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 52803
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Abl SH3SH2KD in complex with axitinib'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N TROSY' . . . 52803 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 52803 1
2 $software_2 . . 52803 1
3 $software_3 . . 52803 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 5 5 PHE H H 1 9.355 . . 1 . . . . . 85 PHE H . 52803 1
2 . 1 . 1 5 5 PHE N N 15 126.526 . . 1 . . . . . 85 PHE N . 52803 1
3 . 1 . 1 6 6 VAL H H 1 9.467 . . 1 . . . . . 86 VAL H . 52803 1
4 . 1 . 1 6 6 VAL N N 15 117.453 . . 1 . . . . . 86 VAL N . 52803 1
5 . 1 . 1 7 7 ALA H H 1 8.474 . . 1 . . . . . 87 ALA H . 52803 1
6 . 1 . 1 7 7 ALA N N 15 127.381 . . 1 . . . . . 87 ALA N . 52803 1
7 . 1 . 1 8 8 LEU H H 1 9.407 . . 1 . . . . . 88 LEU H . 52803 1
8 . 1 . 1 8 8 LEU N N 15 127.029 . . 1 . . . . . 88 LEU N . 52803 1
9 . 1 . 1 9 9 TYR H H 1 7.075 . . 1 . . . . . 89 TYR H . 52803 1
10 . 1 . 1 9 9 TYR N N 15 113.100 . . 1 . . . . . 89 TYR N . 52803 1
11 . 1 . 1 10 10 ASP H H 1 8.201 . . 1 . . . . . 90 ASP H . 52803 1
12 . 1 . 1 10 10 ASP N N 15 118.000 . . 1 . . . . . 90 ASP N . 52803 1
13 . 1 . 1 11 11 PHE H H 1 8.815 . . 1 . . . . . 91 PHE H . 52803 1
14 . 1 . 1 11 11 PHE N N 15 122.735 . . 1 . . . . . 91 PHE N . 52803 1
15 . 1 . 1 12 12 VAL H H 1 7.850 . . 1 . . . . . 92 VAL H . 52803 1
16 . 1 . 1 12 12 VAL N N 15 129.722 . . 1 . . . . . 92 VAL N . 52803 1
17 . 1 . 1 13 13 ALA H H 1 8.283 . . 1 . . . . . 93 ALA H . 52803 1
18 . 1 . 1 13 13 ALA N N 15 130.187 . . 1 . . . . . 93 ALA N . 52803 1
19 . 1 . 1 14 14 SER H H 1 7.999 . . 1 . . . . . 94 SER H . 52803 1
20 . 1 . 1 14 14 SER N N 15 116.454 . . 1 . . . . . 94 SER N . 52803 1
21 . 1 . 1 21 21 ILE H H 1 9.019 . . 1 . . . . . 101 ILE H . 52803 1
22 . 1 . 1 21 21 ILE N N 15 117.591 . . 1 . . . . . 101 ILE N . 52803 1
23 . 1 . 1 22 22 THR H H 1 8.991 . . 1 . . . . . 102 THR H . 52803 1
24 . 1 . 1 22 22 THR N N 15 119.415 . . 1 . . . . . 102 THR N . 52803 1
25 . 1 . 1 24 24 GLY H H 1 8.895 . . 1 . . . . . 104 GLY H . 52803 1
26 . 1 . 1 24 24 GLY N N 15 114.841 . . 1 . . . . . 104 GLY N . 52803 1
27 . 1 . 1 26 26 LYS H H 1 8.299 . . 1 . . . . . 106 LYS H . 52803 1
28 . 1 . 1 26 26 LYS N N 15 122.380 . . 1 . . . . . 106 LYS N . 52803 1
29 . 1 . 1 27 27 LEU H H 1 9.015 . . 1 . . . . . 107 LEU H . 52803 1
30 . 1 . 1 27 27 LEU N N 15 119.836 . . 1 . . . . . 107 LEU N . 52803 1
31 . 1 . 1 28 28 ARG H H 1 8.311 . . 1 . . . . . 108 ARG H . 52803 1
32 . 1 . 1 28 28 ARG N N 15 120.872 . . 1 . . . . . 108 ARG N . 52803 1
33 . 1 . 1 29 29 VAL H H 1 8.506 . . 1 . . . . . 109 VAL H . 52803 1
34 . 1 . 1 29 29 VAL N N 15 125.063 . . 1 . . . . . 109 VAL N . 52803 1
35 . 1 . 1 30 30 LEU H H 1 9.227 . . 1 . . . . . 110 LEU H . 52803 1
36 . 1 . 1 30 30 LEU N N 15 129.039 . . 1 . . . . . 110 LEU N . 52803 1
37 . 1 . 1 31 31 GLY H H 1 6.938 . . 1 . . . . . 111 GLY H . 52803 1
38 . 1 . 1 31 31 GLY N N 15 106.065 . . 1 . . . . . 111 GLY N . 52803 1
39 . 1 . 1 32 32 TYR H H 1 8.724 . . 1 . . . . . 112 TYR H . 52803 1
40 . 1 . 1 32 32 TYR N N 15 117.530 . . 1 . . . . . 112 TYR N . 52803 1
41 . 1 . 1 33 33 ASN H H 1 8.879 . . 1 . . . . . 113 ASN H . 52803 1
42 . 1 . 1 33 33 ASN N N 15 120.848 . . 1 . . . . . 113 ASN N . 52803 1
43 . 1 . 1 35 35 ASN H H 1 6.346 . . 1 . . . . . 115 ASN H . 52803 1
44 . 1 . 1 35 35 ASN N N 15 113.634 . . 1 . . . . . 115 ASN N . 52803 1
45 . 1 . 1 36 36 GLY H H 1 7.600 . . 1 . . . . . 116 GLY H . 52803 1
46 . 1 . 1 36 36 GLY N N 15 108.142 . . 1 . . . . . 116 GLY N . 52803 1
47 . 1 . 1 37 37 GLU H H 1 8.466 . . 1 . . . . . 117 GLU H . 52803 1
48 . 1 . 1 37 37 GLU N N 15 122.671 . . 1 . . . . . 117 GLU N . 52803 1
49 . 1 . 1 38 38 TRP H H 1 8.446 . . 1 . . . . . 118 TRP H . 52803 1
50 . 1 . 1 38 38 TRP N N 15 120.000 . . 1 . . . . . 118 TRP N . 52803 1
51 . 1 . 1 39 39 CYS H H 1 9.744 . . 1 . . . . . 119 CYS H . 52803 1
52 . 1 . 1 39 39 CYS N N 15 118.176 . . 1 . . . . . 119 CYS N . 52803 1
53 . 1 . 1 40 40 GLU H H 1 8.013 . . 1 . . . . . 120 GLU H . 52803 1
54 . 1 . 1 40 40 GLU N N 15 128.420 . . 1 . . . . . 120 GLU N . 52803 1
55 . 1 . 1 41 41 ALA H H 1 9.012 . . 1 . . . . . 121 ALA H . 52803 1
56 . 1 . 1 41 41 ALA N N 15 130.960 . . 1 . . . . . 121 ALA N . 52803 1
57 . 1 . 1 42 42 GLN H H 1 8.719 . . 1 . . . . . 122 GLN H . 52803 1
58 . 1 . 1 42 42 GLN N N 15 117.538 . . 1 . . . . . 122 GLN N . 52803 1
59 . 1 . 1 43 43 THR H H 1 9.063 . . 1 . . . . . 123 THR H . 52803 1
60 . 1 . 1 43 43 THR N N 15 118.109 . . 1 . . . . . 123 THR N . 52803 1
61 . 1 . 1 45 45 ASN H H 1 8.209 . . 1 . . . . . 125 ASN H . 52803 1
62 . 1 . 1 45 45 ASN N N 15 114.368 . . 1 . . . . . 125 ASN N . 52803 1
63 . 1 . 1 46 46 GLY H H 1 7.464 . . 1 . . . . . 126 GLY H . 52803 1
64 . 1 . 1 46 46 GLY N N 15 108.757 . . 1 . . . . . 126 GLY N . 52803 1
65 . 1 . 1 47 47 GLN H H 1 8.227 . . 1 . . . . . 127 GLN H . 52803 1
66 . 1 . 1 47 47 GLN N N 15 120.098 . . 1 . . . . . 127 GLN N . 52803 1
67 . 1 . 1 48 48 GLY H H 1 8.668 . . 1 . . . . . 128 GLY H . 52803 1
68 . 1 . 1 48 48 GLY N N 15 112.862 . . 1 . . . . . 128 GLY N . 52803 1
69 . 1 . 1 49 49 TRP H H 1 8.938 . . 1 . . . . . 129 TRP H . 52803 1
70 . 1 . 1 49 49 TRP N N 15 121.626 . . 1 . . . . . 129 TRP N . 52803 1
71 . 1 . 1 50 50 VAL H H 1 9.629 . . 1 . . . . . 130 VAL H . 52803 1
72 . 1 . 1 50 50 VAL N N 15 115.738 . . 1 . . . . . 130 VAL N . 52803 1
73 . 1 . 1 52 52 SER H H 1 8.429 . . 1 . . . . . 132 SER H . 52803 1
74 . 1 . 1 52 52 SER N N 15 121.456 . . 1 . . . . . 132 SER N . 52803 1
75 . 1 . 1 53 53 ASN H H 1 8.254 . . 1 . . . . . 133 ASN H . 52803 1
76 . 1 . 1 53 53 ASN N N 15 113.806 . . 1 . . . . . 133 ASN N . 52803 1
77 . 1 . 1 54 54 TYR H H 1 7.814 . . 1 . . . . . 134 TYR H . 52803 1
78 . 1 . 1 54 54 TYR N N 15 119.438 . . 1 . . . . . 134 TYR N . 52803 1
79 . 1 . 1 55 55 ILE H H 1 7.325 . . 1 . . . . . 135 ILE H . 52803 1
80 . 1 . 1 55 55 ILE N N 15 112.010 . . 1 . . . . . 135 ILE N . 52803 1
81 . 1 . 1 56 56 THR H H 1 8.584 . . 1 . . . . . 136 THR H . 52803 1
82 . 1 . 1 56 56 THR N N 15 115.635 . . 1 . . . . . 136 THR N . 52803 1
83 . 1 . 1 66 66 TRP H H 1 6.393 . . 1 . . . . . 146 TRP H . 52803 1
84 . 1 . 1 66 66 TRP N N 15 110.808 . . 1 . . . . . 146 TRP N . 52803 1
85 . 1 . 1 68 68 HIS H H 1 8.767 . . 1 . . . . . 148 HIS H . 52803 1
86 . 1 . 1 68 68 HIS N N 15 127.550 . . 1 . . . . . 148 HIS N . 52803 1
87 . 1 . 1 69 69 GLY H H 1 5.888 . . 1 . . . . . 149 GLY H . 52803 1
88 . 1 . 1 69 69 GLY N N 15 105.835 . . 1 . . . . . 149 GLY N . 52803 1
89 . 1 . 1 71 71 VAL H H 1 8.069 . . 1 . . . . . 151 VAL H . 52803 1
90 . 1 . 1 71 71 VAL N N 15 126.938 . . 1 . . . . . 151 VAL N . 52803 1
91 . 1 . 1 76 76 ALA H H 1 8.603 . . 1 . . . . . 156 ALA H . 52803 1
92 . 1 . 1 76 76 ALA N N 15 121.691 . . 1 . . . . . 156 ALA N . 52803 1
93 . 1 . 1 79 79 LEU H H 1 8.680 . . 1 . . . . . 159 LEU H . 52803 1
94 . 1 . 1 79 79 LEU N N 15 123.704 . . 1 . . . . . 159 LEU N . 52803 1
95 . 1 . 1 80 80 LEU H H 1 7.532 . . 1 . . . . . 160 LEU H . 52803 1
96 . 1 . 1 80 80 LEU N N 15 116.421 . . 1 . . . . . 160 LEU N . 52803 1
97 . 1 . 1 86 86 GLY H H 1 9.294 . . 1 . . . . . 166 GLY H . 52803 1
98 . 1 . 1 86 86 GLY N N 15 109.505 . . 1 . . . . . 166 GLY N . 52803 1
99 . 1 . 1 88 88 PHE H H 1 8.780 . . 1 . . . . . 168 PHE H . 52803 1
100 . 1 . 1 88 88 PHE N N 15 121.163 . . 1 . . . . . 168 PHE N . 52803 1
101 . 1 . 1 89 89 LEU H H 1 9.049 . . 1 . . . . . 169 LEU H . 52803 1
102 . 1 . 1 89 89 LEU N N 15 114.884 . . 1 . . . . . 169 LEU N . 52803 1
103 . 1 . 1 90 90 VAL H H 1 9.229 . . 1 . . . . . 170 VAL H . 52803 1
104 . 1 . 1 90 90 VAL N N 15 121.400 . . 1 . . . . . 170 VAL N . 52803 1
105 . 1 . 1 91 91 ARG H H 1 9.121 . . 1 . . . . . 171 ARG H . 52803 1
106 . 1 . 1 91 91 ARG N N 15 123.273 . . 1 . . . . . 171 ARG N . 52803 1
107 . 1 . 1 92 92 GLU H H 1 8.142 . . 1 . . . . . 172 GLU H . 52803 1
108 . 1 . 1 92 92 GLU N N 15 121.516 . . 1 . . . . . 172 GLU N . 52803 1
109 . 1 . 1 93 93 SER H H 1 8.063 . . 1 . . . . . 173 SER H . 52803 1
110 . 1 . 1 93 93 SER N N 15 117.458 . . 1 . . . . . 173 SER N . 52803 1
111 . 1 . 1 99 99 GLN H H 1 8.041 . . 1 . . . . . 179 GLN H . 52803 1
112 . 1 . 1 99 99 GLN N N 15 121.782 . . 1 . . . . . 179 GLN N . 52803 1
113 . 1 . 1 100 100 ARG H H 1 9.160 . . 1 . . . . . 180 ARG H . 52803 1
114 . 1 . 1 100 100 ARG N N 15 126.956 . . 1 . . . . . 180 ARG N . 52803 1
115 . 1 . 1 101 101 SER H H 1 8.989 . . 1 . . . . . 181 SER H . 52803 1
116 . 1 . 1 101 101 SER N N 15 115.131 . . 1 . . . . . 181 SER N . 52803 1
117 . 1 . 1 102 102 ILE H H 1 9.512 . . 1 . . . . . 182 ILE H . 52803 1
118 . 1 . 1 102 102 ILE N N 15 123.034 . . 1 . . . . . 182 ILE N . 52803 1
119 . 1 . 1 103 103 SER H H 1 9.082 . . 1 . . . . . 183 SER H . 52803 1
120 . 1 . 1 103 103 SER N N 15 124.527 . . 1 . . . . . 183 SER N . 52803 1
121 . 1 . 1 104 104 LEU H H 1 9.326 . . 1 . . . . . 184 LEU H . 52803 1
122 . 1 . 1 104 104 LEU N N 15 127.387 . . 1 . . . . . 184 LEU N . 52803 1
123 . 1 . 1 107 107 GLU H H 1 9.344 . . 1 . . . . . 187 GLU H . 52803 1
124 . 1 . 1 107 107 GLU N N 15 129.150 . . 1 . . . . . 187 GLU N . 52803 1
125 . 1 . 1 108 108 GLY H H 1 8.394 . . 1 . . . . . 188 GLY H . 52803 1
126 . 1 . 1 108 108 GLY N N 15 103.212 . . 1 . . . . . 188 GLY N . 52803 1
127 . 1 . 1 109 109 ARG H H 1 7.772 . . 1 . . . . . 189 ARG H . 52803 1
128 . 1 . 1 109 109 ARG N N 15 120.952 . . 1 . . . . . 189 ARG N . 52803 1
129 . 1 . 1 110 110 VAL H H 1 8.264 . . 1 . . . . . 190 VAL H . 52803 1
130 . 1 . 1 110 110 VAL N N 15 121.347 . . 1 . . . . . 190 VAL N . 52803 1
131 . 1 . 1 111 111 TYR H H 1 9.430 . . 1 . . . . . 191 TYR H . 52803 1
132 . 1 . 1 111 111 TYR N N 15 129.460 . . 1 . . . . . 191 TYR N . 52803 1
133 . 1 . 1 112 112 HIS H H 1 8.374 . . 1 . . . . . 192 HIS H . 52803 1
134 . 1 . 1 112 112 HIS N N 15 120.652 . . 1 . . . . . 192 HIS N . 52803 1
135 . 1 . 1 113 113 TYR H H 1 9.653 . . 1 . . . . . 193 TYR H . 52803 1
136 . 1 . 1 113 113 TYR N N 15 122.077 . . 1 . . . . . 193 TYR N . 52803 1
137 . 1 . 1 114 114 ARG H H 1 8.794 . . 1 . . . . . 194 ARG H . 52803 1
138 . 1 . 1 114 114 ARG N N 15 125.639 . . 1 . . . . . 194 ARG N . 52803 1
139 . 1 . 1 115 115 ILE H H 1 8.275 . . 1 . . . . . 195 ILE H . 52803 1
140 . 1 . 1 115 115 ILE N N 15 123.254 . . 1 . . . . . 195 ILE N . 52803 1
141 . 1 . 1 116 116 ASN H H 1 8.740 . . 1 . . . . . 196 ASN H . 52803 1
142 . 1 . 1 116 116 ASN N N 15 128.987 . . 1 . . . . . 196 ASN N . 52803 1
143 . 1 . 1 117 117 THR H H 1 8.303 . . 1 . . . . . 197 THR H . 52803 1
144 . 1 . 1 117 117 THR N N 15 114.514 . . 1 . . . . . 197 THR N . 52803 1
145 . 1 . 1 118 118 ALA H H 1 9.663 . . 1 . . . . . 198 ALA H . 52803 1
146 . 1 . 1 118 118 ALA N N 15 130.090 . . 1 . . . . . 198 ALA N . 52803 1
147 . 1 . 1 120 120 ASP H H 1 7.806 . . 1 . . . . . 200 ASP H . 52803 1
148 . 1 . 1 120 120 ASP N N 15 118.550 . . 1 . . . . . 200 ASP N . 52803 1
149 . 1 . 1 121 121 GLY H H 1 8.129 . . 1 . . . . . 201 GLY H . 52803 1
150 . 1 . 1 121 121 GLY N N 15 108.582 . . 1 . . . . . 201 GLY N . 52803 1
151 . 1 . 1 122 122 LYS H H 1 7.503 . . 1 . . . . . 202 LYS H . 52803 1
152 . 1 . 1 122 122 LYS N N 15 119.695 . . 1 . . . . . 202 LYS N . 52803 1
153 . 1 . 1 123 123 LEU H H 1 9.185 . . 1 . . . . . 203 LEU H . 52803 1
154 . 1 . 1 123 123 LEU N N 15 120.273 . . 1 . . . . . 203 LEU N . 52803 1
155 . 1 . 1 124 124 TYR H H 1 8.687 . . 1 . . . . . 204 TYR H . 52803 1
156 . 1 . 1 124 124 TYR N N 15 114.966 . . 1 . . . . . 204 TYR N . 52803 1
157 . 1 . 1 126 126 SER H H 1 9.226 . . 1 . . . . . 206 SER H . 52803 1
158 . 1 . 1 126 126 SER N N 15 118.139 . . 1 . . . . . 206 SER N . 52803 1
159 . 1 . 1 128 128 GLU H H 1 8.422 . . 1 . . . . . 208 GLU H . 52803 1
160 . 1 . 1 128 128 GLU N N 15 117.199 . . 1 . . . . . 208 GLU N . 52803 1
161 . 1 . 1 131 131 PHE H H 1 9.112 . . 1 . . . . . 211 PHE H . 52803 1
162 . 1 . 1 131 131 PHE N N 15 118.476 . . 1 . . . . . 211 PHE N . 52803 1
163 . 1 . 1 133 133 THR H H 1 7.402 . . 1 . . . . . 213 THR H . 52803 1
164 . 1 . 1 133 133 THR N N 15 105.240 . . 1 . . . . . 213 THR N . 52803 1
165 . 1 . 1 135 135 ALA H H 1 8.882 . . 1 . . . . . 215 ALA H . 52803 1
166 . 1 . 1 135 135 ALA N N 15 120.297 . . 1 . . . . . 215 ALA N . 52803 1
167 . 1 . 1 137 137 LEU H H 1 7.192 . . 1 . . . . . 217 LEU H . 52803 1
168 . 1 . 1 137 137 LEU N N 15 123.893 . . 1 . . . . . 217 LEU N . 52803 1
169 . 1 . 1 138 138 VAL H H 1 8.067 . . 1 . . . . . 218 VAL H . 52803 1
170 . 1 . 1 138 138 VAL N N 15 120.073 . . 1 . . . . . 218 VAL N . 52803 1
171 . 1 . 1 140 140 HIS H H 1 7.897 . . 1 . . . . . 220 HIS H . 52803 1
172 . 1 . 1 140 140 HIS N N 15 121.209 . . 1 . . . . . 220 HIS N . 52803 1
173 . 1 . 1 141 141 HIS H H 1 7.694 . . 1 . . . . . 221 HIS H . 52803 1
174 . 1 . 1 141 141 HIS N N 15 116.002 . . 1 . . . . . 221 HIS N . 52803 1
175 . 1 . 1 142 142 SER H H 1 7.558 . . 1 . . . . . 222 SER H . 52803 1
176 . 1 . 1 142 142 SER N N 15 116.039 . . 1 . . . . . 222 SER N . 52803 1
177 . 1 . 1 144 144 VAL H H 1 7.625 . . 1 . . . . . 224 VAL H . 52803 1
178 . 1 . 1 144 144 VAL N N 15 121.490 . . 1 . . . . . 224 VAL N . 52803 1
179 . 1 . 1 145 145 ALA H H 1 8.244 . . 1 . . . . . 225 ALA H . 52803 1
180 . 1 . 1 145 145 ALA N N 15 128.281 . . 1 . . . . . 225 ALA N . 52803 1
181 . 1 . 1 146 146 ASP H H 1 8.336 . . 1 . . . . . 226 ASP H . 52803 1
182 . 1 . 1 146 146 ASP N N 15 116.891 . . 1 . . . . . 226 ASP N . 52803 1
183 . 1 . 1 147 147 GLY H H 1 8.181 . . 1 . . . . . 227 GLY H . 52803 1
184 . 1 . 1 147 147 GLY N N 15 105.888 . . 1 . . . . . 227 GLY N . 52803 1
185 . 1 . 1 148 148 LEU H H 1 7.236 . . 1 . . . . . 228 LEU H . 52803 1
186 . 1 . 1 148 148 LEU N N 15 120.197 . . 1 . . . . . 228 LEU N . 52803 1
187 . 1 . 1 149 149 ILE H H 1 7.101 . . 1 . . . . . 229 ILE H . 52803 1
188 . 1 . 1 149 149 ILE N N 15 118.809 . . 1 . . . . . 229 ILE N . 52803 1
189 . 1 . 1 150 150 THR H H 1 6.754 . . 1 . . . . . 230 THR H . 52803 1
190 . 1 . 1 150 150 THR N N 15 111.666 . . 1 . . . . . 230 THR N . 52803 1
191 . 1 . 1 151 151 THR H H 1 7.245 . . 1 . . . . . 231 THR H . 52803 1
192 . 1 . 1 151 151 THR N N 15 107.089 . . 1 . . . . . 231 THR N . 52803 1
193 . 1 . 1 152 152 LEU H H 1 7.526 . . 1 . . . . . 232 LEU H . 52803 1
194 . 1 . 1 152 152 LEU N N 15 118.201 . . 1 . . . . . 232 LEU N . 52803 1
195 . 1 . 1 153 153 HIS H H 1 8.357 . . 1 . . . . . 233 HIS H . 52803 1
196 . 1 . 1 153 153 HIS N N 15 123.875 . . 1 . . . . . 233 HIS N . 52803 1
197 . 1 . 1 156 156 ALA H H 1 8.755 . . 1 . . . . . 236 ALA H . 52803 1
198 . 1 . 1 156 156 ALA N N 15 130.465 . . 1 . . . . . 236 ALA N . 52803 1
199 . 1 . 1 175 175 GLU H H 1 7.445 . . 1 . . . . . 255 GLU H . 52803 1
200 . 1 . 1 175 175 GLU N N 15 120.871 . . 1 . . . . . 255 GLU N . 52803 1
201 . 1 . 1 200 200 TRP H H 1 9.648 . . 1 . . . . . 280 TRP H . 52803 1
202 . 1 . 1 200 200 TRP N N 15 130.920 . . 1 . . . . . 280 TRP N . 52803 1
203 . 1 . 1 204 204 SER H H 1 7.793 . . 1 . . . . . 284 SER H . 52803 1
204 . 1 . 1 204 204 SER N N 15 115.552 . . 1 . . . . . 284 SER N . 52803 1
205 . 1 . 1 205 205 LEU H H 1 7.143 . . 1 . . . . . 285 LEU H . 52803 1
206 . 1 . 1 205 205 LEU N N 15 120.097 . . 1 . . . . . 285 LEU N . 52803 1
207 . 1 . 1 206 206 THR H H 1 8.916 . . 1 . . . . . 286 THR H . 52803 1
208 . 1 . 1 206 206 THR N N 15 126.959 . . 1 . . . . . 286 THR N . 52803 1
209 . 1 . 1 207 207 VAL H H 1 8.691 . . 1 . . . . . 287 VAL H . 52803 1
210 . 1 . 1 207 207 VAL N N 15 120.064 . . 1 . . . . . 287 VAL N . 52803 1
211 . 1 . 1 224 224 LYS H H 1 8.071 . . 1 . . . . . 304 LYS H . 52803 1
212 . 1 . 1 224 224 LYS N N 15 122.589 . . 1 . . . . . 304 LYS N . 52803 1
213 . 1 . 1 239 239 GLN H H 1 9.245 . . 1 . . . . . 319 GLN H . 52803 1
214 . 1 . 1 239 239 GLN N N 15 127.790 . . 1 . . . . . 319 GLN N . 52803 1
215 . 1 . 1 256 256 PHE H H 1 8.676 . . 1 . . . . . 336 PHE H . 52803 1
216 . 1 . 1 256 256 PHE N N 15 123.176 . . 1 . . . . . 336 PHE N . 52803 1
217 . 1 . 1 263 263 LEU H H 1 7.149 . . 1 . . . . . 343 LEU H . 52803 1
218 . 1 . 1 263 263 LEU N N 15 120.916 . . 1 . . . . . 343 LEU N . 52803 1
219 . 1 . 1 264 264 ASP H H 1 8.160 . . 1 . . . . . 344 ASP H . 52803 1
220 . 1 . 1 264 264 ASP N N 15 118.700 . . 1 . . . . . 344 ASP N . 52803 1
221 . 1 . 1 267 267 ARG H H 1 7.813 . . 1 . . . . . 347 ARG H . 52803 1
222 . 1 . 1 267 267 ARG N N 15 116.842 . . 1 . . . . . 347 ARG N . 52803 1
223 . 1 . 1 268 268 GLU H H 1 7.374 . . 1 . . . . . 348 GLU H . 52803 1
224 . 1 . 1 268 268 GLU N N 15 115.257 . . 1 . . . . . 348 GLU N . 52803 1
225 . 1 . 1 269 269 CYS H H 1 7.126 . . 1 . . . . . 349 CYS H . 52803 1
226 . 1 . 1 269 269 CYS N N 15 117.322 . . 1 . . . . . 349 CYS N . 52803 1
227 . 1 . 1 270 270 ASN H H 1 8.507 . . 1 . . . . . 350 ASN H . 52803 1
228 . 1 . 1 270 270 ASN N N 15 118.946 . . 1 . . . . . 350 ASN N . 52803 1
229 . 1 . 1 271 271 ARG H H 1 8.861 . . 1 . . . . . 351 ARG H . 52803 1
230 . 1 . 1 271 271 ARG N N 15 128.051 . . 1 . . . . . 351 ARG N . 52803 1
231 . 1 . 1 272 272 GLN H H 1 7.960 . . 1 . . . . . 352 GLN H . 52803 1
232 . 1 . 1 272 272 GLN N N 15 116.236 . . 1 . . . . . 352 GLN N . 52803 1
233 . 1 . 1 273 273 GLU H H 1 7.168 . . 1 . . . . . 353 GLU H . 52803 1
234 . 1 . 1 273 273 GLU N N 15 118.925 . . 1 . . . . . 353 GLU N . 52803 1
235 . 1 . 1 274 274 VAL H H 1 8.434 . . 1 . . . . . 354 VAL H . 52803 1
236 . 1 . 1 274 274 VAL N N 15 122.921 . . 1 . . . . . 354 VAL N . 52803 1
237 . 1 . 1 275 275 ASN H H 1 6.717 . . 1 . . . . . 355 ASN H . 52803 1
238 . 1 . 1 275 275 ASN N N 15 120.701 . . 1 . . . . . 355 ASN N . 52803 1
239 . 1 . 1 276 276 ALA H H 1 9.065 . . 1 . . . . . 356 ALA H . 52803 1
240 . 1 . 1 276 276 ALA N N 15 119.910 . . 1 . . . . . 356 ALA N . 52803 1
241 . 1 . 1 292 292 TYR H H 1 7.324 . . 1 . . . . . 372 TYR H . 52803 1
242 . 1 . 1 292 292 TYR N N 15 122.295 . . 1 . . . . . 372 TYR N . 52803 1
243 . 1 . 1 302 302 ASP H H 1 10.868 . . 1 . . . . . 382 ASP H . 52803 1
244 . 1 . 1 302 302 ASP N N 15 127.625 . . 1 . . . . . 382 ASP N . 52803 1
245 . 1 . 1 303 303 LEU H H 1 9.469 . . 1 . . . . . 383 LEU H . 52803 1
246 . 1 . 1 303 303 LEU N N 15 126.218 . . 1 . . . . . 383 LEU N . 52803 1
247 . 1 . 1 306 306 ARG H H 1 9.393 . . 1 . . . . . 386 ARG H . 52803 1
248 . 1 . 1 306 306 ARG N N 15 114.870 . . 1 . . . . . 386 ARG N . 52803 1
249 . 1 . 1 310 310 VAL H H 1 8.294 . . 1 . . . . . 390 VAL H . 52803 1
250 . 1 . 1 310 310 VAL N N 15 120.886 . . 1 . . . . . 390 VAL N . 52803 1
251 . 1 . 1 311 311 GLY H H 1 9.131 . . 1 . . . . . 391 GLY H . 52803 1
252 . 1 . 1 311 311 GLY N N 15 116.049 . . 1 . . . . . 391 GLY N . 52803 1
253 . 1 . 1 312 312 GLU H H 1 8.522 . . 1 . . . . . 392 GLU H . 52803 1
254 . 1 . 1 312 312 GLU N N 15 119.341 . . 1 . . . . . 392 GLU N . 52803 1
255 . 1 . 1 315 315 LEU H H 1 6.544 . . 1 . . . . . 395 LEU H . 52803 1
256 . 1 . 1 315 315 LEU N N 15 119.919 . . 1 . . . . . 395 LEU N . 52803 1
257 . 1 . 1 320 320 ASP H H 1 7.317 . . 1 . . . . . 400 ASP H . 52803 1
258 . 1 . 1 320 320 ASP N N 15 116.648 . . 1 . . . . . 400 ASP N . 52803 1
259 . 1 . 1 321 321 PHE H H 1 7.839 . . 1 . . . . . 401 PHE H . 52803 1
260 . 1 . 1 321 321 PHE N N 15 123.018 . . 1 . . . . . 401 PHE N . 52803 1
261 . 1 . 1 322 322 GLY H H 1 8.317 . . 1 . . . . . 402 GLY H . 52803 1
262 . 1 . 1 322 322 GLY N N 15 110.977 . . 1 . . . . . 402 GLY N . 52803 1
263 . 1 . 1 337 337 GLY H H 1 8.339 . . 1 . . . . . 417 GLY H . 52803 1
264 . 1 . 1 337 337 GLY N N 15 107.238 . . 1 . . . . . 417 GLY N . 52803 1
265 . 1 . 1 348 348 GLU H H 1 9.691 . . 1 . . . . . 428 GLU H . 52803 1
266 . 1 . 1 348 348 GLU N N 15 117.579 . . 1 . . . . . 428 GLU N . 52803 1
267 . 1 . 1 351 351 ALA H H 1 8.061 . . 1 . . . . . 431 ALA H . 52803 1
268 . 1 . 1 351 351 ALA N N 15 117.857 . . 1 . . . . . 431 ALA N . 52803 1
269 . 1 . 1 352 352 TYR H H 1 6.982 . . 1 . . . . . 432 TYR H . 52803 1
270 . 1 . 1 352 352 TYR N N 15 111.892 . . 1 . . . . . 432 TYR N . 52803 1
271 . 1 . 1 363 363 ALA H H 1 7.968 . . 1 . . . . . 443 ALA H . 52803 1
272 . 1 . 1 363 363 ALA N N 15 122.338 . . 1 . . . . . 443 ALA N . 52803 1
273 . 1 . 1 364 364 PHE H H 1 9.451 . . 1 . . . . . 444 PHE H . 52803 1
274 . 1 . 1 364 364 PHE N N 15 120.556 . . 1 . . . . . 444 PHE N . 52803 1
275 . 1 . 1 375 375 GLY H H 1 9.432 . . 1 . . . . . 455 GLY H . 52803 1
276 . 1 . 1 375 375 GLY N N 15 104.147 . . 1 . . . . . 455 GLY N . 52803 1
277 . 1 . 1 377 377 SER H H 1 8.249 . . 1 . . . . . 457 SER H . 52803 1
278 . 1 . 1 377 377 SER N N 15 117.751 . . 1 . . . . . 457 SER N . 52803 1
279 . 1 . 1 379 379 TYR H H 1 7.090 . . 1 . . . . . 459 TYR H . 52803 1
280 . 1 . 1 379 379 TYR N N 15 115.456 . . 1 . . . . . 459 TYR N . 52803 1
281 . 1 . 1 382 382 ILE H H 1 7.296 . . 1 . . . . . 462 ILE H . 52803 1
282 . 1 . 1 382 382 ILE N N 15 120.155 . . 1 . . . . . 462 ILE N . 52803 1
283 . 1 . 1 383 383 ASP H H 1 8.548 . . 1 . . . . . 463 ASP H . 52803 1
284 . 1 . 1 383 383 ASP N N 15 128.003 . . 1 . . . . . 463 ASP N . 52803 1
285 . 1 . 1 384 384 LEU H H 1 8.507 . . 1 . . . . . 464 LEU H . 52803 1
286 . 1 . 1 384 384 LEU N N 15 126.309 . . 1 . . . . . 464 LEU N . 52803 1
287 . 1 . 1 385 385 SER H H 1 8.453 . . 1 . . . . . 465 SER H . 52803 1
288 . 1 . 1 385 385 SER N N 15 113.024 . . 1 . . . . . 465 SER N . 52803 1
289 . 1 . 1 386 386 GLN H H 1 7.910 . . 1 . . . . . 466 GLN H . 52803 1
290 . 1 . 1 386 386 GLN N N 15 120.332 . . 1 . . . . . 466 GLN N . 52803 1
291 . 1 . 1 387 387 VAL H H 1 6.894 . . 1 . . . . . 467 VAL H . 52803 1
292 . 1 . 1 387 387 VAL N N 15 119.593 . . 1 . . . . . 467 VAL N . 52803 1
293 . 1 . 1 388 388 TYR H H 1 8.660 . . 1 . . . . . 468 TYR H . 52803 1
294 . 1 . 1 388 388 TYR N N 15 119.916 . . 1 . . . . . 468 TYR N . 52803 1
295 . 1 . 1 389 389 GLU H H 1 8.217 . . 1 . . . . . 469 GLU H . 52803 1
296 . 1 . 1 389 389 GLU N N 15 118.007 . . 1 . . . . . 469 GLU N . 52803 1
297 . 1 . 1 391 391 LEU H H 1 8.549 . . 1 . . . . . 471 LEU H . 52803 1
298 . 1 . 1 391 391 LEU N N 15 121.112 . . 1 . . . . . 471 LEU N . 52803 1
299 . 1 . 1 392 392 GLU H H 1 8.590 . . 1 . . . . . 472 GLU H . 52803 1
300 . 1 . 1 392 392 GLU N N 15 123.423 . . 1 . . . . . 472 GLU N . 52803 1
301 . 1 . 1 393 393 LYS H H 1 7.206 . . 1 . . . . . 473 LYS H . 52803 1
302 . 1 . 1 393 393 LYS N N 15 118.688 . . 1 . . . . . 473 LYS N . 52803 1
303 . 1 . 1 394 394 ASP H H 1 7.671 . . 1 . . . . . 474 ASP H . 52803 1
304 . 1 . 1 394 394 ASP N N 15 113.202 . . 1 . . . . . 474 ASP N . 52803 1
305 . 1 . 1 395 395 TYR H H 1 8.093 . . 1 . . . . . 475 TYR H . 52803 1
306 . 1 . 1 395 395 TYR N N 15 121.512 . . 1 . . . . . 475 TYR N . 52803 1
307 . 1 . 1 396 396 ARG H H 1 6.839 . . 1 . . . . . 476 ARG H . 52803 1
308 . 1 . 1 396 396 ARG N N 15 125.904 . . 1 . . . . . 476 ARG N . 52803 1
309 . 1 . 1 397 397 MET H H 1 7.214 . . 1 . . . . . 477 MET H . 52803 1
310 . 1 . 1 397 397 MET N N 15 117.074 . . 1 . . . . . 477 MET N . 52803 1
311 . 1 . 1 398 398 GLU H H 1 8.592 . . 1 . . . . . 478 GLU H . 52803 1
312 . 1 . 1 398 398 GLU N N 15 120.870 . . 1 . . . . . 478 GLU N . 52803 1
313 . 1 . 1 399 399 ARG H H 1 8.220 . . 1 . . . . . 479 ARG H . 52803 1
314 . 1 . 1 399 399 ARG N N 15 124.997 . . 1 . . . . . 479 ARG N . 52803 1
315 . 1 . 1 408 408 TYR H H 1 7.719 . . 1 . . . . . 488 TYR H . 52803 1
316 . 1 . 1 408 408 TYR N N 15 122.545 . . 1 . . . . . 488 TYR N . 52803 1
317 . 1 . 1 410 410 LEU H H 1 6.850 . . 1 . . . . . 490 LEU H . 52803 1
318 . 1 . 1 410 410 LEU N N 15 121.774 . . 1 . . . . . 490 LEU N . 52803 1
319 . 1 . 1 413 413 ALA H H 1 7.595 . . 1 . . . . . 493 ALA H . 52803 1
320 . 1 . 1 413 413 ALA N N 15 124.853 . . 1 . . . . . 493 ALA N . 52803 1
321 . 1 . 1 416 416 GLN H H 1 6.927 . . 1 . . . . . 496 GLN H . 52803 1
322 . 1 . 1 416 416 GLN N N 15 119.869 . . 1 . . . . . 496 GLN N . 52803 1
323 . 1 . 1 417 417 TRP H H 1 9.507 . . 1 . . . . . 497 TRP H . 52803 1
324 . 1 . 1 417 417 TRP N N 15 125.824 . . 1 . . . . . 497 TRP N . 52803 1
325 . 1 . 1 418 418 ASN H H 1 8.894 . . 1 . . . . . 498 ASN H . 52803 1
326 . 1 . 1 418 418 ASN N N 15 116.906 . . 1 . . . . . 498 ASN N . 52803 1
327 . 1 . 1 420 420 SER H H 1 7.790 . . 1 . . . . . 500 SER H . 52803 1
328 . 1 . 1 420 420 SER N N 15 109.079 . . 1 . . . . . 500 SER N . 52803 1
329 . 1 . 1 421 421 ASP H H 1 7.756 . . 1 . . . . . 501 ASP H . 52803 1
330 . 1 . 1 421 421 ASP N N 15 119.616 . . 1 . . . . . 501 ASP N . 52803 1
331 . 1 . 1 422 422 ARG H H 1 7.291 . . 1 . . . . . 502 ARG H . 52803 1
332 . 1 . 1 422 422 ARG N N 15 120.981 . . 1 . . . . . 502 ARG N . 52803 1
333 . 1 . 1 424 424 SER H H 1 7.910 . . 1 . . . . . 504 SER H . 52803 1
334 . 1 . 1 424 424 SER N N 15 110.948 . . 1 . . . . . 504 SER N . 52803 1
335 . 1 . 1 427 427 GLU H H 1 7.810 . . 1 . . . . . 507 GLU H . 52803 1
336 . 1 . 1 427 427 GLU N N 15 119.738 . . 1 . . . . . 507 GLU N . 52803 1
337 . 1 . 1 431 431 ALA H H 1 8.291 . . 1 . . . . . 511 ALA H . 52803 1
338 . 1 . 1 431 431 ALA N N 15 124.422 . . 1 . . . . . 511 ALA N . 52803 1
339 . 1 . 1 449 449 LEU H H 1 8.092 . . 1 . . . . . 529 LEU H . 52803 1
340 . 1 . 1 449 449 LEU N N 15 119.405 . . 1 . . . . . 529 LEU N . 52803 1
341 . 1 . 1 450 450 GLY H H 1 7.804 . . 1 . . . . . 530 GLY H . 52803 1
342 . 1 . 1 450 450 GLY N N 15 106.922 . . 1 . . . . . 530 GLY N . 52803 1
343 . 1 . 1 451 451 LYS H H 1 7.580 . . 1 . . . . . 531 LYS H . 52803 1
344 . 1 . 1 451 451 LYS N N 15 120.626 . . 1 . . . . . 531 LYS N . 52803 1
345 . 1 . 1 454 454 VAL H H 1 7.514 . . 1 . . . . . 534 VAL H . 52803 1
346 . 1 . 1 454 454 VAL N N 15 123.231 . . 1 . . . . . 534 VAL N . 52803 1
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