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 50740
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'IncC1 NTD'
_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 HNCO' . . . 50740 1
2 CON . . . 50740 1
3 (H)CBCACON . . . 50740 1
4 (H)CBCACO . . . 50740 1
5 HNN . . . 50740 1
6 HNCN . . . 50740 1
7 (H)CANCO . . . 50740 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
2 $software_2 . . 50740 1
3 $software_3 . . 50740 1
6 $software_6 . . 50740 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 3 3 SER C C 13 174.492 0.001 . 1 . . . . . -20 S C . 50740 1
2 . 1 . 1 3 3 SER CA C 13 58.255 0.05 . 1 . . . . . -20 S CA . 50740 1
3 . 1 . 1 3 3 SER CB C 13 63.887 0.05 . 1 . . . . . -20 S CB . 50740 1
4 . 1 . 1 4 4 SER H H 1 8.420 0.006 . 1 . . . . . -19 S HN . 50740 1
5 . 1 . 1 4 4 SER C C 13 174.246 0.001 . 1 . . . . . -19 S C . 50740 1
6 . 1 . 1 4 4 SER CA C 13 58.297 0.05 . 1 . . . . . -19 S CA . 50740 1
7 . 1 . 1 4 4 SER CB C 13 63.718 0.05 . 1 . . . . . -19 S CB . 50740 1
8 . 1 . 1 4 4 SER N N 15 117.764 0.05 . 1 . . . . . -19 S N . 50740 1
9 . 1 . 1 5 5 HIS CA C 13 55.703 0.05 . 1 . . . . . -18 H CA . 50740 1
10 . 1 . 1 5 5 HIS CB C 13 29.497 0.05 . 1 . . . . . -18 H CB . 50740 1
11 . 1 . 1 5 5 HIS N N 15 120.448 0.05 . 1 . . . . . -18 H N . 50740 1
12 . 1 . 1 10 10 HIS H H 1 7.977 0.006 . 1 . . . . . -13 H HN . 50740 1
13 . 1 . 1 10 10 HIS N N 15 120.217 0.05 . 1 . . . . . -13 H N . 50740 1
14 . 1 . 1 11 11 SER C C 13 174.411 0.001 . 1 . . . . . -12 S C . 50740 1
15 . 1 . 1 11 11 SER CA C 13 58.322 0.05 . 1 . . . . . -12 S CA . 50740 1
16 . 1 . 1 11 11 SER CB C 13 63.835 0.05 . 1 . . . . . -12 S CB . 50740 1
17 . 1 . 1 11 11 SER N N 15 117.904 0.05 . 1 . . . . . -12 S N . 50740 1
18 . 1 . 1 12 12 SER H H 1 8.336 0.006 . 1 . . . . . -11 S HN . 50740 1
19 . 1 . 1 12 12 SER C C 13 174.592 0.001 . 1 . . . . . -11 S C . 50740 1
20 . 1 . 1 12 12 SER CA C 13 58.375 0.05 . 1 . . . . . -11 S CA . 50740 1
21 . 1 . 1 12 12 SER CB C 13 63.819 0.05 . 1 . . . . . -11 S CB . 50740 1
22 . 1 . 1 12 12 SER N N 15 118.050 0.05 . 1 . . . . . -11 S N . 50740 1
23 . 1 . 1 13 13 GLY H H 1 8.376 0.006 . 1 . . . . . -10 G HN . 50740 1
24 . 1 . 1 13 13 GLY C C 13 173.678 0.001 . 1 . . . . . -10 G C . 50740 1
25 . 1 . 1 13 13 GLY CA C 13 45.186 0.05 . 1 . . . . . -10 G CA . 50740 1
26 . 1 . 1 13 13 GLY N N 15 110.798 0.05 . 1 . . . . . -10 G N . 50740 1
27 . 1 . 1 14 14 LEU H H 1 8.077 0.006 . 1 . . . . . -9 L HN . 50740 1
28 . 1 . 1 14 14 LEU C C 13 177.050 0.001 . 1 . . . . . -9 L C . 50740 1
29 . 1 . 1 14 14 LEU CA C 13 55.076 0.05 . 1 . . . . . -9 L CA . 50740 1
30 . 1 . 1 14 14 LEU CB C 13 42.377 0.05 . 1 . . . . . -9 L CB . 50740 1
31 . 1 . 1 14 14 LEU N N 15 121.673 0.05 . 1 . . . . . -9 L N . 50740 1
32 . 1 . 1 15 15 VAL H H 1 8.021 0.006 . 1 . . . . . -8 V HN . 50740 1
33 . 1 . 1 15 15 VAL C C 13 174.307 0.001 . 1 . . . . . -8 V C . 50740 1
34 . 1 . 1 15 15 VAL CA C 13 59.741 0.05 . 1 . . . . . -8 V CA . 50740 1
35 . 1 . 1 15 15 VAL CB C 13 32.586 0.05 . 1 . . . . . -8 V CB . 50740 1
36 . 1 . 1 15 15 VAL N N 15 122.866 0.05 . 1 . . . . . -8 V N . 50740 1
37 . 1 . 1 16 16 PRO C C 13 176.826 0.001 . 1 . . . . . -7 P C . 50740 1
38 . 1 . 1 16 16 PRO CA C 13 63.224 0.05 . 1 . . . . . -7 P CA . 50740 1
39 . 1 . 1 16 16 PRO CB C 13 32.110 0.05 . 1 . . . . . -7 P CB . 50740 1
40 . 1 . 1 16 16 PRO CG C 13 27.342 0.001 . 1 . . . . . -7 P CG . 50740 1
41 . 1 . 1 16 16 PRO CD C 13 51.097 0.001 . 1 . . . . . -7 P CD . 50740 1
42 . 1 . 1 16 16 PRO N N 15 139.657 0.05 . 1 . . . . . -7 P N . 50740 1
43 . 1 . 1 17 17 ARG H H 1 8.416 0.006 . 1 . . . . . -6 R HN . 50740 1
44 . 1 . 1 17 17 ARG C C 13 176.945 0.001 . 1 . . . . . -6 R C . 50740 1
45 . 1 . 1 17 17 ARG CA C 13 56.407 0.05 . 1 . . . . . -6 R CA . 50740 1
46 . 1 . 1 17 17 ARG CB C 13 30.833 0.05 . 1 . . . . . -6 R CB . 50740 1
47 . 1 . 1 17 17 ARG N N 15 121.920 0.05 . 1 . . . . . -6 R N . 50740 1
48 . 1 . 1 18 18 GLY H H 1 8.417 0.006 . 1 . . . . . -5 G HN . 50740 1
49 . 1 . 1 18 18 GLY C C 13 174.100 0.001 . 1 . . . . . -5 G C . 50740 1
50 . 1 . 1 18 18 GLY CA C 13 45.203 0.05 . 1 . . . . . -5 G CA . 50740 1
51 . 1 . 1 18 18 GLY N N 15 110.255 0.05 . 1 . . . . . -5 G N . 50740 1
52 . 1 . 1 19 19 SER H H 1 8.171 0.006 . 1 . . . . . -4 S HN . 50740 1
53 . 1 . 1 19 19 SER C C 13 174.408 0.001 . 1 . . . . . -4 S C . 50740 1
54 . 1 . 1 19 19 SER CA C 13 58.426 0.05 . 1 . . . . . -4 S CA . 50740 1
55 . 1 . 1 19 19 SER CB C 13 63.856 0.05 . 1 . . . . . -4 S CB . 50740 1
56 . 1 . 1 19 19 SER N N 15 115.522 0.05 . 1 . . . . . -4 S N . 50740 1
57 . 1 . 1 20 20 HIS H H 1 8.506 0.006 . 1 . . . . . -3 H HN . 50740 1
58 . 1 . 1 20 20 HIS C C 13 174.544 0.001 . 1 . . . . . -3 H C . 50740 1
59 . 1 . 1 20 20 HIS CA C 13 55.648 0.05 . 1 . . . . . -3 H CA . 50740 1
60 . 1 . 1 20 20 HIS CB C 13 29.203 0.05 . 1 . . . . . -3 H CB . 50740 1
61 . 1 . 1 20 20 HIS N N 15 120.421 0.05 . 1 . . . . . -3 H N . 50740 1
62 . 1 . 1 21 21 SER H H 1 8.247 0.006 . 1 . . . . . -2 S HN . 50740 1
63 . 1 . 1 21 21 SER C C 13 174.307 0.001 . 1 . . . . . -2 S C . 50740 1
64 . 1 . 1 21 21 SER CA C 13 57.782 0.05 . 1 . . . . . -2 S CA . 50740 1
65 . 1 . 1 21 21 SER CB C 13 63.811 0.05 . 1 . . . . . -2 S CB . 50740 1
66 . 1 . 1 21 21 SER N N 15 116.899 0.05 . 1 . . . . . -2 S N . 50740 1
67 . 1 . 1 22 22 GLU H H 1 8.563 0.006 . 1 . . . . . -1 E HN . 50740 1
68 . 1 . 1 22 22 GLU C C 13 176.040 0.001 . 1 . . . . . -1 E C . 50740 1
69 . 1 . 1 22 22 GLU CA C 13 56.820 0.05 . 1 . . . . . -1 E CA . 50740 1
70 . 1 . 1 22 22 GLU CB C 13 29.869 0.05 . 1 . . . . . -1 E CB . 50740 1
71 . 1 . 1 22 22 GLU N N 15 122.766 0.05 . 1 . . . . . -1 E N . 50740 1
72 . 1 . 1 23 23 PHE H H 1 8.021 0.006 . 1 . . . . . 0 F HN . 50740 1
73 . 1 . 1 23 23 PHE C C 13 175.658 0.001 . 1 . . . . . 0 F C . 50740 1
74 . 1 . 1 23 23 PHE CA C 13 57.797 0.05 . 1 . . . . . 0 F CA . 50740 1
75 . 1 . 1 23 23 PHE CB C 13 39.298 0.05 . 1 . . . . . 0 F CB . 50740 1
76 . 1 . 1 23 23 PHE N N 15 120.689 0.05 . 1 . . . . . 0 F N . 50740 1
77 . 1 . 1 24 24 MET H H 1 7.949 0.006 . 1 . . . . . 1 M HN . 50740 1
78 . 1 . 1 24 24 MET C C 13 176.154 0.001 . 1 . . . . . 1 M C . 50740 1
79 . 1 . 1 24 24 MET CA C 13 55.260 0.05 . 1 . . . . . 1 M CA . 50740 1
80 . 1 . 1 24 24 MET CB C 13 32.278 0.05 . 1 . . . . . 1 M CB . 50740 1
81 . 1 . 1 24 24 MET N N 15 122.457 0.05 . 1 . . . . . 1 M N . 50740 1
82 . 1 . 1 25 25 GLY C C 13 173.951 0.001 . 1 . . . . . 2 G C . 50740 1
83 . 1 . 1 25 25 GLY CA C 13 45.224 0.05 . 1 . . . . . 2 G CA . 50740 1
84 . 1 . 1 25 25 GLY N N 15 109.031 0.05 . 1 . . . . . 2 G N . 50740 1
85 . 1 . 1 26 26 VAL H H 1 7.900 0.006 . 1 . . . . . 3 V HN . 50740 1
86 . 1 . 1 26 26 VAL C C 13 175.920 0.001 . 1 . . . . . 3 V C . 50740 1
87 . 1 . 1 26 26 VAL CA C 13 62.301 0.05 . 1 . . . . . 3 V CA . 50740 1
88 . 1 . 1 26 26 VAL CB C 13 32.734 0.05 . 1 . . . . . 3 V CB . 50740 1
89 . 1 . 1 26 26 VAL N N 15 119.349 0.05 . 1 . . . . . 3 V N . 50740 1
90 . 1 . 1 27 27 ILE H H 1 8.216 0.006 . 1 . . . . . 4 I HN . 50740 1
91 . 1 . 1 27 27 ILE C C 13 175.822 0.001 . 1 . . . . . 4 I C . 50740 1
92 . 1 . 1 27 27 ILE CA C 13 60.836 0.05 . 1 . . . . . 4 I CA . 50740 1
93 . 1 . 1 27 27 ILE CB C 13 38.460 0.05 . 1 . . . . . 4 I CB . 50740 1
94 . 1 . 1 27 27 ILE N N 15 124.655 0.05 . 1 . . . . . 4 I N . 50740 1
95 . 1 . 1 28 28 HIS H H 1 8.549 0.006 . 1 . . . . . 5 H HN . 50740 1
96 . 1 . 1 28 28 HIS C C 13 174.087 0.001 . 1 . . . . . 5 H C . 50740 1
97 . 1 . 1 28 28 HIS CA C 13 55.261 0.05 . 1 . . . . . 5 H CA . 50740 1
98 . 1 . 1 28 28 HIS CB C 13 29.259 0.05 . 1 . . . . . 5 H CB . 50740 1
99 . 1 . 1 28 28 HIS N N 15 123.705 0.05 . 1 . . . . . 5 H N . 50740 1
100 . 1 . 1 29 29 GLU H H 1 8.480 0.006 . 1 . . . . . 6 E HN . 50740 1
101 . 1 . 1 29 29 GLU C C 13 176.192 0.001 . 1 . . . . . 6 E C . 50740 1
102 . 1 . 1 29 29 GLU CA C 13 56.546 0.05 . 1 . . . . . 6 E CA . 50740 1
103 . 1 . 1 29 29 GLU CB C 13 30.183 0.05 . 1 . . . . . 6 E CB . 50740 1
104 . 1 . 1 29 29 GLU N N 15 123.519 0.05 . 1 . . . . . 6 E N . 50740 1
105 . 1 . 1 30 30 GLU H H 1 8.648 0.006 . 1 . . . . . 7 E HN . 50740 1
106 . 1 . 1 30 30 GLU C C 13 176.659 0.001 . 1 . . . . . 7 E C . 50740 1
107 . 1 . 1 30 30 GLU CA C 13 56.701 0.05 . 1 . . . . . 7 E CA . 50740 1
108 . 1 . 1 30 30 GLU CB C 13 30.078 0.05 . 1 . . . . . 7 E CB . 50740 1
109 . 1 . 1 30 30 GLU N N 15 122.652 0.05 . 1 . . . . . 7 E N . 50740 1
110 . 1 . 1 31 31 THR H H 1 8.131 0.006 . 1 . . . . . 8 T HN . 50740 1
111 . 1 . 1 31 31 THR C C 13 174.242 0.001 . 1 . . . . . 8 T C . 50740 1
112 . 1 . 1 31 31 THR CA C 13 62.055 0.05 . 1 . . . . . 8 T CA . 50740 1
113 . 1 . 1 31 31 THR CB C 13 69.595 0.05 . 1 . . . . . 8 T CB . 50740 1
114 . 1 . 1 31 31 THR N N 15 115.149 0.05 . 1 . . . . . 8 T N . 50740 1
115 . 1 . 1 32 32 ALA H H 1 8.185 0.006 . 1 . . . . . 9 A HN . 50740 1
116 . 1 . 1 32 32 ALA C C 13 177.130 0.001 . 1 . . . . . 9 A C . 50740 1
117 . 1 . 1 32 32 ALA CA C 13 52.591 0.05 . 1 . . . . . 9 A CA . 50740 1
118 . 1 . 1 32 32 ALA CB C 13 19.084 0.05 . 1 . . . . . 9 A CB . 50740 1
119 . 1 . 1 32 32 ALA N N 15 126.022 0.05 . 1 . . . . . 9 A N . 50740 1
120 . 1 . 1 33 33 TYR H H 1 7.996 0.006 . 1 . . . . . 10 Y HN . 50740 1
121 . 1 . 1 33 33 TYR C C 13 175.282 0.001 . 1 . . . . . 10 Y C . 50740 1
122 . 1 . 1 33 33 TYR CA C 13 57.916 0.05 . 1 . . . . . 10 Y CA . 50740 1
123 . 1 . 1 33 33 TYR CB C 13 38.631 0.05 . 1 . . . . . 10 Y CB . 50740 1
124 . 1 . 1 33 33 TYR N N 15 119.506 0.05 . 1 . . . . . 10 Y N . 50740 1
125 . 1 . 1 34 34 ARG H H 1 7.897 0.006 . 1 . . . . . 11 R HN . 50740 1
126 . 1 . 1 34 34 ARG C C 13 175.021 0.001 . 1 . . . . . 11 R C . 50740 1
127 . 1 . 1 34 34 ARG CA C 13 55.221 0.05 . 1 . . . . . 11 R CA . 50740 1
128 . 1 . 1 34 34 ARG CB C 13 31.006 0.05 . 1 . . . . . 11 R CB . 50740 1
129 . 1 . 1 34 34 ARG N N 15 124.032 0.05 . 1 . . . . . 11 R N . 50740 1
130 . 1 . 1 35 35 LYS H H 1 8.189 0.006 . 1 . . . . . 12 K HN . 50740 1
131 . 1 . 1 35 35 LYS C C 13 174.415 0.001 . 1 . . . . . 12 K C . 50740 1
132 . 1 . 1 35 35 LYS CA C 13 54.341 0.05 . 1 . . . . . 12 K CA . 50740 1
133 . 1 . 1 35 35 LYS CB C 13 32.269 0.05 . 1 . . . . . 12 K CB . 50740 1
134 . 1 . 1 35 35 LYS N N 15 124.688 0.05 . 1 . . . . . 12 K N . 50740 1
135 . 1 . 1 36 36 PRO C C 13 176.540 0.001 . 1 . . . . . 13 P C . 50740 1
136 . 1 . 1 36 36 PRO CA C 13 62.949 0.05 . 1 . . . . . 13 P CA . 50740 1
137 . 1 . 1 36 36 PRO CB C 13 32.154 0.05 . 1 . . . . . 13 P CB . 50740 1
138 . 1 . 1 36 36 PRO CG C 13 27.337 0.001 . 1 . . . . . 13 P CG . 50740 1
139 . 1 . 1 36 36 PRO CD C 13 50.669 0.001 . 1 . . . . . 13 P CD . 50740 1
140 . 1 . 1 36 36 PRO N N 15 137.157 0.05 . 1 . . . . . 13 P N . 50740 1
141 . 1 . 1 37 37 VAL H H 1 8.195 0.006 . 1 . . . . . 14 V HN . 50740 1
142 . 1 . 1 37 37 VAL C C 13 174.663 0.001 . 1 . . . . . 14 V C . 50740 1
143 . 1 . 1 37 37 VAL CA C 13 59.654 0.05 . 1 . . . . . 14 V CA . 50740 1
144 . 1 . 1 37 37 VAL CB C 13 32.443 0.05 . 1 . . . . . 14 V CB . 50740 1
145 . 1 . 1 37 37 VAL N N 15 121.669 0.05 . 1 . . . . . 14 V N . 50740 1
146 . 1 . 1 38 38 PRO C C 13 177.501 0.001 . 1 . . . . . 15 P C . 50740 1
147 . 1 . 1 38 38 PRO CA C 13 63.620 0.05 . 1 . . . . . 15 P CA . 50740 1
148 . 1 . 1 38 38 PRO CB C 13 32.028 0.05 . 1 . . . . . 15 P CB . 50740 1
149 . 1 . 1 38 38 PRO CG C 13 27.319 0.001 . 1 . . . . . 15 P CG . 50740 1
150 . 1 . 1 38 38 PRO CD C 13 50.951 0.001 . 1 . . . . . 15 P CD . 50740 1
151 . 1 . 1 38 38 PRO N N 15 139.979 0.05 . 1 . . . . . 15 P N . 50740 1
152 . 1 . 1 39 39 GLY H H 1 8.463 0.006 . 1 . . . . . 16 G HN . 50740 1
153 . 1 . 1 39 39 GLY C C 13 174.543 0.001 . 1 . . . . . 16 G C . 50740 1
154 . 1 . 1 39 39 GLY CA C 13 45.117 0.05 . 1 . . . . . 16 G CA . 50740 1
155 . 1 . 1 39 39 GLY N N 15 110.071 0.05 . 1 . . . . . 16 G N . 50740 1
156 . 1 . 1 40 40 GLY H H 1 8.156 0.006 . 1 . . . . . 17 G HN . 50740 1
157 . 1 . 1 40 40 GLY C C 13 173.303 0.001 . 1 . . . . . 17 G C . 50740 1
158 . 1 . 1 40 40 GLY CA C 13 44.899 0.05 . 1 . . . . . 17 G CA . 50740 1
159 . 1 . 1 40 40 GLY N N 15 108.517 0.05 . 1 . . . . . 17 G N . 50740 1
160 . 1 . 1 41 41 ASP H H 1 8.234 0.006 . 1 . . . . . 18 D HN . 50740 1
161 . 1 . 1 41 41 ASP C C 13 175.050 0.001 . 1 . . . . . 18 D C . 50740 1
162 . 1 . 1 41 41 ASP CA C 13 52.110 0.05 . 1 . . . . . 18 D CA . 50740 1
163 . 1 . 1 41 41 ASP CB C 13 41.385 0.05 . 1 . . . . . 18 D CB . 50740 1
164 . 1 . 1 41 41 ASP N N 15 121.463 0.05 . 1 . . . . . 18 D N . 50740 1
165 . 1 . 1 42 42 PRO C C 13 177.656 0.001 . 1 . . . . . 19 P C . 50740 1
166 . 1 . 1 42 42 PRO CA C 13 63.848 0.05 . 1 . . . . . 19 P CA . 50740 1
167 . 1 . 1 42 42 PRO CB C 13 32.007 0.05 . 1 . . . . . 19 P CB . 50740 1
168 . 1 . 1 42 42 PRO CG C 13 27.073 0.001 . 1 . . . . . 19 P CG . 50740 1
169 . 1 . 1 42 42 PRO CD C 13 50.817 0.001 . 1 . . . . . 19 P CD . 50740 1
170 . 1 . 1 42 42 PRO N N 15 137.878 0.05 . 1 . . . . . 19 P N . 50740 1
171 . 1 . 1 43 43 GLY H H 1 8.461 0.006 . 1 . . . . . 20 G HN . 50740 1
172 . 1 . 1 43 43 GLY C C 13 174.171 0.001 . 1 . . . . . 20 G C . 50740 1
173 . 1 . 1 43 43 GLY CA C 13 45.260 0.05 . 1 . . . . . 20 G CA . 50740 1
174 . 1 . 1 43 43 GLY N N 15 108.497 0.05 . 1 . . . . . 20 G N . 50740 1
175 . 1 . 1 44 44 ALA H H 1 7.969 0.006 . 1 . . . . . 21 A HN . 50740 1
176 . 1 . 1 44 44 ALA C C 13 178.336 0.001 . 1 . . . . . 21 A C . 50740 1
177 . 1 . 1 44 44 ALA CA C 13 52.735 0.05 . 1 . . . . . 21 A CA . 50740 1
178 . 1 . 1 44 44 ALA CB C 13 19.155 0.05 . 1 . . . . . 21 A CB . 50740 1
179 . 1 . 1 44 44 ALA N N 15 123.632 0.05 . 1 . . . . . 21 A N . 50740 1
180 . 1 . 1 45 45 GLY H H 1 8.347 0.006 . 1 . . . . . 22 G HN . 50740 1
181 . 1 . 1 45 45 GLY C C 13 174.310 0.001 . 1 . . . . . 22 G C . 50740 1
182 . 1 . 1 45 45 GLY CA C 13 45.235 0.05 . 1 . . . . . 22 G CA . 50740 1
183 . 1 . 1 45 45 GLY N N 15 108.088 0.05 . 1 . . . . . 22 G N . 50740 1
184 . 1 . 1 46 46 SER H H 1 8.208 0.006 . 1 . . . . . 23 S HN . 50740 1
185 . 1 . 1 46 46 SER C C 13 175.174 0.001 . 1 . . . . . 23 S C . 50740 1
186 . 1 . 1 46 46 SER CA C 13 58.458 0.05 . 1 . . . . . 23 S CA . 50740 1
187 . 1 . 1 46 46 SER CB C 13 63.797 0.05 . 1 . . . . . 23 S CB . 50740 1
188 . 1 . 1 46 46 SER N N 15 115.702 0.05 . 1 . . . . . 23 S N . 50740 1
189 . 1 . 1 47 47 GLY H H 1 8.465 0.006 . 1 . . . . . 24 G HN . 50740 1
190 . 1 . 1 47 47 GLY C C 13 173.978 0.001 . 1 . . . . . 24 G C . 50740 1
191 . 1 . 1 47 47 GLY CA C 13 45.294 0.05 . 1 . . . . . 24 G CA . 50740 1
192 . 1 . 1 47 47 GLY N N 15 111.089 0.05 . 1 . . . . . 24 G N . 50740 1
193 . 1 . 1 48 48 ALA H H 1 8.057 0.006 . 1 . . . . . 25 A HN . 50740 1
194 . 1 . 1 48 48 ALA C C 13 177.721 0.001 . 1 . . . . . 25 A C . 50740 1
195 . 1 . 1 48 48 ALA CA C 13 52.608 0.05 . 1 . . . . . 25 A CA . 50740 1
196 . 1 . 1 48 48 ALA CB C 13 19.110 0.05 . 1 . . . . . 25 A CB . 50740 1
197 . 1 . 1 48 48 ALA N N 15 123.711 0.05 . 1 . . . . . 25 A N . 50740 1
198 . 1 . 1 49 49 ALA H H 1 8.220 0.006 . 1 . . . . . 26 A HN . 50740 1
199 . 1 . 1 49 49 ALA C C 13 177.299 0.001 . 1 . . . . . 26 A C . 50740 1
200 . 1 . 1 49 49 ALA CA C 13 52.594 0.05 . 1 . . . . . 26 A CA . 50740 1
201 . 1 . 1 49 49 ALA CB C 13 18.932 0.05 . 1 . . . . . 26 A CB . 50740 1
202 . 1 . 1 49 49 ALA N N 15 122.737 0.05 . 1 . . . . . 26 A N . 50740 1
203 . 1 . 1 50 50 ASP H H 1 8.074 0.006 . 1 . . . . . 27 D HN . 50740 1
204 . 1 . 1 50 50 ASP C C 13 176.017 0.001 . 1 . . . . . 27 D C . 50740 1
205 . 1 . 1 50 50 ASP CA C 13 54.014 0.05 . 1 . . . . . 27 D CA . 50740 1
206 . 1 . 1 50 50 ASP CB C 13 41.071 0.05 . 1 . . . . . 27 D CB . 50740 1
207 . 1 . 1 50 50 ASP N N 15 118.582 0.05 . 1 . . . . . 27 D N . 50740 1
208 . 1 . 1 51 51 HIS H H 1 8.274 0.006 . 1 . . . . . 28 H HN . 50740 1
209 . 1 . 1 51 51 HIS C C 13 174.498 0.001 . 1 . . . . . 28 H C . 50740 1
210 . 1 . 1 51 51 HIS CA C 13 55.646 0.05 . 1 . . . . . 28 H CA . 50740 1
211 . 1 . 1 51 51 HIS CB C 13 28.756 0.05 . 1 . . . . . 28 H CB . 50740 1
212 . 1 . 1 51 51 HIS N N 15 118.882 0.05 . 1 . . . . . 28 H N . 50740 1
213 . 1 . 1 52 52 ARG H H 1 8.241 0.006 . 1 . . . . . 29 R HN . 50740 1
214 . 1 . 1 52 52 ARG C C 13 176.164 0.001 . 1 . . . . . 29 R C . 50740 1
215 . 1 . 1 52 52 ARG CA C 13 56.241 0.05 . 1 . . . . . 29 R CA . 50740 1
216 . 1 . 1 52 52 ARG CB C 13 30.933 0.05 . 1 . . . . . 29 R CB . 50740 1
217 . 1 . 1 52 52 ARG N N 15 121.834 0.05 . 1 . . . . . 29 R N . 50740 1
218 . 1 . 1 53 53 ASP H H 1 8.426 0.006 . 1 . . . . . 30 D HN . 50740 1
219 . 1 . 1 53 53 ASP C C 13 176.762 0.001 . 1 . . . . . 30 D C . 50740 1
220 . 1 . 1 53 53 ASP CA C 13 54.134 0.05 . 1 . . . . . 30 D CA . 50740 1
221 . 1 . 1 53 53 ASP CB C 13 41.244 0.05 . 1 . . . . . 30 D CB . 50740 1
222 . 1 . 1 53 53 ASP N N 15 121.188 0.05 . 1 . . . . . 30 D N . 50740 1
223 . 1 . 1 54 54 SER H H 1 8.240 0.006 . 1 . . . . . 31 S HN . 50740 1
224 . 1 . 1 54 54 SER C C 13 174.683 0.001 . 1 . . . . . 31 S C . 50740 1
225 . 1 . 1 54 54 SER CA C 13 59.126 0.05 . 1 . . . . . 31 S CA . 50740 1
226 . 1 . 1 54 54 SER CB C 13 63.601 0.05 . 1 . . . . . 31 S CB . 50740 1
227 . 1 . 1 54 54 SER N N 15 115.938 0.05 . 1 . . . . . 31 S N . 50740 1
228 . 1 . 1 55 55 ALA H H 1 8.222 0.006 . 1 . . . . . 32 A HN . 50740 1
229 . 1 . 1 55 55 ALA C C 13 178.250 0.001 . 1 . . . . . 32 A C . 50740 1
230 . 1 . 1 55 55 ALA CA C 13 52.820 0.05 . 1 . . . . . 32 A CA . 50740 1
231 . 1 . 1 55 55 ALA CB C 13 18.902 0.05 . 1 . . . . . 32 A CB . 50740 1
232 . 1 . 1 55 55 ALA N N 15 125.191 0.05 . 1 . . . . . 32 A N . 50740 1
233 . 1 . 1 56 56 GLY H H 1 8.223 0.006 . 1 . . . . . 33 G HN . 50740 1
234 . 1 . 1 56 56 GLY C C 13 174.337 0.001 . 1 . . . . . 33 G C . 50740 1
235 . 1 . 1 56 56 GLY CA C 13 45.439 0.05 . 1 . . . . . 33 G CA . 50740 1
236 . 1 . 1 56 56 GLY N N 15 107.708 0.05 . 1 . . . . . 33 G N . 50740 1
237 . 1 . 1 57 57 ARG H H 1 8.090 0.006 . 1 . . . . . 34 R HN . 50740 1
238 . 1 . 1 57 57 ARG C C 13 176.462 0.001 . 1 . . . . . 34 R C . 50740 1
239 . 1 . 1 57 57 ARG CA C 13 56.382 0.05 . 1 . . . . . 34 R CA . 50740 1
240 . 1 . 1 57 57 ARG CB C 13 30.643 0.05 . 1 . . . . . 34 R CB . 50740 1
241 . 1 . 1 57 57 ARG N N 15 120.757 0.05 . 1 . . . . . 34 R N . 50740 1
242 . 1 . 1 58 58 LEU H H 1 8.238 0.006 . 1 . . . . . 35 L HN . 50740 1
243 . 1 . 1 58 58 LEU C C 13 177.388 0.001 . 1 . . . . . 35 L C . 50740 1
244 . 1 . 1 58 58 LEU CA C 13 55.282 0.05 . 1 . . . . . 35 L CA . 50740 1
245 . 1 . 1 58 58 LEU CB C 13 42.217 0.05 . 1 . . . . . 35 L CB . 50740 1
246 . 1 . 1 58 58 LEU N N 15 122.649 0.05 . 1 . . . . . 35 L N . 50740 1
247 . 1 . 1 59 59 SER H H 1 8.224 0.006 . 1 . . . . . 36 S HN . 50740 1
248 . 1 . 1 59 59 SER C C 13 174.439 0.001 . 1 . . . . . 36 S C . 50740 1
249 . 1 . 1 59 59 SER CA C 13 58.296 0.05 . 1 . . . . . 36 S CA . 50740 1
250 . 1 . 1 59 59 SER CB C 13 63.830 0.05 . 1 . . . . . 36 S CB . 50740 1
251 . 1 . 1 59 59 SER N N 15 116.832 0.05 . 1 . . . . . 36 S N . 50740 1
252 . 1 . 1 60 60 ARG H H 1 8.196 0.006 . 1 . . . . . 37 R HN . 50740 1
253 . 1 . 1 60 60 ARG C C 13 175.973 0.001 . 1 . . . . . 37 R C . 50740 1
254 . 1 . 1 60 60 ARG CA C 13 56.342 0.05 . 1 . . . . . 37 R CA . 50740 1
255 . 1 . 1 60 60 ARG CB C 13 30.345 0.05 . 1 . . . . . 37 R CB . 50740 1
256 . 1 . 1 60 60 ARG N N 15 122.455 0.05 . 1 . . . . . 37 R N . 50740 1
257 . 1 . 1 61 61 TRP H H 1 8.059 0.006 . 1 . . . . . 38 W HN . 50740 1
258 . 1 . 1 61 61 TRP HE1 H 1 10.061 0.006 . 1 . . . . . 38 W HE1 . 50740 1
259 . 1 . 1 61 61 TRP C C 13 176.068 0.001 . 1 . . . . . 38 W C . 50740 1
260 . 1 . 1 61 61 TRP CA C 13 57.507 0.05 . 1 . . . . . 38 W CA . 50740 1
261 . 1 . 1 61 61 TRP CB C 13 28.957 0.05 . 1 . . . . . 38 W CB . 50740 1
262 . 1 . 1 61 61 TRP N N 15 121.636 0.05 . 1 . . . . . 38 W N . 50740 1
263 . 1 . 1 61 61 TRP NE1 N 15 129.287 0.05 . 1 . . . . . 38 W NE1 . 50740 1
264 . 1 . 1 62 62 GLU H H 1 8.020 0.006 . 1 . . . . . 39 E HN . 50740 1
265 . 1 . 1 62 62 GLU C C 13 175.745 0.001 . 1 . . . . . 39 E C . 50740 1
266 . 1 . 1 62 62 GLU CA C 13 56.398 0.05 . 1 . . . . . 39 E CA . 50740 1
267 . 1 . 1 62 62 GLU CB C 13 30.584 0.05 . 1 . . . . . 39 E CB . 50740 1
268 . 1 . 1 62 62 GLU N N 15 122.274 0.05 . 1 . . . . . 39 E N . 50740 1
269 . 1 . 1 63 63 ALA H H 1 8.103 0.006 . 1 . . . . . 40 A HN . 50740 1
270 . 1 . 1 63 63 ALA C C 13 177.854 0.001 . 1 . . . . . 40 A C . 50740 1
271 . 1 . 1 63 63 ALA CA C 13 52.618 0.05 . 1 . . . . . 40 A CA . 50740 1
272 . 1 . 1 63 63 ALA CB C 13 19.063 0.05 . 1 . . . . . 40 A CB . 50740 1
273 . 1 . 1 63 63 ALA N N 15 124.575 0.05 . 1 . . . . . 40 A N . 50740 1
274 . 1 . 1 64 64 THR H H 1 7.950 0.006 . 1 . . . . . 41 T HN . 50740 1
275 . 1 . 1 64 64 THR C C 13 175.130 0.001 . 1 . . . . . 41 T C . 50740 1
276 . 1 . 1 64 64 THR CA C 13 61.897 0.05 . 1 . . . . . 41 T CA . 50740 1
277 . 1 . 1 64 64 THR CB C 13 69.940 0.05 . 1 . . . . . 41 T CB . 50740 1
278 . 1 . 1 64 64 THR N N 15 112.095 0.05 . 1 . . . . . 41 T N . 50740 1
279 . 1 . 1 65 65 GLY H H 1 8.263 0.006 . 1 . . . . . 42 G HN . 50740 1
280 . 1 . 1 65 65 GLY C C 13 173.637 0.001 . 1 . . . . . 42 G C . 50740 1
281 . 1 . 1 65 65 GLY CA C 13 45.265 0.05 . 1 . . . . . 42 G CA . 50740 1
282 . 1 . 1 65 65 GLY N N 15 110.606 0.05 . 1 . . . . . 42 G N . 50740 1
283 . 1 . 1 66 66 ASP H H 1 8.161 0.006 . 1 . . . . . 43 D HN . 50740 1
284 . 1 . 1 66 66 ASP C C 13 176.376 0.001 . 1 . . . . . 43 D C . 50740 1
285 . 1 . 1 66 66 ASP CA C 13 54.206 0.05 . 1 . . . . . 43 D CA . 50740 1
286 . 1 . 1 66 66 ASP CB C 13 41.337 0.05 . 1 . . . . . 43 D CB . 50740 1
287 . 1 . 1 66 66 ASP N N 15 120.711 0.05 . 1 . . . . . 43 D N . 50740 1
288 . 1 . 1 67 67 VAL H H 1 8.063 0.006 . 1 . . . . . 44 V HN . 50740 1
289 . 1 . 1 67 67 VAL C C 13 176.196 0.001 . 1 . . . . . 44 V C . 50740 1
290 . 1 . 1 67 67 VAL CA C 13 62.573 0.05 . 1 . . . . . 44 V CA . 50740 1
291 . 1 . 1 67 67 VAL CB C 13 32.304 0.05 . 1 . . . . . 44 V CB . 50740 1
292 . 1 . 1 67 67 VAL N N 15 120.585 0.05 . 1 . . . . . 44 V N . 50740 1
293 . 1 . 1 68 68 ARG H H 1 8.309 0.006 . 1 . . . . . 45 R HN . 50740 1
294 . 1 . 1 68 68 ARG C C 13 175.974 0.001 . 1 . . . . . 45 R C . 50740 1
295 . 1 . 1 68 68 ARG CA C 13 56.217 0.05 . 1 . . . . . 45 R CA . 50740 1
296 . 1 . 1 68 68 ARG CB C 13 30.805 0.05 . 1 . . . . . 45 R CB . 50740 1
297 . 1 . 1 68 68 ARG N N 15 123.643 0.05 . 1 . . . . . 45 R N . 50740 1
298 . 1 . 1 69 69 ASN H H 1 8.309 0.006 . 1 . . . . . 46 N HN . 50740 1
299 . 1 . 1 69 69 ASN HD21 H 1 6.825 0.006 . 1 . . . . . 46 N HD21 . 50740 1
300 . 1 . 1 69 69 ASN C C 13 175.077 0.001 . 1 . . . . . 46 N C . 50740 1
301 . 1 . 1 69 69 ASN CA C 13 53.356 0.05 . 1 . . . . . 46 N CA . 50740 1
302 . 1 . 1 69 69 ASN CB C 13 38.878 0.05 . 1 . . . . . 46 N CB . 50740 1
303 . 1 . 1 69 69 ASN CG C 13 176.946 0.001 . 1 . . . . . 46 N CG . 50740 1
304 . 1 . 1 69 69 ASN N N 15 119.700 0.05 . 1 . . . . . 46 N N . 50740 1
305 . 1 . 1 69 69 ASN ND2 N 15 112.536 0.05 . 1 . . . . . 46 N ND2 . 50740 1
306 . 1 . 1 70 70 VAL H H 1 8.022 0.006 . 1 . . . . . 47 V HN . 50740 1
307 . 1 . 1 70 70 VAL C C 13 175.859 0.001 . 1 . . . . . 47 V C . 50740 1
308 . 1 . 1 70 70 VAL CA C 13 62.313 0.05 . 1 . . . . . 47 V CA . 50740 1
309 . 1 . 1 70 70 VAL CB C 13 32.599 0.05 . 1 . . . . . 47 V CB . 50740 1
310 . 1 . 1 70 70 VAL N N 15 120.346 0.05 . 1 . . . . . 47 V N . 50740 1
311 . 1 . 1 71 71 ALA H H 1 8.332 0.006 . 1 . . . . . 48 A HN . 50740 1
312 . 1 . 1 71 71 ALA C C 13 178.137 0.001 . 1 . . . . . 48 A C . 50740 1
313 . 1 . 1 71 71 ALA CA C 13 52.685 0.05 . 1 . . . . . 48 A CA . 50740 1
314 . 1 . 1 71 71 ALA CB C 13 19.104 0.05 . 1 . . . . . 48 A CB . 50740 1
315 . 1 . 1 71 71 ALA N N 15 127.181 0.05 . 1 . . . . . 48 A N . 50740 1
316 . 1 . 1 72 72 GLY H H 1 8.272 0.006 . 1 . . . . . 49 G HN . 50740 1
317 . 1 . 1 72 72 GLY C C 13 174.481 0.001 . 1 . . . . . 49 G C . 50740 1
318 . 1 . 1 72 72 GLY CA C 13 45.259 0.05 . 1 . . . . . 49 G CA . 50740 1
319 . 1 . 1 72 72 GLY N N 15 108.079 0.05 . 1 . . . . . 49 G N . 50740 1
320 . 1 . 1 73 73 THR H H 1 7.982 0.006 . 1 . . . . . 50 T HN . 50740 1
321 . 1 . 1 73 73 THR C C 13 174.470 0.001 . 1 . . . . . 50 T C . 50740 1
322 . 1 . 1 73 73 THR CA C 13 61.854 0.05 . 1 . . . . . 50 T CA . 50740 1
323 . 1 . 1 73 73 THR CB C 13 69.992 0.05 . 1 . . . . . 50 T CB . 50740 1
324 . 1 . 1 73 73 THR N N 15 112.651 0.05 . 1 . . . . . 50 T N . 50740 1
325 . 1 . 1 74 74 ASP H H 1 8.413 0.006 . 1 . . . . . 51 D HN . 50740 1
326 . 1 . 1 74 74 ASP C C 13 176.446 0.001 . 1 . . . . . 51 D C . 50740 1
327 . 1 . 1 74 74 ASP CA C 13 54.497 0.05 . 1 . . . . . 51 D CA . 50740 1
328 . 1 . 1 74 74 ASP CB C 13 41.003 0.05 . 1 . . . . . 51 D CB . 50740 1
329 . 1 . 1 74 74 ASP N N 15 122.364 0.05 . 1 . . . . . 51 D N . 50740 1
330 . 1 . 1 75 75 GLN H H 1 8.332 0.006 . 1 . . . . . 52 Q HN . 50740 1
331 . 1 . 1 75 75 GLN HE21 H 1 7.462 0.006 . 1 . . . . . 52 Q HE21 . 50740 1
332 . 1 . 1 75 75 GLN HE22 H 1 6.794 0.006 . 1 . . . . . 52 Q HE22 . 50740 1
333 . 1 . 1 75 75 GLN C C 13 176.632 0.001 . 1 . . . . . 52 Q C . 50740 1
334 . 1 . 1 75 75 GLN CA C 13 56.387 0.05 . 1 . . . . . 52 Q CA . 50740 1
335 . 1 . 1 75 75 GLN CB C 13 29.098 0.05 . 1 . . . . . 52 Q CB . 50740 1
336 . 1 . 1 75 75 GLN CG C 13 33.796 0.001 . 1 . . . . . 52 Q CG . 50740 1
337 . 1 . 1 75 75 GLN CD C 13 180.506 0.001 . 1 . . . . . 52 Q CD . 50740 1
338 . 1 . 1 75 75 GLN N N 15 120.656 0.05 . 1 . . . . . 52 Q N . 50740 1
339 . 1 . 1 75 75 GLN NE2 N 15 112.491 0.05 . 1 . . . . . 52 Q NE2 . 50740 1
340 . 1 . 1 76 76 GLY H H 1 8.413 0.006 . 1 . . . . . 53 G HN . 50740 1
341 . 1 . 1 76 76 GLY C C 13 174.290 0.001 . 1 . . . . . 53 G C . 50740 1
342 . 1 . 1 76 76 GLY CA C 13 45.604 0.05 . 1 . . . . . 53 G CA . 50740 1
343 . 1 . 1 76 76 GLY N N 15 109.166 0.05 . 1 . . . . . 53 G N . 50740 1
344 . 1 . 1 77 77 ARG H H 1 7.984 0.006 . 1 . . . . . 54 R HN . 50740 1
345 . 1 . 1 77 77 ARG C C 13 176.400 0.001 . 1 . . . . . 54 R C . 50740 1
346 . 1 . 1 77 77 ARG CA C 13 56.237 0.05 . 1 . . . . . 54 R CA . 50740 1
347 . 1 . 1 77 77 ARG CB C 13 30.800 0.05 . 1 . . . . . 54 R CB . 50740 1
348 . 1 . 1 77 77 ARG N N 15 120.157 0.05 . 1 . . . . . 54 R N . 50740 1
349 . 1 . 1 78 78 SER H H 1 8.299 0.006 . 1 . . . . . 55 S HN . 50740 1
350 . 1 . 1 78 78 SER C C 13 174.620 0.001 . 1 . . . . . 55 S C . 50740 1
351 . 1 . 1 78 78 SER CA C 13 58.297 0.05 . 1 . . . . . 55 S CA . 50740 1
352 . 1 . 1 78 78 SER CB C 13 63.793 0.05 . 1 . . . . . 55 S CB . 50740 1
353 . 1 . 1 78 78 SER N N 15 116.912 0.05 . 1 . . . . . 55 S N . 50740 1
354 . 1 . 1 79 79 VAL H H 1 8.088 0.006 . 1 . . . . . 56 V HN . 50740 1
355 . 1 . 1 79 79 VAL C C 13 176.031 0.001 . 1 . . . . . 56 V C . 50740 1
356 . 1 . 1 79 79 VAL CA C 13 62.274 0.05 . 1 . . . . . 56 V CA . 50740 1
357 . 1 . 1 79 79 VAL CB C 13 32.685 0.05 . 1 . . . . . 56 V CB . 50740 1
358 . 1 . 1 79 79 VAL N N 15 121.550 0.05 . 1 . . . . . 56 V N . 50740 1
359 . 1 . 1 80 80 ALA H H 1 8.297 0.006 . 1 . . . . . 57 A HN . 50740 1
360 . 1 . 1 80 80 ALA C C 13 177.775 0.001 . 1 . . . . . 57 A C . 50740 1
361 . 1 . 1 80 80 ALA CA C 13 52.597 0.05 . 1 . . . . . 57 A CA . 50740 1
362 . 1 . 1 80 80 ALA CB C 13 18.972 0.05 . 1 . . . . . 57 A CB . 50740 1
363 . 1 . 1 80 80 ALA N N 15 127.274 0.05 . 1 . . . . . 57 A N . 50740 1
364 . 1 . 1 81 81 SER H H 1 8.212 0.006 . 1 . . . . . 58 S HN . 50740 1
365 . 1 . 1 81 81 SER C C 13 174.797 0.001 . 1 . . . . . 58 S C . 50740 1
366 . 1 . 1 81 81 SER CA C 13 58.473 0.05 . 1 . . . . . 58 S CA . 50740 1
367 . 1 . 1 81 81 SER CB C 13 63.843 0.05 . 1 . . . . . 58 S CB . 50740 1
368 . 1 . 1 81 81 SER N N 15 115.140 0.05 . 1 . . . . . 58 S N . 50740 1
369 . 1 . 1 82 82 GLY H H 1 8.345 0.006 . 1 . . . . . 59 G HN . 50740 1
370 . 1 . 1 82 82 GLY C C 13 174.062 0.001 . 1 . . . . . 59 G C . 50740 1
371 . 1 . 1 82 82 GLY CA C 13 45.332 0.05 . 1 . . . . . 59 G CA . 50740 1
372 . 1 . 1 82 82 GLY N N 15 110.712 0.05 . 1 . . . . . 59 G N . 50740 1
373 . 1 . 1 83 83 ALA H H 1 8.073 0.006 . 1 . . . . . 60 A HN . 50740 1
374 . 1 . 1 83 83 ALA C C 13 177.890 0.001 . 1 . . . . . 60 A C . 50740 1
375 . 1 . 1 83 83 ALA CA C 13 52.654 0.05 . 1 . . . . . 60 A CA . 50740 1
376 . 1 . 1 83 83 ALA CB C 13 19.133 0.05 . 1 . . . . . 60 A CB . 50740 1
377 . 1 . 1 83 83 ALA N N 15 123.583 0.05 . 1 . . . . . 60 A N . 50740 1
378 . 1 . 1 84 84 SER H H 1 8.195 0.006 . 1 . . . . . 61 S HN . 50740 1
379 . 1 . 1 84 84 SER C C 13 174.636 0.001 . 1 . . . . . 61 S C . 50740 1
380 . 1 . 1 84 84 SER CA C 13 58.387 0.05 . 1 . . . . . 61 S CA . 50740 1
381 . 1 . 1 84 84 SER CB C 13 63.712 0.05 . 1 . . . . . 61 S CB . 50740 1
382 . 1 . 1 84 84 SER N N 15 114.599 0.05 . 1 . . . . . 61 S N . 50740 1
383 . 1 . 1 85 85 ARG H H 1 8.281 0.006 . 1 . . . . . 62 R HN . 50740 1
384 . 1 . 1 85 85 ARG C C 13 176.209 0.001 . 1 . . . . . 62 R C . 50740 1
385 . 1 . 1 85 85 ARG CA C 13 56.217 0.05 . 1 . . . . . 62 R CA . 50740 1
386 . 1 . 1 85 85 ARG CB C 13 30.667 0.05 . 1 . . . . . 62 R CB . 50740 1
387 . 1 . 1 85 85 ARG N N 15 123.009 0.05 . 1 . . . . . 62 R N . 50740 1
388 . 1 . 1 86 86 VAL H H 1 8.006 0.006 . 1 . . . . . 63 V HN . 50740 1
389 . 1 . 1 86 86 VAL C C 13 176.531 0.001 . 1 . . . . . 63 V C . 50740 1
390 . 1 . 1 86 86 VAL CA C 13 62.537 0.05 . 1 . . . . . 63 V CA . 50740 1
391 . 1 . 1 86 86 VAL CB C 13 32.694 0.05 . 1 . . . . . 63 V CB . 50740 1
392 . 1 . 1 86 86 VAL N N 15 120.530 0.05 . 1 . . . . . 63 V N . 50740 1
393 . 1 . 1 87 87 GLY H H 1 8.392 0.006 . 1 . . . . . 64 G HN . 50740 1
394 . 1 . 1 87 87 GLY C C 13 173.785 0.001 . 1 . . . . . 64 G C . 50740 1
395 . 1 . 1 87 87 GLY CA C 13 45.178 0.05 . 1 . . . . . 64 G CA . 50740 1
396 . 1 . 1 87 87 GLY N N 15 112.446 0.05 . 1 . . . . . 64 G N . 50740 1
397 . 1 . 1 88 88 ARG H H 1 8.083 0.006 . 1 . . . . . 65 R HN . 50740 1
398 . 1 . 1 88 88 ARG C C 13 176.300 0.001 . 1 . . . . . 65 R C . 50740 1
399 . 1 . 1 88 88 ARG CA C 13 56.116 0.05 . 1 . . . . . 65 R CA . 50740 1
400 . 1 . 1 88 88 ARG CB C 13 30.919 0.05 . 1 . . . . . 65 R CB . 50740 1
401 . 1 . 1 88 88 ARG N N 15 120.754 0.05 . 1 . . . . . 65 R N . 50740 1
402 . 1 . 1 89 89 VAL H H 1 8.176 0.006 . 1 . . . . . 66 V HN . 50740 1
403 . 1 . 1 89 89 VAL C C 13 176.110 0.001 . 1 . . . . . 66 V C . 50740 1
404 . 1 . 1 89 89 VAL CA C 13 62.353 0.05 . 1 . . . . . 66 V CA . 50740 1
405 . 1 . 1 89 89 VAL CB C 13 32.763 0.05 . 1 . . . . . 66 V CB . 50740 1
406 . 1 . 1 89 89 VAL N N 15 121.813 0.05 . 1 . . . . . 66 V N . 50740 1
407 . 1 . 1 90 90 ARG H H 1 8.450 0.006 . 1 . . . . . 67 R HN . 50740 1
408 . 1 . 1 90 90 ARG C C 13 176.769 0.001 . 1 . . . . . 67 R C . 50740 1
409 . 1 . 1 90 90 ARG CA C 13 56.476 0.05 . 1 . . . . . 67 R CA . 50740 1
410 . 1 . 1 90 90 ARG CB C 13 30.606 0.05 . 1 . . . . . 67 R CB . 50740 1
411 . 1 . 1 90 90 ARG N N 15 125.342 0.05 . 1 . . . . . 67 R N . 50740 1
412 . 1 . 1 91 91 GLY H H 1 8.490 0.006 . 1 . . . . . 68 G HN . 50740 1
413 . 1 . 1 91 91 GLY C C 13 174.247 0.001 . 1 . . . . . 68 G C . 50740 1
414 . 1 . 1 91 91 GLY CA C 13 45.405 0.05 . 1 . . . . . 68 G CA . 50740 1
415 . 1 . 1 91 91 GLY N N 15 110.528 0.05 . 1 . . . . . 68 G N . 50740 1
416 . 1 . 1 92 92 GLN H H 1 8.198 0.006 . 1 . . . . . 69 Q HN . 50740 1
417 . 1 . 1 92 92 GLN HE21 H 1 6.790 0.006 . 1 . . . . . 69 Q HE21 . 50740 1
418 . 1 . 1 92 92 GLN HE22 H 1 7.525 0.006 . 1 . . . . . 69 Q HE22 . 50740 1
419 . 1 . 1 92 92 GLN C C 13 176.093 0.001 . 1 . . . . . 69 Q C . 50740 1
420 . 1 . 1 92 92 GLN CA C 13 55.972 0.05 . 1 . . . . . 69 Q CA . 50740 1
421 . 1 . 1 92 92 GLN CB C 13 29.567 0.05 . 1 . . . . . 69 Q CB . 50740 1
422 . 1 . 1 92 92 GLN CG C 13 33.915 0.001 . 1 . . . . . 69 Q CG . 50740 1
423 . 1 . 1 92 92 GLN CD C 13 180.717 0.001 . 1 . . . . . 69 Q CD . 50740 1
424 . 1 . 1 92 92 GLN N N 15 119.972 0.05 . 1 . . . . . 69 Q N . 50740 1
425 . 1 . 1 92 92 GLN NE2 N 15 112.694 0.05 . 1 . . . . . 69 Q NE2 . 50740 1
426 . 1 . 1 93 93 GLU H H 1 8.555 0.006 . 1 . . . . . 70 E HN . 50740 1
427 . 1 . 1 93 93 GLU C C 13 176.573 0.001 . 1 . . . . . 70 E C . 50740 1
428 . 1 . 1 93 93 GLU CA C 13 56.884 0.05 . 1 . . . . . 70 E CA . 50740 1
429 . 1 . 1 93 93 GLU CB C 13 29.764 0.05 . 1 . . . . . 70 E CB . 50740 1
430 . 1 . 1 93 93 GLU N N 15 122.083 0.05 . 1 . . . . . 70 E N . 50740 1
431 . 1 . 1 94 94 LEU H H 1 8.161 0.006 . 1 . . . . . 71 L HN . 50740 1
432 . 1 . 1 94 94 LEU C C 13 177.191 0.001 . 1 . . . . . 71 L C . 50740 1
433 . 1 . 1 94 94 LEU CA C 13 55.172 0.05 . 1 . . . . . 71 L CA . 50740 1
434 . 1 . 1 94 94 LEU CB C 13 42.264 0.05 . 1 . . . . . 71 L CB . 50740 1
435 . 1 . 1 94 94 LEU N N 15 122.989 0.05 . 1 . . . . . 71 L N . 50740 1
436 . 1 . 1 95 95 ALA H H 1 8.153 0.006 . 1 . . . . . 72 A HN . 50740 1
437 . 1 . 1 95 95 ALA C C 13 177.579 0.001 . 1 . . . . . 72 A C . 50740 1
438 . 1 . 1 95 95 ALA CA C 13 52.533 0.05 . 1 . . . . . 72 A CA . 50740 1
439 . 1 . 1 95 95 ALA CB C 13 18.857 0.05 . 1 . . . . . 72 A CB . 50740 1
440 . 1 . 1 95 95 ALA N N 15 124.500 0.05 . 1 . . . . . 72 A N . 50740 1
441 . 1 . 1 96 96 ARG H H 1 8.182 0.006 . 1 . . . . . 73 R HN . 50740 1
442 . 1 . 1 96 96 ARG C C 13 176.860 0.001 . 1 . . . . . 73 R C . 50740 1
443 . 1 . 1 96 96 ARG CA C 13 56.359 0.05 . 1 . . . . . 73 R CA . 50740 1
444 . 1 . 1 96 96 ARG CB C 13 30.730 0.05 . 1 . . . . . 73 R CB . 50740 1
445 . 1 . 1 96 96 ARG N N 15 119.910 0.05 . 1 . . . . . 73 R N . 50740 1
446 . 1 . 1 97 97 GLY H H 1 8.309 0.006 . 1 . . . . . 74 G HN . 50740 1
447 . 1 . 1 97 97 GLY C C 13 174.020 0.001 . 1 . . . . . 74 G C . 50740 1
448 . 1 . 1 97 97 GLY CA C 13 45.246 0.05 . 1 . . . . . 74 G CA . 50740 1
449 . 1 . 1 97 97 GLY N N 15 109.690 0.05 . 1 . . . . . 74 G N . 50740 1
450 . 1 . 1 98 98 VAL H H 1 7.903 0.006 . 1 . . . . . 75 V HN . 50740 1
451 . 1 . 1 98 98 VAL C C 13 176.097 0.001 . 1 . . . . . 75 V C . 50740 1
452 . 1 . 1 98 98 VAL CA C 13 62.461 0.05 . 1 . . . . . 75 V CA . 50740 1
453 . 1 . 1 98 98 VAL CB C 13 32.760 0.05 . 1 . . . . . 75 V CB . 50740 1
454 . 1 . 1 98 98 VAL N N 15 119.432 0.05 . 1 . . . . . 75 V N . 50740 1
455 . 1 . 1 99 99 ARG H H 1 8.393 0.006 . 1 . . . . . 76 R HN . 50740 1
456 . 1 . 1 99 99 ARG C C 13 175.672 0.001 . 1 . . . . . 76 R C . 50740 1
457 . 1 . 1 99 99 ARG CA C 13 55.841 0.05 . 1 . . . . . 76 R CA . 50740 1
458 . 1 . 1 99 99 ARG CB C 13 30.868 0.05 . 1 . . . . . 76 R CB . 50740 1
459 . 1 . 1 99 99 ARG N N 15 124.886 0.05 . 1 . . . . . 76 R N . 50740 1
460 . 1 . 1 100 100 ALA H H 1 8.312 0.006 . 1 . . . . . 77 A HN . 50740 1
461 . 1 . 1 100 100 ALA C C 13 178.075 0.001 . 1 . . . . . 77 A C . 50740 1
462 . 1 . 1 100 100 ALA CA C 13 52.478 0.05 . 1 . . . . . 77 A CA . 50740 1
463 . 1 . 1 100 100 ALA CB C 13 19.191 0.05 . 1 . . . . . 77 A CB . 50740 1
464 . 1 . 1 100 100 ALA N N 15 125.932 0.05 . 1 . . . . . 77 A N . 50740 1
465 . 1 . 1 101 101 GLY H H 1 8.335 0.006 . 1 . . . . . 78 G HN . 50740 1
466 . 1 . 1 101 101 GLY C C 13 173.848 0.001 . 1 . . . . . 78 G C . 50740 1
467 . 1 . 1 101 101 GLY CA C 13 45.275 0.05 . 1 . . . . . 78 G CA . 50740 1
468 . 1 . 1 101 101 GLY N N 15 108.401 0.05 . 1 . . . . . 78 G N . 50740 1
469 . 1 . 1 102 102 ASN H H 1 8.325 0.006 . 1 . . . . . 79 N HN . 50740 1
470 . 1 . 1 102 102 ASN C C 13 175.894 0.001 . 1 . . . . . 79 N C . 50740 1
471 . 1 . 1 102 102 ASN CA C 13 53.201 0.05 . 1 . . . . . 79 N CA . 50740 1
472 . 1 . 1 102 102 ASN CB C 13 38.997 0.05 . 1 . . . . . 79 N CB . 50740 1
473 . 1 . 1 102 102 ASN N N 15 118.686 0.05 . 1 . . . . . 79 N N . 50740 1
474 . 1 . 1 103 103 GLY H H 1 8.463 0.006 . 1 . . . . . 80 G HN . 50740 1
475 . 1 . 1 103 103 GLY C C 13 174.742 0.001 . 1 . . . . . 80 G C . 50740 1
476 . 1 . 1 103 103 GLY CA C 13 45.466 0.05 . 1 . . . . . 80 G CA . 50740 1
477 . 1 . 1 103 103 GLY N N 15 109.457 0.05 . 1 . . . . . 80 G N . 50740 1
478 . 1 . 1 104 104 GLY H H 1 8.228 0.006 . 1 . . . . . 81 G HN . 50740 1
479 . 1 . 1 104 104 GLY C C 13 174.453 0.001 . 1 . . . . . 81 G C . 50740 1
480 . 1 . 1 104 104 GLY CA C 13 45.332 0.05 . 1 . . . . . 81 G CA . 50740 1
481 . 1 . 1 104 104 GLY N N 15 108.739 0.05 . 1 . . . . . 81 G N . 50740 1
482 . 1 . 1 105 105 SER H H 1 8.215 0.006 . 1 . . . . . 82 S HN . 50740 1
483 . 1 . 1 105 105 SER C C 13 174.544 0.001 . 1 . . . . . 82 S C . 50740 1
484 . 1 . 1 105 105 SER CA C 13 58.405 0.05 . 1 . . . . . 82 S CA . 50740 1
485 . 1 . 1 105 105 SER CB C 13 63.876 0.05 . 1 . . . . . 82 S CB . 50740 1
486 . 1 . 1 105 105 SER N N 15 115.711 0.05 . 1 . . . . . 82 S N . 50740 1
487 . 1 . 1 106 106 ALA H H 1 8.359 0.006 . 1 . . . . . 83 A HN . 50740 1
488 . 1 . 1 106 106 ALA C C 13 178.263 0.001 . 1 . . . . . 83 A C . 50740 1
489 . 1 . 1 106 106 ALA CA C 13 52.812 0.05 . 1 . . . . . 83 A CA . 50740 1
490 . 1 . 1 106 106 ALA CB C 13 18.816 0.05 . 1 . . . . . 83 A CB . 50740 1
491 . 1 . 1 106 106 ALA N N 15 125.807 0.05 . 1 . . . . . 83 A N . 50740 1
492 . 1 . 1 107 107 GLY H H 1 8.278 0.006 . 1 . . . . . 84 G HN . 50740 1
493 . 1 . 1 107 107 GLY C C 13 174.554 0.001 . 1 . . . . . 84 G C . 50740 1
494 . 1 . 1 107 107 GLY CA C 13 45.401 0.05 . 1 . . . . . 84 G CA . 50740 1
495 . 1 . 1 107 107 GLY N N 15 107.720 0.05 . 1 . . . . . 84 G N . 50740 1
496 . 1 . 1 108 108 THR H H 1 8.017 0.006 . 1 . . . . . 85 T HN . 50740 1
497 . 1 . 1 108 108 THR C C 13 174.875 0.001 . 1 . . . . . 85 T C . 50740 1
498 . 1 . 1 108 108 THR CA C 13 61.827 0.05 . 1 . . . . . 85 T CA . 50740 1
499 . 1 . 1 108 108 THR CB C 13 69.852 0.05 . 1 . . . . . 85 T CB . 50740 1
500 . 1 . 1 108 108 THR N N 15 112.852 0.05 . 1 . . . . . 85 T N . 50740 1
501 . 1 . 1 109 109 SER H H 1 8.323 0.006 . 1 . . . . . 86 S HN . 50740 1
502 . 1 . 1 109 109 SER C C 13 174.907 0.001 . 1 . . . . . 86 S C . 50740 1
503 . 1 . 1 109 109 SER CA C 13 58.622 0.05 . 1 . . . . . 86 S CA . 50740 1
504 . 1 . 1 109 109 SER CB C 13 63.813 0.05 . 1 . . . . . 86 S CB . 50740 1
505 . 1 . 1 109 109 SER N N 15 117.897 0.05 . 1 . . . . . 86 S N . 50740 1
506 . 1 . 1 110 110 GLY H H 1 8.349 0.006 . 1 . . . . . 87 G HN . 50740 1
507 . 1 . 1 110 110 GLY C C 13 173.826 0.001 . 1 . . . . . 87 G C . 50740 1
508 . 1 . 1 110 110 GLY CA C 13 45.246 0.05 . 1 . . . . . 87 G CA . 50740 1
509 . 1 . 1 110 110 GLY N N 15 110.715 0.05 . 1 . . . . . 87 G N . 50740 1
510 . 1 . 1 111 111 VAL H H 1 7.848 0.006 . 1 . . . . . 88 V HN . 50740 1
511 . 1 . 1 111 111 VAL C C 13 175.853 0.001 . 1 . . . . . 88 V C . 50740 1
512 . 1 . 1 111 111 VAL CA C 13 62.235 0.05 . 1 . . . . . 88 V CA . 50740 1
513 . 1 . 1 111 111 VAL CB C 13 32.738 0.05 . 1 . . . . . 88 V CB . 50740 1
514 . 1 . 1 111 111 VAL N N 15 119.089 0.05 . 1 . . . . . 88 V N . 50740 1
515 . 1 . 1 112 112 HIS H H 1 8.523 0.006 . 1 . . . . . 89 H HN . 50740 1
516 . 1 . 1 112 112 HIS C C 13 174.049 0.001 . 1 . . . . . 89 H C . 50740 1
517 . 1 . 1 112 112 HIS CA C 13 55.122 0.05 . 1 . . . . . 89 H CA . 50740 1
518 . 1 . 1 112 112 HIS CB C 13 29.194 0.05 . 1 . . . . . 89 H CB . 50740 1
519 . 1 . 1 112 112 HIS N N 15 123.249 0.05 . 1 . . . . . 89 H N . 50740 1
520 . 1 . 1 113 113 ARG H H 1 8.359 0.006 . 1 . . . . . 90 R HN . 50740 1
521 . 1 . 1 113 113 ARG C C 13 173.934 0.001 . 1 . . . . . 90 R C . 50740 1
522 . 1 . 1 113 113 ARG CA C 13 53.954 0.05 . 1 . . . . . 90 R CA . 50740 1
523 . 1 . 1 113 113 ARG CB C 13 30.102 0.05 . 1 . . . . . 90 R CB . 50740 1
524 . 1 . 1 113 113 ARG N N 15 124.788 0.05 . 1 . . . . . 90 R N . 50740 1
525 . 1 . 1 114 114 PRO C C 13 176.725 0.001 . 1 . . . . . 91 P C . 50740 1
526 . 1 . 1 114 114 PRO CA C 13 63.208 0.05 . 1 . . . . . 91 P CA . 50740 1
527 . 1 . 1 114 114 PRO CB C 13 31.992 0.05 . 1 . . . . . 91 P CB . 50740 1
528 . 1 . 1 114 114 PRO CG C 13 27.190 0.001 . 1 . . . . . 91 P CG . 50740 1
529 . 1 . 1 114 114 PRO CD C 13 50.521 0.001 . 1 . . . . . 91 P CD . 50740 1
530 . 1 . 1 114 114 PRO N N 15 136.676 0.05 . 1 . . . . . 91 P N . 50740 1
531 . 1 . 1 115 115 GLU H H 1 8.589 0.006 . 1 . . . . . 92 E HN . 50740 1
532 . 1 . 1 115 115 GLU C C 13 176.612 0.001 . 1 . . . . . 92 E C . 50740 1
533 . 1 . 1 115 115 GLU CA C 13 56.538 0.05 . 1 . . . . . 92 E CA . 50740 1
534 . 1 . 1 115 115 GLU CB C 13 30.075 0.05 . 1 . . . . . 92 E CB . 50740 1
535 . 1 . 1 115 115 GLU N N 15 121.491 0.05 . 1 . . . . . 92 E N . 50740 1
536 . 1 . 1 116 116 VAL H H 1 8.148 0.006 . 1 . . . . . 93 V HN . 50740 1
537 . 1 . 1 116 116 VAL C C 13 176.676 0.001 . 1 . . . . . 93 V C . 50740 1
538 . 1 . 1 116 116 VAL CA C 13 62.544 0.05 . 1 . . . . . 93 V CA . 50740 1
539 . 1 . 1 116 116 VAL CB C 13 32.700 0.05 . 1 . . . . . 93 V CB . 50740 1
540 . 1 . 1 116 116 VAL N N 15 121.167 0.05 . 1 . . . . . 93 V N . 50740 1
541 . 1 . 1 117 117 GLY H H 1 8.458 0.006 . 1 . . . . . 94 G HN . 50740 1
542 . 1 . 1 117 117 GLY C C 13 174.249 0.001 . 1 . . . . . 94 G C . 50740 1
543 . 1 . 1 117 117 GLY CA C 13 45.246 0.05 . 1 . . . . . 94 G CA . 50740 1
544 . 1 . 1 117 117 GLY N N 15 112.436 0.05 . 1 . . . . . 94 G N . 50740 1
545 . 1 . 1 118 118 SER H H 1 8.241 0.006 . 1 . . . . . 95 S HN . 50740 1
546 . 1 . 1 118 118 SER C C 13 175.189 0.001 . 1 . . . . . 95 S C . 50740 1
547 . 1 . 1 118 118 SER CA C 13 58.507 0.05 . 1 . . . . . 95 S CA . 50740 1
548 . 1 . 1 118 118 SER CB C 13 63.844 0.05 . 1 . . . . . 95 S CB . 50740 1
549 . 1 . 1 118 118 SER N N 15 115.657 0.05 . 1 . . . . . 95 S N . 50740 1
550 . 1 . 1 119 119 GLY H H 1 8.480 0.006 . 1 . . . . . 96 G HN . 50740 1
551 . 1 . 1 119 119 GLY C C 13 174.061 0.001 . 1 . . . . . 96 G C . 50740 1
552 . 1 . 1 119 119 GLY CA C 13 45.315 0.05 . 1 . . . . . 96 G CA . 50740 1
553 . 1 . 1 119 119 GLY N N 15 110.866 0.05 . 1 . . . . . 96 G N . 50740 1
554 . 1 . 1 120 120 ARG H H 1 8.115 0.006 . 1 . . . . . 97 R HN . 50740 1
555 . 1 . 1 120 120 ARG C C 13 176.220 0.001 . 1 . . . . . 97 R C . 50740 1
556 . 1 . 1 120 120 ARG CA C 13 55.979 0.05 . 1 . . . . . 97 R CA . 50740 1
557 . 1 . 1 120 120 ARG CB C 13 30.623 0.05 . 1 . . . . . 97 R CB . 50740 1
558 . 1 . 1 120 120 ARG N N 15 120.474 0.05 . 1 . . . . . 97 R N . 50740 1
559 . 1 . 1 121 121 GLN H H 1 8.447 0.006 . 1 . . . . . 98 Q HN . 50740 1
560 . 1 . 1 121 121 GLN C C 13 175.807 0.001 . 1 . . . . . 98 Q C . 50740 1
561 . 1 . 1 121 121 GLN CA C 13 55.818 0.05 . 1 . . . . . 98 Q CA . 50740 1
562 . 1 . 1 121 121 GLN CB C 13 29.306 0.05 . 1 . . . . . 98 Q CB . 50740 1
563 . 1 . 1 121 121 GLN CD C 13 180.401 0.001 . 1 . . . . . 98 Q CD . 50740 1
564 . 1 . 1 121 121 GLN N N 15 121.859 0.05 . 1 . . . . . 98 Q N . 50740 1
565 . 1 . 1 121 121 GLN NE2 N 15 112.267 0.05 . 1 . . . . . 98 Q NE2 . 50740 1
566 . 1 . 1 122 122 GLU H H 1 8.445 0.006 . 1 . . . . . 99 E HN . 50740 1
567 . 1 . 1 122 122 GLU C C 13 176.351 0.001 . 1 . . . . . 99 E C . 50740 1
568 . 1 . 1 122 122 GLU CA C 13 56.496 0.05 . 1 . . . . . 99 E CA . 50740 1
569 . 1 . 1 122 122 GLU CB C 13 30.333 0.05 . 1 . . . . . 99 E CB . 50740 1
570 . 1 . 1 122 122 GLU N N 15 122.698 0.05 . 1 . . . . . 99 E N . 50740 1
571 . 1 . 1 123 123 LYS H H 1 8.407 0.006 . 1 . . . . . 100 K HN . 50740 1
572 . 1 . 1 123 123 LYS C C 13 176.616 0.001 . 1 . . . . . 100 K C . 50740 1
573 . 1 . 1 123 123 LYS CA C 13 56.158 0.05 . 1 . . . . . 100 K CA . 50740 1
574 . 1 . 1 123 123 LYS CB C 13 32.825 0.05 . 1 . . . . . 100 K CB . 50740 1
575 . 1 . 1 123 123 LYS N N 15 122.395 0.05 . 1 . . . . . 100 K N . 50740 1
576 . 1 . 1 124 124 THR H H 1 8.128 0.006 . 1 . . . . . 101 T HN . 50740 1
577 . 1 . 1 124 124 THR C C 13 175.016 0.001 . 1 . . . . . 101 T C . 50740 1
578 . 1 . 1 124 124 THR CA C 13 61.795 0.05 . 1 . . . . . 101 T CA . 50740 1
579 . 1 . 1 124 124 THR CB C 13 69.961 0.05 . 1 . . . . . 101 T CB . 50740 1
580 . 1 . 1 124 124 THR N N 15 114.895 0.05 . 1 . . . . . 101 T N . 50740 1
581 . 1 . 1 125 125 GLY H H 1 8.380 0.006 . 1 . . . . . 102 G HN . 50740 1
582 . 1 . 1 125 125 GLY C C 13 174.013 0.001 . 1 . . . . . 102 G C . 50740 1
583 . 1 . 1 125 125 GLY CA C 13 45.268 0.05 . 1 . . . . . 102 G CA . 50740 1
584 . 1 . 1 125 125 GLY N N 15 110.728 0.05 . 1 . . . . . 102 G N . 50740 1
585 . 1 . 1 126 126 ASN H H 1 8.324 0.006 . 1 . . . . . 103 N HN . 50740 1
586 . 1 . 1 126 126 ASN C C 13 175.066 0.001 . 1 . . . . . 103 N C . 50740 1
587 . 1 . 1 126 126 ASN CA C 13 53.226 0.05 . 1 . . . . . 103 N CA . 50740 1
588 . 1 . 1 126 126 ASN CB C 13 38.990 0.05 . 1 . . . . . 103 N CB . 50740 1
589 . 1 . 1 126 126 ASN N N 15 118.675 0.05 . 1 . . . . . 103 N N . 50740 1
590 . 1 . 1 127 127 GLN H H 1 8.349 0.006 . 1 . . . . . 104 Q HN . 50740 1
591 . 1 . 1 127 127 GLN HE21 H 1 7.514 0.006 . 1 . . . . . 104 Q HE21 . 50740 1
592 . 1 . 1 127 127 GLN HE22 H 1 6.800 0.006 . 1 . . . . . 104 Q HE22 . 50740 1
593 . 1 . 1 127 127 GLN C C 13 175.288 0.001 . 1 . . . . . 104 Q C . 50740 1
594 . 1 . 1 127 127 GLN CA C 13 56.077 0.05 . 1 . . . . . 104 Q CA . 50740 1
595 . 1 . 1 127 127 GLN CB C 13 29.441 0.05 . 1 . . . . . 104 Q CB . 50740 1
596 . 1 . 1 127 127 GLN CD C 13 180.433 0.001 . 1 . . . . . 104 Q CD . 50740 1
597 . 1 . 1 127 127 GLN N N 15 120.924 0.05 . 1 . . . . . 104 Q N . 50740 1
598 . 1 . 1 127 127 GLN NE2 N 15 112.151 0.05 . 1 . . . . . 104 Q NE2 . 50740 1
599 . 1 . 1 128 128 THR H H 1 7.806 0.006 . 1 . . . . . 105 T HN . 50740 1
600 . 1 . 1 128 128 THR CA C 13 63.339 0.05 . 1 . . . . . 105 T CA . 50740 1
601 . 1 . 1 128 128 THR CB C 13 70.663 0.05 . 1 . . . . . 105 T CB . 50740 1
602 . 1 . 1 128 128 THR N N 15 120.559 0.05 . 1 . . . . . 105 T N . 50740 1
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