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 30652
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 '3D CBCA(CO)NH' . . . 30652 1
2 '3D HNCACB' . . . 30652 1
3 '3D HNCO' . . . 30652 1
4 '3D HN(CA)CO' . . . 30652 1
5 '2D 1H-1H TOCSY' . . . 30652 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 MET C C 13 176.012 0.004 . 1 . . . . A 1 MET C . 30652 1
2 . 1 . 1 1 1 MET CA C 13 55.453 0.003 . 1 . . . . A 1 MET CA . 30652 1
3 . 1 . 1 1 1 MET CB C 13 32.655 0.088 . 1 . . . . A 1 MET CB . 30652 1
4 . 1 . 1 1 1 MET N N 15 122.629 0.000 . 1 . . . . A 1 MET N . 30652 1
5 . 1 . 1 2 2 ALA H H 1 8.261 0.004 . 1 . . . . A 2 ALA H . 30652 1
6 . 1 . 1 2 2 ALA C C 13 178.096 0.039 . 1 . . . . A 2 ALA C . 30652 1
7 . 1 . 1 2 2 ALA CA C 13 52.908 0.040 . 1 . . . . A 2 ALA CA . 30652 1
8 . 1 . 1 2 2 ALA CB C 13 19.113 0.056 . 1 . . . . A 2 ALA CB . 30652 1
9 . 1 . 1 2 2 ALA N N 15 125.227 0.000 . 1 . . . . A 2 ALA N . 30652 1
10 . 1 . 1 3 3 GLY H H 1 8.333 0.003 . 1 . . . . A 3 GLY H . 30652 1
11 . 1 . 1 3 3 GLY C C 13 174.049 0.004 . 1 . . . . A 3 GLY C . 30652 1
12 . 1 . 1 3 3 GLY N N 15 108.089 0.030 . 1 . . . . A 3 GLY N . 30652 1
13 . 1 . 1 4 4 LEU H H 1 8.006 0.002 . 1 . . . . A 4 LEU H . 30652 1
14 . 1 . 1 4 4 LEU C C 13 177.523 0.004 . 1 . . . . A 4 LEU C . 30652 1
15 . 1 . 1 4 4 LEU CA C 13 55.248 0.020 . 1 . . . . A 4 LEU CA . 30652 1
16 . 1 . 1 4 4 LEU CB C 13 42.614 0.027 . 1 . . . . A 4 LEU CB . 30652 1
17 . 1 . 1 4 4 LEU N N 15 121.493 0.000 . 1 . . . . A 4 LEU N . 30652 1
18 . 1 . 1 5 5 THR H H 1 8.181 0.003 . 1 . . . . A 5 THR H . 30652 1
19 . 1 . 1 5 5 THR C C 13 174.335 0.019 . 1 . . . . A 5 THR C . 30652 1
20 . 1 . 1 5 5 THR CA C 13 61.937 0.077 . 1 . . . . A 5 THR CA . 30652 1
21 . 1 . 1 5 5 THR CB C 13 69.810 0.041 . 1 . . . . A 5 THR CB . 30652 1
22 . 1 . 1 5 5 THR N N 15 115.733 0.000 . 1 . . . . A 5 THR N . 30652 1
23 . 1 . 1 6 6 VAL H H 1 8.129 0.002 . 1 . . . . A 6 VAL H . 30652 1
24 . 1 . 1 6 6 VAL C C 13 175.701 0.006 . 1 . . . . A 6 VAL C . 30652 1
25 . 1 . 1 6 6 VAL CB C 13 32.856 0.040 . 1 . . . . A 6 VAL CB . 30652 1
26 . 1 . 1 6 6 VAL N N 15 123.063 0.000 . 1 . . . . A 6 VAL N . 30652 1
27 . 1 . 1 7 7 ARG H H 1 8.375 0.002 . 1 . . . . A 7 ARG H . 30652 1
28 . 1 . 1 7 7 ARG CA C 13 55.827 0.011 . 1 . . . . A 7 ARG CA . 30652 1
29 . 1 . 1 7 7 ARG CB C 13 31.082 0.068 . 1 . . . . A 7 ARG CB . 30652 1
30 . 1 . 1 7 7 ARG N N 15 125.203 0.000 . 1 . . . . A 7 ARG N . 30652 1
31 . 1 . 1 8 8 ASP H H 1 8.350 0.003 . 1 . . . . A 8 ASP H . 30652 1
32 . 1 . 1 8 8 ASP N N 15 123.334 0.000 . 1 . . . . A 8 ASP N . 30652 1
33 . 1 . 1 9 9 PRO C C 13 177.383 0.000 . 1 . . . . A 9 PRO C . 30652 1
34 . 1 . 1 10 10 ALA H H 1 8.372 0.004 . 1 . . . . A 10 ALA H . 30652 1
35 . 1 . 1 10 10 ALA C C 13 179.154 0.004 . 1 . . . . A 10 ALA C . 30652 1
36 . 1 . 1 10 10 ALA CA C 13 53.505 0.004 . 1 . . . . A 10 ALA CA . 30652 1
37 . 1 . 1 10 10 ALA CB C 13 18.884 0.031 . 1 . . . . A 10 ALA CB . 30652 1
38 . 1 . 1 10 10 ALA N N 15 121.989 0.000 . 1 . . . . A 10 ALA N . 30652 1
39 . 1 . 1 11 11 VAL H H 1 7.727 0.007 . 1 . . . . A 11 VAL H . 30652 1
40 . 1 . 1 11 11 VAL C C 13 176.888 0.004 . 1 . . . . A 11 VAL C . 30652 1
41 . 1 . 1 11 11 VAL CA C 13 63.621 0.027 . 1 . . . . A 11 VAL CA . 30652 1
42 . 1 . 1 11 11 VAL N N 15 118.879 0.000 . 1 . . . . A 11 VAL N . 30652 1
43 . 1 . 1 12 12 ASP H H 1 8.185 0.009 . 1 . . . . A 12 ASP H . 30652 1
44 . 1 . 1 12 12 ASP CB C 13 41.912 0.022 . 1 . . . . A 12 ASP CB . 30652 1
45 . 1 . 1 12 12 ASP N N 15 122.960 0.024 . 1 . . . . A 12 ASP N . 30652 1
46 . 1 . 1 13 13 ARG H H 1 8.259 0.006 . 1 . . . . A 13 ARG H . 30652 1
47 . 1 . 1 13 13 ARG C C 13 178.918 0.002 . 1 . . . . A 13 ARG C . 30652 1
48 . 1 . 1 13 13 ARG CA C 13 59.385 0.035 . 1 . . . . A 13 ARG CA . 30652 1
49 . 1 . 1 13 13 ARG CB C 13 30.269 0.029 . 1 . . . . A 13 ARG CB . 30652 1
50 . 1 . 1 13 13 ARG N N 15 121.291 0.058 . 1 . . . . A 13 ARG N . 30652 1
51 . 1 . 1 14 14 SER H H 1 8.434 0.009 . 1 . . . . A 14 SER H . 30652 1
52 . 1 . 1 14 14 SER C C 13 175.541 0.037 . 1 . . . . A 14 SER C . 30652 1
53 . 1 . 1 14 14 SER N N 15 117.165 0.000 . 1 . . . . A 14 SER N . 30652 1
54 . 1 . 1 15 15 LEU H H 1 7.470 0.008 . 1 . . . . A 15 LEU H . 30652 1
55 . 1 . 1 15 15 LEU C C 13 177.159 0.013 . 1 . . . . A 15 LEU C . 30652 1
56 . 1 . 1 15 15 LEU CA C 13 56.513 0.061 . 1 . . . . A 15 LEU CA . 30652 1
57 . 1 . 1 15 15 LEU CB C 13 42.135 0.025 . 1 . . . . A 15 LEU CB . 30652 1
58 . 1 . 1 15 15 LEU N N 15 120.170 0.000 . 1 . . . . A 15 LEU N . 30652 1
59 . 1 . 1 16 16 ARG H H 1 7.181 0.006 . 1 . . . . A 16 ARG H . 30652 1
60 . 1 . 1 16 16 ARG C C 13 173.601 0.021 . 1 . . . . A 16 ARG C . 30652 1
61 . 1 . 1 16 16 ARG CA C 13 55.089 0.031 . 1 . . . . A 16 ARG CA . 30652 1
62 . 1 . 1 16 16 ARG N N 15 113.505 0.051 . 1 . . . . A 16 ARG N . 30652 1
63 . 1 . 1 17 17 SER H H 1 7.162 0.007 . 1 . . . . A 17 SER H . 30652 1
64 . 1 . 1 17 17 SER C C 13 172.364 0.023 . 1 . . . . A 17 SER C . 30652 1
65 . 1 . 1 17 17 SER CA C 13 57.077 0.031 . 1 . . . . A 17 SER CA . 30652 1
66 . 1 . 1 17 17 SER CB C 13 66.306 0.049 . 1 . . . . A 17 SER CB . 30652 1
67 . 1 . 1 17 17 SER N N 15 113.397 0.000 . 1 . . . . A 17 SER N . 30652 1
68 . 1 . 1 18 18 VAL H H 1 9.066 0.003 . 1 . . . . A 18 VAL H . 30652 1
69 . 1 . 1 18 18 VAL C C 13 175.322 0.010 . 1 . . . . A 18 VAL C . 30652 1
70 . 1 . 1 18 18 VAL CA C 13 59.081 0.007 . 1 . . . . A 18 VAL CA . 30652 1
71 . 1 . 1 18 18 VAL CB C 13 33.849 0.024 . 1 . . . . A 18 VAL CB . 30652 1
72 . 1 . 1 18 18 VAL N N 15 111.212 0.039 . 1 . . . . A 18 VAL N . 30652 1
73 . 1 . 1 19 19 PHE H H 1 8.763 0.003 . 1 . . . . A 19 PHE H . 30652 1
74 . 1 . 1 19 19 PHE C C 13 173.293 0.002 . 1 . . . . A 19 PHE C . 30652 1
75 . 1 . 1 19 19 PHE CA C 13 57.059 0.005 . 1 . . . . A 19 PHE CA . 30652 1
76 . 1 . 1 19 19 PHE CB C 13 41.381 0.028 . 1 . . . . A 19 PHE CB . 30652 1
77 . 1 . 1 19 19 PHE N N 15 124.678 0.000 . 1 . . . . A 19 PHE N . 30652 1
78 . 1 . 1 20 20 VAL H H 1 7.860 0.002 . 1 . . . . A 20 VAL H . 30652 1
79 . 1 . 1 20 20 VAL C C 13 173.667 0.001 . 1 . . . . A 20 VAL C . 30652 1
80 . 1 . 1 20 20 VAL CA C 13 60.008 0.026 . 1 . . . . A 20 VAL CA . 30652 1
81 . 1 . 1 20 20 VAL CB C 13 33.638 0.025 . 1 . . . . A 20 VAL CB . 30652 1
82 . 1 . 1 20 20 VAL N N 15 127.787 0.000 . 1 . . . . A 20 VAL N . 30652 1
83 . 1 . 1 21 21 GLY H H 1 9.440 0.005 . 1 . . . . A 21 GLY H . 30652 1
84 . 1 . 1 21 21 GLY CA C 13 43.074 0.020 . 1 . . . . A 21 GLY CA . 30652 1
85 . 1 . 1 21 21 GLY N N 15 111.800 0.021 . 1 . . . . A 21 GLY N . 30652 1
86 . 1 . 1 22 22 ASN H H 1 8.570 0.005 . 1 . . . . A 22 ASN H . 30652 1
87 . 1 . 1 22 22 ASN C C 13 173.769 0.025 . 1 . . . . A 22 ASN C . 30652 1
88 . 1 . 1 22 22 ASN CA C 13 53.317 0.006 . 1 . . . . A 22 ASN CA . 30652 1
89 . 1 . 1 22 22 ASN CB C 13 38.335 0.019 . 1 . . . . A 22 ASN CB . 30652 1
90 . 1 . 1 22 22 ASN N N 15 116.087 0.000 . 1 . . . . A 22 ASN N . 30652 1
91 . 1 . 1 23 23 ILE H H 1 7.669 0.006 . 1 . . . . A 23 ILE H . 30652 1
92 . 1 . 1 23 23 ILE N N 15 115.270 0.019 . 1 . . . . A 23 ILE N . 30652 1
93 . 1 . 1 24 24 PRO C C 13 177.423 0.000 . 1 . . . . A 24 PRO C . 30652 1
94 . 1 . 1 25 25 TYR H H 1 8.343 0.003 . 1 . . . . A 25 TYR H . 30652 1
95 . 1 . 1 25 25 TYR CA C 13 60.048 0.039 . 1 . . . . A 25 TYR CA . 30652 1
96 . 1 . 1 25 25 TYR CB C 13 38.024 0.003 . 1 . . . . A 25 TYR CB . 30652 1
97 . 1 . 1 25 25 TYR N N 15 122.907 0.000 . 1 . . . . A 25 TYR N . 30652 1
98 . 1 . 1 26 26 GLU H H 1 9.153 0.007 . 1 . . . . A 26 GLU H . 30652 1
99 . 1 . 1 26 26 GLU C C 13 176.523 0.003 . 1 . . . . A 26 GLU C . 30652 1
100 . 1 . 1 26 26 GLU CA C 13 57.182 0.004 . 1 . . . . A 26 GLU CA . 30652 1
101 . 1 . 1 26 26 GLU CB C 13 28.818 0.027 . 1 . . . . A 26 GLU CB . 30652 1
102 . 1 . 1 26 26 GLU N N 15 116.277 0.000 . 1 . . . . A 26 GLU N . 30652 1
103 . 1 . 1 27 27 ALA H H 1 7.432 0.005 . 1 . . . . A 27 ALA H . 30652 1
104 . 1 . 1 27 27 ALA C C 13 177.008 0.011 . 1 . . . . A 27 ALA C . 30652 1
105 . 1 . 1 27 27 ALA N N 15 122.692 0.000 . 1 . . . . A 27 ALA N . 30652 1
106 . 1 . 1 28 28 THR H H 1 7.917 0.003 . 1 . . . . A 28 THR H . 30652 1
107 . 1 . 1 28 28 THR CA C 13 58.701 0.052 . 1 . . . . A 28 THR CA . 30652 1
108 . 1 . 1 28 28 THR CB C 13 71.653 0.032 . 1 . . . . A 28 THR CB . 30652 1
109 . 1 . 1 28 28 THR N N 15 109.778 0.000 . 1 . . . . A 28 THR N . 30652 1
110 . 1 . 1 29 29 GLU H H 1 9.198 0.010 . 1 . . . . A 29 GLU H . 30652 1
111 . 1 . 1 29 29 GLU C C 13 178.154 0.000 . 1 . . . . A 29 GLU C . 30652 1
112 . 1 . 1 29 29 GLU CA C 13 60.414 0.082 . 1 . . . . A 29 GLU CA . 30652 1
113 . 1 . 1 29 29 GLU CB C 13 29.496 0.039 . 1 . . . . A 29 GLU CB . 30652 1
114 . 1 . 1 29 29 GLU N N 15 120.792 0.000 . 1 . . . . A 29 GLU N . 30652 1
115 . 1 . 1 30 30 GLU H H 1 8.501 0.001 . 1 . . . . A 30 GLU H . 30652 1
116 . 1 . 1 30 30 GLU C C 13 178.686 0.012 . 1 . . . . A 30 GLU C . 30652 1
117 . 1 . 1 30 30 GLU CB C 13 29.358 0.099 . 1 . . . . A 30 GLU CB . 30652 1
118 . 1 . 1 30 30 GLU N N 15 117.527 0.000 . 1 . . . . A 30 GLU N . 30652 1
119 . 1 . 1 31 31 GLN H H 1 7.545 0.003 . 1 . . . . A 31 GLN H . 30652 1
120 . 1 . 1 31 31 GLN C C 13 179.800 0.009 . 1 . . . . A 31 GLN C . 30652 1
121 . 1 . 1 31 31 GLN CA C 13 58.322 0.010 . 1 . . . . A 31 GLN CA . 30652 1
122 . 1 . 1 31 31 GLN CB C 13 29.204 0.054 . 1 . . . . A 31 GLN CB . 30652 1
123 . 1 . 1 31 31 GLN N N 15 118.011 0.000 . 1 . . . . A 31 GLN N . 30652 1
124 . 1 . 1 32 32 LEU H H 1 7.491 0.006 . 1 . . . . A 32 LEU H . 30652 1
125 . 1 . 1 32 32 LEU C C 13 178.494 0.025 . 1 . . . . A 32 LEU C . 30652 1
126 . 1 . 1 32 32 LEU CA C 13 57.046 0.017 . 1 . . . . A 32 LEU CA . 30652 1
127 . 1 . 1 32 32 LEU CB C 13 39.385 0.076 . 1 . . . . A 32 LEU CB . 30652 1
128 . 1 . 1 32 32 LEU N N 15 119.532 0.000 . 1 . . . . A 32 LEU N . 30652 1
129 . 1 . 1 33 33 LYS H H 1 8.538 0.005 . 1 . . . . A 33 LYS H . 30652 1
130 . 1 . 1 33 33 LYS CA C 13 61.187 0.018 . 1 . . . . A 33 LYS CA . 30652 1
131 . 1 . 1 33 33 LYS CB C 13 31.874 0.018 . 1 . . . . A 33 LYS CB . 30652 1
132 . 1 . 1 33 33 LYS N N 15 121.046 0.000 . 1 . . . . A 33 LYS N . 30652 1
133 . 1 . 1 34 34 ASP H H 1 7.477 0.009 . 1 . . . . A 34 ASP H . 30652 1
134 . 1 . 1 34 34 ASP C C 13 178.846 0.002 . 1 . . . . A 34 ASP C . 30652 1
135 . 1 . 1 34 34 ASP CA C 13 57.817 0.022 . 1 . . . . A 34 ASP CA . 30652 1
136 . 1 . 1 34 34 ASP CB C 13 40.406 0.010 . 1 . . . . A 34 ASP CB . 30652 1
137 . 1 . 1 34 34 ASP N N 15 118.795 0.000 . 1 . . . . A 34 ASP N . 30652 1
138 . 1 . 1 35 35 ILE H H 1 7.319 0.003 . 1 . . . . A 35 ILE H . 30652 1
139 . 1 . 1 35 35 ILE C C 13 178.122 0.001 . 1 . . . . A 35 ILE C . 30652 1
140 . 1 . 1 35 35 ILE CA C 13 64.216 0.014 . 1 . . . . A 35 ILE CA . 30652 1
141 . 1 . 1 35 35 ILE CB C 13 38.422 0.025 . 1 . . . . A 35 ILE CB . 30652 1
142 . 1 . 1 35 35 ILE N N 15 119.634 0.019 . 1 . . . . A 35 ILE N . 30652 1
143 . 1 . 1 36 36 PHE H H 1 8.567 0.003 . 1 . . . . A 36 PHE H . 30652 1
144 . 1 . 1 36 36 PHE C C 13 178.138 0.000 . 1 . . . . A 36 PHE C . 30652 1
145 . 1 . 1 36 36 PHE CA C 13 61.912 0.000 . 1 . . . . A 36 PHE CA . 30652 1
146 . 1 . 1 36 36 PHE CB C 13 37.754 0.000 . 1 . . . . A 36 PHE CB . 30652 1
147 . 1 . 1 36 36 PHE N N 15 117.104 0.012 . 1 . . . . A 36 PHE N . 30652 1
148 . 1 . 1 37 37 SER H H 1 8.130 0.003 . 1 . . . . A 37 SER H . 30652 1
149 . 1 . 1 37 37 SER CA C 13 59.548 0.000 . 1 . . . . A 37 SER CA . 30652 1
150 . 1 . 1 37 37 SER CB C 13 63.492 0.000 . 1 . . . . A 37 SER CB . 30652 1
151 . 1 . 1 37 37 SER N N 15 116.845 0.020 . 1 . . . . A 37 SER N . 30652 1
152 . 1 . 1 38 38 GLU H H 1 7.694 0.002 . 1 . . . . A 38 GLU H . 30652 1
153 . 1 . 1 38 38 GLU C C 13 178.046 0.012 . 1 . . . . A 38 GLU C . 30652 1
154 . 1 . 1 38 38 GLU CA C 13 59.505 0.043 . 1 . . . . A 38 GLU CA . 30652 1
155 . 1 . 1 38 38 GLU CB C 13 30.599 0.043 . 1 . . . . A 38 GLU CB . 30652 1
156 . 1 . 1 38 38 GLU N N 15 121.365 0.000 . 1 . . . . A 38 GLU N . 30652 1
157 . 1 . 1 39 39 VAL H H 1 6.506 0.002 . 1 . . . . A 39 VAL H . 30652 1
158 . 1 . 1 39 39 VAL C C 13 174.872 0.004 . 1 . . . . A 39 VAL C . 30652 1
159 . 1 . 1 39 39 VAL CA C 13 61.387 0.001 . 1 . . . . A 39 VAL CA . 30652 1
160 . 1 . 1 39 39 VAL CB C 13 31.540 0.004 . 1 . . . . A 39 VAL CB . 30652 1
161 . 1 . 1 39 39 VAL N N 15 104.406 0.040 . 1 . . . . A 39 VAL N . 30652 1
162 . 1 . 1 40 40 GLY H H 1 7.235 0.003 . 1 . . . . A 40 GLY H . 30652 1
163 . 1 . 1 40 40 GLY N N 15 110.487 0.000 . 1 . . . . A 40 GLY N . 30652 1
164 . 1 . 1 42 42 VAL H H 1 8.389 0.005 . 1 . . . . A 42 VAL H . 30652 1
165 . 1 . 1 42 42 VAL C C 13 176.884 0.009 . 1 . . . . A 42 VAL C . 30652 1
166 . 1 . 1 42 42 VAL CA C 13 62.189 0.008 . 1 . . . . A 42 VAL CA . 30652 1
167 . 1 . 1 42 42 VAL CB C 13 33.815 0.014 . 1 . . . . A 42 VAL CB . 30652 1
168 . 1 . 1 42 42 VAL N N 15 124.534 0.049 . 1 . . . . A 42 VAL N . 30652 1
169 . 1 . 1 43 43 VAL H H 1 9.105 0.005 . 1 . . . . A 43 VAL H . 30652 1
170 . 1 . 1 43 43 VAL CA C 13 64.990 0.001 . 1 . . . . A 43 VAL CA . 30652 1
171 . 1 . 1 43 43 VAL CB C 13 32.294 0.053 . 1 . . . . A 43 VAL CB . 30652 1
172 . 1 . 1 43 43 VAL N N 15 129.959 0.000 . 1 . . . . A 43 VAL N . 30652 1
173 . 1 . 1 44 44 SER H H 1 7.327 0.010 . 1 . . . . A 44 SER H . 30652 1
174 . 1 . 1 44 44 SER CA C 13 57.701 0.024 . 1 . . . . A 44 SER CA . 30652 1
175 . 1 . 1 44 44 SER CB C 13 65.582 0.004 . 1 . . . . A 44 SER CB . 30652 1
176 . 1 . 1 44 44 SER N N 15 110.641 0.000 . 1 . . . . A 44 SER N . 30652 1
177 . 1 . 1 45 45 PHE H H 1 8.856 0.004 . 1 . . . . A 45 PHE H . 30652 1
178 . 1 . 1 45 45 PHE CB C 13 42.723 0.016 . 1 . . . . A 45 PHE CB . 30652 1
179 . 1 . 1 45 45 PHE N N 15 125.905 0.000 . 1 . . . . A 45 PHE N . 30652 1
180 . 1 . 1 46 46 ARG H H 1 8.121 0.006 . 1 . . . . A 46 ARG H . 30652 1
181 . 1 . 1 46 46 ARG C C 13 175.222 0.001 . 1 . . . . A 46 ARG C . 30652 1
182 . 1 . 1 46 46 ARG CA C 13 53.426 0.030 . 1 . . . . A 46 ARG CA . 30652 1
183 . 1 . 1 46 46 ARG CB C 13 32.994 0.015 . 1 . . . . A 46 ARG CB . 30652 1
184 . 1 . 1 46 46 ARG N N 15 126.350 0.000 . 1 . . . . A 46 ARG N . 30652 1
185 . 1 . 1 47 47 LEU H H 1 9.203 0.007 . 1 . . . . A 47 LEU H . 30652 1
186 . 1 . 1 47 47 LEU CA C 13 54.430 0.010 . 1 . . . . A 47 LEU CA . 30652 1
187 . 1 . 1 47 47 LEU CB C 13 43.021 0.017 . 1 . . . . A 47 LEU CB . 30652 1
188 . 1 . 1 47 47 LEU N N 15 124.967 0.000 . 1 . . . . A 47 LEU N . 30652 1
189 . 1 . 1 48 48 VAL H H 1 7.444 0.002 . 1 . . . . A 48 VAL H . 30652 1
190 . 1 . 1 48 48 VAL C C 13 174.855 0.000 . 1 . . . . A 48 VAL C . 30652 1
191 . 1 . 1 48 48 VAL CA C 13 62.532 0.023 . 1 . . . . A 48 VAL CA . 30652 1
192 . 1 . 1 48 48 VAL CB C 13 31.618 0.049 . 1 . . . . A 48 VAL CB . 30652 1
193 . 1 . 1 48 48 VAL N N 15 119.248 0.000 . 1 . . . . A 48 VAL N . 30652 1
194 . 1 . 1 49 49 TYR H H 1 8.682 0.002 . 1 . . . . A 49 TYR H . 30652 1
195 . 1 . 1 49 49 TYR C C 13 175.411 0.007 . 1 . . . . A 49 TYR C . 30652 1
196 . 1 . 1 49 49 TYR CA C 13 56.752 0.004 . 1 . . . . A 49 TYR CA . 30652 1
197 . 1 . 1 49 49 TYR CB C 13 40.904 0.049 . 1 . . . . A 49 TYR CB . 30652 1
198 . 1 . 1 49 49 TYR N N 15 126.596 0.000 . 1 . . . . A 49 TYR N . 30652 1
199 . 1 . 1 50 50 ASP H H 1 9.010 0.002 . 1 . . . . A 50 ASP H . 30652 1
200 . 1 . 1 50 50 ASP C C 13 177.737 0.008 . 1 . . . . A 50 ASP C . 30652 1
201 . 1 . 1 50 50 ASP CA C 13 54.436 0.005 . 1 . . . . A 50 ASP CA . 30652 1
202 . 1 . 1 50 50 ASP CB C 13 43.311 0.009 . 1 . . . . A 50 ASP CB . 30652 1
203 . 1 . 1 50 50 ASP N N 15 122.796 0.000 . 1 . . . . A 50 ASP N . 30652 1
204 . 1 . 1 51 51 ARG H H 1 9.035 0.005 . 1 . . . . A 51 ARG H . 30652 1
205 . 1 . 1 51 51 ARG C C 13 177.312 0.008 . 1 . . . . A 51 ARG C . 30652 1
206 . 1 . 1 51 51 ARG CA C 13 58.744 0.047 . 1 . . . . A 51 ARG CA . 30652 1
207 . 1 . 1 51 51 ARG CB C 13 30.228 0.042 . 1 . . . . A 51 ARG CB . 30652 1
208 . 1 . 1 51 51 ARG N N 15 128.392 0.000 . 1 . . . . A 51 ARG N . 30652 1
209 . 1 . 1 52 52 GLU H H 1 8.575 0.002 . 1 . . . . A 52 GLU H . 30652 1
210 . 1 . 1 52 52 GLU C C 13 178.473 0.010 . 1 . . . . A 52 GLU C . 30652 1
211 . 1 . 1 52 52 GLU CB C 13 30.380 0.050 . 1 . . . . A 52 GLU CB . 30652 1
212 . 1 . 1 52 52 GLU N N 15 117.447 0.007 . 1 . . . . A 52 GLU N . 30652 1
213 . 1 . 1 53 53 THR H H 1 8.243 0.011 . 1 . . . . A 53 THR H . 30652 1
214 . 1 . 1 53 53 THR C C 13 176.748 0.013 . 1 . . . . A 53 THR C . 30652 1
215 . 1 . 1 53 53 THR CA C 13 61.844 0.005 . 1 . . . . A 53 THR CA . 30652 1
216 . 1 . 1 53 53 THR CB C 13 71.275 0.036 . 1 . . . . A 53 THR CB . 30652 1
217 . 1 . 1 53 53 THR N N 15 106.665 0.020 . 1 . . . . A 53 THR N . 30652 1
218 . 1 . 1 54 54 GLY H H 1 8.292 0.003 . 1 . . . . A 54 GLY H . 30652 1
219 . 1 . 1 54 54 GLY C C 13 173.879 0.009 . 1 . . . . A 54 GLY C . 30652 1
220 . 1 . 1 54 54 GLY CA C 13 45.745 0.011 . 1 . . . . A 54 GLY CA . 30652 1
221 . 1 . 1 54 54 GLY N N 15 110.979 0.040 . 1 . . . . A 54 GLY N . 30652 1
222 . 1 . 1 55 55 LYS H H 1 7.748 0.003 . 1 . . . . A 55 LYS H . 30652 1
223 . 1 . 1 55 55 LYS N N 15 119.995 0.000 . 1 . . . . A 55 LYS N . 30652 1
224 . 1 . 1 56 56 PRO C C 13 177.444 0.000 . 1 . . . . A 56 PRO C . 30652 1
225 . 1 . 1 57 57 LYS H H 1 8.244 0.003 . 1 . . . . A 57 LYS H . 30652 1
226 . 1 . 1 57 57 LYS CA C 13 56.722 0.030 . 1 . . . . A 57 LYS CA . 30652 1
227 . 1 . 1 57 57 LYS CB C 13 33.302 0.077 . 1 . . . . A 57 LYS CB . 30652 1
228 . 1 . 1 57 57 LYS N N 15 118.670 0.000 . 1 . . . . A 57 LYS N . 30652 1
229 . 1 . 1 58 58 GLY H H 1 7.996 0.000 . 1 . . . . A 58 GLY H . 30652 1
230 . 1 . 1 58 58 GLY N N 15 107.717 0.000 . 1 . . . . A 58 GLY N . 30652 1
231 . 1 . 1 59 59 TYR H H 1 6.943 0.003 . 1 . . . . A 59 TYR H . 30652 1
232 . 1 . 1 59 59 TYR C C 13 173.748 0.002 . 1 . . . . A 59 TYR C . 30652 1
233 . 1 . 1 59 59 TYR CA C 13 54.983 0.002 . 1 . . . . A 59 TYR CA . 30652 1
234 . 1 . 1 59 59 TYR CB C 13 41.259 0.055 . 1 . . . . A 59 TYR CB . 30652 1
235 . 1 . 1 59 59 TYR N N 15 113.130 0.043 . 1 . . . . A 59 TYR N . 30652 1
236 . 1 . 1 60 60 GLY H H 1 8.781 0.003 . 1 . . . . A 60 GLY H . 30652 1
237 . 1 . 1 60 60 GLY C C 13 168.943 0.014 . 1 . . . . A 60 GLY C . 30652 1
238 . 1 . 1 60 60 GLY N N 15 107.075 0.021 . 1 . . . . A 60 GLY N . 30652 1
239 . 1 . 1 61 61 PHE H H 1 8.282 0.003 . 1 . . . . A 61 PHE H . 30652 1
240 . 1 . 1 61 61 PHE C C 13 174.069 0.011 . 1 . . . . A 61 PHE C . 30652 1
241 . 1 . 1 61 61 PHE CA C 13 56.139 0.006 . 1 . . . . A 61 PHE CA . 30652 1
242 . 1 . 1 61 61 PHE CB C 13 44.042 0.003 . 1 . . . . A 61 PHE CB . 30652 1
243 . 1 . 1 61 61 PHE N N 15 113.499 0.045 . 1 . . . . A 61 PHE N . 30652 1
244 . 1 . 1 62 62 CYS H H 1 8.624 0.004 . 1 . . . . A 62 CYS H . 30652 1
245 . 1 . 1 62 62 CYS C C 13 171.495 0.010 . 1 . . . . A 62 CYS C . 30652 1
246 . 1 . 1 62 62 CYS CA C 13 56.990 0.026 . 1 . . . . A 62 CYS CA . 30652 1
247 . 1 . 1 62 62 CYS CB C 13 27.952 0.001 . 1 . . . . A 62 CYS CB . 30652 1
248 . 1 . 1 62 62 CYS N N 15 123.791 0.000 . 1 . . . . A 62 CYS N . 30652 1
249 . 1 . 1 63 63 GLU H H 1 8.917 0.003 . 1 . . . . A 63 GLU H . 30652 1
250 . 1 . 1 63 63 GLU C C 13 174.445 0.006 . 1 . . . . A 63 GLU C . 30652 1
251 . 1 . 1 63 63 GLU CA C 13 55.363 0.033 . 1 . . . . A 63 GLU CA . 30652 1
252 . 1 . 1 63 63 GLU CB C 13 32.537 0.006 . 1 . . . . A 63 GLU CB . 30652 1
253 . 1 . 1 63 63 GLU N N 15 131.968 0.000 . 1 . . . . A 63 GLU N . 30652 1
254 . 1 . 1 64 64 TYR H H 1 8.940 0.002 . 1 . . . . A 64 TYR H . 30652 1
255 . 1 . 1 64 64 TYR C C 13 175.086 0.013 . 1 . . . . A 64 TYR C . 30652 1
256 . 1 . 1 64 64 TYR CA C 13 58.407 0.030 . 1 . . . . A 64 TYR CA . 30652 1
257 . 1 . 1 64 64 TYR CB C 13 40.739 0.005 . 1 . . . . A 64 TYR CB . 30652 1
258 . 1 . 1 64 64 TYR N N 15 126.315 0.000 . 1 . . . . A 64 TYR N . 30652 1
259 . 1 . 1 65 65 GLN H H 1 9.986 0.002 . 1 . . . . A 65 GLN H . 30652 1
260 . 1 . 1 65 65 GLN C C 13 176.243 0.010 . 1 . . . . A 65 GLN C . 30652 1
261 . 1 . 1 65 65 GLN CA C 13 57.921 0.018 . 1 . . . . A 65 GLN CA . 30652 1
262 . 1 . 1 65 65 GLN CB C 13 29.582 0.005 . 1 . . . . A 65 GLN CB . 30652 1
263 . 1 . 1 65 65 GLN N N 15 115.701 0.000 . 1 . . . . A 65 GLN N . 30652 1
264 . 1 . 1 66 66 ASP H H 1 7.501 0.003 . 1 . . . . A 66 ASP H . 30652 1
265 . 1 . 1 66 66 ASP C C 13 174.413 0.020 . 1 . . . . A 66 ASP C . 30652 1
266 . 1 . 1 66 66 ASP CA C 13 52.637 0.072 . 1 . . . . A 66 ASP CA . 30652 1
267 . 1 . 1 66 66 ASP CB C 13 43.011 0.006 . 1 . . . . A 66 ASP CB . 30652 1
268 . 1 . 1 66 66 ASP N N 15 110.929 0.022 . 1 . . . . A 66 ASP N . 30652 1
269 . 1 . 1 67 67 GLN H H 1 8.870 0.002 . 1 . . . . A 67 GLN H . 30652 1
270 . 1 . 1 67 67 GLN C C 13 177.763 0.014 . 1 . . . . A 67 GLN C . 30652 1
271 . 1 . 1 67 67 GLN CA C 13 58.600 0.026 . 1 . . . . A 67 GLN CA . 30652 1
272 . 1 . 1 67 67 GLN CB C 13 29.070 0.095 . 1 . . . . A 67 GLN CB . 30652 1
273 . 1 . 1 67 67 GLN N N 15 119.677 0.016 . 1 . . . . A 67 GLN N . 30652 1
274 . 1 . 1 68 68 GLU H H 1 9.051 0.005 . 1 . . . . A 68 GLU H . 30652 1
275 . 1 . 1 68 68 GLU C C 13 179.551 0.003 . 1 . . . . A 68 GLU C . 30652 1
276 . 1 . 1 68 68 GLU CA C 13 60.381 0.011 . 1 . . . . A 68 GLU CA . 30652 1
277 . 1 . 1 68 68 GLU N N 15 120.669 0.000 . 1 . . . . A 68 GLU N . 30652 1
278 . 1 . 1 69 69 THR H H 1 8.537 0.004 . 1 . . . . A 69 THR H . 30652 1
279 . 1 . 1 69 69 THR C C 13 175.306 0.003 . 1 . . . . A 69 THR C . 30652 1
280 . 1 . 1 69 69 THR N N 15 118.200 0.000 . 1 . . . . A 69 THR N . 30652 1
281 . 1 . 1 70 70 ALA H H 1 7.027 0.005 . 1 . . . . A 70 ALA H . 30652 1
282 . 1 . 1 70 70 ALA C C 13 179.184 0.009 . 1 . . . . A 70 ALA C . 30652 1
283 . 1 . 1 70 70 ALA CA C 13 55.780 0.023 . 1 . . . . A 70 ALA CA . 30652 1
284 . 1 . 1 70 70 ALA CB C 13 17.103 0.020 . 1 . . . . A 70 ALA CB . 30652 1
285 . 1 . 1 70 70 ALA N N 15 124.434 0.000 . 1 . . . . A 70 ALA N . 30652 1
286 . 1 . 1 71 71 LEU H H 1 8.233 0.004 . 1 . . . . A 71 LEU H . 30652 1
287 . 1 . 1 71 71 LEU C C 13 180.086 0.002 . 1 . . . . A 71 LEU C . 30652 1
288 . 1 . 1 71 71 LEU CA C 13 58.137 0.008 . 1 . . . . A 71 LEU CA . 30652 1
289 . 1 . 1 71 71 LEU CB C 13 41.312 0.039 . 1 . . . . A 71 LEU CB . 30652 1
290 . 1 . 1 71 71 LEU N N 15 117.725 0.000 . 1 . . . . A 71 LEU N . 30652 1
291 . 1 . 1 72 72 SER H H 1 7.843 0.003 . 1 . . . . A 72 SER H . 30652 1
292 . 1 . 1 72 72 SER C C 13 177.527 0.001 . 1 . . . . A 72 SER C . 30652 1
293 . 1 . 1 72 72 SER CA C 13 62.874 0.091 . 1 . . . . A 72 SER CA . 30652 1
294 . 1 . 1 72 72 SER CB C 13 60.958 0.020 . 1 . . . . A 72 SER CB . 30652 1
295 . 1 . 1 72 72 SER N N 15 115.499 0.039 . 1 . . . . A 72 SER N . 30652 1
296 . 1 . 1 73 73 ALA H H 1 8.394 0.004 . 1 . . . . A 73 ALA H . 30652 1
297 . 1 . 1 73 73 ALA C C 13 179.769 0.000 . 1 . . . . A 73 ALA C . 30652 1
298 . 1 . 1 73 73 ALA CA C 13 56.027 0.002 . 1 . . . . A 73 ALA CA . 30652 1
299 . 1 . 1 73 73 ALA CB C 13 19.238 0.058 . 1 . . . . A 73 ALA CB . 30652 1
300 . 1 . 1 73 73 ALA N N 15 124.380 0.002 . 1 . . . . A 73 ALA N . 30652 1
301 . 1 . 1 74 74 MET H H 1 7.937 0.003 . 1 . . . . A 74 MET H . 30652 1
302 . 1 . 1 74 74 MET C C 13 177.785 0.005 . 1 . . . . A 74 MET C . 30652 1
303 . 1 . 1 74 74 MET CA C 13 60.107 0.003 . 1 . . . . A 74 MET CA . 30652 1
304 . 1 . 1 74 74 MET CB C 13 33.532 0.020 . 1 . . . . A 74 MET CB . 30652 1
305 . 1 . 1 74 74 MET N N 15 117.007 0.000 . 1 . . . . A 74 MET N . 30652 1
306 . 1 . 1 75 75 ARG H H 1 7.880 0.004 . 1 . . . . A 75 ARG H . 30652 1
307 . 1 . 1 75 75 ARG C C 13 178.416 0.008 . 1 . . . . A 75 ARG C . 30652 1
308 . 1 . 1 75 75 ARG N N 15 116.004 0.039 . 1 . . . . A 75 ARG N . 30652 1
309 . 1 . 1 76 76 ASN H H 1 8.533 0.002 . 1 . . . . A 76 ASN H . 30652 1
310 . 1 . 1 76 76 ASN C C 13 176.481 0.001 . 1 . . . . A 76 ASN C . 30652 1
311 . 1 . 1 76 76 ASN CA C 13 55.424 0.007 . 1 . . . . A 76 ASN CA . 30652 1
312 . 1 . 1 76 76 ASN CB C 13 40.179 0.017 . 1 . . . . A 76 ASN CB . 30652 1
313 . 1 . 1 76 76 ASN N N 15 113.717 0.019 . 1 . . . . A 76 ASN N . 30652 1
314 . 1 . 1 77 77 LEU H H 1 8.610 0.005 . 1 . . . . A 77 LEU H . 30652 1
315 . 1 . 1 77 77 LEU C C 13 176.750 0.007 . 1 . . . . A 77 LEU C . 30652 1
316 . 1 . 1 77 77 LEU CA C 13 54.922 0.024 . 1 . . . . A 77 LEU CA . 30652 1
317 . 1 . 1 77 77 LEU CB C 13 42.509 0.003 . 1 . . . . A 77 LEU CB . 30652 1
318 . 1 . 1 77 77 LEU N N 15 117.212 0.016 . 1 . . . . A 77 LEU N . 30652 1
319 . 1 . 1 78 78 ASN H H 1 6.813 0.003 . 1 . . . . A 78 ASN H . 30652 1
320 . 1 . 1 78 78 ASN C C 13 176.405 0.007 . 1 . . . . A 78 ASN C . 30652 1
321 . 1 . 1 78 78 ASN N N 15 115.419 0.000 . 1 . . . . A 78 ASN N . 30652 1
322 . 1 . 1 79 79 GLY H H 1 9.071 0.005 . 1 . . . . A 79 GLY H . 30652 1
323 . 1 . 1 79 79 GLY C C 13 173.411 0.020 . 1 . . . . A 79 GLY C . 30652 1
324 . 1 . 1 79 79 GLY CA C 13 45.503 0.005 . 1 . . . . A 79 GLY CA . 30652 1
325 . 1 . 1 79 79 GLY N N 15 117.627 0.000 . 1 . . . . A 79 GLY N . 30652 1
326 . 1 . 1 80 80 ARG H H 1 7.753 0.002 . 1 . . . . A 80 ARG H . 30652 1
327 . 1 . 1 80 80 ARG C C 13 175.476 0.009 . 1 . . . . A 80 ARG C . 30652 1
328 . 1 . 1 80 80 ARG CA C 13 55.421 0.037 . 1 . . . . A 80 ARG CA . 30652 1
329 . 1 . 1 80 80 ARG CB C 13 30.164 0.011 . 1 . . . . A 80 ARG CB . 30652 1
330 . 1 . 1 80 80 ARG N N 15 122.067 0.000 . 1 . . . . A 80 ARG N . 30652 1
331 . 1 . 1 81 81 GLU H H 1 8.584 0.003 . 1 . . . . A 81 GLU H . 30652 1
332 . 1 . 1 81 81 GLU C C 13 176.524 0.002 . 1 . . . . A 81 GLU C . 30652 1
333 . 1 . 1 81 81 GLU CA C 13 56.608 0.015 . 1 . . . . A 81 GLU CA . 30652 1
334 . 1 . 1 81 81 GLU CB C 13 30.177 0.002 . 1 . . . . A 81 GLU CB . 30652 1
335 . 1 . 1 81 81 GLU N N 15 126.787 0.000 . 1 . . . . A 81 GLU N . 30652 1
336 . 1 . 1 82 82 PHE H H 1 9.361 0.004 . 1 . . . . A 82 PHE H . 30652 1
337 . 1 . 1 82 82 PHE CB C 13 41.502 0.022 . 1 . . . . A 82 PHE CB . 30652 1
338 . 1 . 1 82 82 PHE N N 15 126.952 0.000 . 1 . . . . A 82 PHE N . 30652 1
339 . 1 . 1 83 83 SER H H 1 8.874 0.002 . 1 . . . . A 83 SER H . 30652 1
340 . 1 . 1 83 83 SER C C 13 175.018 0.030 . 1 . . . . A 83 SER C . 30652 1
341 . 1 . 1 83 83 SER CA C 13 57.894 0.001 . 1 . . . . A 83 SER CA . 30652 1
342 . 1 . 1 83 83 SER CB C 13 62.543 0.047 . 1 . . . . A 83 SER CB . 30652 1
343 . 1 . 1 83 83 SER N N 15 122.999 0.000 . 1 . . . . A 83 SER N . 30652 1
344 . 1 . 1 84 84 GLY H H 1 8.599 0.005 . 1 . . . . A 84 GLY H . 30652 1
345 . 1 . 1 84 84 GLY C C 13 173.972 0.003 . 1 . . . . A 84 GLY C . 30652 1
346 . 1 . 1 84 84 GLY N N 15 103.936 0.032 . 1 . . . . A 84 GLY N . 30652 1
347 . 1 . 1 85 85 ARG H H 1 7.825 0.001 . 1 . . . . A 85 ARG H . 30652 1
348 . 1 . 1 85 85 ARG CA C 13 53.764 0.006 . 1 . . . . A 85 ARG CA . 30652 1
349 . 1 . 1 85 85 ARG CB C 13 32.785 0.003 . 1 . . . . A 85 ARG CB . 30652 1
350 . 1 . 1 85 85 ARG N N 15 120.286 0.000 . 1 . . . . A 85 ARG N . 30652 1
351 . 1 . 1 86 86 ALA H H 1 8.307 0.005 . 1 . . . . A 86 ALA H . 30652 1
352 . 1 . 1 86 86 ALA C C 13 177.252 0.002 . 1 . . . . A 86 ALA C . 30652 1
353 . 1 . 1 86 86 ALA CA C 13 51.025 0.036 . 1 . . . . A 86 ALA CA . 30652 1
354 . 1 . 1 86 86 ALA CB C 13 18.547 0.062 . 1 . . . . A 86 ALA CB . 30652 1
355 . 1 . 1 86 86 ALA N N 15 124.100 0.016 . 1 . . . . A 86 ALA N . 30652 1
356 . 1 . 1 87 87 LEU H H 1 8.969 0.003 . 1 . . . . A 87 LEU H . 30652 1
357 . 1 . 1 87 87 LEU C C 13 176.658 0.011 . 1 . . . . A 87 LEU C . 30652 1
358 . 1 . 1 87 87 LEU CA C 13 55.702 0.019 . 1 . . . . A 87 LEU CA . 30652 1
359 . 1 . 1 87 87 LEU CB C 13 42.508 0.002 . 1 . . . . A 87 LEU CB . 30652 1
360 . 1 . 1 87 87 LEU N N 15 127.190 0.000 . 1 . . . . A 87 LEU N . 30652 1
361 . 1 . 1 88 88 ARG H H 1 8.050 0.003 . 1 . . . . A 88 ARG H . 30652 1
362 . 1 . 1 88 88 ARG CA C 13 54.021 0.001 . 1 . . . . A 88 ARG CA . 30652 1
363 . 1 . 1 88 88 ARG CB C 13 32.047 0.004 . 1 . . . . A 88 ARG CB . 30652 1
364 . 1 . 1 88 88 ARG N N 15 123.449 0.000 . 1 . . . . A 88 ARG N . 30652 1
365 . 1 . 1 89 89 VAL H H 1 8.864 0.004 . 1 . . . . A 89 VAL H . 30652 1
366 . 1 . 1 89 89 VAL C C 13 174.226 0.043 . 1 . . . . A 89 VAL C . 30652 1
367 . 1 . 1 89 89 VAL CA C 13 61.214 0.039 . 1 . . . . A 89 VAL CA . 30652 1
368 . 1 . 1 89 89 VAL CB C 13 34.205 0.005 . 1 . . . . A 89 VAL CB . 30652 1
369 . 1 . 1 89 89 VAL N N 15 126.041 0.075 . 1 . . . . A 89 VAL N . 30652 1
370 . 1 . 1 90 90 ASP H H 1 9.353 0.002 . 1 . . . . A 90 ASP H . 30652 1
371 . 1 . 1 90 90 ASP C C 13 175.080 0.023 . 1 . . . . A 90 ASP C . 30652 1
372 . 1 . 1 90 90 ASP CA C 13 51.964 0.030 . 1 . . . . A 90 ASP CA . 30652 1
373 . 1 . 1 90 90 ASP CB C 13 45.853 0.030 . 1 . . . . A 90 ASP CB . 30652 1
374 . 1 . 1 90 90 ASP N N 15 126.819 0.000 . 1 . . . . A 90 ASP N . 30652 1
375 . 1 . 1 91 91 ASN H H 1 9.267 0.011 . 1 . . . . A 91 ASN H . 30652 1
376 . 1 . 1 91 91 ASN C C 13 175.501 0.016 . 1 . . . . A 91 ASN C . 30652 1
377 . 1 . 1 91 91 ASN CA C 13 54.696 0.041 . 1 . . . . A 91 ASN CA . 30652 1
378 . 1 . 1 91 91 ASN CB C 13 39.346 0.027 . 1 . . . . A 91 ASN CB . 30652 1
379 . 1 . 1 91 91 ASN N N 15 120.480 0.000 . 1 . . . . A 91 ASN N . 30652 1
380 . 1 . 1 92 92 ALA H H 1 8.553 0.003 . 1 . . . . A 92 ALA H . 30652 1
381 . 1 . 1 92 92 ALA C C 13 175.973 0.003 . 1 . . . . A 92 ALA C . 30652 1
382 . 1 . 1 92 92 ALA CA C 13 53.265 0.062 . 1 . . . . A 92 ALA CA . 30652 1
383 . 1 . 1 92 92 ALA CB C 13 18.974 0.017 . 1 . . . . A 92 ALA CB . 30652 1
384 . 1 . 1 92 92 ALA N N 15 125.846 0.000 . 1 . . . . A 92 ALA N . 30652 1
385 . 1 . 1 93 93 ALA H H 1 8.094 0.002 . 1 . . . . A 93 ALA H . 30652 1
386 . 1 . 1 93 93 ALA C C 13 177.850 0.016 . 1 . . . . A 93 ALA C . 30652 1
387 . 1 . 1 93 93 ALA CA C 13 52.281 0.018 . 1 . . . . A 93 ALA CA . 30652 1
388 . 1 . 1 93 93 ALA CB C 13 19.048 0.058 . 1 . . . . A 93 ALA CB . 30652 1
389 . 1 . 1 93 93 ALA N N 15 118.296 0.000 . 1 . . . . A 93 ALA N . 30652 1
390 . 1 . 1 94 94 SER H H 1 7.700 0.009 . 1 . . . . A 94 SER H . 30652 1
391 . 1 . 1 94 94 SER C C 13 174.950 0.012 . 1 . . . . A 94 SER C . 30652 1
392 . 1 . 1 94 94 SER CA C 13 58.072 0.015 . 1 . . . . A 94 SER CA . 30652 1
393 . 1 . 1 94 94 SER CB C 13 64.010 0.033 . 1 . . . . A 94 SER CB . 30652 1
394 . 1 . 1 94 94 SER N N 15 114.338 0.000 . 1 . . . . A 94 SER N . 30652 1
395 . 1 . 1 95 95 GLU H H 1 8.669 0.008 . 1 . . . . A 95 GLU H . 30652 1
396 . 1 . 1 95 95 GLU C C 13 178.012 0.013 . 1 . . . . A 95 GLU C . 30652 1
397 . 1 . 1 95 95 GLU CA C 13 58.997 0.008 . 1 . . . . A 95 GLU CA . 30652 1
398 . 1 . 1 95 95 GLU CB C 13 29.462 0.006 . 1 . . . . A 95 GLU CB . 30652 1
399 . 1 . 1 95 95 GLU N N 15 123.185 0.000 . 1 . . . . A 95 GLU N . 30652 1
400 . 1 . 1 96 96 LYS H H 1 8.128 0.005 . 1 . . . . A 96 LYS H . 30652 1
401 . 1 . 1 96 96 LYS C C 13 177.795 0.021 . 1 . . . . A 96 LYS C . 30652 1
402 . 1 . 1 96 96 LYS N N 15 118.234 0.000 . 1 . . . . A 96 LYS N . 30652 1
403 . 1 . 1 97 97 ASN H H 1 7.748 0.013 . 1 . . . . A 97 ASN H . 30652 1
404 . 1 . 1 97 97 ASN C C 13 176.198 0.001 . 1 . . . . A 97 ASN C . 30652 1
405 . 1 . 1 97 97 ASN CA C 13 54.399 0.014 . 1 . . . . A 97 ASN CA . 30652 1
406 . 1 . 1 97 97 ASN CB C 13 38.355 0.000 . 1 . . . . A 97 ASN CB . 30652 1
407 . 1 . 1 97 97 ASN N N 15 117.554 0.000 . 1 . . . . A 97 ASN N . 30652 1
408 . 1 . 1 98 98 LYS H H 1 8.218 0.009 . 1 . . . . A 98 LYS H . 30652 1
409 . 1 . 1 98 98 LYS C C 13 178.603 0.019 . 1 . . . . A 98 LYS C . 30652 1
410 . 1 . 1 98 98 LYS CA C 13 59.220 0.034 . 1 . . . . A 98 LYS CA . 30652 1
411 . 1 . 1 98 98 LYS CB C 13 32.393 0.026 . 1 . . . . A 98 LYS CB . 30652 1
412 . 1 . 1 98 98 LYS N N 15 121.110 0.000 . 1 . . . . A 98 LYS N . 30652 1
413 . 1 . 1 99 99 GLU H H 1 8.073 0.003 . 1 . . . . A 99 GLU H . 30652 1
414 . 1 . 1 99 99 GLU CA C 13 58.480 0.022 . 1 . . . . A 99 GLU CA . 30652 1
415 . 1 . 1 99 99 GLU CB C 13 29.441 0.012 . 1 . . . . A 99 GLU CB . 30652 1
416 . 1 . 1 99 99 GLU N N 15 119.759 0.000 . 1 . . . . A 99 GLU N . 30652 1
417 . 1 . 1 100 100 GLU H H 1 8.179 0.010 . 1 . . . . A 100 GLU H . 30652 1
418 . 1 . 1 100 100 GLU N N 15 120.995 0.000 . 1 . . . . A 100 GLU N . 30652 1
419 . 1 . 1 101 101 LEU H H 1 8.170 0.000 . 1 . . . . A 101 LEU H . 30652 1
420 . 1 . 1 101 101 LEU C C 13 178.821 0.016 . 1 . . . . A 101 LEU C . 30652 1
421 . 1 . 1 101 101 LEU CA C 13 56.917 0.027 . 1 . . . . A 101 LEU CA . 30652 1
422 . 1 . 1 101 101 LEU CB C 13 41.641 0.008 . 1 . . . . A 101 LEU CB . 30652 1
423 . 1 . 1 101 101 LEU N N 15 121.004 0.000 . 1 . . . . A 101 LEU N . 30652 1
424 . 1 . 1 102 102 LYS H H 1 7.831 0.007 . 1 . . . . A 102 LYS H . 30652 1
425 . 1 . 1 102 102 LYS C C 13 178.152 0.001 . 1 . . . . A 102 LYS C . 30652 1
426 . 1 . 1 102 102 LYS CA C 13 58.319 0.013 . 1 . . . . A 102 LYS CA . 30652 1
427 . 1 . 1 102 102 LYS CB C 13 32.489 0.012 . 1 . . . . A 102 LYS CB . 30652 1
428 . 1 . 1 102 102 LYS N N 15 119.884 0.000 . 1 . . . . A 102 LYS N . 30652 1
429 . 1 . 1 103 103 SER H H 1 7.876 0.006 . 1 . . . . A 103 SER H . 30652 1
430 . 1 . 1 103 103 SER C C 13 174.869 0.007 . 1 . . . . A 103 SER C . 30652 1
431 . 1 . 1 103 103 SER CA C 13 59.535 0.016 . 1 . . . . A 103 SER CA . 30652 1
432 . 1 . 1 103 103 SER CB C 13 63.551 0.042 . 1 . . . . A 103 SER CB . 30652 1
433 . 1 . 1 103 103 SER N N 15 114.806 0.000 . 1 . . . . A 103 SER N . 30652 1
434 . 1 . 1 104 104 LEU H H 1 7.718 0.011 . 1 . . . . A 104 LEU H . 30652 1
435 . 1 . 1 104 104 LEU C C 13 177.956 0.004 . 1 . . . . A 104 LEU C . 30652 1
436 . 1 . 1 104 104 LEU CA C 13 55.870 0.032 . 1 . . . . A 104 LEU CA . 30652 1
437 . 1 . 1 104 104 LEU CB C 13 42.333 0.016 . 1 . . . . A 104 LEU CB . 30652 1
438 . 1 . 1 104 104 LEU N N 15 122.569 0.000 . 1 . . . . A 104 LEU N . 30652 1
439 . 1 . 1 105 105 GLY H H 1 8.011 0.011 . 1 . . . . A 105 GLY H . 30652 1
440 . 1 . 1 105 105 GLY C C 13 174.361 0.001 . 1 . . . . A 105 GLY C . 30652 1
441 . 1 . 1 105 105 GLY CA C 13 45.433 0.037 . 1 . . . . A 105 GLY CA . 30652 1
442 . 1 . 1 105 105 GLY N N 15 107.697 0.000 . 1 . . . . A 105 GLY N . 30652 1
443 . 1 . 1 106 106 THR H H 1 8.045 0.002 . 1 . . . . A 106 THR H . 30652 1
444 . 1 . 1 106 106 THR N N 15 112.646 0.022 . 1 . . . . A 106 THR N . 30652 1
stop_
save_