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 16500
_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' . . . 16500 1
2 '3D HNCA' . . . 16500 1
3 '3D HNCO' . . . 16500 1
4 '3D HNCACB' . . . 16500 1
5 '3D HN(CO)CA' . . . 16500 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 $SPARKY . . 16500 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 MET C C 13 178.527 . . 1 . . . . 0 M C . 16500 1
2 . 1 1 1 1 MET CA C 13 55.119 . . 1 . . . . 0 M C . 16500 1
3 . 1 1 2 2 VAL H H 1 8.608 . . 1 . . . . 1 V H . 16500 1
4 . 1 1 2 2 VAL C C 13 175.478 . . 1 . . . . 1 V C . 16500 1
5 . 1 1 2 2 VAL CA C 13 62.314 . . 1 . . . . 1 V CA . 16500 1
6 . 1 1 2 2 VAL CB C 13 32.984 . . 1 . . . . 1 V CB . 16500 1
7 . 1 1 2 2 VAL N N 15 123.76 . . 1 . . . . 1 V N . 16500 1
8 . 1 1 3 3 LEU H H 1 8.469 . . 1 . . . . 2 L H . 16500 1
9 . 1 1 3 3 LEU C C 13 177.072 . . 1 . . . . 2 L C . 16500 1
10 . 1 1 3 3 LEU CA C 13 54.969 . . 1 . . . . 2 L CA . 16500 1
11 . 1 1 3 3 LEU CB C 13 42.638 . . 1 . . . . 2 L CB . 16500 1
12 . 1 1 3 3 LEU N N 15 127.166 . . 1 . . . . 2 L N . 16500 1
13 . 1 1 4 4 SER H H 1 8.283 . . 1 . . . . 3 S H . 16500 1
14 . 1 1 4 4 SER C C 13 174.574 . . 1 . . . . 3 S C . 16500 1
15 . 1 1 4 4 SER CA C 13 58.032 . . 1 . . . . 3 S CA . 16500 1
16 . 1 1 4 4 SER CB C 13 63.923 . . 1 . . . . 3 S CB . 16500 1
17 . 1 1 4 4 SER N N 15 117.094 . . 1 . . . . 3 S N . 16500 1
18 . 1 1 5 5 GLU H H 1 8.512 . . 1 . . . . 4 E H . 16500 1
19 . 1 1 5 5 GLU C C 13 176.801 . . 1 . . . . 4 E C . 16500 1
20 . 1 1 5 5 GLU CA C 13 56.67 . . 1 . . . . 4 E CA . 16500 1
21 . 1 1 5 5 GLU CB C 13 28.631 . . 1 . . . . 4 E CB . 16500 1
22 . 1 1 5 5 GLU N N 15 122.172 . . 1 . . . . 4 E N . 16500 1
23 . 1 1 6 6 GLY H H 1 8.435 . . 1 . . . . 5 G H . 16500 1
24 . 1 1 6 6 GLY C C 13 174.659 . . 1 . . . . 5 G C . 16500 1
25 . 1 1 6 6 GLY CA C 13 45.789 . . 1 . . . . 5 G CA . 16500 1
26 . 1 1 6 6 GLY N N 15 108.837 . . 1 . . . . 5 G N . 16500 1
27 . 1 1 7 7 GLU H H 1 8.115 . . 1 . . . . 6 E H . 16500 1
28 . 1 1 7 7 GLU C C 13 176.527 . . 1 . . . . 6 E C . 16500 1
29 . 1 1 7 7 GLU CA C 13 56.644 . . 1 . . . . 6 E CA . 16500 1
30 . 1 1 7 7 GLU CB C 13 28.698 . . 1 . . . . 6 E CB . 16500 1
31 . 1 1 7 7 GLU N N 15 120.223 . . 1 . . . . 6 E N . 16500 1
32 . 1 1 8 8 TRP H H 1 8.185 . . 1 . . . . 7 W H . 16500 1
33 . 1 1 8 8 TRP C C 13 176.57 . . 1 . . . . 7 W C . 16500 1
34 . 1 1 8 8 TRP CA C 13 58.043 . . 1 . . . . 7 W CA . 16500 1
35 . 1 1 8 8 TRP CB C 13 29.464 . . 1 . . . . 7 W CB . 16500 1
36 . 1 1 8 8 TRP N N 15 121.087 . . 1 . . . . 7 W N . 16500 1
37 . 1 1 9 9 GLN H H 1 8.101 . . 1 . . . . 8 Q H . 16500 1
38 . 1 1 9 9 GLN C C 13 176.138 . . 1 . . . . 8 Q C . 16500 1
39 . 1 1 9 9 GLN CA C 13 56.71 . . 1 . . . . 8 Q CA . 16500 1
40 . 1 1 9 9 GLN CB C 13 29.276 . . 1 . . . . 8 Q CB . 16500 1
41 . 1 1 9 9 GLN N N 15 119.752 . . 1 . . . . 8 Q N . 16500 1
42 . 1 1 10 10 LEU H H 1 7.879 . . 1 . . . . 9 L H . 16500 1
43 . 1 1 10 10 LEU C C 13 177.596 . . 1 . . . . 9 L C . 16500 1
44 . 1 1 10 10 LEU CA C 13 56.098 . . 1 . . . . 9 L CA . 16500 1
45 . 1 1 10 10 LEU CB C 13 42.306 . . 1 . . . . 9 L CB . 16500 1
46 . 1 1 10 10 LEU N N 15 121.838 . . 1 . . . . 9 L N . 16500 1
47 . 1 1 11 11 VAL H H 1 7.947 . . 1 . . . . 10 V H . 16500 1
48 . 1 1 11 11 VAL C C 13 176.184 . . 1 . . . . 10 V C . 16500 1
49 . 1 1 11 11 VAL CA C 13 63.006 . . 1 . . . . 10 V CA . 16500 1
50 . 1 1 11 11 VAL N N 15 120.742 . . 1 . . . . 10 V N . 16500 1
51 . 1 1 12 12 LEU H H 1 8.118 . . 1 . . . . 11 L H . 16500 1
52 . 1 1 12 12 LEU C C 13 177.261 . . 1 . . . . 11 L C . 16500 1
53 . 1 1 12 12 LEU CA C 13 55.584 . . 1 . . . . 11 L CA . 16500 1
54 . 1 1 12 12 LEU CB C 13 42.233 . . 1 . . . . 11 L CB . 16500 1
55 . 1 1 12 12 LEU N N 15 123.811 . . 1 . . . . 11 L N . 16500 1
56 . 1 1 13 13 HIS H H 1 8.265 . . 1 . . . . 12 H H . 16500 1
57 . 1 1 13 13 HIS C C 13 174.393 . . 1 . . . . 12 H C . 16500 1
58 . 1 1 13 13 HIS CA C 13 55.657 . . 1 . . . . 12 H CA . 16500 1
59 . 1 1 13 13 HIS CB C 13 28.647 . . 1 . . . . 12 H CB . 16500 1
60 . 1 1 13 13 HIS N N 15 117.859 . . 1 . . . . 12 H N . 16500 1
61 . 1 1 14 14 VAL H H 1 7.996 . . 1 . . . . 13 V H . 16500 1
62 . 1 1 14 14 VAL C C 13 175.856 . . 1 . . . . 13 V C . 16500 1
63 . 1 1 14 14 VAL CA C 13 62.769 . . 1 . . . . 13 V CA . 16500 1
64 . 1 1 14 14 VAL CB C 13 33.007 . . 1 . . . . 13 V CB . 16500 1
65 . 1 1 14 14 VAL N N 15 120.798 . . 1 . . . . 13 V N . 16500 1
66 . 1 1 15 15 TRP H H 1 8.259 . . 1 . . . . 14 W H . 16500 1
67 . 1 1 15 15 TRP CA C 13 57.445 . . 1 . . . . 14 W CA . 16500 1
68 . 1 1 15 15 TRP CB C 13 29.749 . . 1 . . . . 14 W CB . 16500 1
69 . 1 1 15 15 TRP N N 15 124.37 . . 1 . . . . 14 W N . 16500 1
70 . 1 1 16 16 ALA C C 13 177.366 . . 1 . . . . 15 A C . 16500 1
71 . 1 1 16 16 ALA CA C 13 52.628 . . 1 . . . . 15 A CA . 16500 1
72 . 1 1 16 16 ALA CB C 13 19.878 . . 1 . . . . 15 A CB . 16500 1
73 . 1 1 17 17 LYS H H 1 8.051 . . 1 . . . . 16 K H . 16500 1
74 . 1 1 17 17 LYS C C 13 176.77 . . 1 . . . . 16 K C . 16500 1
75 . 1 1 17 17 LYS CA C 13 56.726 . . 1 . . . . 16 K CA . 16500 1
76 . 1 1 17 17 LYS CB C 13 32.92 . . 1 . . . . 16 K CB . 16500 1
77 . 1 1 17 17 LYS N N 15 120.318 . . 1 . . . . 16 K N . 16500 1
78 . 1 1 18 18 VAL H H 1 8.069 . . 1 . . . . 17 V H . 16500 1
79 . 1 1 18 18 VAL C C 13 176.357 . . 1 . . . . 17 V C . 16500 1
80 . 1 1 18 18 VAL CA C 13 62.583 . . 1 . . . . 17 V CA . 16500 1
81 . 1 1 18 18 VAL CB C 13 32.895 . . 1 . . . . 17 V CB . 16500 1
82 . 1 1 18 18 VAL N N 15 121.219 . . 1 . . . . 17 V N . 16500 1
83 . 1 1 19 19 GLU H H 1 8.359 . . 1 . . . . 18 E H . 16500 1
84 . 1 1 19 19 GLU CA C 13 55.9 . . 1 . . . . 18 E CA . 16500 1
85 . 1 1 19 19 GLU CB C 13 28.846 . . 1 . . . . 18 E CB . 16500 1
86 . 1 1 19 19 GLU N N 15 123.665 . . 1 . . . . 18 E N . 16500 1
87 . 1 1 20 20 ALA C C 13 177.511 . . 1 . . . . 19 A C . 16500 1
88 . 1 1 20 20 ALA CA C 13 52.817 . . 1 . . . . 19 A CA . 16500 1
89 . 1 1 20 20 ALA CB C 13 19.411 . . 1 . . . . 19 A CB . 16500 1
90 . 1 1 21 21 ASP H H 1 8.351 . . 1 . . . . 20 D H . 16500 1
91 . 1 1 21 21 ASP C C 13 175.328 . . 1 . . . . 20 D C . 16500 1
92 . 1 1 21 21 ASP CA C 13 53.124 . . 1 . . . . 20 D CA . 16500 1
93 . 1 1 21 21 ASP CB C 13 38.153 . . 1 . . . . 20 D CB . 16500 1
94 . 1 1 21 21 ASP N N 15 117.807 . . 1 . . . . 20 D N . 16500 1
95 . 1 1 22 22 VAL H H 1 8.007 . . 1 . . . . 21 V H . 16500 1
96 . 1 1 22 22 VAL C C 13 176.033 . . 1 . . . . 21 V C . 16500 1
97 . 1 1 22 22 VAL CA C 13 62.456 . . 1 . . . . 21 V CA . 16500 1
98 . 1 1 22 22 VAL CB C 13 32.754 . . 1 . . . . 21 V CB . 16500 1
99 . 1 1 22 22 VAL N N 15 120.267 . . 1 . . . . 21 V N . 16500 1
100 . 1 1 23 23 ALA H H 1 8.32 . . 1 . . . . 22 A H . 16500 1
101 . 1 1 23 23 ALA C C 13 178.249 . . 1 . . . . 22 A C . 16500 1
102 . 1 1 23 23 ALA CA C 13 52.882 . . 1 . . . . 22 A CA . 16500 1
103 . 1 1 23 23 ALA CB C 13 19.127 . . 1 . . . . 22 A CB . 16500 1
104 . 1 1 23 23 ALA N N 15 126.909 . . 1 . . . . 22 A N . 16500 1
105 . 1 1 24 24 GLY H H 1 8.283 . . 1 . . . . 23 G H . 16500 1
106 . 1 1 24 24 GLY C C 13 174.243 . . 1 . . . . 23 G C . 16500 1
107 . 1 1 24 24 GLY CA C 13 45.527 . . 1 . . . . 23 G CA . 16500 1
108 . 1 1 24 24 GLY N N 15 107.736 . . 1 . . . . 23 G N . 16500 1
109 . 1 1 25 25 HIS H H 1 8.374 . . 1 . . . . 24 H H . 16500 1
110 . 1 1 25 25 HIS C C 13 175.016 . . 1 . . . . 24 H C . 16500 1
111 . 1 1 25 25 HIS CA C 13 55.414 . . 1 . . . . 24 H CA . 16500 1
112 . 1 1 25 25 HIS CB C 13 28.992 . . 1 . . . . 24 H CB . 16500 1
113 . 1 1 25 25 HIS N N 15 117.696 . . 1 . . . . 24 H N . 16500 1
114 . 1 1 26 26 GLY H H 1 8.543 . . 1 . . . . 25 G H . 16500 1
115 . 1 1 26 26 GLY C C 13 174.177 . . 1 . . . . 25 G C . 16500 1
116 . 1 1 26 26 GLY CA C 13 45.689 . . 1 . . . . 25 G CA . 16500 1
117 . 1 1 26 26 GLY N N 15 109.752 . . 1 . . . . 25 G N . 16500 1
118 . 1 1 27 27 GLN H H 1 8.338 . . 1 . . . . 26 Q H . 16500 1
119 . 1 1 27 27 GLN C C 13 175.893 . . 1 . . . . 26 Q C . 16500 1
120 . 1 1 27 27 GLN CA C 13 56.171 . . 1 . . . . 26 Q CA . 16500 1
121 . 1 1 27 27 GLN CB C 13 29.613 . . 1 . . . . 26 Q CB . 16500 1
122 . 1 1 27 27 GLN N N 15 119.752 . . 1 . . . . 26 Q N . 16500 1
123 . 1 1 28 28 ASP H H 1 8.55 . . 1 . . . . 27 D H . 16500 1
124 . 1 1 28 28 ASP C C 13 175.247 . . 1 . . . . 27 D C . 16500 1
125 . 1 1 28 28 ASP CA C 13 53.449 . . 1 . . . . 27 D CA . 16500 1
126 . 1 1 28 28 ASP CB C 13 38.198 . . 1 . . . . 27 D CB . 16500 1
127 . 1 1 28 28 ASP N N 15 120.211 . . 1 . . . . 27 D N . 16500 1
128 . 1 1 29 29 ILE H H 1 8.065 . . 1 . . . . 28 I H . 16500 1
129 . 1 1 29 29 ILE C C 13 176.017 . . 1 . . . . 28 I C . 16500 1
130 . 1 1 29 29 ILE CA C 13 61.585 . . 1 . . . . 28 I CA . 16500 1
131 . 1 1 29 29 ILE CB C 13 38.481 . . 1 . . . . 28 I CB . 16500 1
132 . 1 1 29 29 ILE N N 15 121.146 . . 1 . . . . 28 I N . 16500 1
133 . 1 1 30 30 LEU H H 1 8.134 . . 1 . . . . 29 L H . 16500 1
134 . 1 1 30 30 LEU C C 13 177.201 . . 1 . . . . 29 L C . 16500 1
135 . 1 1 30 30 LEU CA C 13 55.571 . . 1 . . . . 29 L CA . 16500 1
136 . 1 1 30 30 LEU CB C 13 42.167 . . 1 . . . . 29 L CB . 16500 1
137 . 1 1 30 30 LEU N N 15 125.229 . . 1 . . . . 29 L N . 16500 1
138 . 1 1 31 31 ILE H H 1 8.019 . . 1 . . . . 30 I H . 16500 1
139 . 1 1 31 31 ILE C C 13 176.232 . . 1 . . . . 30 I C . 16500 1
140 . 1 1 31 31 ILE CA C 13 61.47 . . 1 . . . . 30 I CA . 16500 1
141 . 1 1 31 31 ILE CB C 13 38.587 . . 1 . . . . 30 I CB . 16500 1
142 . 1 1 31 31 ILE N N 15 121.788 . . 1 . . . . 30 I N . 16500 1
143 . 1 1 32 32 ARG H H 1 8.198 . . 1 . . . . 31 R H . 16500 1
144 . 1 1 32 32 ARG C C 13 176.045 . . 1 . . . . 31 R C . 16500 1
145 . 1 1 32 32 ARG CA C 13 56.356 . . 1 . . . . 31 R CA . 16500 1
146 . 1 1 32 32 ARG N N 15 124.271 . . 1 . . . . 31 R N . 16500 1
147 . 1 1 33 33 LEU H H 1 8.103 . . 1 . . . . 32 L H . 16500 1
148 . 1 1 33 33 LEU C C 13 177.033 . . 1 . . . . 32 L C . 16500 1
149 . 1 1 33 33 LEU CA C 13 55.243 . . 1 . . . . 32 L CA . 16500 1
150 . 1 1 33 33 LEU CB C 13 42.528 . . 1 . . . . 32 L CB . 16500 1
151 . 1 1 33 33 LEU N N 15 122.972 . . 1 . . . . 32 L N . 16500 1
152 . 1 1 34 34 PHE H H 1 8.219 . . 1 . . . . 33 F H . 16500 1
153 . 1 1 34 34 PHE C C 13 175.667 . . 1 . . . . 33 F C . 16500 1
154 . 1 1 34 34 PHE CA C 13 57.751 . . 1 . . . . 33 F CA . 16500 1
155 . 1 1 34 34 PHE CB C 13 39.625 . . 1 . . . . 33 F CB . 16500 1
156 . 1 1 34 34 PHE N N 15 121.003 . . 1 . . . . 33 F N . 16500 1
157 . 1 1 35 35 LYS H H 1 8.187 . . 1 . . . . 34 K H . 16500 1
158 . 1 1 35 35 LYS C C 13 176.169 . . 1 . . . . 34 K C . 16500 1
159 . 1 1 35 35 LYS CA C 13 56.285 . . 1 . . . . 34 K CA . 16500 1
160 . 1 1 35 35 LYS CB C 13 33.154 . . 1 . . . . 34 K CB . 16500 1
161 . 1 1 35 35 LYS N N 15 122.75 . . 1 . . . . 34 K N . 16500 1
162 . 1 1 36 36 SER H H 1 8.168 . . 1 . . . . 35 S H . 16500 1
163 . 1 1 36 36 SER C C 13 173.861 . . 1 . . . . 35 S C . 16500 1
164 . 1 1 36 36 SER CA C 13 58.304 . . 1 . . . . 35 S CA . 16500 1
165 . 1 1 36 36 SER CB C 13 63.91 . . 1 . . . . 35 S CB . 16500 1
166 . 1 1 36 36 SER N N 15 116.485 . . 1 . . . . 35 S N . 16500 1
167 . 1 1 37 37 HIS H H 1 8.484 . . 1 . . . . 36 H H . 16500 1
168 . 1 1 37 37 HIS CA C 13 53.48 . . 1 . . . . 36 H CA . 16500 1
169 . 1 1 37 37 HIS CB C 13 28.78 . . 1 . . . . 36 H CB . 16500 1
170 . 1 1 37 37 HIS N N 15 120.219 . . 1 . . . . 36 H N . 16500 1
171 . 1 1 38 38 PRO C C 13 177.06 . . 1 . . . . 37 P C . 16500 1
172 . 1 1 38 38 PRO CA C 13 63.408 . . 1 . . . . 37 P CA . 16500 1
173 . 1 1 38 38 PRO CB C 13 32.118 . . 1 . . . . 37 P CB . 16500 1
174 . 1 1 39 39 GLU H H 1 8.626 . . 1 . . . . 38 E H . 16500 1
175 . 1 1 39 39 GLU C C 13 176.352 . . 1 . . . . 38 E C . 16500 1
176 . 1 1 39 39 GLU CA C 13 56.065 . . 1 . . . . 38 E CA . 16500 1
177 . 1 1 39 39 GLU CB C 13 28.981 . . 1 . . . . 38 E CB . 16500 1
178 . 1 1 39 39 GLU N N 15 121.158 . . 1 . . . . 38 E N . 16500 1
179 . 1 1 40 40 THR H H 1 8.247 . . 1 . . . . 39 T H . 16500 1
180 . 1 1 40 40 THR C C 13 174.401 . . 1 . . . . 39 T C . 16500 1
181 . 1 1 40 40 THR CA C 13 62.209 . . 1 . . . . 39 T CA . 16500 1
182 . 1 1 40 40 THR CB C 13 69.745 . . 1 . . . . 39 T CB . 16500 1
183 . 1 1 40 40 THR N N 15 116.417 . . 1 . . . . 39 T N . 16500 1
184 . 1 1 41 41 LEU H H 1 8.269 . . 1 . . . . 40 L H . 16500 1
185 . 1 1 41 41 LEU C C 13 177.28 . . 1 . . . . 40 L C . 16500 1
186 . 1 1 41 41 LEU CA C 13 55.438 . . 1 . . . . 40 L CA . 16500 1
187 . 1 1 41 41 LEU CB C 13 42.369 . . 1 . . . . 40 L CB . 16500 1
188 . 1 1 41 41 LEU N N 15 124.871 . . 1 . . . . 40 L N . 16500 1
189 . 1 1 42 42 GLU H H 1 8.297 . . 1 . . . . 41 E H . 16500 1
190 . 1 1 42 42 GLU C C 13 176.134 . . 1 . . . . 41 E C . 16500 1
191 . 1 1 42 42 GLU CA C 13 56.16 . . 1 . . . . 41 E CA . 16500 1
192 . 1 1 42 42 GLU CB C 13 28.84 . . 1 . . . . 41 E CB . 16500 1
193 . 1 1 42 42 GLU N N 15 121.411 . . 1 . . . . 41 E N . 16500 1
194 . 1 1 43 43 LYS H H 1 8.221 . . 1 . . . . 42 K H . 16500 1
195 . 1 1 43 43 LYS C C 13 176.378 . . 1 . . . . 42 K C . 16500 1
196 . 1 1 43 43 LYS CA C 13 56.733 . . 1 . . . . 42 K CA . 16500 1
197 . 1 1 43 43 LYS CB C 13 32.983 . . 1 . . . . 42 K CB . 16500 1
198 . 1 1 43 43 LYS N N 15 122.069 . . 1 . . . . 42 K N . 16500 1
199 . 1 1 44 44 PHE H H 1 8.172 . . 1 . . . . 43 F H . 16500 1
200 . 1 1 44 44 PHE C C 13 175.532 . . 1 . . . . 43 F C . 16500 1
201 . 1 1 44 44 PHE CA C 13 57.893 . . 1 . . . . 43 F CA . 16500 1
202 . 1 1 44 44 PHE CB C 13 39.654 . . 1 . . . . 43 F CB . 16500 1
203 . 1 1 44 44 PHE N N 15 120.75 . . 1 . . . . 43 F N . 16500 1
204 . 1 1 45 45 ASP H H 1 8.37 . . 1 . . . . 44 D H . 16500 1
205 . 1 1 45 45 ASP C C 13 175.483 . . 1 . . . . 44 D C . 16500 1
206 . 1 1 45 45 ASP CA C 13 53.202 . . 1 . . . . 44 D CA . 16500 1
207 . 1 1 45 45 ASP CB C 13 38.75 . . 1 . . . . 44 D CB . 16500 1
208 . 1 1 45 45 ASP N N 15 121.261 . . 1 . . . . 44 D N . 16500 1
209 . 1 1 46 46 ARG H H 1 8.149 . . 1 . . . . 45 R H . 16500 1
210 . 1 1 46 46 ARG C C 13 176.225 . . 1 . . . . 45 R C . 16500 1
211 . 1 1 46 46 ARG CA C 13 57.009 . . 1 . . . . 45 R CA . 16500 1
212 . 1 1 46 46 ARG CB C 13 30.423 . . 1 . . . . 45 R CB . 16500 1
213 . 1 1 46 46 ARG N N 15 121.93 . . 1 . . . . 45 R N . 16500 1
214 . 1 1 47 47 PHE H H 1 7.994 . . 1 . . . . 46 F H . 16500 1
215 . 1 1 47 47 PHE C C 13 175.797 . . 1 . . . . 46 F C . 16500 1
216 . 1 1 47 47 PHE CA C 13 57.813 . . 1 . . . . 46 F CA . 16500 1
217 . 1 1 47 47 PHE CB C 13 39.178 . . 1 . . . . 46 F CB . 16500 1
218 . 1 1 47 47 PHE N N 15 119.384 . . 1 . . . . 46 F N . 16500 1
219 . 1 1 48 48 LYS H H 1 7.98 . . 1 . . . . 47 K H . 16500 1
220 . 1 1 48 48 LYS C C 13 176.216 . . 1 . . . . 47 K C . 16500 1
221 . 1 1 48 48 LYS CA C 13 56.642 . . 1 . . . . 47 K CA . 16500 1
222 . 1 1 48 48 LYS CB C 13 33.101 . . 1 . . . . 47 K CB . 16500 1
223 . 1 1 48 48 LYS N N 15 121.53 . . 1 . . . . 47 K N . 16500 1
224 . 1 1 49 49 HIS H H 1 8.444 . . 1 . . . . 48 H H . 16500 1
225 . 1 1 49 49 HIS C C 13 174.326 . . 1 . . . . 48 H C . 16500 1
226 . 1 1 49 49 HIS CA C 13 55.309 . . 1 . . . . 48 H CA . 16500 1
227 . 1 1 49 49 HIS CB C 13 28.851 . . 1 . . . . 48 H CB . 16500 1
228 . 1 1 49 49 HIS N N 15 119.459 . . 1 . . . . 48 H N . 16500 1
229 . 1 1 50 50 LEU H H 1 8.275 . . 1 . . . . 49 L H . 16500 1
230 . 1 1 50 50 LEU C C 13 177.414 . . 1 . . . . 49 L C . 16500 1
231 . 1 1 50 50 LEU CA C 13 55.381 . . 1 . . . . 49 L CA . 16500 1
232 . 1 1 50 50 LEU CB C 13 42.597 . . 1 . . . . 49 L CB . 16500 1
233 . 1 1 50 50 LEU N N 15 123.792 . . 1 . . . . 49 L N . 16500 1
234 . 1 1 51 51 LYS H H 1 8.402 . . 1 . . . . 50 K H . 16500 1
235 . 1 1 51 51 LYS C C 13 176.861 . . 1 . . . . 50 K C . 16500 1
236 . 1 1 51 51 LYS CA C 13 56.67 . . 1 . . . . 50 K CA . 16500 1
237 . 1 1 51 51 LYS CB C 13 33.214 . . 1 . . . . 50 K CB . 16500 1
238 . 1 1 51 51 LYS N N 15 122.611 . . 1 . . . . 50 K N . 16500 1
239 . 1 1 52 52 THR H H 1 8.076 . . 1 . . . . 51 T H . 16500 1
240 . 1 1 52 52 THR C C 13 174.887 . . 1 . . . . 51 T C . 16500 1
241 . 1 1 52 52 THR CA C 13 61.851 . . 1 . . . . 51 T CA . 16500 1
242 . 1 1 52 52 THR CB C 13 70.027 . . 1 . . . . 51 T CB . 16500 1
243 . 1 1 52 52 THR N N 15 115.158 . . 1 . . . . 51 T N . 16500 1
244 . 1 1 53 53 GLU H H 1 8.501 . . 1 . . . . 52 E H . 16500 1
245 . 1 1 53 53 GLU C C 13 176.595 . . 1 . . . . 52 E C . 16500 1
246 . 1 1 53 53 GLU CA C 13 56.9 . . 1 . . . . 52 E CA . 16500 1
247 . 1 1 53 53 GLU CB C 13 28.661 . . 1 . . . . 52 E CB . 16500 1
248 . 1 1 53 53 GLU N N 15 122.473 . . 1 . . . . 52 E N . 16500 1
249 . 1 1 54 54 ALA H H 1 8.344 . . 1 . . . . 53 A H . 16500 1
250 . 1 1 54 54 ALA C C 13 178.662 . . 1 . . . . 53 A C . 16500 1
251 . 1 1 54 54 ALA CA C 13 53.511 . . 1 . . . . 53 A CA . 16500 1
252 . 1 1 54 54 ALA CB C 13 18.939 . . 1 . . . . 53 A CB . 16500 1
253 . 1 1 54 54 ALA N N 15 124.067 . . 1 . . . . 53 A N . 16500 1
254 . 1 1 55 55 GLU H H 1 8.145 . . 1 . . . . 54 E H . 16500 1
255 . 1 1 55 55 GLU C C 13 177.023 . . 1 . . . . 54 E C . 16500 1
256 . 1 1 55 55 GLU CA C 13 56.533 . . 1 . . . . 54 E CA . 16500 1
257 . 1 1 55 55 GLU CB C 13 28.767 . . 1 . . . . 54 E CB . 16500 1
258 . 1 1 55 55 GLU N N 15 119.095 . . 1 . . . . 54 E N . 16500 1
259 . 1 1 56 56 MET H H 1 8.336 . . 1 . . . . 55 M H . 16500 1
260 . 1 1 56 56 MET C C 13 176.907 . . 1 . . . . 55 M C . 16500 1
261 . 1 1 56 56 MET CA C 13 56.441 . . 1 . . . . 55 M CA . 16500 1
262 . 1 1 56 56 MET CB C 13 32.764 . . 1 . . . . 55 M CB . 16500 1
263 . 1 1 56 56 MET N N 15 121.625 . . 1 . . . . 55 M N . 16500 1
264 . 1 1 57 57 LYS H H 1 8.265 . . 1 . . . . 56 K H . 16500 1
265 . 1 1 57 57 LYS C C 13 176.935 . . 1 . . . . 56 K C . 16500 1
266 . 1 1 57 57 LYS CA C 13 57.079 . . 1 . . . . 56 K CA . 16500 1
267 . 1 1 57 57 LYS CB C 13 32.88 . . 1 . . . . 56 K CB . 16500 1
268 . 1 1 57 57 LYS N N 15 122.239 . . 1 . . . . 56 K N . 16500 1
269 . 1 1 58 58 ALA H H 1 8.22 . . 1 . . . . 57 A H . 16500 1
270 . 1 1 58 58 ALA C C 13 178.461 . . 1 . . . . 57 A C . 16500 1
271 . 1 1 58 58 ALA CA C 13 53.22 . . 1 . . . . 57 A CA . 16500 1
272 . 1 1 58 58 ALA CB C 13 19.178 . . 1 . . . . 57 A CB . 16500 1
273 . 1 1 58 58 ALA N N 15 124.4 . . 1 . . . . 57 A N . 16500 1
274 . 1 1 59 59 SER H H 1 8.182 . . 1 . . . . 58 S H . 16500 1
275 . 1 1 59 59 SER C C 13 175.143 . . 1 . . . . 58 S C . 16500 1
276 . 1 1 59 59 SER CA C 13 59.051 . . 1 . . . . 58 S CA . 16500 1
277 . 1 1 59 59 SER CB C 13 63.676 . . 1 . . . . 58 S CB . 16500 1
278 . 1 1 59 59 SER N N 15 114.488 . . 1 . . . . 58 S N . 16500 1
279 . 1 1 60 60 GLU H H 1 8.223 . . 1 . . . . 59 E H . 16500 1
280 . 1 1 60 60 GLU C C 13 176.11 . . 1 . . . . 59 E C . 16500 1
281 . 1 1 60 60 GLU CA C 13 56.371 . . 1 . . . . 59 E CA . 16500 1
282 . 1 1 60 60 GLU CB C 13 28.772 . . 1 . . . . 59 E CB . 16500 1
283 . 1 1 60 60 GLU N N 15 121.716 . . 1 . . . . 59 E N . 16500 1
284 . 1 1 61 61 ASP H H 1 8.372 . . 1 . . . . 60 D H . 16500 1
285 . 1 1 61 61 ASP C C 13 175.375 . . 1 . . . . 60 D C . 16500 1
286 . 1 1 61 61 ASP CA C 13 53.437 . . 1 . . . . 60 D CA . 16500 1
287 . 1 1 61 61 ASP CB C 13 38.331 . . 1 . . . . 60 D CB . 16500 1
288 . 1 1 61 61 ASP N N 15 119.661 . . 1 . . . . 60 D N . 16500 1
289 . 1 1 62 62 LEU H H 1 8.101 . . 1 . . . . 61 L H . 16500 1
290 . 1 1 62 62 LEU C C 13 177.505 . . 1 . . . . 61 L C . 16500 1
291 . 1 1 62 62 LEU CA C 13 55.622 . . 1 . . . . 61 L CA . 16500 1
292 . 1 1 62 62 LEU CB C 13 42.308 . . 1 . . . . 61 L CB . 16500 1
293 . 1 1 62 62 LEU N N 15 122.659 . . 1 . . . . 61 L N . 16500 1
294 . 1 1 63 63 LYS H H 1 8.123 . . 1 . . . . 62 K H . 16500 1
295 . 1 1 63 63 LYS CA C 13 56.36 . . 1 . . . . 62 K CA . 16500 1
296 . 1 1 63 63 LYS CB C 13 32.893 . . 1 . . . . 62 K CB . 16500 1
297 . 1 1 63 63 LYS N N 15 121.34 . . 1 . . . . 62 K N . 16500 1
298 . 1 1 64 64 LYS C C 13 176.41 . . 1 . . . . 63 K C . 16500 1
299 . 1 1 64 64 LYS CA C 13 56.379 . . 1 . . . . 63 K CA . 16500 1
300 . 1 1 64 64 LYS CB C 13 38.709 . . 1 . . . . 63 K CB . 16500 1
301 . 1 1 65 65 HIS H H 1 8.529 . . 1 . . . . 64 H H . 16500 1
302 . 1 1 65 65 HIS C C 13 174.742 . . 1 . . . . 64 H C . 16500 1
303 . 1 1 65 65 HIS CA C 13 55.315 . . 1 . . . . 64 H CA . 16500 1
304 . 1 1 65 65 HIS CB C 13 29.314 . . 1 . . . . 64 H CB . 16500 1
305 . 1 1 65 65 HIS N N 15 119.712 . . 1 . . . . 64 H N . 16500 1
306 . 1 1 66 66 GLY H H 1 8.467 . . 1 . . . . 65 G H . 16500 1
307 . 1 1 66 66 GLY C C 13 173.79 . . 1 . . . . 65 G C . 16500 1
308 . 1 1 66 66 GLY CA C 13 45.34 . . 1 . . . . 65 G CA . 16500 1
309 . 1 1 66 66 GLY N N 15 110.524 . . 1 . . . . 65 G N . 16500 1
310 . 1 1 67 67 VAL H H 1 8.14 . . 1 . . . . 66 V H . 16500 1
311 . 1 1 67 67 VAL C C 13 176.373 . . 1 . . . . 66 V C . 16500 1
312 . 1 1 67 67 VAL CA C 13 62.162 . . 1 . . . . 66 V CA . 16500 1
313 . 1 1 67 67 VAL CB C 13 33.148 . . 1 . . . . 66 V CB . 16500 1
314 . 1 1 67 67 VAL N N 15 119.558 . . 1 . . . . 66 V N . 16500 1
315 . 1 1 68 68 THR H H 1 8.382 . . 1 . . . . 67 T H . 16500 1
316 . 1 1 68 68 THR C C 13 174.215 . . 1 . . . . 67 T C . 16500 1
317 . 1 1 68 68 THR CA C 13 62.209 . . 1 . . . . 67 T CA . 16500 1
318 . 1 1 68 68 THR CB C 13 69.878 . . 1 . . . . 67 T CB . 16500 1
319 . 1 1 68 68 THR N N 15 119.988 . . 1 . . . . 67 T N . 16500 1
320 . 1 1 69 69 VAL H H 1 8.314 . . 1 . . . . 68 V H . 16500 1
321 . 1 1 69 69 VAL C C 13 175.869 . . 1 . . . . 68 V C . 16500 1
322 . 1 1 69 69 VAL CA C 13 62.265 . . 1 . . . . 68 V CA . 16500 1
323 . 1 1 69 69 VAL CB C 13 32.981 . . 1 . . . . 68 V CB . 16500 1
324 . 1 1 69 69 VAL N N 15 124.398 . . 1 . . . . 68 V N . 16500 1
325 . 1 1 70 70 LEU H H 1 8.42 . . 1 . . . . 69 L H . 16500 1
326 . 1 1 70 70 LEU C C 13 177.495 . . 1 . . . . 69 L C . 16500 1
327 . 1 1 70 70 LEU CA C 13 55.218 . . 1 . . . . 69 L CA . 16500 1
328 . 1 1 70 70 LEU CB C 13 42.434 . . 1 . . . . 69 L CB . 16500 1
329 . 1 1 70 70 LEU N N 15 126.722 . . 1 . . . . 69 L N . 16500 1
330 . 1 1 71 71 THR H H 1 8.106 . . 1 . . . . 70 T H . 16500 1
331 . 1 1 71 71 THR C C 13 174.281 . . 1 . . . . 70 T C . 16500 1
332 . 1 1 71 71 THR CA C 13 61.926 . . 1 . . . . 70 T CA . 16500 1
333 . 1 1 71 71 THR CB C 13 69.85 . . 1 . . . . 70 T CB . 16500 1
334 . 1 1 71 71 THR N N 15 115.649 . . 1 . . . . 70 T N . 16500 1
335 . 1 1 72 72 ALA H H 1 8.347 . . 1 . . . . 71 A H . 16500 1
336 . 1 1 72 72 ALA C C 13 177.896 . . 1 . . . . 71 A C . 16500 1
337 . 1 1 72 72 ALA CA C 13 52.736 . . 1 . . . . 71 A CA . 16500 1
338 . 1 1 72 72 ALA CB C 13 19.14 . . 1 . . . . 71 A CB . 16500 1
339 . 1 1 72 72 ALA N N 15 126.604 . . 1 . . . . 71 A N . 16500 1
340 . 1 1 73 73 LEU H H 1 8.216 . . 1 . . . . 72 L H . 16500 1
341 . 1 1 73 73 LEU C C 13 178.227 . . 1 . . . . 72 L C . 16500 1
342 . 1 1 73 73 LEU CA C 13 55.803 . . 1 . . . . 72 L CA . 16500 1
343 . 1 1 73 73 LEU CB C 13 42.342 . . 1 . . . . 72 L CB . 16500 1
344 . 1 1 73 73 LEU N N 15 121.534 . . 1 . . . . 72 L N . 16500 1
345 . 1 1 74 74 GLY H H 1 8.344 . . 1 . . . . 73 G H . 16500 1
346 . 1 1 74 74 GLY C C 13 174.225 . . 1 . . . . 73 G C . 16500 1
347 . 1 1 74 74 GLY CA C 13 45.72 . . 1 . . . . 73 G CA . 16500 1
348 . 1 1 74 74 GLY N N 15 108.94 . . 1 . . . . 73 G N . 16500 1
349 . 1 1 75 75 ALA H H 1 8.041 . . 1 . . . . 74 A H . 16500 1
350 . 1 1 75 75 ALA C C 13 178.133 . . 1 . . . . 74 A C . 16500 1
351 . 1 1 75 75 ALA CA C 13 52.927 . . 1 . . . . 74 A CA . 16500 1
352 . 1 1 75 75 ALA CB C 13 19.238 . . 1 . . . . 74 A CB . 16500 1
353 . 1 1 75 75 ALA N N 15 123.534 . . 1 . . . . 74 A N . 16500 1
354 . 1 1 76 76 ILE H H 1 8.022 . . 1 . . . . 75 I H . 16500 1
355 . 1 1 76 76 ILE C C 13 176.62 . . 1 . . . . 75 I C . 16500 1
356 . 1 1 76 76 ILE CA C 13 61.6 . . 1 . . . . 75 I CA . 16500 1
357 . 1 1 76 76 ILE CB C 13 38.489 . . 1 . . . . 75 I CB . 16500 1
358 . 1 1 76 76 ILE N N 15 120.021 . . 1 . . . . 75 I N . 16500 1
359 . 1 1 77 77 LEU H H 1 8.214 . . 1 . . . . 76 L H . 16500 1
360 . 1 1 77 77 LEU C C 13 177.466 . . 1 . . . . 76 L C . 16500 1
361 . 1 1 77 77 LEU CA C 13 55.434 . . 1 . . . . 76 L CA . 16500 1
362 . 1 1 77 77 LEU CB C 13 42.242 . . 1 . . . . 76 L CB . 16500 1
363 . 1 1 77 77 LEU N N 15 125.641 . . 1 . . . . 76 L N . 16500 1
364 . 1 1 78 78 LYS H H 1 8.175 . . 1 . . . . 77 K H . 16500 1
365 . 1 1 78 78 LYS CA C 13 56.463 . . 1 . . . . 77 K CA . 16500 1
366 . 1 1 78 78 LYS N N 15 122.256 . . 1 . . . . 77 K N . 16500 1
367 . 1 1 79 79 LYS C C 13 176.68 . . 1 . . . . 78 K C . 16500 1
368 . 1 1 79 79 LYS CA C 13 56.459 . . 1 . . . . 78 K CA . 16500 1
369 . 1 1 80 80 LYS H H 1 8.341 . . 1 . . . . 79 K H . 16500 1
370 . 1 1 80 80 LYS C C 13 177.087 . . 1 . . . . 79 K C . 16500 1
371 . 1 1 80 80 LYS CA C 13 56.571 . . 1 . . . . 79 K CA . 16500 1
372 . 1 1 80 80 LYS CB C 13 33.266 . . 1 . . . . 79 K CB . 16500 1
373 . 1 1 80 80 LYS N N 15 122.794 . . 1 . . . . 79 K N . 16500 1
374 . 1 1 81 81 GLY H H 1 8.37 . . 1 . . . . 80 G H . 16500 1
375 . 1 1 81 81 GLY C C 13 173.568 . . 1 . . . . 80 G C . 16500 1
376 . 1 1 81 81 GLY CA C 13 45.24 . . 1 . . . . 80 G CA . 16500 1
377 . 1 1 81 81 GLY N N 15 109.736 . . 1 . . . . 80 G N . 16500 1
378 . 1 1 82 82 HIS H H 1 8.422 . . 1 . . . . 81 H H . 16500 1
379 . 1 1 82 82 HIS C C 13 174.108 . . 1 . . . . 81 H C . 16500 1
380 . 1 1 82 82 HIS CA C 13 55.171 . . 1 . . . . 81 H CA . 16500 1
381 . 1 1 82 82 HIS CB C 13 29.411 . . 1 . . . . 81 H CB . 16500 1
382 . 1 1 82 82 HIS N N 15 118.061 . . 1 . . . . 81 H N . 16500 1
383 . 1 1 83 83 HIS H H 1 8.679 . . 1 . . . . 82 H H . 16500 1
384 . 1 1 83 83 HIS C C 13 174.027 . . 1 . . . . 82 H C . 16500 1
385 . 1 1 83 83 HIS CA C 13 55.364 . . 1 . . . . 82 H CA . 16500 1
386 . 1 1 83 83 HIS CB C 13 29.277 . . 1 . . . . 82 H CB . 16500 1
387 . 1 1 83 83 HIS N N 15 121.043 . . 1 . . . . 82 H N . 16500 1
388 . 1 1 84 84 GLU H H 1 8.52 . . 1 . . . . 83 E H . 16500 1
389 . 1 1 84 84 GLU C C 13 175.362 . . 1 . . . . 83 E C . 16500 1
390 . 1 1 84 84 GLU CA C 13 55.635 . . 1 . . . . 83 E CA . 16500 1
391 . 1 1 84 84 GLU CB C 13 29.295 . . 1 . . . . 83 E CB . 16500 1
392 . 1 1 84 84 GLU N N 15 123.225 . . 1 . . . . 83 E N . 16500 1
393 . 1 1 85 85 ALA H H 1 8.458 . . 1 . . . . 84 A H . 16500 1
394 . 1 1 85 85 ALA C C 13 177.332 . . 1 . . . . 84 A C . 16500 1
395 . 1 1 85 85 ALA CA C 13 52.491 . . 1 . . . . 84 A CA . 16500 1
396 . 1 1 85 85 ALA CB C 13 19.388 . . 1 . . . . 84 A CB . 16500 1
397 . 1 1 85 85 ALA N N 15 126.085 . . 1 . . . . 84 A N . 16500 1
398 . 1 1 86 86 GLU H H 1 8.356 . . 1 . . . . 85 E H . 16500 1
399 . 1 1 86 86 GLU C C 13 175.755 . . 1 . . . . 85 E C . 16500 1
400 . 1 1 86 86 GLU CA C 13 55.523 . . 1 . . . . 85 E CA . 16500 1
401 . 1 1 86 86 GLU CB C 13 29.086 . . 1 . . . . 85 E CB . 16500 1
402 . 1 1 86 86 GLU N N 15 120.223 . . 1 . . . . 85 E N . 16500 1
403 . 1 1 87 87 LEU H H 1 8.332 . . 1 . . . . 86 L H . 16500 1
404 . 1 1 87 87 LEU C C 13 176.937 . . 1 . . . . 86 L C . 16500 1
405 . 1 1 87 87 LEU CA C 13 55.032 . . 1 . . . . 86 L CA . 16500 1
406 . 1 1 87 87 LEU CB C 13 42.446 . . 1 . . . . 86 L CB . 16500 1
407 . 1 1 87 87 LEU N N 15 124.675 . . 1 . . . . 86 L N . 16500 1
408 . 1 1 88 88 LYS H H 1 8.334 . . 1 . . . . 87 K H . 16500 1
409 . 1 1 88 88 LYS CA C 13 54.138 . . 1 . . . . 87 K CA . 16500 1
410 . 1 1 88 88 LYS CB C 13 32.621 . . 1 . . . . 87 K CB . 16500 1
411 . 1 1 88 88 LYS N N 15 123.987 . . 1 . . . . 87 K N . 16500 1
412 . 1 1 89 89 PRO C C 13 176.877 . . 1 . . . . 88 P C . 16500 1
413 . 1 1 89 89 PRO CA C 13 62.916 . . 1 . . . . 88 P CA . 16500 1
414 . 1 1 89 89 PRO CB C 13 32.213 . . 1 . . . . 88 P CB . 16500 1
415 . 1 1 90 90 LEU H H 1 8.349 . . 1 . . . . 89 L H . 16500 1
416 . 1 1 90 90 LEU C C 13 177.373 . . 1 . . . . 89 L C . 16500 1
417 . 1 1 90 90 LEU CA C 13 55.176 . . 1 . . . . 89 L CA . 16500 1
418 . 1 1 90 90 LEU CB C 13 42.503 . . 1 . . . . 89 L CB . 16500 1
419 . 1 1 90 90 LEU N N 15 122.972 . . 1 . . . . 89 L N . 16500 1
420 . 1 1 91 91 ALA H H 1 8.333 . . 1 . . . . 90 A H . 16500 1
421 . 1 1 91 91 ALA C C 13 177.655 . . 1 . . . . 90 A C . 16500 1
422 . 1 1 91 91 ALA CA C 13 52.545 . . 1 . . . . 90 A CA . 16500 1
423 . 1 1 91 91 ALA CB C 13 19.387 . . 1 . . . . 90 A CB . 16500 1
424 . 1 1 91 91 ALA N N 15 125.415 . . 1 . . . . 90 A N . 16500 1
425 . 1 1 92 92 GLN H H 1 8.372 . . 1 . . . . 91 Q H . 16500 1
426 . 1 1 92 92 GLN C C 13 176.017 . . 1 . . . . 91 Q C . 16500 1
427 . 1 1 92 92 GLN CA C 13 55.65 . . 1 . . . . 91 Q CA . 16500 1
428 . 1 1 92 92 GLN CB C 13 29.758 . . 1 . . . . 91 Q CB . 16500 1
429 . 1 1 92 92 GLN N N 15 119.986 . . 1 . . . . 91 Q N . 16500 1
430 . 1 1 93 93 SER H H 1 8.36 . . 1 . . . . 92 S H . 16500 1
431 . 1 1 93 93 SER C C 13 174.476 . . 1 . . . . 92 S C . 16500 1
432 . 1 1 93 93 SER CA C 13 58.314 . . 1 . . . . 92 S CA . 16500 1
433 . 1 1 93 93 SER CB C 13 63.831 . . 1 . . . . 92 S CB . 16500 1
434 . 1 1 93 93 SER N N 15 117.241 . . 1 . . . . 92 S N . 16500 1
435 . 1 1 94 94 HIS H H 1 8.601 . . 1 . . . . 93 H H . 16500 1
436 . 1 1 94 94 HIS C C 13 173.958 . . 1 . . . . 93 H C . 16500 1
437 . 1 1 94 94 HIS CA C 13 55.064 . . 1 . . . . 93 H CA . 16500 1
438 . 1 1 94 94 HIS CB C 13 29.117 . . 1 . . . . 93 H CB . 16500 1
439 . 1 1 94 94 HIS N N 15 120.592 . . 1 . . . . 93 H N . 16500 1
440 . 1 1 95 95 ALA H H 1 8.344 . . 1 . . . . 94 A H . 16500 1
441 . 1 1 95 95 ALA C C 13 177.767 . . 1 . . . . 94 A C . 16500 1
442 . 1 1 95 95 ALA CA C 13 52.583 . . 1 . . . . 94 A CA . 16500 1
443 . 1 1 95 95 ALA CB C 13 19.377 . . 1 . . . . 94 A CB . 16500 1
444 . 1 1 95 95 ALA N N 15 125.328 . . 1 . . . . 94 A N . 16500 1
445 . 1 1 96 96 THR H H 1 8.275 . . 1 . . . . 95 T H . 16500 1
446 . 1 1 96 96 THR C C 13 174.356 . . 1 . . . . 95 T C . 16500 1
447 . 1 1 96 96 THR CA C 13 61.822 . . 1 . . . . 95 T CA . 16500 1
448 . 1 1 96 96 THR CB C 13 69.96 . . 1 . . . . 95 T CB . 16500 1
449 . 1 1 96 96 THR N N 15 115.106 . . 1 . . . . 95 T N . 16500 1
450 . 1 1 97 97 LYS H H 1 8.382 . . 1 . . . . 96 K H . 16500 1
451 . 1 1 97 97 LYS C C 13 176.201 . . 1 . . . . 96 K C . 16500 1
452 . 1 1 97 97 LYS CA C 13 56.214 . . 1 . . . . 96 K CA . 16500 1
453 . 1 1 97 97 LYS CB C 13 33.173 . . 1 . . . . 96 K CB . 16500 1
454 . 1 1 97 97 LYS N N 15 124.243 . . 1 . . . . 96 K N . 16500 1
455 . 1 1 98 98 HIS H H 1 8.564 . . 1 . . . . 97 H H . 16500 1
456 . 1 1 98 98 HIS C C 13 174.023 . . 1 . . . . 97 H C . 16500 1
457 . 1 1 98 98 HIS CA C 13 54.958 . . 1 . . . . 97 H CA . 16500 1
458 . 1 1 98 98 HIS CB C 13 29.428 . . 1 . . . . 97 H CB . 16500 1
459 . 1 1 98 98 HIS N N 15 120.429 . . 1 . . . . 97 H N . 16500 1
460 . 1 1 99 99 LYS H H 1 8.508 . . 1 . . . . 98 K H . 16500 1
461 . 1 1 99 99 LYS C C 13 176.09 . . 1 . . . . 98 K C . 16500 1
462 . 1 1 99 99 LYS CA C 13 56.356 . . 1 . . . . 98 K CA . 16500 1
463 . 1 1 99 99 LYS CB C 13 33.194 . . 1 . . . . 98 K CB . 16500 1
464 . 1 1 99 99 LYS N N 15 124.208 . . 1 . . . . 98 K N . 16500 1
465 . 1 1 100 100 ILE H H 1 8.319 . . 1 . . . . 99 I H . 16500 1
466 . 1 1 100 100 ILE CA C 13 58.631 . . 1 . . . . 99 I CA . 16500 1
467 . 1 1 100 100 ILE CB C 13 38.83 . . 1 . . . . 99 I CB . 16500 1
468 . 1 1 100 100 ILE N N 15 125.015 . . 1 . . . . 99 I N . 16500 1
469 . 1 1 101 101 PRO C C 13 177.464 . . 1 . . . . 100 P C . 16500 1
470 . 1 1 101 101 PRO CA C 13 62.993 . . 1 . . . . 100 P CA . 16500 1
471 . 1 1 101 101 PRO CB C 13 33.045 . . 1 . . . . 100 P CB . 16500 1
472 . 1 1 102 102 ILE H H 1 8.176 . . 1 . . . . 101 I H . 16500 1
473 . 1 1 102 102 ILE C C 13 176.234 . . 1 . . . . 101 I C . 16500 1
474 . 1 1 102 102 ILE CA C 13 61.491 . . 1 . . . . 101 I CA . 16500 1
475 . 1 1 102 102 ILE CB C 13 38.778 . . 1 . . . . 101 I CB . 16500 1
476 . 1 1 102 102 ILE N N 15 122.005 . . 1 . . . . 101 I N . 16500 1
477 . 1 1 103 103 LYS H H 1 8.265 . . 1 . . . . 102 K H . 16500 1
478 . 1 1 103 103 LYS C C 13 176.1 . . 1 . . . . 102 K C . 16500 1
479 . 1 1 103 103 LYS CA C 13 56.497 . . 1 . . . . 102 K CA . 16500 1
480 . 1 1 103 103 LYS CB C 13 33.1 . . 1 . . . . 102 K CB . 16500 1
481 . 1 1 103 103 LYS N N 15 124.871 . . 1 . . . . 102 K N . 16500 1
482 . 1 1 104 104 TYR H H 1 8.112 . . 1 . . . . 103 Y H . 16500 1
483 . 1 1 104 104 TYR C C 13 175.614 . . 1 . . . . 103 Y C . 16500 1
484 . 1 1 104 104 TYR CA C 13 58.085 . . 1 . . . . 103 Y CA . 16500 1
485 . 1 1 104 104 TYR CB C 13 38.824 . . 1 . . . . 103 Y CB . 16500 1
486 . 1 1 104 104 TYR N N 15 121.815 . . 1 . . . . 103 Y N . 16500 1
487 . 1 1 105 105 LEU H H 1 8.09 . . 1 . . . . 104 L H . 16500 1
488 . 1 1 105 105 LEU C C 13 176.941 . . 1 . . . . 104 L C . 16500 1
489 . 1 1 105 105 LEU CA C 13 55.3 . . 1 . . . . 104 L CA . 16500 1
490 . 1 1 105 105 LEU CB C 13 42.383 . . 1 . . . . 104 L CB . 16500 1
491 . 1 1 105 105 LEU N N 15 123.558 . . 1 . . . . 104 L N . 16500 1
492 . 1 1 106 106 GLU H H 1 8.094 . . 1 . . . . 105 E H . 16500 1
493 . 1 1 106 106 GLU C C 13 175.586 . . 1 . . . . 105 E C . 16500 1
494 . 1 1 106 106 GLU CA C 13 56.047 . . 1 . . . . 105 E CA . 16500 1
495 . 1 1 106 106 GLU CB C 13 28.946 . . 1 . . . . 105 E CB . 16500 1
496 . 1 1 106 106 GLU N N 15 120.564 . . 1 . . . . 105 E N . 16500 1
497 . 1 1 107 107 PHE H H 1 8.164 . . 1 . . . . 106 F H . 16500 1
498 . 1 1 107 107 PHE C C 13 175.618 . . 1 . . . . 106 F C . 16500 1
499 . 1 1 107 107 PHE CA C 13 57.911 . . 1 . . . . 106 F CA . 16500 1
500 . 1 1 107 107 PHE CB C 13 39.558 . . 1 . . . . 106 F CB . 16500 1
501 . 1 1 107 107 PHE N N 15 121.194 . . 1 . . . . 106 F N . 16500 1
502 . 1 1 108 108 ILE H H 1 8.01 . . 1 . . . . 107 I H . 16500 1
503 . 1 1 108 108 ILE C C 13 175.96 . . 1 . . . . 107 I C . 16500 1
504 . 1 1 108 108 ILE CA C 13 61.13 . . 1 . . . . 107 I CA . 16500 1
505 . 1 1 108 108 ILE CB C 13 38.952 . . 1 . . . . 107 I CB . 16500 1
506 . 1 1 108 108 ILE N N 15 122.845 . . 1 . . . . 107 I N . 16500 1
507 . 1 1 109 109 SER H H 1 8.218 . . 1 . . . . 108 S H . 16500 1
508 . 1 1 109 109 SER C C 13 174.737 . . 1 . . . . 108 S C . 16500 1
509 . 1 1 109 109 SER CA C 13 58.491 . . 1 . . . . 108 S CA . 16500 1
510 . 1 1 109 109 SER CB C 13 63.734 . . 1 . . . . 108 S CB . 16500 1
511 . 1 1 109 109 SER N N 15 119.308 . . 1 . . . . 108 S N . 16500 1
512 . 1 1 110 110 GLU H H 1 8.326 . . 1 . . . . 109 E H . 16500 1
513 . 1 1 110 110 GLU C C 13 175.793 . . 1 . . . . 109 E C . 16500 1
514 . 1 1 110 110 GLU CA C 13 56.031 . . 1 . . . . 109 E CA . 16500 1
515 . 1 1 110 110 GLU CB C 13 28.793 . . 1 . . . . 109 E CB . 16500 1
516 . 1 1 110 110 GLU N N 15 122.457 . . 1 . . . . 109 E N . 16500 1
517 . 1 1 111 111 ALA H H 1 8.176 . . 1 . . . . 110 A H . 16500 1
518 . 1 1 111 111 ALA C C 13 177.72 . . 1 . . . . 110 A C . 16500 1
519 . 1 1 111 111 ALA CA C 13 52.869 . . 1 . . . . 110 A CA . 16500 1
520 . 1 1 111 111 ALA CB C 13 19.058 . . 1 . . . . 110 A CB . 16500 1
521 . 1 1 111 111 ALA N N 15 124.501 . . 1 . . . . 110 A N . 16500 1
522 . 1 1 112 112 ILE H H 1 7.975 . . 1 . . . . 111 I H . 16500 1
523 . 1 1 112 112 ILE C C 13 176.191 . . 1 . . . . 111 I C . 16500 1
524 . 1 1 112 112 ILE CA C 13 61.215 . . 1 . . . . 111 I CA . 16500 1
525 . 1 1 112 112 ILE CB C 13 38.525 . . 1 . . . . 111 I CB . 16500 1
526 . 1 1 112 112 ILE N N 15 119.962 . . 1 . . . . 111 I N . 16500 1
527 . 1 1 113 113 ILE H H 1 8.058 . . 1 . . . . 112 I H . 16500 1
528 . 1 1 113 113 ILE C C 13 176.092 . . 1 . . . . 112 I C . 16500 1
529 . 1 1 113 113 ILE CA C 13 61.148 . . 1 . . . . 112 I CA . 16500 1
530 . 1 1 113 113 ILE CB C 13 38.6 . . 1 . . . . 112 I CB . 16500 1
531 . 1 1 113 113 ILE N N 15 124.461 . . 1 . . . . 112 I N . 16500 1
532 . 1 1 114 114 HIS H H 1 8.56 . . 1 . . . . 113 H H . 16500 1
533 . 1 1 114 114 HIS C C 13 174.156 . . 1 . . . . 113 H C . 16500 1
534 . 1 1 114 114 HIS CA C 13 55.126 . . 1 . . . . 113 H CA . 16500 1
535 . 1 1 114 114 HIS CB C 13 29.028 . . 1 . . . . 113 H CB . 16500 1
536 . 1 1 114 114 HIS N N 15 122.806 . . 1 . . . . 113 H N . 16500 1
537 . 1 1 115 115 VAL H H 1 8.184 . . 1 . . . . 114 V H . 16500 1
538 . 1 1 115 115 VAL C C 13 175.833 . . 1 . . . . 114 V C . 16500 1
539 . 1 1 115 115 VAL CA C 13 62.439 . . 1 . . . . 114 V CA . 16500 1
540 . 1 1 115 115 VAL CB C 13 33.045 . . 1 . . . . 114 V CB . 16500 1
541 . 1 1 115 115 VAL N N 15 122.301 . . 1 . . . . 114 V N . 16500 1
542 . 1 1 116 116 LEU H H 1 8.371 . . 1 . . . . 115 L H . 16500 1
543 . 1 1 116 116 LEU C C 13 177.091 . . 1 . . . . 115 L C . 16500 1
544 . 1 1 116 116 LEU CA C 13 55.215 . . 1 . . . . 115 L CA . 16500 1
545 . 1 1 116 116 LEU CB C 13 42.575 . . 1 . . . . 115 L CB . 16500 1
546 . 1 1 116 116 LEU N N 15 126.16 . . 1 . . . . 115 L N . 16500 1
547 . 1 1 117 117 HIS H H 1 8.557 . . 1 . . . . 116 H H . 16500 1
548 . 1 1 117 117 HIS C C 13 174.279 . . 1 . . . . 116 H C . 16500 1
549 . 1 1 117 117 HIS CA C 13 55.091 . . 1 . . . . 116 H CA . 16500 1
550 . 1 1 117 117 HIS CB C 13 28.981 . . 1 . . . . 116 H CB . 16500 1
551 . 1 1 117 117 HIS N N 15 119.372 . . 1 . . . . 116 H N . 16500 1
552 . 1 1 118 118 SER H H 1 8.317 . . 1 . . . . 117 S H . 16500 1
553 . 1 1 118 118 SER C C 13 174.207 . . 1 . . . . 117 S C . 16500 1
554 . 1 1 118 118 SER CA C 13 58.352 . . 1 . . . . 117 S CA . 16500 1
555 . 1 1 118 118 SER CB C 13 63.89 . . 1 . . . . 117 S CB . 16500 1
556 . 1 1 118 118 SER N N 15 117.194 . . 1 . . . . 117 S N . 16500 1
557 . 1 1 119 119 ARG H H 1 8.437 . . 1 . . . . 118 R H . 16500 1
558 . 1 1 119 119 ARG C C 13 175.697 . . 1 . . . . 118 R C . 16500 1
559 . 1 1 119 119 ARG CA C 13 56.309 . . 1 . . . . 118 R CA . 16500 1
560 . 1 1 119 119 ARG CB C 13 30.959 . . 1 . . . . 118 R CB . 16500 1
561 . 1 1 119 119 ARG N N 15 122.964 . . 1 . . . . 118 R N . 16500 1
562 . 1 1 120 120 HIS H H 1 8.41 . . 1 . . . . 119 H H . 16500 1
563 . 1 1 120 120 HIS CA C 13 55.638 . . 1 . . . . 119 H CA . 16500 1
564 . 1 1 120 120 HIS CB C 13 29.451 . . 1 . . . . 119 H CB . 16500 1
565 . 1 1 120 120 HIS N N 15 122.22 . . 1 . . . . 119 H N . 16500 1
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