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 17948
_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' . . . 17948 1
2 '3D HNCACB' . . . 17948 1
3 '3D CBCA(CO)NH' . . . 17948 1
4 '3D HBHA(CO)NH' . . . 17948 1
5 '3D 1H-13C NOESY aliphatic' . . . 17948 1
6 '3D 1H-15N NOESY' . . . 17948 1
7 '2D 1H-13C HSQC' . . . 17948 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 3 3 ASP H H 1 8.330 0.000 . 1 . . . A 3 ASP H . 17948 1
2 . 1 1 3 3 ASP HA H 1 4.610 0.000 . 1 . . . A 3 ASP HA . 17948 1
3 . 1 1 4 4 ALA H H 1 8.180 0.001 . 1 . . . A 4 ALA H . 17948 1
4 . 1 1 4 4 ALA HA H 1 4.260 0.000 . 1 . . . A 4 ALA HA . 17948 1
5 . 1 1 4 4 ALA HB1 H 1 1.403 0.000 . 1 . . . A 4 ALA HB1 . 17948 1
6 . 1 1 4 4 ALA HB2 H 1 1.403 0.000 . 1 . . . A 4 ALA HB2 . 17948 1
7 . 1 1 4 4 ALA HB3 H 1 1.403 0.000 . 1 . . . A 4 ALA HB3 . 17948 1
8 . 1 1 4 4 ALA CA C 13 53.000 0.000 . 1 . . . A 4 ALA CA . 17948 1
9 . 1 1 4 4 ALA CB C 13 18.965 0.000 . 1 . . . A 4 ALA CB . 17948 1
10 . 1 1 4 4 ALA N N 15 124.218 0.000 . 1 . . . A 4 ALA N . 17948 1
11 . 1 1 5 5 GLY H H 1 8.344 0.000 . 1 . . . A 5 GLY H . 17948 1
12 . 1 1 5 5 GLY HA2 H 1 3.930 0.000 . 2 . . . A 5 GLY HA2 . 17948 1
13 . 1 1 5 5 GLY HA3 H 1 3.950 0.000 . 2 . . . A 5 GLY HA3 . 17948 1
14 . 1 1 5 5 GLY CA C 13 45.100 0.000 . 1 . . . A 5 GLY CA . 17948 1
15 . 1 1 5 5 GLY N N 15 107.349 0.000 . 1 . . . A 5 GLY N . 17948 1
16 . 1 1 6 6 ARG H H 1 7.971 0.000 . 1 . . . A 6 ARG H . 17948 1
17 . 1 1 6 6 ARG HA H 1 4.270 0.000 . 1 . . . A 6 ARG HA . 17948 1
18 . 1 1 6 6 ARG N N 15 119.351 0.000 . 1 . . . A 6 ARG N . 17948 1
19 . 1 1 7 7 LYS H H 1 8.034 0.003 . 1 . . . A 7 LYS H . 17948 1
20 . 1 1 7 7 LYS HA H 1 4.280 0.000 . 1 . . . A 7 LYS HA . 17948 1
21 . 1 1 7 7 LYS HB2 H 1 1.790 0.000 . 2 . . . A 7 LYS HB2 . 17948 1
22 . 1 1 7 7 LYS HB3 H 1 1.780 0.000 . 2 . . . A 7 LYS HB3 . 17948 1
23 . 1 1 7 7 LYS CA C 13 56.400 0.000 . 1 . . . A 7 LYS CA . 17948 1
24 . 1 1 7 7 LYS CB C 13 32.900 0.000 . 1 . . . A 7 LYS CB . 17948 1
25 . 1 1 7 7 LYS N N 15 122.700 0.000 . 1 . . . A 7 LYS N . 17948 1
26 . 1 1 8 8 GLY H H 1 8.340 0.000 . 1 . . . A 8 GLY H . 17948 1
27 . 1 1 8 8 GLY HA2 H 1 3.930 0.000 . 2 . . . A 8 GLY HA2 . 17948 1
28 . 1 1 8 8 GLY HA3 H 1 3.950 0.000 . 2 . . . A 8 GLY HA3 . 17948 1
29 . 1 1 9 9 PHE H H 1 8.093 0.000 . 1 . . . A 9 PHE H . 17948 1
30 . 1 1 9 9 PHE HA H 1 4.620 0.000 . 1 . . . A 9 PHE HA . 17948 1
31 . 1 1 9 9 PHE HB2 H 1 2.990 0.000 . 2 . . . A 9 PHE HB2 . 17948 1
32 . 1 1 9 9 PHE HB3 H 1 2.970 0.000 . 2 . . . A 9 PHE HB3 . 17948 1
33 . 1 1 9 9 PHE CA C 13 56.000 0.000 . 1 . . . A 9 PHE CA . 17948 1
34 . 1 1 9 9 PHE CB C 13 39.950 0.000 . 1 . . . A 9 PHE CB . 17948 1
35 . 1 1 9 9 PHE N N 15 122.017 0.000 . 1 . . . A 9 PHE N . 17948 1
36 . 1 1 10 10 GLY H H 1 7.996 0.008 . 1 . . . A 10 GLY H . 17948 1
37 . 1 1 10 10 GLY HA2 H 1 3.836 0.000 . 2 . . . A 10 GLY HA2 . 17948 1
38 . 1 1 10 10 GLY HA3 H 1 3.950 0.000 . 2 . . . A 10 GLY HA3 . 17948 1
39 . 1 1 10 10 GLY CA C 13 45.554 0.000 . 1 . . . A 10 GLY CA . 17948 1
40 . 1 1 10 10 GLY N N 15 120.389 0.000 . 1 . . . A 10 GLY N . 17948 1
41 . 1 1 11 11 GLU H H 1 8.168 0.001 . 1 . . . A 11 GLU H . 17948 1
42 . 1 1 11 11 GLU HA H 1 4.260 0.000 . 1 . . . A 11 GLU HA . 17948 1
43 . 1 1 11 11 GLU HB2 H 1 1.966 0.000 . 2 . . . A 11 GLU HB2 . 17948 1
44 . 1 1 11 11 GLU HB3 H 1 2.040 0.000 . 2 . . . A 11 GLU HB3 . 17948 1
45 . 1 1 11 11 GLU CA C 13 57.061 0.000 . 1 . . . A 11 GLU CA . 17948 1
46 . 1 1 11 11 GLU CB C 13 30.200 0.000 . 1 . . . A 11 GLU CB . 17948 1
47 . 1 1 11 11 GLU N N 15 120.847 0.000 . 1 . . . A 11 GLU N . 17948 1
48 . 1 1 12 12 LYS H H 1 8.273 0.000 . 1 . . . A 12 LYS H . 17948 1
49 . 1 1 12 12 LYS HA H 1 4.280 0.000 . 1 . . . A 12 LYS HA . 17948 1
50 . 1 1 12 12 LYS HB2 H 1 1.777 0.000 . 2 . . . A 12 LYS HB2 . 17948 1
51 . 1 1 12 12 LYS HB3 H 1 1.833 0.000 . 2 . . . A 12 LYS HB3 . 17948 1
52 . 1 1 12 12 LYS CA C 13 56.552 0.000 . 1 . . . A 12 LYS CA . 17948 1
53 . 1 1 12 12 LYS CB C 13 32.800 0.000 . 1 . . . A 12 LYS CB . 17948 1
54 . 1 1 12 12 LYS N N 15 121.524 0.000 . 1 . . . A 12 LYS N . 17948 1
55 . 1 1 13 13 ALA H H 1 8.288 0.000 . 1 . . . A 13 ALA H . 17948 1
56 . 1 1 13 13 ALA HA H 1 4.260 0.000 . 1 . . . A 13 ALA HA . 17948 1
57 . 1 1 13 13 ALA HB1 H 1 1.388 0.000 . 1 . . . A 13 ALA HB1 . 17948 1
58 . 1 1 13 13 ALA HB2 H 1 1.388 0.000 . 1 . . . A 13 ALA HB2 . 17948 1
59 . 1 1 13 13 ALA HB3 H 1 1.388 0.000 . 1 . . . A 13 ALA HB3 . 17948 1
60 . 1 1 13 13 ALA CA C 13 53.056 0.000 . 1 . . . A 13 ALA CA . 17948 1
61 . 1 1 13 13 ALA CB C 13 18.900 0.000 . 1 . . . A 13 ALA CB . 17948 1
62 . 1 1 13 13 ALA N N 15 124.765 0.000 . 1 . . . A 13 ALA N . 17948 1
63 . 1 1 14 14 SER H H 1 8.145 0.000 . 1 . . . A 14 SER H . 17948 1
64 . 1 1 14 14 SER HA H 1 4.342 0.000 . 1 . . . A 14 SER HA . 17948 1
65 . 1 1 14 14 SER HB2 H 1 3.911 0.000 . 2 . . . A 14 SER HB2 . 17948 1
66 . 1 1 14 14 SER HB3 H 1 3.892 0.000 . 2 . . . A 14 SER HB3 . 17948 1
67 . 1 1 14 14 SER CA C 13 58.918 0.000 . 1 . . . A 14 SER CA . 17948 1
68 . 1 1 14 14 SER CB C 13 63.539 0.000 . 1 . . . A 14 SER CB . 17948 1
69 . 1 1 14 14 SER N N 15 114.047 0.000 . 1 . . . A 14 SER N . 17948 1
70 . 1 1 15 15 GLU H H 1 8.223 0.000 . 1 . . . A 15 GLU H . 17948 1
71 . 1 1 15 15 GLU HA H 1 4.260 0.000 . 1 . . . A 15 GLU HA . 17948 1
72 . 1 1 15 15 GLU HB2 H 1 1.961 0.000 . 2 . . . A 15 GLU HB2 . 17948 1
73 . 1 1 15 15 GLU HB3 H 1 2.080 0.000 . 2 . . . A 15 GLU HB3 . 17948 1
74 . 1 1 15 15 GLU CA C 13 48.017 0.000 . 1 . . . A 15 GLU CA . 17948 1
75 . 1 1 15 15 GLU CB C 13 30.341 0.000 . 1 . . . A 15 GLU CB . 17948 1
76 . 1 1 15 15 GLU N N 15 122.145 0.000 . 1 . . . A 15 GLU N . 17948 1
77 . 1 1 16 16 ALA H H 1 8.033 0.000 . 1 . . . A 16 ALA H . 17948 1
78 . 1 1 16 16 ALA HA H 1 4.284 0.000 . 1 . . . A 16 ALA HA . 17948 1
79 . 1 1 16 16 ALA HB1 H 1 1.388 0.001 . 1 . . . A 16 ALA HB1 . 17948 1
80 . 1 1 16 16 ALA HB2 H 1 1.388 0.001 . 1 . . . A 16 ALA HB2 . 17948 1
81 . 1 1 16 16 ALA HB3 H 1 1.388 0.001 . 1 . . . A 16 ALA HB3 . 17948 1
82 . 1 1 16 16 ALA CA C 13 52.500 0.000 . 1 . . . A 16 ALA CA . 17948 1
83 . 1 1 16 16 ALA CB C 13 19.200 0.000 . 1 . . . A 16 ALA CB . 17948 1
84 . 1 1 16 16 ALA N N 15 123.491 0.000 . 1 . . . A 16 ALA N . 17948 1
85 . 1 1 17 17 LEU H H 1 7.901 0.002 . 1 . . . A 17 LEU H . 17948 1
86 . 1 1 17 17 LEU HA H 1 4.334 0.007 . 1 . . . A 17 LEU HA . 17948 1
87 . 1 1 17 17 LEU HB2 H 1 1.649 0.010 . 2 . . . A 17 LEU HB2 . 17948 1
88 . 1 1 17 17 LEU HB3 H 1 1.583 0.000 . 2 . . . A 17 LEU HB3 . 17948 1
89 . 1 1 17 17 LEU CA C 13 54.900 0.000 . 1 . . . A 17 LEU CA . 17948 1
90 . 1 1 17 17 LEU CB C 13 42.300 0.000 . 1 . . . A 17 LEU CB . 17948 1
91 . 1 1 17 17 LEU N N 15 120.066 0.000 . 1 . . . A 17 LEU N . 17948 1
92 . 1 1 18 18 LYS H H 1 8.081 0.004 . 1 . . . A 18 LYS H . 17948 1
93 . 1 1 18 18 LYS HA H 1 4.280 0.000 . 1 . . . A 18 LYS HA . 17948 1
94 . 1 1 18 18 LYS HB2 H 1 1.790 0.000 . 2 . . . A 18 LYS HB2 . 17948 1
95 . 1 1 18 18 LYS HB3 H 1 1.780 0.000 . 2 . . . A 18 LYS HB3 . 17948 1
96 . 1 1 18 18 LYS CA C 13 54.000 0.000 . 1 . . . A 18 LYS CA . 17948 1
97 . 1 1 18 18 LYS CB C 13 32.637 0.000 . 1 . . . A 18 LYS CB . 17948 1
98 . 1 1 18 18 LYS N N 15 122.658 0.000 . 1 . . . A 18 LYS N . 17948 1
99 . 1 1 19 19 PRO HA H 1 4.427 0.000 . 1 . . . A 19 PRO HA . 17948 1
100 . 1 1 19 19 PRO HB2 H 1 1.948 0.000 . 2 . . . A 19 PRO HB2 . 17948 1
101 . 1 1 19 19 PRO HB3 H 1 2.299 0.000 . 2 . . . A 19 PRO HB3 . 17948 1
102 . 1 1 19 19 PRO CA C 13 63.300 0.000 . 1 . . . A 19 PRO CA . 17948 1
103 . 1 1 19 19 PRO CB C 13 31.900 0.000 . 1 . . . A 19 PRO CB . 17948 1
104 . 1 1 20 20 ASP H H 1 8.398 0.004 . 1 . . . A 20 ASP H . 17948 1
105 . 1 1 20 20 ASP HA H 1 4.571 0.000 . 1 . . . A 20 ASP HA . 17948 1
106 . 1 1 20 20 ASP HB2 H 1 2.674 0.000 . 2 . . . A 20 ASP HB2 . 17948 1
107 . 1 1 20 20 ASP HB3 H 1 2.700 0.000 . 2 . . . A 20 ASP HB3 . 17948 1
108 . 1 1 20 20 ASP CA C 13 54.500 0.000 . 1 . . . A 20 ASP CA . 17948 1
109 . 1 1 20 20 ASP CB C 13 40.900 0.000 . 1 . . . A 20 ASP CB . 17948 1
110 . 1 1 20 20 ASP N N 15 119.912 0.000 . 1 . . . A 20 ASP N . 17948 1
111 . 1 1 21 21 SER H H 1 8.113 0.001 . 1 . . . A 21 SER H . 17948 1
112 . 1 1 21 21 SER HA H 1 4.513 0.000 . 1 . . . A 21 SER HA . 17948 1
113 . 1 1 21 21 SER HB2 H 1 3.923 0.000 . 2 . . . A 21 SER HB2 . 17948 1
114 . 1 1 21 21 SER HB3 H 1 3.916 0.000 . 2 . . . A 21 SER HB3 . 17948 1
115 . 1 1 21 21 SER CA C 13 58.726 0.000 . 1 . . . A 21 SER CA . 17948 1
116 . 1 1 21 21 SER CB C 13 63.709 0.000 . 1 . . . A 21 SER CB . 17948 1
117 . 1 1 21 21 SER N N 15 115.552 0.000 . 1 . . . A 21 SER N . 17948 1
118 . 1 1 22 22 GLN H H 1 8.224 0.000 . 1 . . . A 22 GLN H . 17948 1
119 . 1 1 22 22 GLN HA H 1 4.280 0.000 . 1 . . . A 22 GLN HA . 17948 1
120 . 1 1 22 22 GLN HB2 H 1 2.050 0.000 . 2 . . . A 22 GLN HB2 . 17948 1
121 . 1 1 22 22 GLN HB3 H 1 2.040 0.000 . 2 . . . A 22 GLN HB3 . 17948 1
122 . 1 1 22 22 GLN HE21 H 1 7.170 0.000 . 2 . . . A 22 GLN HE21 . 17948 1
123 . 1 1 22 22 GLN HE22 H 1 7.070 0.000 . 2 . . . A 22 GLN HE22 . 17948 1
124 . 1 1 22 22 GLN N N 15 119.920 0.000 . 1 . . . A 22 GLN N . 17948 1
125 . 1 1 23 23 LYS H H 1 8.415 0.000 . 1 . . . A 23 LYS H . 17948 1
126 . 1 1 23 23 LYS HA H 1 4.280 0.000 . 1 . . . A 23 LYS HA . 17948 1
127 . 1 1 23 23 LYS HB2 H 1 1.790 0.000 . 2 . . . A 23 LYS HB2 . 17948 1
128 . 1 1 23 23 LYS HB3 H 1 1.780 0.000 . 2 . . . A 23 LYS HB3 . 17948 1
129 . 1 1 23 23 LYS HD2 H 1 1.610 0.000 . 1 . . . A 23 LYS HD2 . 17948 1
130 . 1 1 23 23 LYS HD3 H 1 1.610 0.000 . 1 . . . A 23 LYS HD3 . 17948 1
131 . 1 1 23 23 LYS CA C 13 56.173 0.000 . 1 . . . A 23 LYS CA . 17948 1
132 . 1 1 23 23 LYS CB C 13 30.593 0.000 . 1 . . . A 23 LYS CB . 17948 1
133 . 1 1 23 23 LYS N N 15 121.734 0.000 . 1 . . . A 23 LYS N . 17948 1
134 . 1 1 24 24 SER H H 1 7.595 0.000 . 1 . . . A 24 SER H . 17948 1
135 . 1 1 24 24 SER HA H 1 4.510 0.000 . 1 . . . A 24 SER HA . 17948 1
136 . 1 1 24 24 SER HB2 H 1 3.880 0.000 . 2 . . . A 24 SER HB2 . 17948 1
137 . 1 1 24 24 SER HB3 H 1 3.870 0.000 . 2 . . . A 24 SER HB3 . 17948 1
138 . 1 1 24 24 SER CA C 13 57.341 0.000 . 1 . . . A 24 SER CA . 17948 1
139 . 1 1 24 24 SER CB C 13 63.800 0.000 . 1 . . . A 24 SER CB . 17948 1
140 . 1 1 24 24 SER N N 15 126.408 0.000 . 1 . . . A 24 SER N . 17948 1
141 . 1 1 25 25 TYR H H 1 8.370 0.000 . 1 . . . A 25 TYR H . 17948 1
142 . 1 1 25 25 TYR HA H 1 4.456 0.005 . 1 . . . A 25 TYR HA . 17948 1
143 . 1 1 25 25 TYR HB2 H 1 3.034 0.001 . 2 . . . A 25 TYR HB2 . 17948 1
144 . 1 1 25 25 TYR HB3 H 1 3.046 0.000 . 2 . . . A 25 TYR HB3 . 17948 1
145 . 1 1 25 25 TYR CA C 13 59.736 0.000 . 1 . . . A 25 TYR CA . 17948 1
146 . 1 1 25 25 TYR CB C 13 38.069 0.000 . 1 . . . A 25 TYR CB . 17948 1
147 . 1 1 25 25 TYR N N 15 120.790 0.000 . 1 . . . A 25 TYR N . 17948 1
148 . 1 1 26 26 ALA H H 1 8.405 0.000 . 1 . . . A 26 ALA H . 17948 1
149 . 1 1 26 26 ALA HA H 1 4.164 0.000 . 1 . . . A 26 ALA HA . 17948 1
150 . 1 1 26 26 ALA HB1 H 1 1.380 0.000 . 1 . . . A 26 ALA HB1 . 17948 1
151 . 1 1 26 26 ALA HB2 H 1 1.380 0.000 . 1 . . . A 26 ALA HB2 . 17948 1
152 . 1 1 26 26 ALA HB3 H 1 1.380 0.000 . 1 . . . A 26 ALA HB3 . 17948 1
153 . 1 1 26 26 ALA CA C 13 54.000 0.000 . 1 . . . A 26 ALA CA . 17948 1
154 . 1 1 26 26 ALA CB C 13 18.900 0.000 . 1 . . . A 26 ALA CB . 17948 1
155 . 1 1 26 26 ALA N N 15 122.684 0.000 . 1 . . . A 26 ALA N . 17948 1
156 . 1 1 27 27 GLU H H 1 7.988 0.006 . 1 . . . A 27 GLU H . 17948 1
157 . 1 1 27 27 GLU HA H 1 4.116 0.001 . 1 . . . A 27 GLU HA . 17948 1
158 . 1 1 27 27 GLU HB2 H 1 2.065 0.000 . 2 . . . A 27 GLU HB2 . 17948 1
159 . 1 1 27 27 GLU HB3 H 1 2.076 0.000 . 2 . . . A 27 GLU HB3 . 17948 1
160 . 1 1 27 27 GLU HG2 H 1 2.310 0.000 . 1 . . . A 27 GLU HG2 . 17948 1
161 . 1 1 27 27 GLU HG3 H 1 2.310 0.000 . 1 . . . A 27 GLU HG3 . 17948 1
162 . 1 1 27 27 GLU CA C 13 58.000 0.000 . 1 . . . A 27 GLU CA . 17948 1
163 . 1 1 27 27 GLU CB C 13 30.000 0.000 . 1 . . . A 27 GLU CB . 17948 1
164 . 1 1 27 27 GLU N N 15 118.504 0.000 . 1 . . . A 27 GLU N . 17948 1
165 . 1 1 28 28 GLN H H 1 8.282 0.001 . 1 . . . A 28 GLN H . 17948 1
166 . 1 1 28 28 GLN HA H 1 4.224 0.000 . 1 . . . A 28 GLN HA . 17948 1
167 . 1 1 28 28 GLN HB2 H 1 2.050 0.000 . 2 . . . A 28 GLN HB2 . 17948 1
168 . 1 1 28 28 GLN HB3 H 1 2.040 0.000 . 2 . . . A 28 GLN HB3 . 17948 1
169 . 1 1 28 28 GLN CA C 13 57.600 0.000 . 1 . . . A 28 GLN CA . 17948 1
170 . 1 1 28 28 GLN CB C 13 29.400 0.000 . 1 . . . A 28 GLN CB . 17948 1
171 . 1 1 28 28 GLN N N 15 119.735 0.000 . 1 . . . A 28 GLN N . 17948 1
172 . 1 1 29 29 GLY H H 1 8.645 0.000 . 1 . . . A 29 GLY H . 17948 1
173 . 1 1 29 29 GLY HA2 H 1 3.929 0.001 . 2 . . . A 29 GLY HA2 . 17948 1
174 . 1 1 29 29 GLY HA3 H 1 3.950 0.000 . 2 . . . A 29 GLY HA3 . 17948 1
175 . 1 1 29 29 GLY CA C 13 46.400 0.000 . 1 . . . A 29 GLY CA . 17948 1
176 . 1 1 29 29 GLY N N 15 108.734 0.000 . 1 . . . A 29 GLY N . 17948 1
177 . 1 1 30 30 LYS H H 1 8.140 0.001 . 1 . . . A 30 LYS H . 17948 1
178 . 1 1 30 30 LYS HA H 1 4.280 0.000 . 1 . . . A 30 LYS HA . 17948 1
179 . 1 1 30 30 LYS HB2 H 1 1.790 0.000 . 2 . . . A 30 LYS HB2 . 17948 1
180 . 1 1 30 30 LYS HB3 H 1 1.780 0.000 . 2 . . . A 30 LYS HB3 . 17948 1
181 . 1 1 30 30 LYS CA C 13 57.992 0.000 . 1 . . . A 30 LYS CA . 17948 1
182 . 1 1 30 30 LYS CB C 13 29.800 0.000 . 1 . . . A 30 LYS CB . 17948 1
183 . 1 1 30 30 LYS N N 15 120.800 0.000 . 1 . . . A 30 LYS N . 17948 1
184 . 1 1 31 31 GLU H H 1 8.039 0.002 . 1 . . . A 31 GLU H . 17948 1
185 . 1 1 31 31 GLU HA H 1 4.260 0.000 . 1 . . . A 31 GLU HA . 17948 1
186 . 1 1 31 31 GLU HB2 H 1 2.040 0.000 . 1 . . . A 31 GLU HB2 . 17948 1
187 . 1 1 31 31 GLU HB3 H 1 2.040 0.000 . 1 . . . A 31 GLU HB3 . 17948 1
188 . 1 1 31 31 GLU CA C 13 59.400 0.000 . 1 . . . A 31 GLU CA . 17948 1
189 . 1 1 31 31 GLU CB C 13 32.521 0.000 . 1 . . . A 31 GLU CB . 17948 1
190 . 1 1 31 31 GLU N N 15 119.994 0.000 . 1 . . . A 31 GLU N . 17948 1
191 . 1 1 32 32 TYR H H 1 7.994 0.000 . 1 . . . A 32 TYR H . 17948 1
192 . 1 1 32 32 TYR HA H 1 4.630 0.000 . 1 . . . A 32 TYR HA . 17948 1
193 . 1 1 32 32 TYR HB2 H 1 2.910 0.000 . 1 . . . A 32 TYR HB2 . 17948 1
194 . 1 1 32 32 TYR HB3 H 1 2.910 0.000 . 1 . . . A 32 TYR HB3 . 17948 1
195 . 1 1 32 32 TYR CA C 13 58.020 0.000 . 1 . . . A 32 TYR CA . 17948 1
196 . 1 1 32 32 TYR CB C 13 39.160 0.000 . 1 . . . A 32 TYR CB . 17948 1
197 . 1 1 32 32 TYR N N 15 119.254 0.000 . 1 . . . A 32 TYR N . 17948 1
198 . 1 1 33 33 ILE H H 1 8.260 0.000 . 1 . . . A 33 ILE H . 17948 1
199 . 1 1 33 33 ILE HA H 1 4.024 0.000 . 1 . . . A 33 ILE HA . 17948 1
200 . 1 1 33 33 ILE HB H 1 1.944 0.002 . 1 . . . A 33 ILE HB . 17948 1
201 . 1 1 33 33 ILE HG12 H 1 1.615 0.006 . 2 . . . A 33 ILE HG12 . 17948 1
202 . 1 1 33 33 ILE HG13 H 1 1.278 0.015 . 2 . . . A 33 ILE HG13 . 17948 1
203 . 1 1 33 33 ILE HG21 H 1 0.949 0.005 . 1 . . . A 33 ILE HG21 . 17948 1
204 . 1 1 33 33 ILE HG22 H 1 0.949 0.005 . 1 . . . A 33 ILE HG22 . 17948 1
205 . 1 1 33 33 ILE HG23 H 1 0.949 0.005 . 1 . . . A 33 ILE HG23 . 17948 1
206 . 1 1 33 33 ILE HD11 H 1 0.885 0.006 . 1 . . . A 33 ILE HD11 . 17948 1
207 . 1 1 33 33 ILE HD12 H 1 0.885 0.006 . 1 . . . A 33 ILE HD12 . 17948 1
208 . 1 1 33 33 ILE HD13 H 1 0.885 0.006 . 1 . . . A 33 ILE HD13 . 17948 1
209 . 1 1 33 33 ILE CA C 13 62.100 0.000 . 1 . . . A 33 ILE CA . 17948 1
210 . 1 1 33 33 ILE CB C 13 38.300 0.000 . 1 . . . A 33 ILE CB . 17948 1
211 . 1 1 33 33 ILE CG1 C 13 27.650 0.000 . 1 . . . A 33 ILE CG1 . 17948 1
212 . 1 1 33 33 ILE CG2 C 13 17.360 0.000 . 1 . . . A 33 ILE CG2 . 17948 1
213 . 1 1 33 33 ILE CD1 C 13 12.987 0.000 . 1 . . . A 33 ILE CD1 . 17948 1
214 . 1 1 33 33 ILE N N 15 121.600 0.000 . 1 . . . A 33 ILE N . 17948 1
215 . 1 1 34 34 THR H H 1 8.082 0.005 . 1 . . . A 34 THR H . 17948 1
216 . 1 1 34 34 THR HA H 1 4.480 0.000 . 1 . . . A 34 THR HA . 17948 1
217 . 1 1 34 34 THR HB H 1 4.170 0.000 . 1 . . . A 34 THR HB . 17948 1
218 . 1 1 34 34 THR HG21 H 1 1.160 0.000 . 1 . . . A 34 THR HG21 . 17948 1
219 . 1 1 34 34 THR HG22 H 1 1.160 0.000 . 1 . . . A 34 THR HG22 . 17948 1
220 . 1 1 34 34 THR HG23 H 1 1.160 0.000 . 1 . . . A 34 THR HG23 . 17948 1
221 . 1 1 34 34 THR CA C 13 63.600 0.000 . 1 . . . A 34 THR CA . 17948 1
222 . 1 1 34 34 THR CB C 13 69.300 0.000 . 1 . . . A 34 THR CB . 17948 1
223 . 1 1 34 34 THR CG2 C 13 21.440 0.000 . 1 . . . A 34 THR CG2 . 17948 1
224 . 1 1 34 34 THR N N 15 115.849 0.000 . 1 . . . A 34 THR N . 17948 1
225 . 1 1 35 35 ASP H H 1 8.102 0.005 . 1 . . . A 35 ASP H . 17948 1
226 . 1 1 35 35 ASP HA H 1 4.554 0.000 . 1 . . . A 35 ASP HA . 17948 1
227 . 1 1 35 35 ASP HB2 H 1 2.695 0.000 . 2 . . . A 35 ASP HB2 . 17948 1
228 . 1 1 35 35 ASP HB3 H 1 2.712 0.004 . 2 . . . A 35 ASP HB3 . 17948 1
229 . 1 1 35 35 ASP CA C 13 55.400 0.000 . 1 . . . A 35 ASP CA . 17948 1
230 . 1 1 35 35 ASP CB C 13 41.500 0.000 . 1 . . . A 35 ASP CB . 17948 1
231 . 1 1 35 35 ASP N N 15 122.190 0.000 . 1 . . . A 35 ASP N . 17948 1
232 . 1 1 36 36 LYS H H 1 7.983 0.005 . 1 . . . A 36 LYS H . 17948 1
233 . 1 1 36 36 LYS HA H 1 4.210 0.000 . 1 . . . A 36 LYS HA . 17948 1
234 . 1 1 36 36 LYS HB2 H 1 1.788 0.000 . 2 . . . A 36 LYS HB2 . 17948 1
235 . 1 1 36 36 LYS HB3 H 1 1.808 0.000 . 2 . . . A 36 LYS HB3 . 17948 1
236 . 1 1 36 36 LYS HG2 H 1 1.380 0.000 . 2 . . . A 36 LYS HG2 . 17948 1
237 . 1 1 36 36 LYS HG3 H 1 1.370 0.000 . 2 . . . A 36 LYS HG3 . 17948 1
238 . 1 1 36 36 LYS HD2 H 1 1.610 0.000 . 1 . . . A 36 LYS HD2 . 17948 1
239 . 1 1 36 36 LYS HD3 H 1 1.610 0.000 . 1 . . . A 36 LYS HD3 . 17948 1
240 . 1 1 36 36 LYS CA C 13 56.500 0.000 . 1 . . . A 36 LYS CA . 17948 1
241 . 1 1 36 36 LYS CB C 13 32.500 0.000 . 1 . . . A 36 LYS CB . 17948 1
242 . 1 1 36 36 LYS N N 15 119.451 0.000 . 1 . . . A 36 LYS N . 17948 1
243 . 1 1 37 37 ALA H H 1 8.241 0.006 . 1 . . . A 37 ALA H . 17948 1
244 . 1 1 37 37 ALA HA H 1 4.181 0.000 . 1 . . . A 37 ALA HA . 17948 1
245 . 1 1 37 37 ALA HB1 H 1 1.424 0.000 . 1 . . . A 37 ALA HB1 . 17948 1
246 . 1 1 37 37 ALA HB2 H 1 1.424 0.000 . 1 . . . A 37 ALA HB2 . 17948 1
247 . 1 1 37 37 ALA HB3 H 1 1.424 0.000 . 1 . . . A 37 ALA HB3 . 17948 1
248 . 1 1 37 37 ALA CA C 13 53.600 0.000 . 1 . . . A 37 ALA CA . 17948 1
249 . 1 1 37 37 ALA CB C 13 18.800 0.000 . 1 . . . A 37 ALA CB . 17948 1
250 . 1 1 37 37 ALA N N 15 123.038 0.000 . 1 . . . A 37 ALA N . 17948 1
251 . 1 1 38 38 ASP H H 1 8.144 0.004 . 1 . . . A 38 ASP H . 17948 1
252 . 1 1 38 38 ASP HA H 1 4.504 0.000 . 1 . . . A 38 ASP HA . 17948 1
253 . 1 1 38 38 ASP HB2 H 1 2.683 0.000 . 2 . . . A 38 ASP HB2 . 17948 1
254 . 1 1 38 38 ASP HB3 H 1 2.700 0.000 . 2 . . . A 38 ASP HB3 . 17948 1
255 . 1 1 38 38 ASP CA C 13 55.100 0.000 . 1 . . . A 38 ASP CA . 17948 1
256 . 1 1 38 38 ASP CB C 13 41.000 0.000 . 1 . . . A 38 ASP CB . 17948 1
257 . 1 1 38 38 ASP N N 15 118.323 0.000 . 1 . . . A 38 ASP N . 17948 1
258 . 1 1 39 39 LYS H H 1 7.960 0.004 . 1 . . . A 39 LYS H . 17948 1
259 . 1 1 39 39 LYS HA H 1 4.275 0.000 . 1 . . . A 39 LYS HA . 17948 1
260 . 1 1 39 39 LYS HB2 H 1 1.848 0.002 . 2 . . . A 39 LYS HB2 . 17948 1
261 . 1 1 39 39 LYS HB3 H 1 1.873 0.000 . 2 . . . A 39 LYS HB3 . 17948 1
262 . 1 1 39 39 LYS CA C 13 56.900 0.000 . 1 . . . A 39 LYS CA . 17948 1
263 . 1 1 39 39 LYS CB C 13 32.754 0.000 . 1 . . . A 39 LYS CB . 17948 1
264 . 1 1 39 39 LYS N N 15 120.011 0.000 . 1 . . . A 39 LYS N . 17948 1
265 . 1 1 40 40 VAL H H 1 7.948 0.006 . 1 . . . A 40 VAL H . 17948 1
266 . 1 1 40 40 VAL HA H 1 4.044 0.004 . 1 . . . A 40 VAL HA . 17948 1
267 . 1 1 40 40 VAL HB H 1 2.127 0.002 . 1 . . . A 40 VAL HB . 17948 1
268 . 1 1 40 40 VAL HG11 H 1 0.974 0.003 . 2 . . . A 40 VAL HG11 . 17948 1
269 . 1 1 40 40 VAL HG12 H 1 0.974 0.003 . 2 . . . A 40 VAL HG12 . 17948 1
270 . 1 1 40 40 VAL HG13 H 1 0.974 0.003 . 2 . . . A 40 VAL HG13 . 17948 1
271 . 1 1 40 40 VAL HG21 H 1 0.957 0.010 . 2 . . . A 40 VAL HG21 . 17948 1
272 . 1 1 40 40 VAL HG22 H 1 0.957 0.010 . 2 . . . A 40 VAL HG22 . 17948 1
273 . 1 1 40 40 VAL HG23 H 1 0.957 0.010 . 2 . . . A 40 VAL HG23 . 17948 1
274 . 1 1 40 40 VAL CA C 13 62.900 0.000 . 1 . . . A 40 VAL CA . 17948 1
275 . 1 1 40 40 VAL CB C 13 32.500 0.000 . 1 . . . A 40 VAL CB . 17948 1
276 . 1 1 40 40 VAL CG1 C 13 21.380 0.000 . 1 . . . A 40 VAL CG1 . 17948 1
277 . 1 1 40 40 VAL CG2 C 13 21.310 0.000 . 1 . . . A 40 VAL CG2 . 17948 1
278 . 1 1 40 40 VAL N N 15 119.113 0.000 . 1 . . . A 40 VAL N . 17948 1
279 . 1 1 41 41 ALA H H 1 8.168 0.005 . 1 . . . A 41 ALA H . 17948 1
280 . 1 1 41 41 ALA HA H 1 4.294 0.000 . 1 . . . A 41 ALA HA . 17948 1
281 . 1 1 41 41 ALA HB1 H 1 1.433 0.000 . 1 . . . A 41 ALA HB1 . 17948 1
282 . 1 1 41 41 ALA HB2 H 1 1.433 0.000 . 1 . . . A 41 ALA HB2 . 17948 1
283 . 1 1 41 41 ALA HB3 H 1 1.433 0.000 . 1 . . . A 41 ALA HB3 . 17948 1
284 . 1 1 41 41 ALA CA C 13 52.900 0.000 . 1 . . . A 41 ALA CA . 17948 1
285 . 1 1 41 41 ALA CB C 13 19.100 0.000 . 1 . . . A 41 ALA CB . 17948 1
286 . 1 1 41 41 ALA N N 15 125.220 0.000 . 1 . . . A 41 ALA N . 17948 1
287 . 1 1 42 42 GLY H H 1 8.130 0.000 . 1 . . . A 42 GLY H . 17948 1
288 . 1 1 42 42 GLY HA2 H 1 3.930 0.000 . 2 . . . A 42 GLY HA2 . 17948 1
289 . 1 1 42 42 GLY HA3 H 1 3.950 0.000 . 2 . . . A 42 GLY HA3 . 17948 1
290 . 1 1 42 42 GLY CA C 13 45.400 0.000 . 1 . . . A 42 GLY CA . 17948 1
291 . 1 1 42 42 GLY N N 15 107.007 0.000 . 1 . . . A 42 GLY N . 17948 1
292 . 1 1 43 43 LYS H H 1 8.253 0.000 . 1 . . . A 43 LYS H . 17948 1
293 . 1 1 43 43 LYS HA H 1 4.371 0.000 . 1 . . . A 43 LYS HA . 17948 1
294 . 1 1 43 43 LYS HB2 H 1 1.759 0.000 . 2 . . . A 43 LYS HB2 . 17948 1
295 . 1 1 43 43 LYS HB3 H 1 1.837 0.000 . 2 . . . A 43 LYS HB3 . 17948 1
296 . 1 1 43 43 LYS HG2 H 1 1.380 0.000 . 2 . . . A 43 LYS HG2 . 17948 1
297 . 1 1 43 43 LYS HG3 H 1 1.370 0.000 . 2 . . . A 43 LYS HG3 . 17948 1
298 . 1 1 43 43 LYS HD2 H 1 1.610 0.000 . 1 . . . A 43 LYS HD2 . 17948 1
299 . 1 1 43 43 LYS HD3 H 1 1.610 0.000 . 1 . . . A 43 LYS HD3 . 17948 1
300 . 1 1 43 43 LYS CA C 13 56.000 0.000 . 1 . . . A 43 LYS CA . 17948 1
301 . 1 1 43 43 LYS CB C 13 33.000 0.000 . 1 . . . A 43 LYS CB . 17948 1
302 . 1 1 43 43 LYS N N 15 122.310 0.000 . 1 . . . A 43 LYS N . 17948 1
303 . 1 1 44 44 VAL H H 1 8.026 0.003 . 1 . . . A 44 VAL H . 17948 1
304 . 1 1 44 44 VAL HA H 1 4.140 0.004 . 1 . . . A 44 VAL HA . 17948 1
305 . 1 1 44 44 VAL HB H 1 2.067 0.001 . 1 . . . A 44 VAL HB . 17948 1
306 . 1 1 44 44 VAL HG11 H 1 0.919 0.002 . 2 . . . A 44 VAL HG11 . 17948 1
307 . 1 1 44 44 VAL HG12 H 1 0.919 0.002 . 2 . . . A 44 VAL HG12 . 17948 1
308 . 1 1 44 44 VAL HG13 H 1 0.919 0.002 . 2 . . . A 44 VAL HG13 . 17948 1
309 . 1 1 44 44 VAL HG21 H 1 0.900 0.011 . 2 . . . A 44 VAL HG21 . 17948 1
310 . 1 1 44 44 VAL HG22 H 1 0.900 0.011 . 2 . . . A 44 VAL HG22 . 17948 1
311 . 1 1 44 44 VAL HG23 H 1 0.900 0.011 . 2 . . . A 44 VAL HG23 . 17948 1
312 . 1 1 44 44 VAL CA C 13 62.000 0.000 . 1 . . . A 44 VAL CA . 17948 1
313 . 1 1 44 44 VAL CB C 13 32.700 0.000 . 1 . . . A 44 VAL CB . 17948 1
314 . 1 1 44 44 VAL CG1 C 13 21.380 0.000 . 1 . . . A 44 VAL CG1 . 17948 1
315 . 1 1 44 44 VAL CG2 C 13 21.310 0.000 . 1 . . . A 44 VAL CG2 . 17948 1
316 . 1 1 44 44 VAL N N 15 120.734 0.000 . 1 . . . A 44 VAL N . 17948 1
317 . 1 1 45 45 GLN H H 1 8.385 0.006 . 1 . . . A 45 GLN H . 17948 1
318 . 1 1 45 45 GLN HA H 1 4.280 0.000 . 1 . . . A 45 GLN HA . 17948 1
319 . 1 1 45 45 GLN HB2 H 1 2.050 0.000 . 2 . . . A 45 GLN HB2 . 17948 1
320 . 1 1 45 45 GLN HB3 H 1 2.040 0.000 . 2 . . . A 45 GLN HB3 . 17948 1
321 . 1 1 45 45 GLN CA C 13 53.400 0.000 . 1 . . . A 45 GLN CA . 17948 1
322 . 1 1 45 45 GLN CB C 13 29.000 0.000 . 1 . . . A 45 GLN CB . 17948 1
323 . 1 1 45 45 GLN N N 15 124.893 0.000 . 1 . . . A 45 GLN N . 17948 1
324 . 1 1 46 46 PRO HA H 1 4.171 0.000 . 1 . . . A 46 PRO HA . 17948 1
325 . 1 1 46 46 PRO HB2 H 1 2.079 0.000 . 2 . . . A 46 PRO HB2 . 17948 1
326 . 1 1 46 46 PRO HB3 H 1 2.085 0.000 . 2 . . . A 46 PRO HB3 . 17948 1
327 . 1 1 46 46 PRO CA C 13 61.800 0.000 . 1 . . . A 46 PRO CA . 17948 1
328 . 1 1 46 46 PRO CB C 13 32.929 0.000 . 1 . . . A 46 PRO CB . 17948 1
329 . 1 1 47 47 GLU H H 1 8.039 0.006 . 1 . . . A 47 GLU H . 17948 1
330 . 1 1 47 47 GLU HA H 1 4.260 0.000 . 1 . . . A 47 GLU HA . 17948 1
331 . 1 1 47 47 GLU HB2 H 1 2.040 0.000 . 1 . . . A 47 GLU HB2 . 17948 1
332 . 1 1 47 47 GLU HB3 H 1 2.040 0.000 . 1 . . . A 47 GLU HB3 . 17948 1
333 . 1 1 47 47 GLU CA C 13 56.200 0.000 . 1 . . . A 47 GLU CA . 17948 1
334 . 1 1 47 47 GLU CB C 13 30.700 0.000 . 1 . . . A 47 GLU CB . 17948 1
335 . 1 1 47 47 GLU N N 15 123.526 0.000 . 1 . . . A 47 GLU N . 17948 1
336 . 1 1 48 48 ASP H H 1 8.402 0.004 . 1 . . . A 48 ASP H . 17948 1
337 . 1 1 48 48 ASP HA H 1 4.598 0.000 . 1 . . . A 48 ASP HA . 17948 1
338 . 1 1 48 48 ASP HB2 H 1 2.656 0.000 . 2 . . . A 48 ASP HB2 . 17948 1
339 . 1 1 48 48 ASP HB3 H 1 2.700 0.000 . 2 . . . A 48 ASP HB3 . 17948 1
340 . 1 1 48 48 ASP CA C 13 56.330 0.000 . 1 . . . A 48 ASP CA . 17948 1
341 . 1 1 48 48 ASP CB C 13 30.700 0.000 . 1 . . . A 48 ASP CB . 17948 1
342 . 1 1 48 48 ASP N N 15 122.131 0.000 . 1 . . . A 48 ASP N . 17948 1
343 . 1 1 49 49 ASN H H 1 8.338 0.000 . 1 . . . A 49 ASN H . 17948 1
344 . 1 1 49 49 ASN HA H 1 4.700 0.000 . 1 . . . A 49 ASN HA . 17948 1
345 . 1 1 49 49 ASN HB2 H 1 2.803 0.000 . 2 . . . A 49 ASN HB2 . 17948 1
346 . 1 1 49 49 ASN HB3 H 1 2.821 0.000 . 2 . . . A 49 ASN HB3 . 17948 1
347 . 1 1 49 49 ASN CA C 13 51.600 0.000 . 1 . . . A 49 ASN CA . 17948 1
348 . 1 1 49 49 ASN CB C 13 41.573 0.000 . 1 . . . A 49 ASN CB . 17948 1
349 . 1 1 49 49 ASN N N 15 121.154 0.000 . 1 . . . A 49 ASN N . 17948 1
350 . 1 1 50 50 LYS H H 1 8.247 0.000 . 1 . . . A 50 LYS H . 17948 1
351 . 1 1 50 50 LYS HA H 1 4.299 0.000 . 1 . . . A 50 LYS HA . 17948 1
352 . 1 1 50 50 LYS HB2 H 1 1.811 0.000 . 2 . . . A 50 LYS HB2 . 17948 1
353 . 1 1 50 50 LYS HB3 H 1 1.887 0.000 . 2 . . . A 50 LYS HB3 . 17948 1
354 . 1 1 50 50 LYS N N 15 120.660 0.000 . 1 . . . A 50 LYS N . 17948 1
355 . 1 1 51 51 GLY H H 1 8.320 0.000 . 1 . . . A 51 GLY H . 17948 1
356 . 1 1 51 51 GLY HA2 H 1 3.930 0.000 . 2 . . . A 51 GLY HA2 . 17948 1
357 . 1 1 51 51 GLY HA3 H 1 3.950 0.000 . 2 . . . A 51 GLY HA3 . 17948 1
358 . 1 1 51 51 GLY CA C 13 45.400 0.000 . 1 . . . A 51 GLY CA . 17948 1
359 . 1 1 51 51 GLY N N 15 108.915 0.000 . 1 . . . A 51 GLY N . 17948 1
360 . 1 1 52 52 VAL H H 1 7.836 0.003 . 1 . . . A 52 VAL H . 17948 1
361 . 1 1 52 52 VAL HA H 1 4.046 0.000 . 1 . . . A 52 VAL HA . 17948 1
362 . 1 1 52 52 VAL HB H 1 1.984 0.000 . 1 . . . A 52 VAL HB . 17948 1
363 . 1 1 52 52 VAL HG11 H 1 0.840 0.000 . 2 . . . A 52 VAL HG11 . 17948 1
364 . 1 1 52 52 VAL HG12 H 1 0.840 0.000 . 2 . . . A 52 VAL HG12 . 17948 1
365 . 1 1 52 52 VAL HG13 H 1 0.840 0.000 . 2 . . . A 52 VAL HG13 . 17948 1
366 . 1 1 52 52 VAL HG21 H 1 0.830 0.000 . 2 . . . A 52 VAL HG21 . 17948 1
367 . 1 1 52 52 VAL HG22 H 1 0.830 0.000 . 2 . . . A 52 VAL HG22 . 17948 1
368 . 1 1 52 52 VAL HG23 H 1 0.830 0.000 . 2 . . . A 52 VAL HG23 . 17948 1
369 . 1 1 52 52 VAL CA C 13 62.400 0.000 . 1 . . . A 52 VAL CA . 17948 1
370 . 1 1 52 52 VAL CB C 13 32.500 0.000 . 1 . . . A 52 VAL CB . 17948 1
371 . 1 1 52 52 VAL CG1 C 13 21.380 0.000 . 1 . . . A 52 VAL CG1 . 17948 1
372 . 1 1 52 52 VAL CG2 C 13 21.310 0.000 . 1 . . . A 52 VAL CG2 . 17948 1
373 . 1 1 52 52 VAL N N 15 118.906 0.000 . 1 . . . A 52 VAL N . 17948 1
374 . 1 1 53 53 PHE H H 1 8.284 0.002 . 1 . . . A 53 PHE H . 17948 1
375 . 1 1 53 53 PHE HA H 1 4.648 0.000 . 1 . . . A 53 PHE HA . 17948 1
376 . 1 1 53 53 PHE HB2 H 1 3.037 0.000 . 2 . . . A 53 PHE HB2 . 17948 1
377 . 1 1 53 53 PHE HB3 H 1 3.140 0.000 . 2 . . . A 53 PHE HB3 . 17948 1
378 . 1 1 53 53 PHE CA C 13 57.600 0.000 . 1 . . . A 53 PHE CA . 17948 1
379 . 1 1 53 53 PHE CB C 13 39.400 0.000 . 1 . . . A 53 PHE CB . 17948 1
380 . 1 1 53 53 PHE N N 15 123.002 0.000 . 1 . . . A 53 PHE N . 17948 1
381 . 1 1 54 54 GLN H H 1 8.223 0.001 . 1 . . . A 54 GLN H . 17948 1
382 . 1 1 54 54 GLN HA H 1 4.313 0.000 . 1 . . . A 54 GLN HA . 17948 1
383 . 1 1 54 54 GLN HB2 H 1 1.936 0.000 . 2 . . . A 54 GLN HB2 . 17948 1
384 . 1 1 54 54 GLN HB3 H 1 2.092 0.000 . 2 . . . A 54 GLN HB3 . 17948 1
385 . 1 1 54 54 GLN HG2 H 1 2.320 0.000 . 1 . . . A 54 GLN HG2 . 17948 1
386 . 1 1 54 54 GLN HG3 H 1 2.320 0.000 . 1 . . . A 54 GLN HG3 . 17948 1
387 . 1 1 54 54 GLN CA C 13 55.800 0.000 . 1 . . . A 54 GLN CA . 17948 1
388 . 1 1 54 54 GLN CB C 13 29.500 0.000 . 1 . . . A 54 GLN CB . 17948 1
389 . 1 1 54 54 GLN N N 15 122.278 0.000 . 1 . . . A 54 GLN N . 17948 1
390 . 1 1 55 55 GLY H H 1 7.900 0.000 . 1 . . . A 55 GLY H . 17948 1
391 . 1 1 55 55 GLY HA2 H 1 3.887 0.000 . 2 . . . A 55 GLY HA2 . 17948 1
392 . 1 1 55 55 GLY HA3 H 1 3.933 0.000 . 2 . . . A 55 GLY HA3 . 17948 1
393 . 1 1 55 55 GLY CA C 13 45.200 0.000 . 1 . . . A 55 GLY CA . 17948 1
394 . 1 1 55 55 GLY N N 15 109.285 0.000 . 1 . . . A 55 GLY N . 17948 1
395 . 1 1 56 56 VAL H H 1 7.898 0.000 . 1 . . . A 56 VAL H . 17948 1
396 . 1 1 57 57 HIS H H 1 8.529 0.000 . 1 . . . A 57 HIS H . 17948 1
397 . 1 1 57 57 HIS HA H 1 4.249 0.000 . 1 . . . A 57 HIS HA . 17948 1
398 . 1 1 57 57 HIS HB2 H 1 3.120 0.000 . 2 . . . A 57 HIS HB2 . 17948 1
399 . 1 1 57 57 HIS HB3 H 1 3.110 0.000 . 2 . . . A 57 HIS HB3 . 17948 1
400 . 1 1 57 57 HIS N N 15 120.411 0.000 . 1 . . . A 57 HIS N . 17948 1
401 . 1 1 58 58 ASP H H 1 8.234 0.000 . 1 . . . A 58 ASP H . 17948 1
402 . 1 1 58 58 ASP HA H 1 4.610 0.000 . 1 . . . A 58 ASP HA . 17948 1
403 . 1 1 58 58 ASP HB2 H 1 2.636 0.000 . 2 . . . A 58 ASP HB2 . 17948 1
404 . 1 1 58 58 ASP HB3 H 1 2.670 0.000 . 2 . . . A 58 ASP HB3 . 17948 1
405 . 1 1 58 58 ASP N N 15 120.960 0.000 . 1 . . . A 58 ASP N . 17948 1
406 . 1 1 59 59 SER H H 1 8.248 0.000 . 1 . . . A 59 SER H . 17948 1
407 . 1 1 59 59 SER HA H 1 4.398 0.000 . 1 . . . A 59 SER HA . 17948 1
408 . 1 1 59 59 SER HB2 H 1 3.935 0.000 . 2 . . . A 59 SER HB2 . 17948 1
409 . 1 1 59 59 SER HB3 H 1 3.870 0.000 . 2 . . . A 59 SER HB3 . 17948 1
410 . 1 1 59 59 SER CA C 13 58.500 0.000 . 1 . . . A 59 SER CA . 17948 1
411 . 1 1 59 59 SER CB C 13 63.700 0.000 . 1 . . . A 59 SER CB . 17948 1
412 . 1 1 59 59 SER N N 15 116.391 0.000 . 1 . . . A 59 SER N . 17948 1
413 . 1 1 60 60 ALA H H 1 8.290 0.000 . 1 . . . A 60 ALA H . 17948 1
414 . 1 1 60 60 ALA HA H 1 4.308 0.000 . 1 . . . A 60 ALA HA . 17948 1
415 . 1 1 60 60 ALA HB1 H 1 1.404 0.000 . 1 . . . A 60 ALA HB1 . 17948 1
416 . 1 1 60 60 ALA HB2 H 1 1.404 0.000 . 1 . . . A 60 ALA HB2 . 17948 1
417 . 1 1 60 60 ALA HB3 H 1 1.404 0.000 . 1 . . . A 60 ALA HB3 . 17948 1
418 . 1 1 60 60 ALA CA C 13 52.800 0.000 . 1 . . . A 60 ALA CA . 17948 1
419 . 1 1 60 60 ALA CB C 13 19.161 0.000 . 1 . . . A 60 ALA CB . 17948 1
420 . 1 1 60 60 ALA N N 15 125.620 0.000 . 1 . . . A 60 ALA N . 17948 1
421 . 1 1 61 61 GLU H H 1 8.206 0.000 . 1 . . . A 61 GLU H . 17948 1
422 . 1 1 61 61 GLU HA H 1 4.251 0.000 . 1 . . . A 61 GLU HA . 17948 1
423 . 1 1 61 61 GLU HB2 H 1 1.950 0.000 . 2 . . . A 61 GLU HB2 . 17948 1
424 . 1 1 61 61 GLU HB3 H 1 2.054 0.000 . 2 . . . A 61 GLU HB3 . 17948 1
425 . 1 1 61 61 GLU CA C 13 56.600 0.000 . 1 . . . A 61 GLU CA . 17948 1
426 . 1 1 61 61 GLU CB C 13 30.100 0.000 . 1 . . . A 61 GLU CB . 17948 1
427 . 1 1 61 61 GLU N N 15 119.550 0.000 . 1 . . . A 61 GLU N . 17948 1
428 . 1 1 62 62 LYS H H 1 8.157 0.003 . 1 . . . A 62 LYS H . 17948 1
429 . 1 1 62 62 LYS HA H 1 4.300 0.008 . 1 . . . A 62 LYS HA . 17948 1
430 . 1 1 62 62 LYS HB2 H 1 1.790 0.000 . 2 . . . A 62 LYS HB2 . 17948 1
431 . 1 1 62 62 LYS HB3 H 1 1.866 0.000 . 2 . . . A 62 LYS HB3 . 17948 1
432 . 1 1 62 62 LYS CA C 13 56.800 0.000 . 1 . . . A 62 LYS CA . 17948 1
433 . 1 1 62 62 LYS CB C 13 32.900 0.000 . 1 . . . A 62 LYS CB . 17948 1
434 . 1 1 62 62 LYS N N 15 122.003 0.000 . 1 . . . A 62 LYS N . 17948 1
435 . 1 1 63 63 GLY H H 1 8.371 0.000 . 1 . . . A 63 GLY H . 17948 1
436 . 1 1 63 63 GLY HA2 H 1 3.945 0.000 . 2 . . . A 63 GLY HA2 . 17948 1
437 . 1 1 63 63 GLY HA3 H 1 3.991 0.000 . 2 . . . A 63 GLY HA3 . 17948 1
438 . 1 1 63 63 GLY CA C 13 45.300 0.000 . 1 . . . A 63 GLY CA . 17948 1
439 . 1 1 63 63 GLY N N 15 109.728 0.000 . 1 . . . A 63 GLY N . 17948 1
440 . 1 1 64 64 LYS H H 1 8.078 0.000 . 1 . . . A 64 LYS H . 17948 1
441 . 1 1 64 64 LYS HA H 1 4.340 0.000 . 1 . . . A 64 LYS HA . 17948 1
442 . 1 1 64 64 LYS HB2 H 1 1.753 0.000 . 2 . . . A 64 LYS HB2 . 17948 1
443 . 1 1 64 64 LYS HB3 H 1 1.849 0.000 . 2 . . . A 64 LYS HB3 . 17948 1
444 . 1 1 64 64 LYS CA C 13 56.200 0.000 . 1 . . . A 64 LYS CA . 17948 1
445 . 1 1 64 64 LYS CB C 13 33.000 0.000 . 1 . . . A 64 LYS CB . 17948 1
446 . 1 1 64 64 LYS N N 15 120.537 0.000 . 1 . . . A 64 LYS N . 17948 1
447 . 1 1 65 65 ASP H H 1 8.336 0.000 . 1 . . . A 65 ASP H . 17948 1
448 . 1 1 65 65 ASP HA H 1 4.590 0.000 . 1 . . . A 65 ASP HA . 17948 1
449 . 1 1 65 65 ASP HB2 H 1 2.641 0.000 . 2 . . . A 65 ASP HB2 . 17948 1
450 . 1 1 65 65 ASP HB3 H 1 2.700 0.000 . 2 . . . A 65 ASP HB3 . 17948 1
451 . 1 1 65 65 ASP CA C 13 54.300 0.000 . 1 . . . A 65 ASP CA . 17948 1
452 . 1 1 65 65 ASP CB C 13 41.200 0.000 . 1 . . . A 65 ASP CB . 17948 1
453 . 1 1 65 65 ASP N N 15 120.981 0.000 . 1 . . . A 65 ASP N . 17948 1
454 . 1 1 66 66 ASN H H 1 8.280 0.000 . 1 . . . A 66 ASN H . 17948 1
455 . 1 1 66 66 ASN HA H 1 4.691 0.000 . 1 . . . A 66 ASN HA . 17948 1
456 . 1 1 66 66 ASN HB2 H 1 2.756 0.000 . 2 . . . A 66 ASN HB2 . 17948 1
457 . 1 1 66 66 ASN HB3 H 1 2.836 0.000 . 2 . . . A 66 ASN HB3 . 17948 1
458 . 1 1 66 66 ASN CA C 13 53.200 0.000 . 1 . . . A 66 ASN CA . 17948 1
459 . 1 1 66 66 ASN CB C 13 39.000 0.000 . 1 . . . A 66 ASN CB . 17948 1
460 . 1 1 66 66 ASN N N 15 119.056 0.000 . 1 . . . A 66 ASN N . 17948 1
461 . 1 1 67 67 ALA H H 1 8.248 0.000 . 1 . . . A 67 ALA H . 17948 1
462 . 1 1 67 67 ALA HA H 1 4.313 0.000 . 1 . . . A 67 ALA HA . 17948 1
463 . 1 1 67 67 ALA HB1 H 1 1.400 0.000 . 1 . . . A 67 ALA HB1 . 17948 1
464 . 1 1 67 67 ALA HB2 H 1 1.400 0.000 . 1 . . . A 67 ALA HB2 . 17948 1
465 . 1 1 67 67 ALA HB3 H 1 1.400 0.000 . 1 . . . A 67 ALA HB3 . 17948 1
466 . 1 1 67 67 ALA CA C 13 52.724 0.000 . 1 . . . A 67 ALA CA . 17948 1
467 . 1 1 67 67 ALA CB C 13 19.171 0.000 . 1 . . . A 67 ALA CB . 17948 1
468 . 1 1 67 67 ALA N N 15 124.164 0.000 . 1 . . . A 67 ALA N . 17948 1
469 . 1 1 68 68 GLU H H 1 8.295 0.003 . 1 . . . A 68 GLU H . 17948 1
470 . 1 1 68 68 GLU HA H 1 4.282 0.000 . 1 . . . A 68 GLU HA . 17948 1
471 . 1 1 68 68 GLU HB2 H 1 1.985 0.000 . 2 . . . A 68 GLU HB2 . 17948 1
472 . 1 1 68 68 GLU HB3 H 1 2.081 0.000 . 2 . . . A 68 GLU HB3 . 17948 1
473 . 1 1 68 68 GLU HG2 H 1 2.310 0.000 . 1 . . . A 68 GLU HG2 . 17948 1
474 . 1 1 68 68 GLU HG3 H 1 2.310 0.000 . 1 . . . A 68 GLU HG3 . 17948 1
475 . 1 1 68 68 GLU CA C 13 56.812 0.000 . 1 . . . A 68 GLU CA . 17948 1
476 . 1 1 68 68 GLU CB C 13 30.126 0.000 . 1 . . . A 68 GLU CB . 17948 1
477 . 1 1 68 68 GLU N N 15 119.599 0.000 . 1 . . . A 68 GLU N . 17948 1
478 . 1 1 69 69 GLY H H 1 8.348 0.006 . 1 . . . A 69 GLY H . 17948 1
479 . 1 1 69 69 GLY HA2 H 1 3.966 0.000 . 2 . . . A 69 GLY HA2 . 17948 1
480 . 1 1 69 69 GLY HA3 H 1 3.988 0.000 . 2 . . . A 69 GLY HA3 . 17948 1
481 . 1 1 69 69 GLY CA C 13 45.440 0.000 . 1 . . . A 69 GLY CA . 17948 1
482 . 1 1 69 69 GLY N N 15 109.616 0.000 . 1 . . . A 69 GLY N . 17948 1
483 . 1 1 70 70 GLN H H 1 8.200 0.004 . 1 . . . A 70 GLN H . 17948 1
484 . 1 1 70 70 GLN HA H 1 4.388 0.000 . 1 . . . A 70 GLN HA . 17948 1
485 . 1 1 70 70 GLN HB2 H 1 2.015 0.000 . 2 . . . A 70 GLN HB2 . 17948 1
486 . 1 1 70 70 GLN HB3 H 1 2.175 0.000 . 2 . . . A 70 GLN HB3 . 17948 1
487 . 1 1 70 70 GLN CA C 13 55.860 0.000 . 1 . . . A 70 GLN CA . 17948 1
488 . 1 1 70 70 GLN CB C 13 29.500 0.000 . 1 . . . A 70 GLN CB . 17948 1
489 . 1 1 70 70 GLN N N 15 119.476 0.000 . 1 . . . A 70 GLN N . 17948 1
490 . 1 1 71 71 GLY H H 1 8.438 0.003 . 1 . . . A 71 GLY H . 17948 1
491 . 1 1 71 71 GLY HA2 H 1 3.978 0.004 . 2 . . . A 71 GLY HA2 . 17948 1
492 . 1 1 71 71 GLY HA3 H 1 4.005 0.000 . 2 . . . A 71 GLY HA3 . 17948 1
493 . 1 1 71 71 GLY CA C 13 45.360 0.000 . 1 . . . A 71 GLY CA . 17948 1
494 . 1 1 71 71 GLY N N 15 109.928 0.000 . 1 . . . A 71 GLY N . 17948 1
495 . 1 1 72 72 GLU H H 1 8.296 0.010 . 1 . . . A 72 GLU H . 17948 1
496 . 1 1 72 72 GLU HA H 1 4.398 0.000 . 1 . . . A 72 GLU HA . 17948 1
497 . 1 1 72 72 GLU HB2 H 1 1.948 0.000 . 2 . . . A 72 GLU HB2 . 17948 1
498 . 1 1 72 72 GLU HB3 H 1 2.093 0.000 . 2 . . . A 72 GLU HB3 . 17948 1
499 . 1 1 72 72 GLU HG2 H 1 2.310 0.000 . 1 . . . A 72 GLU HG2 . 17948 1
500 . 1 1 72 72 GLU HG3 H 1 2.310 0.000 . 1 . . . A 72 GLU HG3 . 17948 1
501 . 1 1 72 72 GLU CA C 13 56.400 0.000 . 1 . . . A 72 GLU CA . 17948 1
502 . 1 1 72 72 GLU CB C 13 30.700 0.000 . 1 . . . A 72 GLU CB . 17948 1
503 . 1 1 72 72 GLU CG C 13 36.010 0.000 . 1 . . . A 72 GLU CG . 17948 1
504 . 1 1 72 72 GLU N N 15 120.438 0.000 . 1 . . . A 72 GLU N . 17948 1
505 . 1 1 73 73 SER H H 1 8.666 0.004 . 1 . . . A 73 SER H . 17948 1
506 . 1 1 73 73 SER HA H 1 4.601 0.002 . 1 . . . A 73 SER HA . 17948 1
507 . 1 1 73 73 SER HB2 H 1 3.972 0.004 . 2 . . . A 73 SER HB2 . 17948 1
508 . 1 1 73 73 SER HB3 H 1 4.180 0.004 . 2 . . . A 73 SER HB3 . 17948 1
509 . 1 1 73 73 SER CA C 13 58.011 0.000 . 1 . . . A 73 SER CA . 17948 1
510 . 1 1 73 73 SER CB C 13 64.816 0.000 . 1 . . . A 73 SER CB . 17948 1
511 . 1 1 73 73 SER N N 15 117.699 0.000 . 1 . . . A 73 SER N . 17948 1
512 . 1 1 74 74 LEU H H 1 8.899 0.003 . 1 . . . A 74 LEU H . 17948 1
513 . 1 1 74 74 LEU HA H 1 4.241 0.013 . 1 . . . A 74 LEU HA . 17948 1
514 . 1 1 74 74 LEU HB2 H 1 1.619 0.000 . 2 . . . A 74 LEU HB2 . 17948 1
515 . 1 1 74 74 LEU HB3 H 1 1.790 0.008 . 2 . . . A 74 LEU HB3 . 17948 1
516 . 1 1 74 74 LEU HG H 1 1.589 0.019 . 1 . . . A 74 LEU HG . 17948 1
517 . 1 1 74 74 LEU HD11 H 1 0.992 0.004 . 2 . . . A 74 LEU HD11 . 17948 1
518 . 1 1 74 74 LEU HD12 H 1 0.992 0.004 . 2 . . . A 74 LEU HD12 . 17948 1
519 . 1 1 74 74 LEU HD13 H 1 0.992 0.004 . 2 . . . A 74 LEU HD13 . 17948 1
520 . 1 1 74 74 LEU HD21 H 1 0.935 0.002 . 2 . . . A 74 LEU HD21 . 17948 1
521 . 1 1 74 74 LEU HD22 H 1 0.935 0.002 . 2 . . . A 74 LEU HD22 . 17948 1
522 . 1 1 74 74 LEU HD23 H 1 0.935 0.002 . 2 . . . A 74 LEU HD23 . 17948 1
523 . 1 1 74 74 LEU CA C 13 57.723 0.000 . 1 . . . A 74 LEU CA . 17948 1
524 . 1 1 74 74 LEU CB C 13 42.155 0.000 . 1 . . . A 74 LEU CB . 17948 1
525 . 1 1 74 74 LEU CG C 13 26.770 0.000 . 1 . . . A 74 LEU CG . 17948 1
526 . 1 1 74 74 LEU CD1 C 13 24.730 0.000 . 1 . . . A 74 LEU CD1 . 17948 1
527 . 1 1 74 74 LEU CD2 C 13 24.100 0.000 . 1 . . . A 74 LEU CD2 . 17948 1
528 . 1 1 74 74 LEU N N 15 125.422 0.000 . 1 . . . A 74 LEU N . 17948 1
529 . 1 1 75 75 ALA H H 1 8.389 0.005 . 1 . . . A 75 ALA H . 17948 1
530 . 1 1 75 75 ALA HA H 1 4.021 0.007 . 1 . . . A 75 ALA HA . 17948 1
531 . 1 1 75 75 ALA HB1 H 1 1.429 0.010 . 1 . . . A 75 ALA HB1 . 17948 1
532 . 1 1 75 75 ALA HB2 H 1 1.429 0.010 . 1 . . . A 75 ALA HB2 . 17948 1
533 . 1 1 75 75 ALA HB3 H 1 1.429 0.010 . 1 . . . A 75 ALA HB3 . 17948 1
534 . 1 1 75 75 ALA CA C 13 54.800 0.000 . 1 . . . A 75 ALA CA . 17948 1
535 . 1 1 75 75 ALA CB C 13 18.600 0.000 . 1 . . . A 75 ALA CB . 17948 1
536 . 1 1 75 75 ALA N N 15 120.685 0.000 . 1 . . . A 75 ALA N . 17948 1
537 . 1 1 76 76 ASP H H 1 7.777 0.003 . 1 . . . A 76 ASP H . 17948 1
538 . 1 1 76 76 ASP HA H 1 4.434 0.002 . 1 . . . A 76 ASP HA . 17948 1
539 . 1 1 76 76 ASP HB2 H 1 2.789 0.015 . 2 . . . A 76 ASP HB2 . 17948 1
540 . 1 1 76 76 ASP HB3 H 1 2.771 0.004 . 2 . . . A 76 ASP HB3 . 17948 1
541 . 1 1 76 76 ASP CA C 13 56.700 0.000 . 1 . . . A 76 ASP CA . 17948 1
542 . 1 1 76 76 ASP CB C 13 40.683 0.000 . 1 . . . A 76 ASP CB . 17948 1
543 . 1 1 76 76 ASP N N 15 117.754 0.000 . 1 . . . A 76 ASP N . 17948 1
544 . 1 1 77 77 GLN H H 1 8.038 0.003 . 1 . . . A 77 GLN H . 17948 1
545 . 1 1 77 77 GLN HA H 1 4.221 0.008 . 1 . . . A 77 GLN HA . 17948 1
546 . 1 1 77 77 GLN HB2 H 1 2.149 0.000 . 2 . . . A 77 GLN HB2 . 17948 1
547 . 1 1 77 77 GLN HB3 H 1 2.163 0.001 . 2 . . . A 77 GLN HB3 . 17948 1
548 . 1 1 77 77 GLN HG2 H 1 2.344 0.003 . 2 . . . A 77 GLN HG2 . 17948 1
549 . 1 1 77 77 GLN HG3 H 1 2.488 0.001 . 2 . . . A 77 GLN HG3 . 17948 1
550 . 1 1 77 77 GLN HE21 H 1 7.150 0.009 . 2 . . . A 77 GLN HE21 . 17948 1
551 . 1 1 77 77 GLN HE22 H 1 6.700 0.004 . 2 . . . A 77 GLN HE22 . 17948 1
552 . 1 1 77 77 GLN CA C 13 57.844 0.000 . 1 . . . A 77 GLN CA . 17948 1
553 . 1 1 77 77 GLN CB C 13 29.602 0.000 . 1 . . . A 77 GLN CB . 17948 1
554 . 1 1 77 77 GLN CG C 13 34.533 0.000 . 1 . . . A 77 GLN CG . 17948 1
555 . 1 1 77 77 GLN N N 15 119.402 0.000 . 1 . . . A 77 GLN N . 17948 1
556 . 1 1 77 77 GLN NE2 N 15 110.135 0.000 . 1 . . . A 77 GLN NE2 . 17948 1
557 . 1 1 78 78 ALA H H 1 8.427 0.000 . 1 . . . A 78 ALA H . 17948 1
558 . 1 1 78 78 ALA HA H 1 4.171 0.004 . 1 . . . A 78 ALA HA . 17948 1
559 . 1 1 78 78 ALA HB1 H 1 1.495 0.004 . 1 . . . A 78 ALA HB1 . 17948 1
560 . 1 1 78 78 ALA HB2 H 1 1.495 0.004 . 1 . . . A 78 ALA HB2 . 17948 1
561 . 1 1 78 78 ALA HB3 H 1 1.495 0.004 . 1 . . . A 78 ALA HB3 . 17948 1
562 . 1 1 78 78 ALA CA C 13 54.550 0.000 . 1 . . . A 78 ALA CA . 17948 1
563 . 1 1 78 78 ALA CB C 13 18.854 0.000 . 1 . . . A 78 ALA CB . 17948 1
564 . 1 1 78 78 ALA N N 15 121.376 0.000 . 1 . . . A 78 ALA N . 17948 1
565 . 1 1 79 79 ARG H H 1 8.031 0.005 . 1 . . . A 79 ARG H . 17948 1
566 . 1 1 79 79 ARG HA H 1 4.018 0.005 . 1 . . . A 79 ARG HA . 17948 1
567 . 1 1 79 79 ARG HB2 H 1 1.970 0.004 . 2 . . . A 79 ARG HB2 . 17948 1
568 . 1 1 79 79 ARG HB3 H 1 1.953 0.003 . 2 . . . A 79 ARG HB3 . 17948 1
569 . 1 1 79 79 ARG HG2 H 1 1.831 0.004 . 2 . . . A 79 ARG HG2 . 17948 1
570 . 1 1 79 79 ARG HG3 H 1 1.612 0.004 . 2 . . . A 79 ARG HG3 . 17948 1
571 . 1 1 79 79 ARG HD2 H 1 3.273 0.003 . 2 . . . A 79 ARG HD2 . 17948 1
572 . 1 1 79 79 ARG HD3 H 1 3.271 0.003 . 2 . . . A 79 ARG HD3 . 17948 1
573 . 1 1 79 79 ARG CA C 13 59.293 0.000 . 1 . . . A 79 ARG CA . 17948 1
574 . 1 1 79 79 ARG CB C 13 30.159 0.000 . 1 . . . A 79 ARG CB . 17948 1
575 . 1 1 79 79 ARG CG C 13 27.877 0.000 . 1 . . . A 79 ARG CG . 17948 1
576 . 1 1 79 79 ARG CD C 13 43.417 0.000 . 1 . . . A 79 ARG CD . 17948 1
577 . 1 1 79 79 ARG N N 15 117.905 0.000 . 1 . . . A 79 ARG N . 17948 1
578 . 1 1 80 80 ASP H H 1 8.126 0.005 . 1 . . . A 80 ASP H . 17948 1
579 . 1 1 80 80 ASP HA H 1 4.561 0.004 . 1 . . . A 80 ASP HA . 17948 1
580 . 1 1 80 80 ASP HB2 H 1 2.633 0.004 . 2 . . . A 80 ASP HB2 . 17948 1
581 . 1 1 80 80 ASP HB3 H 1 2.730 0.006 . 2 . . . A 80 ASP HB3 . 17948 1
582 . 1 1 80 80 ASP CA C 13 56.276 0.000 . 1 . . . A 80 ASP CA . 17948 1
583 . 1 1 80 80 ASP CB C 13 40.500 0.000 . 1 . . . A 80 ASP CB . 17948 1
584 . 1 1 80 80 ASP N N 15 120.290 0.000 . 1 . . . A 80 ASP N . 17948 1
585 . 1 1 81 81 TYR H H 1 8.250 0.003 . 1 . . . A 81 TYR H . 17948 1
586 . 1 1 81 81 TYR HA H 1 4.340 0.006 . 1 . . . A 81 TYR HA . 17948 1
587 . 1 1 81 81 TYR HB2 H 1 3.072 0.003 . 2 . . . A 81 TYR HB2 . 17948 1
588 . 1 1 81 81 TYR HB3 H 1 3.034 0.001 . 2 . . . A 81 TYR HB3 . 17948 1
589 . 1 1 81 81 TYR CA C 13 61.119 0.000 . 1 . . . A 81 TYR CA . 17948 1
590 . 1 1 81 81 TYR CB C 13 38.500 0.000 . 1 . . . A 81 TYR CB . 17948 1
591 . 1 1 81 81 TYR N N 15 120.191 0.000 . 1 . . . A 81 TYR N . 17948 1
592 . 1 1 82 82 MET H H 1 8.354 0.004 . 1 . . . A 82 MET H . 17948 1
593 . 1 1 82 82 MET HA H 1 4.222 0.006 . 1 . . . A 82 MET HA . 17948 1
594 . 1 1 82 82 MET HB2 H 1 2.270 0.004 . 2 . . . A 82 MET HB2 . 17948 1
595 . 1 1 82 82 MET HB3 H 1 2.150 0.006 . 2 . . . A 82 MET HB3 . 17948 1
596 . 1 1 82 82 MET HG2 H 1 2.609 0.006 . 2 . . . A 82 MET HG2 . 17948 1
597 . 1 1 82 82 MET HG3 H 1 2.732 0.005 . 2 . . . A 82 MET HG3 . 17948 1
598 . 1 1 82 82 MET CA C 13 58.618 0.000 . 1 . . . A 82 MET CA . 17948 1
599 . 1 1 82 82 MET CB C 13 32.875 0.000 . 1 . . . A 82 MET CB . 17948 1
600 . 1 1 82 82 MET CG C 13 32.539 0.000 . 1 . . . A 82 MET CG . 17948 1
601 . 1 1 82 82 MET N N 15 117.996 0.000 . 1 . . . A 82 MET N . 17948 1
602 . 1 1 83 83 GLY H H 1 8.365 0.005 . 1 . . . A 83 GLY H . 17948 1
603 . 1 1 83 83 GLY HA2 H 1 3.848 0.000 . 2 . . . A 83 GLY HA2 . 17948 1
604 . 1 1 83 83 GLY HA3 H 1 4.029 0.000 . 2 . . . A 83 GLY HA3 . 17948 1
605 . 1 1 83 83 GLY CA C 13 47.200 0.000 . 1 . . . A 83 GLY CA . 17948 1
606 . 1 1 83 83 GLY N N 15 106.902 0.000 . 1 . . . A 83 GLY N . 17948 1
607 . 1 1 84 84 ALA H H 1 7.950 0.005 . 1 . . . A 84 ALA H . 17948 1
608 . 1 1 84 84 ALA HA H 1 4.318 0.008 . 1 . . . A 84 ALA HA . 17948 1
609 . 1 1 84 84 ALA HB1 H 1 1.551 0.009 . 1 . . . A 84 ALA HB1 . 17948 1
610 . 1 1 84 84 ALA HB2 H 1 1.551 0.009 . 1 . . . A 84 ALA HB2 . 17948 1
611 . 1 1 84 84 ALA HB3 H 1 1.551 0.009 . 1 . . . A 84 ALA HB3 . 17948 1
612 . 1 1 84 84 ALA CA C 13 54.278 0.000 . 1 . . . A 84 ALA CA . 17948 1
613 . 1 1 84 84 ALA CB C 13 18.569 0.000 . 1 . . . A 84 ALA CB . 17948 1
614 . 1 1 84 84 ALA N N 15 124.830 0.000 . 1 . . . A 84 ALA N . 17948 1
615 . 1 1 85 85 ALA H H 1 8.274 0.004 . 1 . . . A 85 ALA H . 17948 1
616 . 1 1 85 85 ALA HA H 1 4.037 0.006 . 1 . . . A 85 ALA HA . 17948 1
617 . 1 1 85 85 ALA HB1 H 1 1.535 0.007 . 1 . . . A 85 ALA HB1 . 17948 1
618 . 1 1 85 85 ALA HB2 H 1 1.535 0.007 . 1 . . . A 85 ALA HB2 . 17948 1
619 . 1 1 85 85 ALA HB3 H 1 1.535 0.007 . 1 . . . A 85 ALA HB3 . 17948 1
620 . 1 1 85 85 ALA CA C 13 54.979 0.000 . 1 . . . A 85 ALA CA . 17948 1
621 . 1 1 85 85 ALA CB C 13 18.500 0.000 . 1 . . . A 85 ALA CB . 17948 1
622 . 1 1 85 85 ALA N N 15 120.542 0.000 . 1 . . . A 85 ALA N . 17948 1
623 . 1 1 86 86 LYS H H 1 8.265 0.004 . 1 . . . A 86 LYS H . 17948 1
624 . 1 1 86 86 LYS HA H 1 3.887 0.006 . 1 . . . A 86 LYS HA . 17948 1
625 . 1 1 86 86 LYS HB2 H 1 2.006 0.004 . 2 . . . A 86 LYS HB2 . 17948 1
626 . 1 1 86 86 LYS HB3 H 1 1.957 0.007 . 2 . . . A 86 LYS HB3 . 17948 1
627 . 1 1 86 86 LYS HG2 H 1 1.602 0.000 . 2 . . . A 86 LYS HG2 . 17948 1
628 . 1 1 86 86 LYS HG3 H 1 1.501 0.004 . 2 . . . A 86 LYS HG3 . 17948 1
629 . 1 1 86 86 LYS HD2 H 1 1.802 0.001 . 2 . . . A 86 LYS HD2 . 17948 1
630 . 1 1 86 86 LYS HD3 H 1 1.791 0.001 . 2 . . . A 86 LYS HD3 . 17948 1
631 . 1 1 86 86 LYS HE2 H 1 2.930 0.000 . 1 . . . A 86 LYS HE2 . 17948 1
632 . 1 1 86 86 LYS HE3 H 1 2.930 0.000 . 1 . . . A 86 LYS HE3 . 17948 1
633 . 1 1 86 86 LYS CA C 13 60.060 0.000 . 1 . . . A 86 LYS CA . 17948 1
634 . 1 1 86 86 LYS CB C 13 32.300 0.000 . 1 . . . A 86 LYS CB . 17948 1
635 . 1 1 86 86 LYS CG C 13 24.910 0.000 . 1 . . . A 86 LYS CG . 17948 1
636 . 1 1 86 86 LYS CD C 13 28.780 0.000 . 1 . . . A 86 LYS CD . 17948 1
637 . 1 1 86 86 LYS N N 15 116.920 0.000 . 1 . . . A 86 LYS N . 17948 1
638 . 1 1 87 87 SER H H 1 7.926 0.002 . 1 . . . A 87 SER H . 17948 1
639 . 1 1 87 87 SER HA H 1 4.312 0.006 . 1 . . . A 87 SER HA . 17948 1
640 . 1 1 87 87 SER HB2 H 1 4.061 0.004 . 2 . . . A 87 SER HB2 . 17948 1
641 . 1 1 87 87 SER HB3 H 1 3.980 0.015 . 2 . . . A 87 SER HB3 . 17948 1
642 . 1 1 87 87 SER CA C 13 61.330 0.000 . 1 . . . A 87 SER CA . 17948 1
643 . 1 1 87 87 SER CB C 13 62.900 0.000 . 1 . . . A 87 SER CB . 17948 1
644 . 1 1 87 87 SER N N 15 113.664 0.000 . 1 . . . A 87 SER N . 17948 1
645 . 1 1 88 88 LYS H H 1 7.859 0.005 . 1 . . . A 88 LYS H . 17948 1
646 . 1 1 88 88 LYS HA H 1 4.386 0.001 . 1 . . . A 88 LYS HA . 17948 1
647 . 1 1 88 88 LYS HB2 H 1 1.905 0.001 . 2 . . . A 88 LYS HB2 . 17948 1
648 . 1 1 88 88 LYS HB3 H 1 2.006 0.002 . 2 . . . A 88 LYS HB3 . 17948 1
649 . 1 1 88 88 LYS HG2 H 1 1.675 0.008 . 2 . . . A 88 LYS HG2 . 17948 1
650 . 1 1 88 88 LYS HG3 H 1 1.580 0.010 . 2 . . . A 88 LYS HG3 . 17948 1
651 . 1 1 88 88 LYS HD2 H 1 1.799 0.001 . 2 . . . A 88 LYS HD2 . 17948 1
652 . 1 1 88 88 LYS HD3 H 1 1.807 0.003 . 2 . . . A 88 LYS HD3 . 17948 1
653 . 1 1 88 88 LYS HE2 H 1 2.930 0.000 . 1 . . . A 88 LYS HE2 . 17948 1
654 . 1 1 88 88 LYS HE3 H 1 2.930 0.000 . 1 . . . A 88 LYS HE3 . 17948 1
655 . 1 1 88 88 LYS CA C 13 57.344 0.000 . 1 . . . A 88 LYS CA . 17948 1
656 . 1 1 88 88 LYS CB C 13 31.800 0.000 . 1 . . . A 88 LYS CB . 17948 1
657 . 1 1 88 88 LYS CG C 13 24.910 0.000 . 1 . . . A 88 LYS CG . 17948 1
658 . 1 1 88 88 LYS CD C 13 28.780 0.000 . 1 . . . A 88 LYS CD . 17948 1
659 . 1 1 88 88 LYS N N 15 120.310 0.000 . 1 . . . A 88 LYS N . 17948 1
660 . 1 1 89 89 LEU H H 1 8.158 0.003 . 1 . . . A 89 LEU H . 17948 1
661 . 1 1 89 89 LEU HA H 1 4.101 0.014 . 1 . . . A 89 LEU HA . 17948 1
662 . 1 1 89 89 LEU HB2 H 1 1.799 0.003 . 2 . . . A 89 LEU HB2 . 17948 1
663 . 1 1 89 89 LEU HB3 H 1 1.821 0.008 . 2 . . . A 89 LEU HB3 . 17948 1
664 . 1 1 89 89 LEU HG H 1 1.604 0.011 . 1 . . . A 89 LEU HG . 17948 1
665 . 1 1 89 89 LEU HD11 H 1 0.938 0.008 . 2 . . . A 89 LEU HD11 . 17948 1
666 . 1 1 89 89 LEU HD12 H 1 0.938 0.008 . 2 . . . A 89 LEU HD12 . 17948 1
667 . 1 1 89 89 LEU HD13 H 1 0.938 0.008 . 2 . . . A 89 LEU HD13 . 17948 1
668 . 1 1 89 89 LEU HD21 H 1 0.927 0.007 . 2 . . . A 89 LEU HD21 . 17948 1
669 . 1 1 89 89 LEU HD22 H 1 0.927 0.007 . 2 . . . A 89 LEU HD22 . 17948 1
670 . 1 1 89 89 LEU HD23 H 1 0.927 0.007 . 2 . . . A 89 LEU HD23 . 17948 1
671 . 1 1 89 89 LEU CA C 13 58.067 0.000 . 1 . . . A 89 LEU CA . 17948 1
672 . 1 1 89 89 LEU CB C 13 41.500 0.000 . 1 . . . A 89 LEU CB . 17948 1
673 . 1 1 89 89 LEU CG C 13 26.770 0.000 . 1 . . . A 89 LEU CG . 17948 1
674 . 1 1 89 89 LEU CD1 C 13 24.730 0.000 . 1 . . . A 89 LEU CD1 . 17948 1
675 . 1 1 89 89 LEU CD2 C 13 24.100 0.000 . 1 . . . A 89 LEU CD2 . 17948 1
676 . 1 1 89 89 LEU N N 15 119.648 0.000 . 1 . . . A 89 LEU N . 17948 1
677 . 1 1 90 90 ASN H H 1 8.240 0.005 . 1 . . . A 90 ASN H . 17948 1
678 . 1 1 90 90 ASN HA H 1 4.398 0.001 . 1 . . . A 90 ASN HA . 17948 1
679 . 1 1 90 90 ASN HB2 H 1 2.930 0.002 . 2 . . . A 90 ASN HB2 . 17948 1
680 . 1 1 90 90 ASN HB3 H 1 2.969 0.003 . 2 . . . A 90 ASN HB3 . 17948 1
681 . 1 1 90 90 ASN HD21 H 1 7.270 0.000 . 2 . . . A 90 ASN HD21 . 17948 1
682 . 1 1 90 90 ASN HD22 H 1 7.200 0.000 . 2 . . . A 90 ASN HD22 . 17948 1
683 . 1 1 90 90 ASN CA C 13 57.059 0.000 . 1 . . . A 90 ASN CA . 17948 1
684 . 1 1 90 90 ASN CB C 13 38.500 0.000 . 1 . . . A 90 ASN CB . 17948 1
685 . 1 1 90 90 ASN N N 15 117.422 0.000 . 1 . . . A 90 ASN N . 17948 1
686 . 1 1 91 91 ASP H H 1 8.111 0.004 . 1 . . . A 91 ASP H . 17948 1
687 . 1 1 91 91 ASP HA H 1 4.441 0.005 . 1 . . . A 91 ASP HA . 17948 1
688 . 1 1 91 91 ASP HB2 H 1 2.967 0.007 . 2 . . . A 91 ASP HB2 . 17948 1
689 . 1 1 91 91 ASP HB3 H 1 2.659 0.008 . 2 . . . A 91 ASP HB3 . 17948 1
690 . 1 1 91 91 ASP CA C 13 57.344 0.000 . 1 . . . A 91 ASP CA . 17948 1
691 . 1 1 91 91 ASP CB C 13 40.300 0.000 . 1 . . . A 91 ASP CB . 17948 1
692 . 1 1 91 91 ASP N N 15 119.945 0.000 . 1 . . . A 91 ASP N . 17948 1
693 . 1 1 92 92 ALA H H 1 8.240 0.005 . 1 . . . A 92 ALA H . 17948 1
694 . 1 1 92 92 ALA HA H 1 4.174 0.007 . 1 . . . A 92 ALA HA . 17948 1
695 . 1 1 92 92 ALA HB1 H 1 1.611 0.002 . 1 . . . A 92 ALA HB1 . 17948 1
696 . 1 1 92 92 ALA HB2 H 1 1.611 0.002 . 1 . . . A 92 ALA HB2 . 17948 1
697 . 1 1 92 92 ALA HB3 H 1 1.611 0.002 . 1 . . . A 92 ALA HB3 . 17948 1
698 . 1 1 92 92 ALA CA C 13 55.373 0.000 . 1 . . . A 92 ALA CA . 17948 1
699 . 1 1 92 92 ALA CB C 13 18.300 0.000 . 1 . . . A 92 ALA CB . 17948 1
700 . 1 1 92 92 ALA N N 15 123.226 0.000 . 1 . . . A 92 ALA N . 17948 1
701 . 1 1 93 93 VAL H H 1 8.410 0.001 . 1 . . . A 93 VAL H . 17948 1
702 . 1 1 93 93 VAL HA H 1 3.599 0.007 . 1 . . . A 93 VAL HA . 17948 1
703 . 1 1 93 93 VAL HB H 1 2.343 0.002 . 1 . . . A 93 VAL HB . 17948 1
704 . 1 1 93 93 VAL HG11 H 1 1.151 0.005 . 2 . . . A 93 VAL HG11 . 17948 1
705 . 1 1 93 93 VAL HG12 H 1 1.151 0.005 . 2 . . . A 93 VAL HG12 . 17948 1
706 . 1 1 93 93 VAL HG13 H 1 1.151 0.005 . 2 . . . A 93 VAL HG13 . 17948 1
707 . 1 1 93 93 VAL HG21 H 1 1.009 0.003 . 2 . . . A 93 VAL HG21 . 17948 1
708 . 1 1 93 93 VAL HG22 H 1 1.009 0.003 . 2 . . . A 93 VAL HG22 . 17948 1
709 . 1 1 93 93 VAL HG23 H 1 1.009 0.003 . 2 . . . A 93 VAL HG23 . 17948 1
710 . 1 1 93 93 VAL CA C 13 66.893 0.000 . 1 . . . A 93 VAL CA . 17948 1
711 . 1 1 93 93 VAL CB C 13 31.613 0.000 . 1 . . . A 93 VAL CB . 17948 1
712 . 1 1 93 93 VAL CG1 C 13 23.132 0.000 . 1 . . . A 93 VAL CG1 . 17948 1
713 . 1 1 93 93 VAL CG2 C 13 21.446 0.000 . 1 . . . A 93 VAL CG2 . 17948 1
714 . 1 1 93 93 VAL N N 15 117.940 0.000 . 1 . . . A 93 VAL N . 17948 1
715 . 1 1 94 94 GLU H H 1 8.289 0.004 . 1 . . . A 94 GLU H . 17948 1
716 . 1 1 94 94 GLU HA H 1 4.050 0.005 . 1 . . . A 94 GLU HA . 17948 1
717 . 1 1 94 94 GLU HB2 H 1 2.175 0.006 . 2 . . . A 94 GLU HB2 . 17948 1
718 . 1 1 94 94 GLU HB3 H 1 2.161 0.005 . 2 . . . A 94 GLU HB3 . 17948 1
719 . 1 1 94 94 GLU HG2 H 1 2.310 0.000 . 1 . . . A 94 GLU HG2 . 17948 1
720 . 1 1 94 94 GLU HG3 H 1 2.309 0.001 . 1 . . . A 94 GLU HG3 . 17948 1
721 . 1 1 94 94 GLU CA C 13 59.600 0.000 . 1 . . . A 94 GLU CA . 17948 1
722 . 1 1 94 94 GLU CB C 13 29.600 0.000 . 1 . . . A 94 GLU CB . 17948 1
723 . 1 1 94 94 GLU CG C 13 36.010 0.000 . 1 . . . A 94 GLU CG . 17948 1
724 . 1 1 94 94 GLU N N 15 120.610 0.000 . 1 . . . A 94 GLU N . 17948 1
725 . 1 1 95 95 TYR H H 1 8.186 0.003 . 1 . . . A 95 TYR H . 17948 1
726 . 1 1 95 95 TYR HA H 1 4.270 0.001 . 1 . . . A 95 TYR HA . 17948 1
727 . 1 1 95 95 TYR HB2 H 1 3.270 0.008 . 2 . . . A 95 TYR HB2 . 17948 1
728 . 1 1 95 95 TYR HB3 H 1 3.235 0.002 . 2 . . . A 95 TYR HB3 . 17948 1
729 . 1 1 95 95 TYR CA C 13 61.300 0.000 . 1 . . . A 95 TYR CA . 17948 1
730 . 1 1 95 95 TYR CB C 13 38.700 0.000 . 1 . . . A 95 TYR CB . 17948 1
731 . 1 1 95 95 TYR N N 15 120.241 0.000 . 1 . . . A 95 TYR N . 17948 1
732 . 1 1 96 96 VAL H H 1 8.394 0.006 . 1 . . . A 96 VAL H . 17948 1
733 . 1 1 96 96 VAL HA H 1 3.546 0.004 . 1 . . . A 96 VAL HA . 17948 1
734 . 1 1 96 96 VAL HB H 1 2.233 0.000 . 1 . . . A 96 VAL HB . 17948 1
735 . 1 1 96 96 VAL HG11 H 1 1.021 0.006 . 2 . . . A 96 VAL HG11 . 17948 1
736 . 1 1 96 96 VAL HG12 H 1 1.021 0.006 . 2 . . . A 96 VAL HG12 . 17948 1
737 . 1 1 96 96 VAL HG13 H 1 1.021 0.006 . 2 . . . A 96 VAL HG13 . 17948 1
738 . 1 1 96 96 VAL HG21 H 1 1.231 0.005 . 2 . . . A 96 VAL HG21 . 17948 1
739 . 1 1 96 96 VAL HG22 H 1 1.231 0.005 . 2 . . . A 96 VAL HG22 . 17948 1
740 . 1 1 96 96 VAL HG23 H 1 1.231 0.005 . 2 . . . A 96 VAL HG23 . 17948 1
741 . 1 1 96 96 VAL CA C 13 66.070 0.000 . 1 . . . A 96 VAL CA . 17948 1
742 . 1 1 96 96 VAL CB C 13 31.745 0.000 . 1 . . . A 96 VAL CB . 17948 1
743 . 1 1 96 96 VAL CG1 C 13 22.075 0.000 . 1 . . . A 96 VAL CG1 . 17948 1
744 . 1 1 96 96 VAL CG2 C 13 22.871 0.000 . 1 . . . A 96 VAL CG2 . 17948 1
745 . 1 1 96 96 VAL N N 15 116.942 0.000 . 1 . . . A 96 VAL N . 17948 1
746 . 1 1 97 97 SER H H 1 8.433 0.001 . 1 . . . A 97 SER H . 17948 1
747 . 1 1 97 97 SER HA H 1 4.145 0.000 . 1 . . . A 97 SER HA . 17948 1
748 . 1 1 97 97 SER HB2 H 1 4.026 0.008 . 2 . . . A 97 SER HB2 . 17948 1
749 . 1 1 97 97 SER HB3 H 1 3.963 0.003 . 2 . . . A 97 SER HB3 . 17948 1
750 . 1 1 97 97 SER CA C 13 61.393 0.000 . 1 . . . A 97 SER CA . 17948 1
751 . 1 1 97 97 SER CB C 13 63.415 0.000 . 1 . . . A 97 SER CB . 17948 1
752 . 1 1 97 97 SER N N 15 113.924 0.000 . 1 . . . A 97 SER N . 17948 1
753 . 1 1 98 98 GLY H H 1 7.899 0.005 . 1 . . . A 98 GLY H . 17948 1
754 . 1 1 98 98 GLY HA2 H 1 3.935 0.000 . 2 . . . A 98 GLY HA2 . 17948 1
755 . 1 1 98 98 GLY HA3 H 1 3.964 0.000 . 2 . . . A 98 GLY HA3 . 17948 1
756 . 1 1 98 98 GLY CA C 13 46.298 0.000 . 1 . . . A 98 GLY CA . 17948 1
757 . 1 1 98 98 GLY N N 15 107.509 0.000 . 1 . . . A 98 GLY N . 17948 1
758 . 1 1 99 99 ARG H H 1 7.696 0.005 . 1 . . . A 99 ARG H . 17948 1
759 . 1 1 99 99 ARG HA H 1 4.268 0.002 . 1 . . . A 99 ARG HA . 17948 1
760 . 1 1 99 99 ARG HB2 H 1 1.744 0.004 . 2 . . . A 99 ARG HB2 . 17948 1
761 . 1 1 99 99 ARG HB3 H 1 1.814 0.005 . 2 . . . A 99 ARG HB3 . 17948 1
762 . 1 1 99 99 ARG HG2 H 1 1.510 0.006 . 2 . . . A 99 ARG HG2 . 17948 1
763 . 1 1 99 99 ARG HG3 H 1 1.505 0.009 . 2 . . . A 99 ARG HG3 . 17948 1
764 . 1 1 99 99 ARG HD2 H 1 3.041 0.007 . 2 . . . A 99 ARG HD2 . 17948 1
765 . 1 1 99 99 ARG HD3 H 1 3.076 0.009 . 2 . . . A 99 ARG HD3 . 17948 1
766 . 1 1 99 99 ARG CA C 13 56.527 0.000 . 1 . . . A 99 ARG CA . 17948 1
767 . 1 1 99 99 ARG CB C 13 30.300 0.000 . 1 . . . A 99 ARG CB . 17948 1
768 . 1 1 99 99 ARG CG C 13 27.310 0.000 . 1 . . . A 99 ARG CG . 17948 1
769 . 1 1 99 99 ARG CD C 13 43.100 0.000 . 1 . . . A 99 ARG CD . 17948 1
770 . 1 1 99 99 ARG N N 15 119.471 0.000 . 1 . . . A 99 ARG N . 17948 1
771 . 1 1 100 100 VAL H H 1 7.906 0.005 . 1 . . . A 100 VAL H . 17948 1
772 . 1 1 100 100 VAL HA H 1 3.960 0.004 . 1 . . . A 100 VAL HA . 17948 1
773 . 1 1 100 100 VAL HB H 1 2.044 0.003 . 1 . . . A 100 VAL HB . 17948 1
774 . 1 1 100 100 VAL HG11 H 1 0.804 0.009 . 2 . . . A 100 VAL HG11 . 17948 1
775 . 1 1 100 100 VAL HG12 H 1 0.804 0.009 . 2 . . . A 100 VAL HG12 . 17948 1
776 . 1 1 100 100 VAL HG13 H 1 0.804 0.009 . 2 . . . A 100 VAL HG13 . 17948 1
777 . 1 1 100 100 VAL HG21 H 1 0.912 0.001 . 2 . . . A 100 VAL HG21 . 17948 1
778 . 1 1 100 100 VAL HG22 H 1 0.912 0.001 . 2 . . . A 100 VAL HG22 . 17948 1
779 . 1 1 100 100 VAL HG23 H 1 0.912 0.001 . 2 . . . A 100 VAL HG23 . 17948 1
780 . 1 1 100 100 VAL CA C 13 63.400 0.000 . 1 . . . A 100 VAL CA . 17948 1
781 . 1 1 100 100 VAL CB C 13 32.320 0.000 . 1 . . . A 100 VAL CB . 17948 1
782 . 1 1 100 100 VAL CG1 C 13 21.380 0.000 . 1 . . . A 100 VAL CG1 . 17948 1
783 . 1 1 100 100 VAL CG2 C 13 21.310 0.000 . 1 . . . A 100 VAL CG2 . 17948 1
784 . 1 1 100 100 VAL N N 15 117.316 0.000 . 1 . . . A 100 VAL N . 17948 1
785 . 1 1 101 101 HIS H H 1 8.130 0.006 . 1 . . . A 101 HIS H . 17948 1
786 . 1 1 101 101 HIS HA H 1 4.701 0.006 . 1 . . . A 101 HIS HA . 17948 1
787 . 1 1 101 101 HIS HB2 H 1 3.166 0.005 . 2 . . . A 101 HIS HB2 . 17948 1
788 . 1 1 101 101 HIS HB3 H 1 3.294 0.000 . 2 . . . A 101 HIS HB3 . 17948 1
789 . 1 1 101 101 HIS CA C 13 56.200 0.000 . 1 . . . A 101 HIS CA . 17948 1
790 . 1 1 101 101 HIS CB C 13 30.048 0.000 . 1 . . . A 101 HIS CB . 17948 1
791 . 1 1 101 101 HIS N N 15 119.155 0.000 . 1 . . . A 101 HIS N . 17948 1
792 . 1 1 102 102 GLY H H 1 8.086 0.003 . 1 . . . A 102 GLY H . 17948 1
793 . 1 1 102 102 GLY HA2 H 1 3.930 0.000 . 2 . . . A 102 GLY HA2 . 17948 1
794 . 1 1 102 102 GLY HA3 H 1 3.950 0.000 . 2 . . . A 102 GLY HA3 . 17948 1
795 . 1 1 102 102 GLY CA C 13 45.333 0.000 . 1 . . . A 102 GLY CA . 17948 1
796 . 1 1 102 102 GLY N N 15 109.145 0.000 . 1 . . . A 102 GLY N . 17948 1
797 . 1 1 103 103 GLU H H 1 7.932 0.000 . 1 . . . A 103 GLU H . 17948 1
798 . 1 1 103 103 GLU HA H 1 4.330 0.000 . 1 . . . A 103 GLU HA . 17948 1
799 . 1 1 103 103 GLU HB2 H 1 1.902 0.000 . 2 . . . A 103 GLU HB2 . 17948 1
800 . 1 1 103 103 GLU HB3 H 1 2.054 0.000 . 2 . . . A 103 GLU HB3 . 17948 1
801 . 1 1 103 103 GLU HG2 H 1 2.310 0.000 . 1 . . . A 103 GLU HG2 . 17948 1
802 . 1 1 103 103 GLU HG3 H 1 2.310 0.000 . 1 . . . A 103 GLU HG3 . 17948 1
803 . 1 1 103 103 GLU CA C 13 62.300 0.000 . 1 . . . A 103 GLU CA . 17948 1
804 . 1 1 103 103 GLU CB C 13 32.754 0.000 . 1 . . . A 103 GLU CB . 17948 1
805 . 1 1 103 103 GLU CG C 13 36.010 0.000 . 1 . . . A 103 GLU CG . 17948 1
806 . 1 1 103 103 GLU N N 15 119.345 0.000 . 1 . . . A 103 GLU N . 17948 1
807 . 1 1 104 104 GLU H H 1 8.325 0.000 . 1 . . . A 104 GLU H . 17948 1
808 . 1 1 104 104 GLU HA H 1 4.272 0.000 . 1 . . . A 104 GLU HA . 17948 1
809 . 1 1 104 104 GLU HB2 H 1 1.921 0.000 . 2 . . . A 104 GLU HB2 . 17948 1
810 . 1 1 104 104 GLU HB3 H 1 2.015 0.000 . 2 . . . A 104 GLU HB3 . 17948 1
811 . 1 1 104 104 GLU HG2 H 1 2.310 0.000 . 1 . . . A 104 GLU HG2 . 17948 1
812 . 1 1 104 104 GLU HG3 H 1 2.310 0.000 . 1 . . . A 104 GLU HG3 . 17948 1
813 . 1 1 104 104 GLU CA C 13 56.232 0.000 . 1 . . . A 104 GLU CA . 17948 1
814 . 1 1 104 104 GLU CB C 13 30.500 0.000 . 1 . . . A 104 GLU CB . 17948 1
815 . 1 1 104 104 GLU CG C 13 36.010 0.000 . 1 . . . A 104 GLU CG . 17948 1
816 . 1 1 104 104 GLU N N 15 122.105 0.000 . 1 . . . A 104 GLU N . 17948 1
817 . 1 1 105 105 ASP H H 1 8.077 0.000 . 1 . . . A 105 ASP H . 17948 1
818 . 1 1 105 105 ASP HA H 1 4.610 0.000 . 1 . . . A 105 ASP HA . 17948 1
819 . 1 1 105 105 ASP HB2 H 1 2.740 0.000 . 2 . . . A 105 ASP HB2 . 17948 1
820 . 1 1 105 105 ASP HB3 H 1 2.700 0.000 . 2 . . . A 105 ASP HB3 . 17948 1
821 . 1 1 105 105 ASP CA C 13 54.520 0.000 . 1 . . . A 105 ASP CA . 17948 1
822 . 1 1 105 105 ASP CB C 13 40.700 0.000 . 1 . . . A 105 ASP CB . 17948 1
823 . 1 1 105 105 ASP N N 15 124.188 0.000 . 1 . . . A 105 ASP N . 17948 1
824 . 1 1 106 106 PRO HA H 1 4.484 0.000 . 1 . . . A 106 PRO HA . 17948 1
825 . 1 1 106 106 PRO HB2 H 1 2.050 0.000 . 2 . . . A 106 PRO HB2 . 17948 1
826 . 1 1 106 106 PRO HB3 H 1 2.323 0.000 . 2 . . . A 106 PRO HB3 . 17948 1
827 . 1 1 106 106 PRO HG2 H 1 1.930 0.000 . 2 . . . A 106 PRO HG2 . 17948 1
828 . 1 1 106 106 PRO HG3 H 1 1.920 0.000 . 2 . . . A 106 PRO HG3 . 17948 1
829 . 1 1 106 106 PRO HD2 H 1 3.640 0.000 . 2 . . . A 106 PRO HD2 . 17948 1
830 . 1 1 106 106 PRO HD3 H 1 3.630 0.000 . 2 . . . A 106 PRO HD3 . 17948 1
831 . 1 1 106 106 PRO CA C 13 63.824 0.000 . 1 . . . A 106 PRO CA . 17948 1
832 . 1 1 106 106 PRO CB C 13 32.200 0.000 . 1 . . . A 106 PRO CB . 17948 1
833 . 1 1 107 107 THR H H 1 8.339 0.004 . 1 . . . A 107 THR H . 17948 1
834 . 1 1 107 107 THR HA H 1 4.273 0.001 . 1 . . . A 107 THR HA . 17948 1
835 . 1 1 107 107 THR HB H 1 4.266 0.008 . 1 . . . A 107 THR HB . 17948 1
836 . 1 1 107 107 THR HG21 H 1 1.254 0.002 . 1 . . . A 107 THR HG21 . 17948 1
837 . 1 1 107 107 THR HG22 H 1 1.254 0.002 . 1 . . . A 107 THR HG22 . 17948 1
838 . 1 1 107 107 THR HG23 H 1 1.254 0.002 . 1 . . . A 107 THR HG23 . 17948 1
839 . 1 1 107 107 THR CA C 13 62.700 0.000 . 1 . . . A 107 THR CA . 17948 1
840 . 1 1 107 107 THR CB C 13 69.400 0.000 . 1 . . . A 107 THR CB . 17948 1
841 . 1 1 107 107 THR CG2 C 13 21.440 0.000 . 1 . . . A 107 THR CG2 . 17948 1
842 . 1 1 107 107 THR N N 15 111.950 0.000 . 1 . . . A 107 THR N . 17948 1
843 . 1 1 108 108 LYS H H 1 7.727 0.005 . 1 . . . A 108 LYS H . 17948 1
844 . 1 1 108 108 LYS HA H 1 4.357 0.000 . 1 . . . A 108 LYS HA . 17948 1
845 . 1 1 108 108 LYS HB2 H 1 1.759 0.000 . 2 . . . A 108 LYS HB2 . 17948 1
846 . 1 1 108 108 LYS HB3 H 1 1.915 0.000 . 2 . . . A 108 LYS HB3 . 17948 1
847 . 1 1 108 108 LYS HG2 H 1 1.380 0.000 . 2 . . . A 108 LYS HG2 . 17948 1
848 . 1 1 108 108 LYS HG3 H 1 1.370 0.000 . 2 . . . A 108 LYS HG3 . 17948 1
849 . 1 1 108 108 LYS HD2 H 1 1.610 0.000 . 1 . . . A 108 LYS HD2 . 17948 1
850 . 1 1 108 108 LYS HD3 H 1 1.610 0.000 . 1 . . . A 108 LYS HD3 . 17948 1
851 . 1 1 108 108 LYS CA C 13 56.000 0.000 . 1 . . . A 108 LYS CA . 17948 1
852 . 1 1 108 108 LYS CB C 13 32.800 0.000 . 1 . . . A 108 LYS CB . 17948 1
853 . 1 1 108 108 LYS N N 15 123.349 0.000 . 1 . . . A 108 LYS N . 17948 1
854 . 1 1 109 109 LYS H H 1 7.685 0.000 . 1 . . . A 109 LYS H . 17948 1
855 . 1 1 109 109 LYS HA H 1 4.280 0.000 . 1 . . . A 109 LYS HA . 17948 1
856 . 1 1 109 109 LYS HB2 H 1 1.790 0.000 . 2 . . . A 109 LYS HB2 . 17948 1
857 . 1 1 109 109 LYS HB3 H 1 1.780 0.000 . 2 . . . A 109 LYS HB3 . 17948 1
858 . 1 1 109 109 LYS HD2 H 1 1.610 0.000 . 1 . . . A 109 LYS HD2 . 17948 1
859 . 1 1 109 109 LYS HD3 H 1 1.610 0.000 . 1 . . . A 109 LYS HD3 . 17948 1
860 . 1 1 109 109 LYS CA C 13 57.517 0.000 . 1 . . . A 109 LYS CA . 17948 1
861 . 1 1 109 109 LYS CB C 13 33.805 0.000 . 1 . . . A 109 LYS CB . 17948 1
862 . 1 1 109 109 LYS N N 15 127.890 0.000 . 1 . . . A 109 LYS N . 17948 1
stop_
save_