1 . . . . . 33 LYS CB . 50688 1
405 . 1 . 1 33 33 LYS CG C 13 24.027 0 . 1 . . . . . 33 LYS CG . 50688 1
406 . 1 . 1 33 33 LYS CD C 13 28.581 0 . 1 . . . . . 33 LYS CD . 50688 1
407 . 1 . 1 33 33 LYS CE C 13 42.849 0 . 1 . . . . . 33 LYS CE . 50688 1
408 . 1 . 1 34 34 ASP H H 1 7.179 0.019 . 1 . . . . . 34 ASP H . 50688 1
409 . 1 . 1 34 34 ASP HA H 1 4.71 0.001 . 1 . . . . . 34 ASP HA . 50688 1
410 . 1 . 1 34 34 ASP HB2 H 1 2.879 0.005 . 2 . . . . . 34 ASP HB2 . 50688 1
411 . 1 . 1 34 34 ASP HB3 H 1 2.708 0.005 . 2 . . . . . 34 ASP HB3 . 50688 1
412 . 1 . 1 34 34 ASP C C 13 176.091 0.004 . 1 . . . . . 34 ASP C . 50688 1
413 . 1 . 1 34 34 ASP CA C 13 53.472 0.116 . 1 . . . . . 34 ASP CA . 50688 1
414 . 1 . 1 34 34 ASP CB C 13 42.274 0.07 . 1 . . . . . 34 ASP CB . 50688 1
415 . 1 . 1 34 34 ASP N N 15 118.628 0.109 . 1 . . . . . 34 ASP N . 50688 1
416 . 1 . 1 35 35 LEU H H 1 8.674 0.014 . 1 . . . . . 35 LEU H . 50688 1
417 . 1 . 1 35 35 LEU HA H 1 4.07 0.007 . 1 . . . . . 35 LEU HA . 50688 1
418 . 1 . 1 35 35 LEU HB2 H 1 1.647 0.005 . 2 . . . . . 35 LEU HB2 . 50688 1
419 . 1 . 1 35 35 LEU HB3 H 1 1.714 0.002 . 2 . . . . . 35 LEU HB3 . 50688 1
420 . 1 . 1 35 35 LEU HG H 1 1.713 0.003 . 1 . . . . . 35 LEU HG . 50688 1
421 . 1 . 1 35 35 LEU HD11 H 1 0.916 0.003 . 2 . . . . . 35 LEU HD11 . 50688 1
422 . 1 . 1 35 35 LEU HD12 H 1 0.916 0.003 . 2 . . . . . 35 LEU HD12 . 50688 1
423 . 1 . 1 35 35 LEU HD13 H 1 0.916 0.003 . 2 . . . . . 35 LEU HD13 . 50688 1
424 . 1 . 1 35 35 LEU HD21 H 1 0.952 0.002 . 2 . . . . . 35 LEU HD21 . 50688 1
425 . 1 . 1 35 35 LEU HD22 H 1 0.952 0.002 . 2 . . . . . 35 LEU HD22 . 50688 1
426 . 1 . 1 35 35 LEU HD23 H 1 0.952 0.002 . 2 . . . . . 35 LEU HD23 . 50688 1
427 . 1 . 1 35 35 LEU C C 13 178.926 0.011 . 1 . . . . . 35 LEU C . 50688 1
428 . 1 . 1 35 35 LEU CA C 13 57.599 0 . 1 . . . . . 35 LEU CA . 50688 1
429 . 1 . 1 35 35 LEU CB C 13 42.153 0 . 1 . . . . . 35 LEU CB . 50688 1
430 . 1 . 1 35 35 LEU CG C 13 26.894 0 . 1 . . . . . 35 LEU CG . 50688 1
431 . 1 . 1 35 35 LEU CD1 C 13 24.199 0 . 2 . . . . . 35 LEU CD1 . 50688 1
432 . 1 . 1 35 35 LEU CD2 C 13 25.102 0 . 2 . . . . . 35 LEU CD2 . 50688 1
433 . 1 . 1 35 35 LEU N N 15 126.55 0.087 . 1 . . . . . 35 LEU N . 50688 1
434 . 1 . 1 36 36 ASN H H 1 8.432 0.009 . 1 . . . . . 36 ASN H . 50688 1
435 . 1 . 1 36 36 ASN HA H 1 4.502 0.007 . 1 . . . . . 36 ASN HA . 50688 1
436 . 1 . 1 36 36 ASN HB2 H 1 2.996 0.001 . 2 . . . . . 36 ASN HB2 . 50688 1
437 . 1 . 1 36 36 ASN HB3 H 1 2.847 0.003 . 2 . . . . . 36 ASN HB3 . 50688 1
438 . 1 . 1 36 36 ASN HD21 H 1 7.79 0.005 . 1 . . . . . 36 ASN HD21 . 50688 1
439 . 1 . 1 36 36 ASN HD22 H 1 6.913 0.003 . 1 . . . . . 36 ASN HD22 . 50688 1
440 . 1 . 1 36 36 ASN C C 13 177.243 0 . 1 . . . . . 36 ASN C . 50688 1
441 . 1 . 1 36 36 ASN CA C 13 56.142 0.119 . 1 . . . . . 36 ASN CA . 50688 1
442 . 1 . 1 36 36 ASN CB C 13 38.013 0.014 . 1 . . . . . 36 ASN CB . 50688 1
443 . 1 . 1 36 36 ASN N N 15 118.696 0.04 . 1 . . . . . 36 ASN N . 50688 1
444 . 1 . 1 36 36 ASN ND2 N 15 113.666 0.025 . 1 . . . . . 36 ASN ND2 . 50688 1
445 . 1 . 1 37 37 ALA H H 1 7.862 0.002 . 1 . . . . . 37 ALA H . 50688 1
446 . 1 . 1 37 37 ALA HA H 1 4.215 0.006 . 1 . . . . . 37 ALA HA . 50688 1
447 . 1 . 1 37 37 ALA HB1 H 1 1.515 0.002 . 1 . . . . . 37 ALA HB1 . 50688 1
448 . 1 . 1 37 37 ALA HB2 H 1 1.515 0.002 . 1 . . . . . 37 ALA HB2 . 50688 1
449 . 1 . 1 37 37 ALA HB3 H 1 1.515 0.002 . 1 . . . . . 37 ALA HB3 . 50688 1
450 . 1 . 1 37 37 ALA C C 13 179.992 0 . 1 . . . . . 37 ALA C . 50688 1
451 . 1 . 1 37 37 ALA CA C 13 54.389 0.059 . 1 . . . . . 37 ALA CA . 50688 1
452 . 1 . 1 37 37 ALA CB C 13 18.782 0 . 1 . . . . . 37 ALA CB . 50688 1
453 . 1 . 1 37 37 ALA N N 15 124.32 0.046 . 1 . . . . . 37 ALA N . 50688 1
454 . 1 . 1 38 38 LEU H H 1 8.056 0.009 . 1 . . . . . 38 LEU H . 50688 1
455 . 1 . 1 38 38 LEU HA H 1 4.063 0.011 . 1 . . . . . 38 LEU HA . 50688 1
456 . 1 . 1 38 38 LEU HB2 H 1 1.882 0.005 . 2 . . . . . 38 LEU HB2 . 50688 1
457 . 1 . 1 38 38 LEU HB3 H 1 1.438 0.008 . 2 . . . . . 38 LEU HB3 . 50688 1
458 . 1 . 1 38 38 LEU HG H 1 1.641 0.001 . 1 . . . . . 38 LEU HG . 50688 1
459 . 1 . 1 38 38 LEU HD11 H 1 0.862 0.002 . 2 . . . . . 38 LEU HD11 . 50688 1
460 . 1 . 1 38 38 LEU HD12 H 1 0.862 0.002 . 2 . . . . . 38 LEU HD12 . 50688 1
461 . 1 . 1 38 38 LEU HD13 H 1 0.862 0.002 . 2 . . . . . 38 LEU HD13 . 50688 1
462 . 1 . 1 38 38 LEU HD21 H 1 0.86 0.001 . 2 . . . . . 38 LEU HD21 . 50688 1
463 . 1 . 1 38 38 LEU HD22 H 1 0.86 0.001 . 2 . . . . . 38 LEU HD22 . 50688 1
464 . 1 . 1 38 38 LEU HD23 H 1 0.86 0.001 . 2 . . . . . 38 LEU HD23 . 50688 1
465 . 1 . 1 38 38 LEU C C 13 178.648 0.012 . 1 . . . . . 38 LEU C . 50688 1
466 . 1 . 1 38 38 LEU CA C 13 57.463 0.09 . 1 . . . . . 38 LEU CA . 50688 1
467 . 1 . 1 38 38 LEU CB C 13 43.221 0.053 . 1 . . . . . 38 LEU CB . 50688 1
468 . 1 . 1 38 38 LEU CG C 13 27.849 0 . 1 . . . . . 38 LEU CG . 50688 1
469 . 1 . 1 38 38 LEU CD1 C 13 26.352 0 . 2 . . . . . 38 LEU CD1 . 50688 1
470 . 1 . 1 38 38 LEU CD2 C 13 23.73 0 . 2 . . . . . 38 LEU CD2 . 50688 1
471 . 1 . 1 38 38 LEU N N 15 118.261 0.06 . 1 . . . . . 38 LEU N . 50688 1
472 . 1 . 1 39 39 SER H H 1 8.232 0.012 . 1 . . . . . 39 SER H . 50688 1
473 . 1 . 1 39 39 SER HA H 1 4.193 0 . 1 . . . . . 39 SER HA . 50688 1
474 . 1 . 1 39 39 SER HB2 H 1 4.009 0 . 1 . . . . . 39 SER HB2 . 50688 1
475 . 1 . 1 39 39 SER HB3 H 1 4.009 0 . 1 . . . . . 39 SER HB3 . 50688 1
476 . 1 . 1 39 39 SER C C 13 175.32 0 . 1 . . . . . 39 SER C . 50688 1
477 . 1 . 1 39 39 SER CA C 13 61.916 0.114 . 1 . . . . . 39 SER CA . 50688 1
478 . 1 . 1 39 39 SER CB C 13 63.211 0.078 . 1 . . . . . 39 SER CB . 50688 1
479 . 1 . 1 39 39 SER N N 15 113.876 0.074 . 1 . . . . . 39 SER N . 50688 1
480 . 1 . 1 40 40 ALA H H 1 7.453 0.008 . 1 . . . . . 40 ALA H . 50688 1
481 . 1 . 1 40 40 ALA HA H 1 4.225 0.002 . 1 . . . . . 40 ALA HA . 50688 1
482 . 1 . 1 40 40 ALA HB1 H 1 1.499 0.005 . 1 . . . . . 40 ALA HB1 . 50688 1
483 . 1 . 1 40 40 ALA HB2 H 1 1.499 0.005 . 1 . . . . . 40 ALA HB2 . 50688 1
484 . 1 . 1 40 40 ALA HB3 H 1 1.499 0.005 . 1 . . . . . 40 ALA HB3 . 50688 1
485 . 1 . 1 40 40 ALA C C 13 179.035 0.012 . 1 . . . . . 40 ALA C . 50688 1
486 . 1 . 1 40 40 ALA CA C 13 54.219 0.114 . 1 . . . . . 40 ALA CA . 50688 1
487 . 1 . 1 40 40 ALA CB C 13 18.372 0.003 . 1 . . . . . 40 ALA CB . 50688 1
488 . 1 . 1 40 40 ALA N N 15 122.257 0.073 . 1 . . . . . 40 ALA N . 50688 1
489 . 1 . 1 41 41 LEU H H 1 7.385 0.007 . 1 . . . . . 41 LEU H . 50688 1
490 . 1 . 1 41 41 LEU HA H 1 4.244 0.006 . 1 . . . . . 41 LEU HA . 50688 1
491 . 1 . 1 41 41 LEU HB2 H 1 1.953 0.002 . 2 . . . . . 41 LEU HB2 . 50688 1
492 . 1 . 1 41 41 LEU HB3 H 1 1.453 0.003 . 2 . . . . . 41 LEU HB3 . 50688 1
493 . 1 . 1 41 41 LEU HG H 1 1.753 0.004 . 1 . . . . . 41 LEU HG . 50688 1
494 . 1 . 1 41 41 LEU HD11 H 1 0.628 0.002 . 2 . . . . . 41 LEU HD11 . 50688 1
495 . 1 . 1 41 41 LEU HD12 H 1 0.628 0.002 . 2 . . . . . 41 LEU HD12 . 50688 1
496 . 1 . 1 41 41 LEU HD13 H 1 0.628 0.002 . 2 . . . . . 41 LEU HD13 . 50688 1
497 . 1 . 1 41 41 LEU HD21 H 1 0.826 0.002 . 2 . . . . . 41 LEU HD21 . 50688 1
498 . 1 . 1 41 41 LEU HD22 H 1 0.826 0.002 . 2 . . . . . 41 LEU HD22 . 50688 1
499 . 1 . 1 41 41 LEU HD23 H 1 0.826 0.002 . 2 . . . . . 41 LEU HD23 . 50688 1
500 . 1 . 1 41 41 LEU C C 13 178.295 0 . 1 . . . . . 41 LEU C . 50688 1
501 . 1 . 1 41 41 LEU CA C 13 56.145 0.113 . 1 . . . . . 41 LEU CA . 50688 1
502 . 1 . 1 41 41 LEU CB C 13 42.31 0.037 . 1 . . . . . 41 LEU CB . 50688 1
503 . 1 . 1 41 41 LEU CG C 13 26.287 0 . 1 . . . . . 41 LEU CG . 50688 1
504 . 1 . 1 41 41 LEU CD1 C 13 25.727 0 . 2 . . . . . 41 LEU CD1 . 50688 1
505 . 1 . 1 41 41 LEU CD2 C 13 22.793 0 . 2 . . . . . 41 LEU CD2 . 50688 1
506 . 1 . 1 41 41 LEU N N 15 117.066 0.103 . 1 . . . . . 41 LEU N . 50688 1
507 . 1 . 1 42 42 VAL H H 1 7.588 0.006 . 1 . . . . . 42 VAL H . 50688 1
508 . 1 . 1 42 42 VAL HA H 1 3.562 0.022 . 1 . . . . . 42 VAL HA . 50688 1
509 . 1 . 1 42 42 VAL HB H 1 1.854 0.008 . 1 . . . . . 42 VAL HB . 50688 1
510 . 1 . 1 42 42 VAL HG11 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG11 . 50688 1
511 . 1 . 1 42 42 VAL HG12 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG12 . 50688 1
512 . 1 . 1 42 42 VAL HG13 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG13 . 50688 1
513 . 1 . 1 42 42 VAL HG21 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG21 . 50688 1
514 . 1 . 1 42 42 VAL HG22 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG22 . 50688 1
515 . 1 . 1 42 42 VAL HG23 H 1 0.819 0.003 . 2 . . . . . 42 VAL HG23 . 50688 1
516 . 1 . 1 42 42 VAL C C 13 176.468 0 . 1 . . . . . 42 VAL C . 50688 1
517 . 1 . 1 42 42 VAL CA C 13 64.866 0.029 . 1 . . . . . 42 VAL CA . 50688 1
518 . 1 . 1 42 42 VAL CB C 13 31.711 0.08 . 1 . . . . . 42 VAL CB . 50688 1
519 . 1 . 1 42 42 VAL CG1 C 13 22.094 0 . 1 . . . . . 42 VAL CG1 . 50688 1
520 . 1 . 1 42 42 VAL CG2 C 13 22.094 0 . 1 . . . . . 42 VAL CG2 . 50688 1
521 . 1 . 1 42 42 VAL N N 15 119.438 0.049 . 1 . . . . . 42 VAL N . 50688 1
522 . 1 . 1 43 43 LEU H H 1 7.519 0.014 . 1 . . . . . 43 LEU H . 50688 1
523 . 1 . 1 43 43 LEU HA H 1 4.264 0.006 . 1 . . . . . 43 LEU HA . 50688 1
524 . 1 . 1 43 43 LEU HB2 H 1 1.671 0.004 . 2 . . . . . 43 LEU HB2 . 50688 1
525 . 1 . 1 43 43 LEU HB3 H 1 1.738 0.001 . 2 . . . . . 43 LEU HB3 . 50688 1
526 . 1 . 1 43 43 LEU HG H 1 1.738 0.001 . 1 . . . . . 43 LEU HG . 50688 1
527 . 1 . 1 43 43 LEU HD11 H 1 1.012 0.001 . 2 . . . . . 43 LEU HD11 . 50688 1
528 . 1 . 1 43 43 LEU HD12 H 1 1.012 0.001 . 2 . . . . . 43 LEU HD12 . 50688 1
529 . 1 . 1 43 43 LEU HD13 H 1 1.012 0.001 . 2 . . . . . 43 LEU HD13 . 50688 1
530 . 1 . 1 43 43 LEU HD21 H 1 0.955 0.001 . 2 . . . . . 43 LEU HD21 . 50688 1
531 . 1 . 1 43 43 LEU HD22 H 1 0.955 0.001 . 2 . . . . . 43 LEU HD22 . 50688 1
532 . 1 . 1 43 43 LEU HD23 H 1 0.955 0.001 . 2 . . . . . 43 LEU HD23 . 50688 1
533 . 1 . 1 43 43 LEU C C 13 176.219 0.011 . 1 . . . . . 43 LEU C . 50688 1
534 . 1 . 1 43 43 LEU CA C 13 55.157 0.129 . 1 . . . . . 43 LEU CA . 50688 1
535 . 1 . 1 43 43 LEU CB C 13 42.938 0.217 . 1 . . . . . 43 LEU CB . 50688 1
536 . 1 . 1 43 43 LEU CG C 13 26.755 0 . 1 . . . . . 43 LEU CG . 50688 1
537 . 1 . 1 43 43 LEU CD1 C 13 25.293 0 . 2 . . . . . 43 LEU CD1 . 50688 1
538 . 1 . 1 43 43 LEU CD2 C 13 23.227 0 . 2 . . . . . 43 LEU CD2 . 50688 1
539 . 1 . 1 43 43 LEU N N 15 121.079 0.152 . 1 . . . . . 43 LEU N . 50688 1
540 . 1 . 1 44 44 ASP H H 1 7.477 0.004 . 1 . . . . . 44 ASP H . 50688 1
541 . 1 . 1 44 44 ASP HA H 1 4.415 0.001 . 1 . . . . . 44 ASP HA . 50688 1
542 . 1 . 1 44 44 ASP HB2 H 1 2.687 0.001 . 2 . . . . . 44 ASP HB2 . 50688 1
543 . 1 . 1 44 44 ASP HB3 H 1 2.595 0.005 . 2 . . . . . 44 ASP HB3 . 50688 1
544 . 1 . 1 44 44 ASP CA C 13 56.273 0.029 . 1 . . . . . 44 ASP CA . 50688 1
545 . 1 . 1 44 44 ASP CB C 13 42.464 0 . 1 . . . . . 44 ASP CB . 50688 1
546 . 1 . 1 44 44 ASP N N 15 125.456 0.067 . 1 . . . . . 44 ASP N . 50688 1
stop_
save_