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 53386
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'extRRM2 W123A'
_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 HSQC' . . . 53386 1
2 '3D HNCACB' . . . 53386 1
3 '3D HNCO' . . . 53386 1
4 '3D HN(CA)CO' . . . 53386 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 . . 53386 1
2 $software_2 . . 53386 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 GLY H H 1 8.387 0.002 . 1 . . . . . 88 GLY H . 53386 1
2 . 1 . 1 3 3 GLY C C 13 174.904 0.000 . 1 . . . . . 88 GLY C . 53386 1
3 . 1 . 1 3 3 GLY CA C 13 45.098 0.000 . 1 . . . . . 88 GLY CA . 53386 1
4 . 1 . 1 3 3 GLY N N 15 109.435 0.024 . 1 . . . . . 88 GLY N . 53386 1
5 . 1 . 1 4 4 GLY H H 1 8.314 0.001 . 1 . . . . . 89 GLY H . 53386 1
6 . 1 . 1 4 4 GLY C C 13 174.771 0.004 . 1 . . . . . 89 GLY C . 53386 1
7 . 1 . 1 4 4 GLY CA C 13 45.069 0.000 . 1 . . . . . 89 GLY CA . 53386 1
8 . 1 . 1 4 4 GLY N N 15 109.165 0.035 . 1 . . . . . 89 GLY N . 53386 1
9 . 1 . 1 5 5 GLY H H 1 8.232 0.002 . 1 . . . . . 90 GLY H . 53386 1
10 . 1 . 1 5 5 GLY C C 13 174.177 0.013 . 1 . . . . . 90 GLY C . 53386 1
11 . 1 . 1 5 5 GLY CA C 13 44.998 0.000 . 1 . . . . . 90 GLY CA . 53386 1
12 . 1 . 1 5 5 GLY N N 15 109.049 0.031 . 1 . . . . . 90 GLY N . 53386 1
13 . 1 . 1 6 6 TYR H H 1 8.084 0.014 . 1 . . . . . 91 TYR H . 53386 1
14 . 1 . 1 6 6 TYR C C 13 176.207 0.000 . 1 . . . . . 91 TYR C . 53386 1
15 . 1 . 1 6 6 TYR CA C 13 58.13 0.000 . 1 . . . . . 91 TYR CA . 53386 1
16 . 1 . 1 6 6 TYR CB C 13 38.722 0.032 . 1 . . . . . 91 TYR CB . 53386 1
17 . 1 . 1 6 6 TYR N N 15 120.692 0.081 . 1 . . . . . 91 TYR N . 53386 1
18 . 1 . 1 7 7 SER H H 1 8.172 0.001 . 1 . . . . . 92 SER H . 53386 1
19 . 1 . 1 7 7 SER C C 13 177.647 0.000 . 1 . . . . . 92 SER C . 53386 1
20 . 1 . 1 7 7 SER CA C 13 58.035 0.000 . 1 . . . . . 92 SER CA . 53386 1
21 . 1 . 1 7 7 SER CB C 13 63.734 0.000 . 1 . . . . . 92 SER CB . 53386 1
22 . 1 . 1 7 7 SER N N 15 117.758 0.011 . 1 . . . . . 92 SER N . 53386 1
23 . 1 . 1 8 8 SER H H 1 8.139 0.002 . 1 . . . . . 93 SER H . 53386 1
24 . 1 . 1 8 8 SER C C 13 174.577 0.000 . 1 . . . . . 93 SER C . 53386 1
25 . 1 . 1 8 8 SER CA C 13 58.302 0.006 . 1 . . . . . 93 SER CA . 53386 1
26 . 1 . 1 8 8 SER CB C 13 63.677 0.013 . 1 . . . . . 93 SER CB . 53386 1
27 . 1 . 1 8 8 SER N N 15 117.653 0.005 . 1 . . . . . 93 SER N . 53386 1
28 . 1 . 1 9 9 ARG H H 1 8.159 0.003 . 1 . . . . . 94 ARG H . 53386 1
29 . 1 . 1 9 9 ARG C C 13 176.317 0.010 . 1 . . . . . 94 ARG C . 53386 1
30 . 1 . 1 9 9 ARG CA C 13 56.213 0.014 . 1 . . . . . 94 ARG CA . 53386 1
31 . 1 . 1 9 9 ARG CB C 13 30.544 0.001 . 1 . . . . . 94 ARG CB . 53386 1
32 . 1 . 1 9 9 ARG N N 15 122.839 0.052 . 1 . . . . . 94 ARG N . 53386 1
33 . 1 . 1 10 10 ARG H H 1 8.276 0.002 . 1 . . . . . 95 ARG H . 53386 1
34 . 1 . 1 10 10 ARG C C 13 176.621 0.009 . 1 . . . . . 95 ARG C . 53386 1
35 . 1 . 1 10 10 ARG CA C 13 56.177 0.025 . 1 . . . . . 95 ARG CA . 53386 1
36 . 1 . 1 10 10 ARG CB C 13 30.651 0.033 . 1 . . . . . 95 ARG CB . 53386 1
37 . 1 . 1 10 10 ARG N N 15 122.455 0.048 . 1 . . . . . 95 ARG N . 53386 1
38 . 1 . 1 11 11 THR H H 1 8.139 0.004 . 1 . . . . . 96 THR H . 53386 1
39 . 1 . 1 11 11 THR C C 13 174.612 0.013 . 1 . . . . . 96 THR C . 53386 1
40 . 1 . 1 11 11 THR CA C 13 61.699 0.069 . 1 . . . . . 96 THR CA . 53386 1
41 . 1 . 1 11 11 THR CB C 13 69.698 0.032 . 1 . . . . . 96 THR CB . 53386 1
42 . 1 . 1 11 11 THR N N 15 115.245 0.037 . 1 . . . . . 96 THR N . 53386 1
43 . 1 . 1 12 12 SER H H 1 8.289 0.002 . 1 . . . . . 97 SER H . 53386 1
44 . 1 . 1 12 12 SER C C 13 176.648 0.000 . 1 . . . . . 97 SER C . 53386 1
45 . 1 . 1 12 12 SER CA C 13 58.24 0.038 . 1 . . . . . 97 SER CA . 53386 1
46 . 1 . 1 12 12 SER CB C 13 63.9 0.056 . 1 . . . . . 97 SER CB . 53386 1
47 . 1 . 1 12 12 SER N N 15 118.171 0.063 . 1 . . . . . 97 SER N . 53386 1
48 . 1 . 1 13 13 GLY H H 1 8.424 0.007 . 1 . . . . . 98 GLY H . 53386 1
49 . 1 . 1 13 13 GLY C C 13 174.28 0.011 . 1 . . . . . 98 GLY C . 53386 1
50 . 1 . 1 13 13 GLY CA C 13 45.257 0.010 . 1 . . . . . 98 GLY CA . 53386 1
51 . 1 . 1 13 13 GLY N N 15 111.162 0.072 . 1 . . . . . 98 GLY N . 53386 1
52 . 1 . 1 14 14 ARG H H 1 8.12 0.017 . 1 . . . . . 99 ARG H . 53386 1
53 . 1 . 1 14 14 ARG C C 13 176.223 0.013 . 1 . . . . . 99 ARG C . 53386 1
54 . 1 . 1 14 14 ARG CA C 13 56.147 0.020 . 1 . . . . . 99 ARG CA . 53386 1
55 . 1 . 1 14 14 ARG CB C 13 30.634 0.004 . 1 . . . . . 99 ARG CB . 53386 1
56 . 1 . 1 14 14 ARG N N 15 120.616 0.067 . 1 . . . . . 99 ARG N . 53386 1
57 . 1 . 1 15 15 ASP H H 1 8.267 0.013 . 1 . . . . . 100 ASP H . 53386 1
58 . 1 . 1 15 15 ASP C C 13 176.266 0.010 . 1 . . . . . 100 ASP C . 53386 1
59 . 1 . 1 15 15 ASP CA C 13 54.309 0.008 . 1 . . . . . 100 ASP CA . 53386 1
60 . 1 . 1 15 15 ASP CB C 13 41.04 0.010 . 1 . . . . . 100 ASP CB . 53386 1
61 . 1 . 1 15 15 ASP N N 15 121.173 0.106 . 1 . . . . . 100 ASP N . 53386 1
62 . 1 . 1 16 16 LYS H H 1 8.024 0.012 . 1 . . . . . 101 LYS H . 53386 1
63 . 1 . 1 16 16 LYS C C 13 176.287 0.004 . 1 . . . . . 101 LYS C . 53386 1
64 . 1 . 1 16 16 LYS CA C 13 56.482 0.024 . 1 . . . . . 101 LYS CA . 53386 1
65 . 1 . 1 16 16 LYS CB C 13 32.729 0.015 . 1 . . . . . 101 LYS CB . 53386 1
66 . 1 . 1 16 16 LYS N N 15 121.343 0.110 . 1 . . . . . 101 LYS N . 53386 1
67 . 1 . 1 17 17 TYR H H 1 8.076 0.018 . 1 . . . . . 102 TYR H . 53386 1
68 . 1 . 1 17 17 TYR C C 13 176.035 0.004 . 1 . . . . . 102 TYR C . 53386 1
69 . 1 . 1 17 17 TYR CA C 13 57.562 0.007 . 1 . . . . . 102 TYR CA . 53386 1
70 . 1 . 1 17 17 TYR CB C 13 38.748 0.015 . 1 . . . . . 102 TYR CB . 53386 1
71 . 1 . 1 17 17 TYR N N 15 120.234 0.067 . 1 . . . . . 102 TYR N . 53386 1
72 . 1 . 1 18 18 GLY H H 1 7.975 0.002 . 1 . . . . . 103 GLY H . 53386 1
73 . 1 . 1 18 18 GLY C C 13 170.94 0.000 . 1 . . . . . 103 GLY C . 53386 1
74 . 1 . 1 18 18 GLY CA C 13 44.283 0.000 . 1 . . . . . 103 GLY CA . 53386 1
75 . 1 . 1 18 18 GLY N N 15 110.426 0.033 . 1 . . . . . 103 GLY N . 53386 1
76 . 1 . 1 22 22 ARG C C 13 176.854 0.000 . 1 . . . . . 107 ARG C . 53386 1
77 . 1 . 1 22 22 ARG CA C 13 52.803 0.000 . 1 . . . . . 107 ARG CA . 53386 1
78 . 1 . 1 22 22 ARG CB C 13 29.312 0.000 . 1 . . . . . 107 ARG CB . 53386 1
79 . 1 . 1 23 23 THR H H 1 8.288 0.003 . 1 . . . . . 108 THR H . 53386 1
80 . 1 . 1 23 23 THR C C 13 172.89 0.002 . 1 . . . . . 108 THR C . 53386 1
81 . 1 . 1 23 23 THR CA C 13 59.891 0.011 . 1 . . . . . 108 THR CA . 53386 1
82 . 1 . 1 23 23 THR CB C 13 71.501 0.007 . 1 . . . . . 108 THR CB . 53386 1
83 . 1 . 1 23 23 THR N N 15 114.433 0.039 . 1 . . . . . 108 THR N . 53386 1
84 . 1 . 1 24 24 GLU H H 1 7.817 0.001 . 1 . . . . . 109 GLU H . 53386 1
85 . 1 . 1 24 24 GLU C C 13 176.328 0.000 . 1 . . . . . 109 GLU C . 53386 1
86 . 1 . 1 24 24 GLU CA C 13 54.746 0.003 . 1 . . . . . 109 GLU CA . 53386 1
87 . 1 . 1 24 24 GLU CB C 13 29.756 0.024 . 1 . . . . . 109 GLU CB . 53386 1
88 . 1 . 1 24 24 GLU N N 15 114.392 0.043 . 1 . . . . . 109 GLU N . 53386 1
89 . 1 . 1 25 25 TYR H H 1 7.963 0.002 . 1 . . . . . 110 TYR H . 53386 1
90 . 1 . 1 25 25 TYR C C 13 174.126 0.008 . 1 . . . . . 110 TYR C . 53386 1
91 . 1 . 1 25 25 TYR CA C 13 56.118 0.021 . 1 . . . . . 110 TYR CA . 53386 1
92 . 1 . 1 25 25 TYR CB C 13 35.236 0.007 . 1 . . . . . 110 TYR CB . 53386 1
93 . 1 . 1 25 25 TYR N N 15 124.54 0.057 . 1 . . . . . 110 TYR N . 53386 1
94 . 1 . 1 26 26 ARG H H 1 7.868 0.002 . 1 . . . . . 111 ARG H . 53386 1
95 . 1 . 1 26 26 ARG C C 13 175.253 0.004 . 1 . . . . . 111 ARG C . 53386 1
96 . 1 . 1 26 26 ARG CA C 13 54.631 0.011 . 1 . . . . . 111 ARG CA . 53386 1
97 . 1 . 1 26 26 ARG CB C 13 34.385 0.012 . 1 . . . . . 111 ARG CB . 53386 1
98 . 1 . 1 26 26 ARG N N 15 124.46 0.065 . 1 . . . . . 111 ARG N . 53386 1
99 . 1 . 1 27 27 LEU H H 1 9.475 0.002 . 1 . . . . . 112 LEU H . 53386 1
100 . 1 . 1 27 27 LEU C C 13 175.497 0.000 . 1 . . . . . 112 LEU C . 53386 1
101 . 1 . 1 27 27 LEU CA C 13 52.513 0.014 . 1 . . . . . 112 LEU CA . 53386 1
102 . 1 . 1 27 27 LEU CB C 13 44.607 0.017 . 1 . . . . . 112 LEU CB . 53386 1
103 . 1 . 1 27 27 LEU N N 15 124.505 0.041 . 1 . . . . . 112 LEU N . 53386 1
104 . 1 . 1 28 28 ILE H H 1 9.317 0.002 . 1 . . . . . 113 ILE H . 53386 1
105 . 1 . 1 28 28 ILE C C 13 174.981 0.004 . 1 . . . . . 113 ILE C . 53386 1
106 . 1 . 1 28 28 ILE CA C 13 59.707 0.003 . 1 . . . . . 113 ILE CA . 53386 1
107 . 1 . 1 28 28 ILE CB C 13 38.522 0.000 . 1 . . . . . 113 ILE CB . 53386 1
108 . 1 . 1 28 28 ILE N N 15 123.488 0.070 . 1 . . . . . 113 ILE N . 53386 1
109 . 1 . 1 29 29 VAL H H 1 8.438 0.003 . 1 . . . . . 114 VAL H . 53386 1
110 . 1 . 1 29 29 VAL C C 13 174.585 0.003 . 1 . . . . . 114 VAL C . 53386 1
111 . 1 . 1 29 29 VAL CA C 13 59.477 0.071 . 1 . . . . . 114 VAL CA . 53386 1
112 . 1 . 1 29 29 VAL CB C 13 32.646 0.008 . 1 . . . . . 114 VAL CB . 53386 1
113 . 1 . 1 29 29 VAL N N 15 125.982 0.056 . 1 . . . . . 114 VAL N . 53386 1
114 . 1 . 1 30 30 GLU H H 1 9.262 0.001 . 1 . . . . . 115 GLU H . 53386 1
115 . 1 . 1 30 30 GLU C C 13 176.256 0.001 . 1 . . . . . 115 GLU C . 53386 1
116 . 1 . 1 30 30 GLU CA C 13 54.376 0.009 . 1 . . . . . 115 GLU CA . 53386 1
117 . 1 . 1 30 30 GLU CB C 13 32.594 0.023 . 1 . . . . . 115 GLU CB . 53386 1
118 . 1 . 1 30 30 GLU N N 15 124.501 0.045 . 1 . . . . . 115 GLU N . 53386 1
119 . 1 . 1 31 31 ASN H H 1 8.911 0.001 . 1 . . . . . 116 ASN H . 53386 1
120 . 1 . 1 31 31 ASN C C 13 173.142 0.000 . 1 . . . . . 116 ASN C . 53386 1
121 . 1 . 1 31 31 ASN CA C 13 52.934 0.001 . 1 . . . . . 116 ASN CA . 53386 1
122 . 1 . 1 31 31 ASN CB C 13 37.838 0.004 . 1 . . . . . 116 ASN CB . 53386 1
123 . 1 . 1 31 31 ASN N N 15 118.586 0.036 . 1 . . . . . 116 ASN N . 53386 1
124 . 1 . 1 32 32 LEU H H 1 7.734 0.002 . 1 . . . . . 117 LEU H . 53386 1
125 . 1 . 1 32 32 LEU C C 13 176.398 0.019 . 1 . . . . . 117 LEU C . 53386 1
126 . 1 . 1 32 32 LEU CA C 13 52.443 0.039 . 1 . . . . . 117 LEU CA . 53386 1
127 . 1 . 1 32 32 LEU CB C 13 43.904 0.021 . 1 . . . . . 117 LEU CB . 53386 1
128 . 1 . 1 32 32 LEU N N 15 117.477 0.039 . 1 . . . . . 117 LEU N . 53386 1
129 . 1 . 1 33 33 SER H H 1 9.271 0.004 . 1 . . . . . 118 SER H . 53386 1
130 . 1 . 1 33 33 SER C C 13 176.709 0.002 . 1 . . . . . 118 SER C . 53386 1
131 . 1 . 1 33 33 SER CA C 13 58.203 0.005 . 1 . . . . . 118 SER CA . 53386 1
132 . 1 . 1 33 33 SER CB C 13 64.108 0.011 . 1 . . . . . 118 SER CB . 53386 1
133 . 1 . 1 33 33 SER N N 15 122.196 0.053 . 1 . . . . . 118 SER N . 53386 1
134 . 1 . 1 34 34 SER H H 1 9.664 0.009 . 1 . . . . . 119 SER H . 53386 1
135 . 1 . 1 34 34 SER C C 13 174.603 0.000 . 1 . . . . . 119 SER C . 53386 1
136 . 1 . 1 34 34 SER CA C 13 61.217 0.005 . 1 . . . . . 119 SER CA . 53386 1
137 . 1 . 1 34 34 SER CB C 13 62.303 0.008 . 1 . . . . . 119 SER CB . 53386 1
138 . 1 . 1 34 34 SER N N 15 126.67 0.039 . 1 . . . . . 119 SER N . 53386 1
139 . 1 . 1 35 35 ARG H H 1 7.833 0.002 . 1 . . . . . 120 ARG H . 53386 1
140 . 1 . 1 35 35 ARG C C 13 175.284 0.002 . 1 . . . . . 120 ARG C . 53386 1
141 . 1 . 1 35 35 ARG CA C 13 56.071 0.003 . 1 . . . . . 120 ARG CA . 53386 1
142 . 1 . 1 35 35 ARG CB C 13 30.196 0.023 . 1 . . . . . 120 ARG CB . 53386 1
143 . 1 . 1 35 35 ARG N N 15 119.632 0.034 . 1 . . . . . 120 ARG N . 53386 1
144 . 1 . 1 36 36 CYS H H 1 7.594 0.018 . 1 . . . . . 121 CYS H . 53386 1
145 . 1 . 1 36 36 CYS C C 13 173.272 0.000 . 1 . . . . . 121 CYS C . 53386 1
146 . 1 . 1 36 36 CYS CA C 13 58.16 0.095 . 1 . . . . . 121 CYS CA . 53386 1
147 . 1 . 1 36 36 CYS CB C 13 27.209 0.012 . 1 . . . . . 121 CYS CB . 53386 1
148 . 1 . 1 36 36 CYS N N 15 121.155 0.204 . 1 . . . . . 121 CYS N . 53386 1
149 . 1 . 1 37 37 SER H H 1 8.996 0.002 . 1 . . . . . 122 SER H . 53386 1
150 . 1 . 1 37 37 SER C C 13 174.789 0.037 . 1 . . . . . 122 SER C . 53386 1
151 . 1 . 1 37 37 SER CA C 13 56.884 0.014 . 1 . . . . . 122 SER CA . 53386 1
152 . 1 . 1 37 37 SER CB C 13 66.139 0.001 . 1 . . . . . 122 SER CB . 53386 1
153 . 1 . 1 37 37 SER N N 15 124.546 0.063 . 1 . . . . . 122 SER N . 53386 1
154 . 1 . 1 38 38 ALA H H 1 8.925 0.002 . 1 . . . . . 123 ALA H . 53386 1
155 . 1 . 1 38 38 ALA C C 13 178.827 0.002 . 1 . . . . . 123 ALA C . 53386 1
156 . 1 . 1 38 38 ALA CA C 13 55.851 0.020 . 1 . . . . . 123 ALA CA . 53386 1
157 . 1 . 1 38 38 ALA CB C 13 18.224 0.003 . 1 . . . . . 123 ALA CB . 53386 1
158 . 1 . 1 38 38 ALA N N 15 122 0.059 . 1 . . . . . 123 ALA N . 53386 1
159 . 1 . 1 39 39 GLN H H 1 8.073 0.012 . 1 . . . . . 124 GLN H . 53386 1
160 . 1 . 1 39 39 GLN C C 13 177.65 0.000 . 1 . . . . . 124 GLN C . 53386 1
161 . 1 . 1 39 39 GLN CA C 13 58.337 0.024 . 1 . . . . . 124 GLN CA . 53386 1
162 . 1 . 1 39 39 GLN CB C 13 28.197 0.016 . 1 . . . . . 124 GLN CB . 53386 1
163 . 1 . 1 39 39 GLN N N 15 116.8 0.110 . 1 . . . . . 124 GLN N . 53386 1
164 . 1 . 1 40 40 ASP H H 1 7.634 0.016 . 1 . . . . . 125 ASP H . 53386 1
165 . 1 . 1 40 40 ASP C C 13 179.277 0.000 . 1 . . . . . 125 ASP C . 53386 1
166 . 1 . 1 40 40 ASP CA C 13 56.987 0.000 . 1 . . . . . 125 ASP CA . 53386 1
167 . 1 . 1 40 40 ASP CB C 13 41.197 0.000 . 1 . . . . . 125 ASP CB . 53386 1
168 . 1 . 1 40 40 ASP N N 15 120.6 0.045 . 1 . . . . . 125 ASP N . 53386 1
169 . 1 . 1 42 42 LYS C C 13 179.282 0.000 . 1 . . . . . 127 LYS C . 53386 1
170 . 1 . 1 43 43 ASP H H 1 8.258 0.012 . 1 . . . . . 128 ASP H . 53386 1
171 . 1 . 1 43 43 ASP C C 13 177.862 0.004 . 1 . . . . . 128 ASP C . 53386 1
172 . 1 . 1 43 43 ASP CA C 13 57.473 0.047 . 1 . . . . . 128 ASP CA . 53386 1
173 . 1 . 1 43 43 ASP CB C 13 41.799 0.040 . 1 . . . . . 128 ASP CB . 53386 1
174 . 1 . 1 43 43 ASP N N 15 122.172 0.184 . 1 . . . . . 128 ASP N . 53386 1
175 . 1 . 1 44 44 PHE H H 1 8.048 0.002 . 1 . . . . . 129 PHE H . 53386 1
176 . 1 . 1 44 44 PHE C C 13 178.045 0.019 . 1 . . . . . 129 PHE C . 53386 1
177 . 1 . 1 44 44 PHE CA C 13 60.856 0.064 . 1 . . . . . 129 PHE CA . 53386 1
178 . 1 . 1 44 44 PHE CB C 13 39.67 0.051 . 1 . . . . . 129 PHE CB . 53386 1
179 . 1 . 1 44 44 PHE N N 15 120.432 0.039 . 1 . . . . . 129 PHE N . 53386 1
180 . 1 . 1 45 45 MET H H 1 8.311 0.001 . 1 . . . . . 130 MET H . 53386 1
181 . 1 . 1 45 45 MET C C 13 177.6 0.001 . 1 . . . . . 130 MET C . 53386 1
182 . 1 . 1 45 45 MET CA C 13 56.224 0.013 . 1 . . . . . 130 MET CA . 53386 1
183 . 1 . 1 45 45 MET CB C 13 32.007 0.037 . 1 . . . . . 130 MET CB . 53386 1
184 . 1 . 1 45 45 MET N N 15 117.059 0.046 . 1 . . . . . 130 MET N . 53386 1
185 . 1 . 1 46 46 ARG H H 1 7.911 0.001 . 1 . . . . . 131 ARG H . 53386 1
186 . 1 . 1 46 46 ARG C C 13 177.528 0.008 . 1 . . . . . 131 ARG C . 53386 1
187 . 1 . 1 46 46 ARG CA C 13 57.452 0.004 . 1 . . . . . 131 ARG CA . 53386 1
188 . 1 . 1 46 46 ARG CB C 13 29.742 0.006 . 1 . . . . . 131 ARG CB . 53386 1
189 . 1 . 1 46 46 ARG N N 15 119.734 0.039 . 1 . . . . . 131 ARG N . 53386 1
190 . 1 . 1 47 47 GLN H H 1 7.256 0.002 . 1 . . . . . 132 GLN H . 53386 1
191 . 1 . 1 47 47 GLN C C 13 176.439 0.001 . 1 . . . . . 132 GLN C . 53386 1
192 . 1 . 1 47 47 GLN CA C 13 57.748 0.023 . 1 . . . . . 132 GLN CA . 53386 1
193 . 1 . 1 47 47 GLN CB C 13 29.908 0.013 . 1 . . . . . 132 GLN CB . 53386 1
194 . 1 . 1 47 47 GLN N N 15 116.188 0.036 . 1 . . . . . 132 GLN N . 53386 1
195 . 1 . 1 48 48 ALA H H 1 7.978 0.002 . 1 . . . . . 133 ALA H . 53386 1
196 . 1 . 1 48 48 ALA C C 13 175.484 0.005 . 1 . . . . . 133 ALA C . 53386 1
197 . 1 . 1 48 48 ALA CA C 13 52.068 0.033 . 1 . . . . . 133 ALA CA . 53386 1
198 . 1 . 1 48 48 ALA CB C 13 20.266 0.016 . 1 . . . . . 133 ALA CB . 53386 1
199 . 1 . 1 48 48 ALA N N 15 120.484 0.046 . 1 . . . . . 133 ALA N . 53386 1
200 . 1 . 1 49 49 GLY H H 1 7.344 0.001 . 1 . . . . . 134 GLY H . 53386 1
201 . 1 . 1 49 49 GLY C C 13 171.023 0.002 . 1 . . . . . 134 GLY C . 53386 1
202 . 1 . 1 49 49 GLY CA C 13 44.768 0.005 . 1 . . . . . 134 GLY CA . 53386 1
203 . 1 . 1 49 49 GLY N N 15 103.612 0.028 . 1 . . . . . 134 GLY N . 53386 1
204 . 1 . 1 50 50 GLU H H 1 8.192 0.001 . 1 . . . . . 135 GLU H . 53386 1
205 . 1 . 1 50 50 GLU C C 13 175.387 0.001 . 1 . . . . . 135 GLU C . 53386 1
206 . 1 . 1 50 50 GLU CA C 13 56.573 0.015 . 1 . . . . . 135 GLU CA . 53386 1
207 . 1 . 1 50 50 GLU CB C 13 29.692 0.012 . 1 . . . . . 135 GLU CB . 53386 1
208 . 1 . 1 50 50 GLU N N 15 119.411 0.046 . 1 . . . . . 135 GLU N . 53386 1
209 . 1 . 1 51 51 VAL H H 1 7.935 0.002 . 1 . . . . . 136 VAL H . 53386 1
210 . 1 . 1 51 51 VAL C C 13 176.698 0.005 . 1 . . . . . 136 VAL C . 53386 1
211 . 1 . 1 51 51 VAL CA C 13 61.386 0.000 . 1 . . . . . 136 VAL CA . 53386 1
212 . 1 . 1 51 51 VAL CB C 13 33.31 0.034 . 1 . . . . . 136 VAL CB . 53386 1
213 . 1 . 1 51 51 VAL N N 15 129.382 0.070 . 1 . . . . . 136 VAL N . 53386 1
214 . 1 . 1 52 52 THR H H 1 8.953 0.002 . 1 . . . . . 137 THR H . 53386 1
215 . 1 . 1 52 52 THR C C 13 175.139 0.033 . 1 . . . . . 137 THR C . 53386 1
216 . 1 . 1 52 52 THR CA C 13 62.203 0.042 . 1 . . . . . 137 THR CA . 53386 1
217 . 1 . 1 52 52 THR CB C 13 67.904 0.046 . 1 . . . . . 137 THR CB . 53386 1
218 . 1 . 1 52 52 THR N N 15 119.794 0.047 . 1 . . . . . 137 THR N . 53386 1
219 . 1 . 1 53 53 TYR H H 1 7.362 0.003 . 1 . . . . . 138 TYR H . 53386 1
220 . 1 . 1 53 53 TYR C C 13 172.159 0.000 . 1 . . . . . 138 TYR C . 53386 1
221 . 1 . 1 53 53 TYR CA C 13 58.09 0.016 . 1 . . . . . 138 TYR CA . 53386 1
222 . 1 . 1 53 53 TYR CB C 13 41.898 0.005 . 1 . . . . . 138 TYR CB . 53386 1
223 . 1 . 1 53 53 TYR N N 15 123.337 0.060 . 1 . . . . . 138 TYR N . 53386 1
224 . 1 . 1 54 54 ALA H H 1 7.083 0.002 . 1 . . . . . 139 ALA H . 53386 1
225 . 1 . 1 54 54 ALA C C 13 174.407 0.002 . 1 . . . . . 139 ALA C . 53386 1
226 . 1 . 1 54 54 ALA CA C 13 50.629 0.032 . 1 . . . . . 139 ALA CA . 53386 1
227 . 1 . 1 54 54 ALA CB C 13 23.415 0.011 . 1 . . . . . 139 ALA CB . 53386 1
228 . 1 . 1 54 54 ALA N N 15 126.841 0.055 . 1 . . . . . 139 ALA N . 53386 1
229 . 1 . 1 55 55 ASP H H 1 8.645 0.001 . 1 . . . . . 140 ASP H . 53386 1
230 . 1 . 1 55 55 ASP C C 13 173.347 0.010 . 1 . . . . . 140 ASP C . 53386 1
231 . 1 . 1 55 55 ASP CA C 13 52.807 0.000 . 1 . . . . . 140 ASP CA . 53386 1
232 . 1 . 1 55 55 ASP CB C 13 44.559 0.000 . 1 . . . . . 140 ASP CB . 53386 1
233 . 1 . 1 55 55 ASP N N 15 118.891 0.047 . 1 . . . . . 140 ASP N . 53386 1
234 . 1 . 1 56 56 ALA H H 1 8.288 0.011 . 1 . . . . . 141 ALA H . 53386 1
235 . 1 . 1 56 56 ALA C C 13 176.124 0.001 . 1 . . . . . 141 ALA C . 53386 1
236 . 1 . 1 56 56 ALA CA C 13 52.461 0.004 . 1 . . . . . 141 ALA CA . 53386 1
237 . 1 . 1 56 56 ALA CB C 13 21.742 0.004 . 1 . . . . . 141 ALA CB . 53386 1
238 . 1 . 1 56 56 ALA N N 15 120.516 0.045 . 1 . . . . . 141 ALA N . 53386 1
239 . 1 . 1 57 57 HIS H H 1 8.426 0.016 . 1 . . . . . 142 HIS H . 53386 1
240 . 1 . 1 57 57 HIS C C 13 175.303 0.003 . 1 . . . . . 142 HIS C . 53386 1
241 . 1 . 1 57 57 HIS CA C 13 57.377 0.010 . 1 . . . . . 142 HIS CA . 53386 1
242 . 1 . 1 57 57 HIS CB C 13 28.623 0.002 . 1 . . . . . 142 HIS CB . 53386 1
243 . 1 . 1 57 57 HIS N N 15 114.154 0.106 . 1 . . . . . 142 HIS N . 53386 1
244 . 1 . 1 58 58 LYS H H 1 8.366 0.003 . 1 . . . . . 143 LYS H . 53386 1
245 . 1 . 1 58 58 LYS C C 13 177.343 0.004 . 1 . . . . . 143 LYS C . 53386 1
246 . 1 . 1 58 58 LYS CA C 13 57.708 0.009 . 1 . . . . . 143 LYS CA . 53386 1
247 . 1 . 1 58 58 LYS CB C 13 32.37 0.027 . 1 . . . . . 143 LYS CB . 53386 1
248 . 1 . 1 58 58 LYS N N 15 121.76 0.044 . 1 . . . . . 143 LYS N . 53386 1
249 . 1 . 1 59 59 GLU H H 1 8.297 0.003 . 1 . . . . . 144 GLU H . 53386 1
250 . 1 . 1 59 59 GLU C C 13 176.706 0.004 . 1 . . . . . 144 GLU C . 53386 1
251 . 1 . 1 59 59 GLU CA C 13 57.885 0.032 . 1 . . . . . 144 GLU CA . 53386 1
252 . 1 . 1 59 59 GLU CB C 13 30.011 0.008 . 1 . . . . . 144 GLU CB . 53386 1
253 . 1 . 1 59 59 GLU N N 15 119.489 0.043 . 1 . . . . . 144 GLU N . 53386 1
254 . 1 . 1 60 60 ARG H H 1 8.055 0.001 . 1 . . . . . 145 ARG H . 53386 1
255 . 1 . 1 60 60 ARG C C 13 175.465 0.000 . 1 . . . . . 145 ARG C . 53386 1
256 . 1 . 1 60 60 ARG CA C 13 54.737 0.000 . 1 . . . . . 145 ARG CA . 53386 1
257 . 1 . 1 60 60 ARG CB C 13 32.684 0.000 . 1 . . . . . 145 ARG CB . 53386 1
258 . 1 . 1 60 60 ARG N N 15 118.366 0.042 . 1 . . . . . 145 ARG N . 53386 1
259 . 1 . 1 61 61 THR H H 1 8.298 0.014 . 1 . . . . . 146 THR H . 53386 1
260 . 1 . 1 61 61 THR N N 15 118.83 0.063 . 1 . . . . . 146 THR N . 53386 1
261 . 1 . 1 62 62 ASN C C 13 173.409 0.000 . 1 . . . . . 147 ASN C . 53386 1
262 . 1 . 1 62 62 ASN CA C 13 55.964 0.000 . 1 . . . . . 147 ASN CA . 53386 1
263 . 1 . 1 62 62 ASN CB C 13 37.754 0.000 . 1 . . . . . 147 ASN CB . 53386 1
264 . 1 . 1 63 63 GLU H H 1 7.614 0.002 . 1 . . . . . 148 GLU H . 53386 1
265 . 1 . 1 63 63 GLU C C 13 175.445 0.004 . 1 . . . . . 148 GLU C . 53386 1
266 . 1 . 1 63 63 GLU CA C 13 54.342 0.014 . 1 . . . . . 148 GLU CA . 53386 1
267 . 1 . 1 63 63 GLU CB C 13 34.349 0.032 . 1 . . . . . 148 GLU CB . 53386 1
268 . 1 . 1 63 63 GLU N N 15 117.655 0.041 . 1 . . . . . 148 GLU N . 53386 1
269 . 1 . 1 64 64 GLY H H 1 9.196 0.002 . 1 . . . . . 149 GLY H . 53386 1
270 . 1 . 1 64 64 GLY C C 13 171.755 0.002 . 1 . . . . . 149 GLY C . 53386 1
271 . 1 . 1 64 64 GLY CA C 13 44.376 0.003 . 1 . . . . . 149 GLY CA . 53386 1
272 . 1 . 1 64 64 GLY N N 15 112.02 0.033 . 1 . . . . . 149 GLY N . 53386 1
273 . 1 . 1 65 65 VAL H H 1 8.721 0.001 . 1 . . . . . 150 VAL H . 53386 1
274 . 1 . 1 65 65 VAL C C 13 172.947 0.004 . 1 . . . . . 150 VAL C . 53386 1
275 . 1 . 1 65 65 VAL CA C 13 60.651 0.025 . 1 . . . . . 150 VAL CA . 53386 1
276 . 1 . 1 65 65 VAL CB C 13 35.572 0.007 . 1 . . . . . 150 VAL CB . 53386 1
277 . 1 . 1 65 65 VAL N N 15 120.345 0.041 . 1 . . . . . 150 VAL N . 53386 1
278 . 1 . 1 66 66 ILE H H 1 8.833 0.002 . 1 . . . . . 151 ILE H . 53386 1
279 . 1 . 1 66 66 ILE C C 13 173.509 0.001 . 1 . . . . . 151 ILE C . 53386 1
280 . 1 . 1 66 66 ILE CA C 13 58.128 0.043 . 1 . . . . . 151 ILE CA . 53386 1
281 . 1 . 1 66 66 ILE CB C 13 41.939 0.017 . 1 . . . . . 151 ILE CB . 53386 1
282 . 1 . 1 66 66 ILE N N 15 123.002 0.051 . 1 . . . . . 151 ILE N . 53386 1
283 . 1 . 1 67 67 GLU H H 1 8.751 0.001 . 1 . . . . . 152 GLU H . 53386 1
284 . 1 . 1 67 67 GLU C C 13 175.755 0.008 . 1 . . . . . 152 GLU C . 53386 1
285 . 1 . 1 67 67 GLU CA C 13 54.012 0.015 . 1 . . . . . 152 GLU CA . 53386 1
286 . 1 . 1 67 67 GLU CB C 13 32.301 0.042 . 1 . . . . . 152 GLU CB . 53386 1
287 . 1 . 1 67 67 GLU N N 15 124.381 0.050 . 1 . . . . . 152 GLU N . 53386 1
288 . 1 . 1 68 68 PHE H H 1 8.496 0.003 . 1 . . . . . 153 PHE H . 53386 1
289 . 1 . 1 68 68 PHE C C 13 176.364 0.013 . 1 . . . . . 153 PHE C . 53386 1
290 . 1 . 1 68 68 PHE CA C 13 56.363 0.032 . 1 . . . . . 153 PHE CA . 53386 1
291 . 1 . 1 68 68 PHE CB C 13 43.82 0.005 . 1 . . . . . 153 PHE CB . 53386 1
292 . 1 . 1 68 68 PHE N N 15 118.397 0.056 . 1 . . . . . 153 PHE N . 53386 1
293 . 1 . 1 69 69 ARG H H 1 8.485 0.001 . 1 . . . . . 154 ARG H . 53386 1
294 . 1 . 1 69 69 ARG C C 13 175.575 0.000 . 1 . . . . . 154 ARG C . 53386 1
295 . 1 . 1 69 69 ARG CA C 13 58.029 0.043 . 1 . . . . . 154 ARG CA . 53386 1
296 . 1 . 1 69 69 ARG CB C 13 30.71 0.040 . 1 . . . . . 154 ARG CB . 53386 1
297 . 1 . 1 69 69 ARG N N 15 119.188 0.052 . 1 . . . . . 154 ARG N . 53386 1
298 . 1 . 1 70 70 SER H H 1 7.702 0.004 . 1 . . . . . 155 SER H . 53386 1
299 . 1 . 1 70 70 SER C C 13 173.094 0.001 . 1 . . . . . 155 SER C . 53386 1
300 . 1 . 1 70 70 SER CA C 13 55.891 0.015 . 1 . . . . . 155 SER CA . 53386 1
301 . 1 . 1 70 70 SER CB C 13 67.302 0.011 . 1 . . . . . 155 SER CB . 53386 1
302 . 1 . 1 70 70 SER N N 15 109.005 0.031 . 1 . . . . . 155 SER N . 53386 1
303 . 1 . 1 71 71 TYR H H 1 7.995 0.002 . 1 . . . . . 156 TYR H . 53386 1
304 . 1 . 1 71 71 TYR C C 13 176.79 0.001 . 1 . . . . . 156 TYR C . 53386 1
305 . 1 . 1 71 71 TYR CA C 13 61.479 0.005 . 1 . . . . . 156 TYR CA . 53386 1
306 . 1 . 1 71 71 TYR CB C 13 37.94 0.003 . 1 . . . . . 156 TYR CB . 53386 1
307 . 1 . 1 71 71 TYR N N 15 123.6 0.042 . 1 . . . . . 156 TYR N . 53386 1
308 . 1 . 1 72 72 SER H H 1 8.244 0.006 . 1 . . . . . 157 SER H . 53386 1
309 . 1 . 1 72 72 SER C C 13 176.866 0.049 . 1 . . . . . 157 SER C . 53386 1
310 . 1 . 1 72 72 SER CA C 13 61.27 0.014 . 1 . . . . . 157 SER CA . 53386 1
311 . 1 . 1 72 72 SER CB C 13 62.119 0.023 . 1 . . . . . 157 SER CB . 53386 1
312 . 1 . 1 72 72 SER N N 15 112.415 0.053 . 1 . . . . . 157 SER N . 53386 1
313 . 1 . 1 73 73 ASP H H 1 7.207 0.003 . 1 . . . . . 158 ASP H . 53386 1
314 . 1 . 1 73 73 ASP C C 13 175.283 0.006 . 1 . . . . . 158 ASP C . 53386 1
315 . 1 . 1 73 73 ASP CA C 13 56.737 0.023 . 1 . . . . . 158 ASP CA . 53386 1
316 . 1 . 1 73 73 ASP CB C 13 41.437 0.001 . 1 . . . . . 158 ASP CB . 53386 1
317 . 1 . 1 73 73 ASP N N 15 122.923 0.065 . 1 . . . . . 158 ASP N . 53386 1
318 . 1 . 1 74 74 MET H H 1 6.681 0.001 . 1 . . . . . 159 MET H . 53386 1
319 . 1 . 1 74 74 MET C C 13 177.407 0.005 . 1 . . . . . 159 MET C . 53386 1
320 . 1 . 1 74 74 MET CA C 13 58.097 0.032 . 1 . . . . . 159 MET CA . 53386 1
321 . 1 . 1 74 74 MET CB C 13 32.637 0.097 . 1 . . . . . 159 MET CB . 53386 1
322 . 1 . 1 74 74 MET N N 15 119.152 0.044 . 1 . . . . . 159 MET N . 53386 1
323 . 1 . 1 75 75 LYS H H 1 8.144 0.013 . 1 . . . . . 160 LYS H . 53386 1
324 . 1 . 1 75 75 LYS C C 13 177.837 0.002 . 1 . . . . . 160 LYS C . 53386 1
325 . 1 . 1 75 75 LYS CA C 13 57.403 0.005 . 1 . . . . . 160 LYS CA . 53386 1
326 . 1 . 1 75 75 LYS CB C 13 31.55 0.019 . 1 . . . . . 160 LYS CB . 53386 1
327 . 1 . 1 75 75 LYS N N 15 118 0.096 . 1 . . . . . 160 LYS N . 53386 1
328 . 1 . 1 76 76 ARG H H 1 7.512 0.002 . 1 . . . . . 161 ARG H . 53386 1
329 . 1 . 1 76 76 ARG C C 13 178.356 0.008 . 1 . . . . . 161 ARG C . 53386 1
330 . 1 . 1 76 76 ARG CA C 13 59.44 0.011 . 1 . . . . . 161 ARG CA . 53386 1
331 . 1 . 1 76 76 ARG CB C 13 29.531 0.009 . 1 . . . . . 161 ARG CB . 53386 1
332 . 1 . 1 76 76 ARG N N 15 120.308 0.050 . 1 . . . . . 161 ARG N . 53386 1
333 . 1 . 1 77 77 ALA H H 1 7.367 0.002 . 1 . . . . . 162 ALA H . 53386 1
334 . 1 . 1 77 77 ALA C C 13 178.913 0.000 . 1 . . . . . 162 ALA C . 53386 1
335 . 1 . 1 77 77 ALA CA C 13 55.308 0.015 . 1 . . . . . 162 ALA CA . 53386 1
336 . 1 . 1 77 77 ALA CB C 13 18.972 0.014 . 1 . . . . . 162 ALA CB . 53386 1
337 . 1 . 1 77 77 ALA N N 15 121.049 0.045 . 1 . . . . . 162 ALA N . 53386 1
338 . 1 . 1 78 78 LEU H H 1 7.738 0.002 . 1 . . . . . 163 LEU H . 53386 1
339 . 1 . 1 78 78 LEU C C 13 178.432 0.002 . 1 . . . . . 163 LEU C . 53386 1
340 . 1 . 1 78 78 LEU CA C 13 58.182 0.017 . 1 . . . . . 163 LEU CA . 53386 1
341 . 1 . 1 78 78 LEU CB C 13 42.426 0.001 . 1 . . . . . 163 LEU CB . 53386 1
342 . 1 . 1 78 78 LEU N N 15 118.367 0.045 . 1 . . . . . 163 LEU N . 53386 1
343 . 1 . 1 79 79 ASP H H 1 8.112 0.001 . 1 . . . . . 164 ASP H . 53386 1
344 . 1 . 1 79 79 ASP C C 13 178.421 0.004 . 1 . . . . . 164 ASP C . 53386 1
345 . 1 . 1 79 79 ASP CA C 13 56.502 0.032 . 1 . . . . . 164 ASP CA . 53386 1
346 . 1 . 1 79 79 ASP CB C 13 41.318 0.006 . 1 . . . . . 164 ASP CB . 53386 1
347 . 1 . 1 79 79 ASP N N 15 116.52 0.043 . 1 . . . . . 164 ASP N . 53386 1
348 . 1 . 1 80 80 LYS H H 1 8.202 0.002 . 1 . . . . . 165 LYS H . 53386 1
349 . 1 . 1 80 80 LYS C C 13 178.446 0.001 . 1 . . . . . 165 LYS C . 53386 1
350 . 1 . 1 80 80 LYS CA C 13 57.077 0.013 . 1 . . . . . 165 LYS CA . 53386 1
351 . 1 . 1 80 80 LYS CB C 13 33.981 0.002 . 1 . . . . . 165 LYS CB . 53386 1
352 . 1 . 1 80 80 LYS N N 15 114.812 0.037 . 1 . . . . . 165 LYS N . 53386 1
353 . 1 . 1 81 81 LEU H H 1 8.352 0.001 . 1 . . . . . 166 LEU H . 53386 1
354 . 1 . 1 81 81 LEU C C 13 178.617 0.014 . 1 . . . . . 166 LEU C . 53386 1
355 . 1 . 1 81 81 LEU CA C 13 54.13 0.067 . 1 . . . . . 166 LEU CA . 53386 1
356 . 1 . 1 81 81 LEU CB C 13 41.753 0.031 . 1 . . . . . 166 LEU CB . 53386 1
357 . 1 . 1 81 81 LEU N N 15 114.577 0.044 . 1 . . . . . 166 LEU N . 53386 1
358 . 1 . 1 82 82 ASP H H 1 7.091 0.003 . 1 . . . . . 167 ASP H . 53386 1
359 . 1 . 1 82 82 ASP C C 13 177.66 0.004 . 1 . . . . . 167 ASP C . 53386 1
360 . 1 . 1 82 82 ASP CA C 13 56.645 0.019 . 1 . . . . . 167 ASP CA . 53386 1
361 . 1 . 1 82 82 ASP CB C 13 41.367 0.010 . 1 . . . . . 167 ASP CB . 53386 1
362 . 1 . 1 82 82 ASP N N 15 121.643 0.041 . 1 . . . . . 167 ASP N . 53386 1
363 . 1 . 1 83 83 GLY H H 1 7.899 0.002 . 1 . . . . . 168 GLY H . 53386 1
364 . 1 . 1 83 83 GLY C C 13 174.576 0.010 . 1 . . . . . 168 GLY C . 53386 1
365 . 1 . 1 83 83 GLY CA C 13 45.899 0.002 . 1 . . . . . 168 GLY CA . 53386 1
366 . 1 . 1 83 83 GLY N N 15 115.116 0.062 . 1 . . . . . 168 GLY N . 53386 1
367 . 1 . 1 84 84 THR H H 1 7.396 0.001 . 1 . . . . . 169 THR H . 53386 1
368 . 1 . 1 84 84 THR C C 13 172.938 0.001 . 1 . . . . . 169 THR C . 53386 1
369 . 1 . 1 84 84 THR CA C 13 63.766 0.022 . 1 . . . . . 169 THR CA . 53386 1
370 . 1 . 1 84 84 THR CB C 13 69.919 0.023 . 1 . . . . . 169 THR CB . 53386 1
371 . 1 . 1 84 84 THR N N 15 115.681 0.038 . 1 . . . . . 169 THR N . 53386 1
372 . 1 . 1 85 85 GLU H H 1 8.408 0.002 . 1 . . . . . 170 GLU H . 53386 1
373 . 1 . 1 85 85 GLU C C 13 175.76 0.006 . 1 . . . . . 170 GLU C . 53386 1
374 . 1 . 1 85 85 GLU CA C 13 56.365 0.013 . 1 . . . . . 170 GLU CA . 53386 1
375 . 1 . 1 85 85 GLU CB C 13 30.472 0.007 . 1 . . . . . 170 GLU CB . 53386 1
376 . 1 . 1 85 85 GLU N N 15 124.634 0.050 . 1 . . . . . 170 GLU N . 53386 1
377 . 1 . 1 86 86 ILE H H 1 8.365 0.001 . 1 . . . . . 171 ILE H . 53386 1
378 . 1 . 1 86 86 ILE C C 13 176.534 0.005 . 1 . . . . . 171 ILE C . 53386 1
379 . 1 . 1 86 86 ILE CA C 13 61.563 0.016 . 1 . . . . . 171 ILE CA . 53386 1
380 . 1 . 1 86 86 ILE CB C 13 39.258 0.040 . 1 . . . . . 171 ILE CB . 53386 1
381 . 1 . 1 86 86 ILE N N 15 126.13 0.050 . 1 . . . . . 171 ILE N . 53386 1
382 . 1 . 1 87 87 ASN H H 1 9.421 0.003 . 1 . . . . . 172 ASN H . 53386 1
383 . 1 . 1 87 87 ASN C C 13 175.343 0.003 . 1 . . . . . 172 ASN C . 53386 1
384 . 1 . 1 87 87 ASN CA C 13 54.152 0.007 . 1 . . . . . 172 ASN CA . 53386 1
385 . 1 . 1 87 87 ASN CB C 13 37.412 0.003 . 1 . . . . . 172 ASN CB . 53386 1
386 . 1 . 1 87 87 ASN N N 15 127.028 0.048 . 1 . . . . . 172 ASN N . 53386 1
387 . 1 . 1 88 88 GLY H H 1 8.728 0.002 . 1 . . . . . 173 GLY H . 53386 1
388 . 1 . 1 88 88 GLY C C 13 173.626 0.002 . 1 . . . . . 173 GLY C . 53386 1
389 . 1 . 1 88 88 GLY CA C 13 45.408 0.015 . 1 . . . . . 173 GLY CA . 53386 1
390 . 1 . 1 88 88 GLY N N 15 103.435 0.028 . 1 . . . . . 173 GLY N . 53386 1
391 . 1 . 1 89 89 ARG H H 1 7.328 0.002 . 1 . . . . . 174 ARG H . 53386 1
392 . 1 . 1 89 89 ARG C C 13 174.78 0.002 . 1 . . . . . 174 ARG C . 53386 1
393 . 1 . 1 89 89 ARG CA C 13 54.438 0.053 . 1 . . . . . 174 ARG CA . 53386 1
394 . 1 . 1 89 89 ARG CB C 13 33.737 0.023 . 1 . . . . . 174 ARG CB . 53386 1
395 . 1 . 1 89 89 ARG N N 15 119.534 0.047 . 1 . . . . . 174 ARG N . 53386 1
396 . 1 . 1 90 90 ASN H H 1 8.581 0.003 . 1 . . . . . 175 ASN H . 53386 1
397 . 1 . 1 90 90 ASN C C 13 175.082 0.007 . 1 . . . . . 175 ASN C . 53386 1
398 . 1 . 1 90 90 ASN CA C 13 53.346 0.001 . 1 . . . . . 175 ASN CA . 53386 1
399 . 1 . 1 90 90 ASN CB C 13 38.351 0.010 . 1 . . . . . 175 ASN CB . 53386 1
400 . 1 . 1 90 90 ASN N N 15 122.339 0.047 . 1 . . . . . 175 ASN N . 53386 1
401 . 1 . 1 91 91 ILE H H 1 8.425 0.001 . 1 . . . . . 176 ILE H . 53386 1
402 . 1 . 1 91 91 ILE C C 13 175.089 0.005 . 1 . . . . . 176 ILE C . 53386 1
403 . 1 . 1 91 91 ILE CA C 13 61.787 0.021 . 1 . . . . . 176 ILE CA . 53386 1
404 . 1 . 1 91 91 ILE CB C 13 39.568 0.014 . 1 . . . . . 176 ILE CB . 53386 1
405 . 1 . 1 91 91 ILE N N 15 122.476 0.044 . 1 . . . . . 176 ILE N . 53386 1
406 . 1 . 1 92 92 ARG H H 1 7.966 0.002 . 1 . . . . . 177 ARG H . 53386 1
407 . 1 . 1 92 92 ARG C C 13 174.791 0.000 . 1 . . . . . 177 ARG C . 53386 1
408 . 1 . 1 92 92 ARG CA C 13 53.957 0.038 . 1 . . . . . 177 ARG CA . 53386 1
409 . 1 . 1 92 92 ARG CB C 13 33.075 0.009 . 1 . . . . . 177 ARG CB . 53386 1
410 . 1 . 1 92 92 ARG N N 15 121.504 0.049 . 1 . . . . . 177 ARG N . 53386 1
411 . 1 . 1 93 93 LEU H H 1 8.606 0.001 . 1 . . . . . 178 LEU H . 53386 1
412 . 1 . 1 93 93 LEU C C 13 175.586 0.003 . 1 . . . . . 178 LEU C . 53386 1
413 . 1 . 1 93 93 LEU CA C 13 52.645 0.008 . 1 . . . . . 178 LEU CA . 53386 1
414 . 1 . 1 93 93 LEU CB C 13 44.556 0.001 . 1 . . . . . 178 LEU CB . 53386 1
415 . 1 . 1 93 93 LEU N N 15 124.371 0.055 . 1 . . . . . 178 LEU N . 53386 1
416 . 1 . 1 94 94 ILE H H 1 8.916 0.001 . 1 . . . . . 179 ILE H . 53386 1
417 . 1 . 1 94 94 ILE C C 13 175.518 0.003 . 1 . . . . . 179 ILE C . 53386 1
418 . 1 . 1 94 94 ILE CA C 13 59.185 0.002 . 1 . . . . . 179 ILE CA . 53386 1
419 . 1 . 1 94 94 ILE CB C 13 41.691 0.005 . 1 . . . . . 179 ILE CB . 53386 1
420 . 1 . 1 94 94 ILE N N 15 121.998 0.056 . 1 . . . . . 179 ILE N . 53386 1
421 . 1 . 1 95 95 GLU H H 1 8.924 0.002 . 1 . . . . . 180 GLU H . 53386 1
422 . 1 . 1 95 95 GLU C C 13 175.888 0.002 . 1 . . . . . 180 GLU C . 53386 1
423 . 1 . 1 95 95 GLU CA C 13 57.173 0.002 . 1 . . . . . 180 GLU CA . 53386 1
424 . 1 . 1 95 95 GLU CB C 13 30.465 0.020 . 1 . . . . . 180 GLU CB . 53386 1
425 . 1 . 1 95 95 GLU N N 15 127.56 0.061 . 1 . . . . . 180 GLU N . 53386 1
426 . 1 . 1 96 96 ASP H H 1 8.172 0.001 . 1 . . . . . 181 ASP H . 53386 1
427 . 1 . 1 96 96 ASP C C 13 175.347 0.001 . 1 . . . . . 181 ASP C . 53386 1
428 . 1 . 1 96 96 ASP CA C 13 54.017 0.000 . 1 . . . . . 181 ASP CA . 53386 1
429 . 1 . 1 96 96 ASP CB C 13 41.846 0.005 . 1 . . . . . 181 ASP CB . 53386 1
430 . 1 . 1 96 96 ASP N N 15 127.349 0.061 . 1 . . . . . 181 ASP N . 53386 1
431 . 1 . 1 97 97 LYS H H 1 8.049 0.002 . 1 . . . . . 182 LYS H . 53386 1
432 . 1 . 1 97 97 LYS C C 13 174.058 0.000 . 1 . . . . . 182 LYS C . 53386 1
433 . 1 . 1 97 97 LYS CA C 13 54.128 0.000 . 1 . . . . . 182 LYS CA . 53386 1
434 . 1 . 1 97 97 LYS CB C 13 32.646 0.000 . 1 . . . . . 182 LYS CB . 53386 1
435 . 1 . 1 97 97 LYS N N 15 124.403 0.041 . 1 . . . . . 182 LYS N . 53386 1
436 . 1 . 1 98 98 PRO C C 13 177.108 0.000 . 1 . . . . . 183 PRO C . 53386 1
437 . 1 . 1 98 98 PRO CA C 13 63.138 0.000 . 1 . . . . . 183 PRO CA . 53386 1
438 . 1 . 1 98 98 PRO CB C 13 32.078 0.000 . 1 . . . . . 183 PRO CB . 53386 1
439 . 1 . 1 99 99 ARG H H 1 8.579 0.002 . 1 . . . . . 184 ARG H . 53386 1
440 . 1 . 1 99 99 ARG C C 13 176.721 0.005 . 1 . . . . . 184 ARG C . 53386 1
441 . 1 . 1 99 99 ARG CA C 13 56.103 0.000 . 1 . . . . . 184 ARG CA . 53386 1
442 . 1 . 1 99 99 ARG CB C 13 30.66 0.011 . 1 . . . . . 184 ARG CB . 53386 1
443 . 1 . 1 99 99 ARG N N 15 122.204 0.043 . 1 . . . . . 184 ARG N . 53386 1
444 . 1 . 1 100 100 THR H H 1 8.07 0.002 . 1 . . . . . 185 THR H . 53386 1
445 . 1 . 1 100 100 THR C C 13 174.404 0.000 . 1 . . . . . 185 THR C . 53386 1
446 . 1 . 1 100 100 THR CA C 13 61.631 0.041 . 1 . . . . . 185 THR CA . 53386 1
447 . 1 . 1 100 100 THR CB C 13 69.71 0.014 . 1 . . . . . 185 THR CB . 53386 1
448 . 1 . 1 100 100 THR N N 15 114.611 0.035 . 1 . . . . . 185 THR N . 53386 1
449 . 1 . 1 101 101 SER H H 1 8.182 0.024 . 1 . . . . . 186 SER H . 53386 1
450 . 1 . 1 101 101 SER CA C 13 58.083 0.000 . 1 . . . . . 186 SER CA . 53386 1
451 . 1 . 1 101 101 SER CB C 13 63.849 0.092 . 1 . . . . . 186 SER CB . 53386 1
452 . 1 . 1 101 101 SER N N 15 118.045 0.183 . 1 . . . . . 186 SER N . 53386 1
453 . 1 . 1 102 102 HIS H H 1 8.291 0.015 . 1 . . . . . 187 HIS H . 53386 1
454 . 1 . 1 102 102 HIS C C 13 174.047 0.000 . 1 . . . . . 187 HIS C . 53386 1
455 . 1 . 1 102 102 HIS CA C 13 55.805 0.010 . 1 . . . . . 187 HIS CA . 53386 1
456 . 1 . 1 102 102 HIS CB C 13 30.048 0.031 . 1 . . . . . 187 HIS CB . 53386 1
457 . 1 . 1 102 102 HIS N N 15 121.597 0.107 . 1 . . . . . 187 HIS N . 53386 1
458 . 1 . 1 103 103 ARG H H 1 7.965 0.016 . 1 . . . . . 188 ARG H . 53386 1
459 . 1 . 1 103 103 ARG C C 13 180.989 0.000 . 1 . . . . . 188 ARG C . 53386 1
460 . 1 . 1 103 103 ARG CA C 13 57.45 0.000 . 1 . . . . . 188 ARG CA . 53386 1
461 . 1 . 1 103 103 ARG CB C 13 31.223 0.000 . 1 . . . . . 188 ARG CB . 53386 1
462 . 1 . 1 103 103 ARG N N 15 127.746 0.074 . 1 . . . . . 188 ARG N . 53386 1
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