Content for NMR-STAR saveframe, assigned_chemical_shifts_2
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 52882
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'Assigned Backbone Chemical Shifts of PstA apo with His-Tag'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N TROSY' . . . 52882 2
3 '3D HNCA' . . . 52882 2
4 '3D HNCACB' . . . 52882 2
5 '3D HNCO' . . . 52882 2
6 '3D HN(CA)CO' . . . 52882 2
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 . . 52882 2
2 $software_2 . . 52882 2
3 $software_3 . . 52882 2
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 . 2 . 2 21 21 MET H H 1 8.443 0.003 . 1 . . . . . 1 MET H . 52882 2
2 . 2 . 2 21 21 MET CA C 13 50.612 0.000 . 1 . . . . . 1 MET CA . 52882 2
3 . 2 . 2 21 21 MET CB C 13 30.471 0.068 . 1 . . . . . 1 MET CB . 52882 2
4 . 2 . 2 21 21 MET N N 15 118.970 0.073 . 1 . . . . . 1 MET N . 52882 2
5 . 2 . 2 22 22 LYS H H 1 9.012 0.002 . 1 . . . . . 2 LYS H . 52882 2
6 . 2 . 2 22 22 LYS CB C 13 32.028 0.000 . 1 . . . . . 2 LYS CB . 52882 2
7 . 2 . 2 22 22 LYS N N 15 117.453 0.045 . 1 . . . . . 2 LYS N . 52882 2
8 . 2 . 2 26 26 ALA H H 1 9.172 0.004 . 1 . . . . . 6 ALA H . 52882 2
9 . 2 . 2 26 26 ALA CA C 13 46.325 0.000 . 1 . . . . . 6 ALA CA . 52882 2
10 . 2 . 2 26 26 ALA CB C 13 17.763 0.000 . 1 . . . . . 6 ALA CB . 52882 2
11 . 2 . 2 26 26 ALA N N 15 128.536 0.027 . 1 . . . . . 6 ALA N . 52882 2
12 . 2 . 2 27 27 ILE H H 1 9.405 0.000 . 1 . . . . . 7 ILE H . 52882 2
13 . 2 . 2 27 27 ILE N N 15 125.031 0.000 . 1 . . . . . 7 ILE N . 52882 2
14 . 2 . 2 28 28 VAL H H 1 9.120 0.001 . 1 . . . . . 8 VAL H . 52882 2
15 . 2 . 2 28 28 VAL CA C 13 55.815 0.000 . 1 . . . . . 8 VAL CA . 52882 2
16 . 2 . 2 28 28 VAL CB C 13 31.368 0.000 . 1 . . . . . 8 VAL CB . 52882 2
17 . 2 . 2 28 28 VAL N N 15 121.438 0.042 . 1 . . . . . 8 VAL N . 52882 2
18 . 2 . 2 29 29 GLN H H 1 9.795 0.005 . 1 . . . . . 9 GLN H . 52882 2
19 . 2 . 2 29 29 GLN C C 13 176.809 0.000 . 1 . . . . . 9 GLN C . 52882 2
20 . 2 . 2 29 29 GLN CA C 13 53.093 0.010 . 1 . . . . . 9 GLN CA . 52882 2
21 . 2 . 2 29 29 GLN CB C 13 25.334 0.000 . 1 . . . . . 9 GLN CB . 52882 2
22 . 2 . 2 29 29 GLN N N 15 120.596 0.012 . 1 . . . . . 9 GLN N . 52882 2
23 . 2 . 2 30 30 ASP H H 1 8.781 0.003 . 1 . . . . . 10 ASP H . 52882 2
24 . 2 . 2 30 30 ASP CA C 13 55.124 0.000 . 1 . . . . . 10 ASP CA . 52882 2
25 . 2 . 2 30 30 ASP CB C 13 37.252 0.000 . 1 . . . . . 10 ASP CB . 52882 2
26 . 2 . 2 30 30 ASP N N 15 123.517 0.038 . 1 . . . . . 10 ASP N . 52882 2
27 . 2 . 2 31 31 GLN H H 1 9.164 0.007 . 1 . . . . . 11 GLN H . 52882 2
28 . 2 . 2 31 31 GLN C C 13 173.963 0.000 . 1 . . . . . 11 GLN C . 52882 2
29 . 2 . 2 31 31 GLN CA C 13 55.503 0.000 . 1 . . . . . 11 GLN CA . 52882 2
30 . 2 . 2 31 31 GLN CB C 13 24.684 0.000 . 1 . . . . . 11 GLN CB . 52882 2
31 . 2 . 2 31 31 GLN N N 15 117.021 0.010 . 1 . . . . . 11 GLN N . 52882 2
32 . 2 . 2 32 32 ASP H H 1 7.630 0.006 . 1 . . . . . 12 ASP H . 52882 2
33 . 2 . 2 32 32 ASP C C 13 174.414 0.000 . 1 . . . . . 12 ASP C . 52882 2
34 . 2 . 2 32 32 ASP CA C 13 51.819 0.000 . 1 . . . . . 12 ASP CA . 52882 2
35 . 2 . 2 32 32 ASP CB C 13 39.936 0.000 . 1 . . . . . 12 ASP CB . 52882 2
36 . 2 . 2 32 32 ASP N N 15 117.979 0.038 . 1 . . . . . 12 ASP N . 52882 2
37 . 2 . 2 33 33 SER H H 1 7.822 0.000 . 1 . . . . . 13 SER H . 52882 2
38 . 2 . 2 33 33 SER N N 15 114.894 0.166 . 1 . . . . . 13 SER N . 52882 2
39 . 2 . 2 34 34 GLN C C 13 175.625 0.000 . 1 . . . . . 14 GLN C . 52882 2
40 . 2 . 2 35 35 GLU H H 1 8.428 0.001 . 1 . . . . . 15 GLU H . 52882 2
41 . 2 . 2 35 35 GLU C C 13 177.237 0.000 . 1 . . . . . 15 GLU C . 52882 2
42 . 2 . 2 35 35 GLU CA C 13 55.882 0.000 . 1 . . . . . 15 GLU CA . 52882 2
43 . 2 . 2 35 35 GLU CB C 13 25.216 0.000 . 1 . . . . . 15 GLU CB . 52882 2
44 . 2 . 2 35 35 GLU N N 15 120.308 0.040 . 1 . . . . . 15 GLU N . 52882 2
45 . 2 . 2 36 36 LEU H H 1 8.056 0.007 . 1 . . . . . 16 LEU H . 52882 2
46 . 2 . 2 36 36 LEU C C 13 175.628 0.026 . 1 . . . . . 16 LEU C . 52882 2
47 . 2 . 2 36 36 LEU CA C 13 55.189 0.000 . 1 . . . . . 16 LEU CA . 52882 2
48 . 2 . 2 36 36 LEU CB C 13 35.870 0.047 . 1 . . . . . 16 LEU CB . 52882 2
49 . 2 . 2 36 36 LEU N N 15 117.451 0.008 . 1 . . . . . 16 LEU N . 52882 2
50 . 2 . 2 37 37 ALA H H 1 8.392 0.010 . 1 . . . . . 17 ALA H . 52882 2
51 . 2 . 2 37 37 ALA C C 13 178.589 0.054 . 1 . . . . . 17 ALA C . 52882 2
52 . 2 . 2 37 37 ALA CA C 13 53.141 0.000 . 1 . . . . . 17 ALA CA . 52882 2
53 . 2 . 2 37 37 ALA CB C 13 14.506 0.052 . 1 . . . . . 17 ALA CB . 52882 2
54 . 2 . 2 37 37 ALA N N 15 120.487 0.051 . 1 . . . . . 17 ALA N . 52882 2
55 . 2 . 2 38 38 ASP H H 1 8.305 0.004 . 1 . . . . . 18 ASP H . 52882 2
56 . 2 . 2 38 38 ASP C C 13 177.252 0.000 . 1 . . . . . 18 ASP C . 52882 2
57 . 2 . 2 38 38 ASP CA C 13 54.364 0.000 . 1 . . . . . 18 ASP CA . 52882 2
58 . 2 . 2 38 38 ASP CB C 13 37.497 0.000 . 1 . . . . . 18 ASP CB . 52882 2
59 . 2 . 2 38 38 ASP N N 15 117.807 0.048 . 1 . . . . . 18 ASP N . 52882 2
60 . 2 . 2 39 39 GLN H H 1 8.538 0.000 . 1 . . . . . 19 GLN H . 52882 2
61 . 2 . 2 39 39 GLN C C 13 178.113 0.000 . 1 . . . . . 19 GLN C . 52882 2
62 . 2 . 2 39 39 GLN CA C 13 55.025 0.000 . 1 . . . . . 19 GLN CA . 52882 2
63 . 2 . 2 39 39 GLN CB C 13 24.912 0.000 . 1 . . . . . 19 GLN CB . 52882 2
64 . 2 . 2 39 39 GLN N N 15 119.185 0.026 . 1 . . . . . 19 GLN N . 52882 2
65 . 2 . 2 40 40 LEU H H 1 9.025 0.004 . 1 . . . . . 20 LEU H . 52882 2
66 . 2 . 2 40 40 LEU C C 13 177.009 0.000 . 1 . . . . . 20 LEU C . 52882 2
67 . 2 . 2 40 40 LEU CA C 13 55.921 0.048 . 1 . . . . . 20 LEU CA . 52882 2
68 . 2 . 2 40 40 LEU CB C 13 36.179 0.025 . 1 . . . . . 20 LEU CB . 52882 2
69 . 2 . 2 40 40 LEU N N 15 121.488 0.015 . 1 . . . . . 20 LEU N . 52882 2
70 . 2 . 2 41 41 VAL H H 1 7.676 0.004 . 1 . . . . . 21 VAL H . 52882 2
71 . 2 . 2 41 41 VAL CA C 13 63.734 0.000 . 1 . . . . . 21 VAL CA . 52882 2
72 . 2 . 2 41 41 VAL CB C 13 28.246 0.000 . 1 . . . . . 21 VAL CB . 52882 2
73 . 2 . 2 41 41 VAL N N 15 119.044 0.039 . 1 . . . . . 21 VAL N . 52882 2
74 . 2 . 2 42 42 LYS H H 1 8.157 0.004 . 1 . . . . . 22 LYS H . 52882 2
75 . 2 . 2 42 42 LYS C C 13 174.975 0.000 . 1 . . . . . 22 LYS C . 52882 2
76 . 2 . 2 42 42 LYS CA C 13 56.240 0.000 . 1 . . . . . 22 LYS CA . 52882 2
77 . 2 . 2 42 42 LYS CB C 13 28.868 0.000 . 1 . . . . . 22 LYS CB . 52882 2
78 . 2 . 2 42 42 LYS N N 15 121.126 0.141 . 1 . . . . . 22 LYS N . 52882 2
79 . 2 . 2 43 43 ASN H H 1 7.423 0.008 . 1 . . . . . 23 ASN H . 52882 2
80 . 2 . 2 43 43 ASN C C 13 169.849 0.000 . 1 . . . . . 23 ASN C . 52882 2
81 . 2 . 2 43 43 ASN CA C 13 50.575 0.009 . 1 . . . . . 23 ASN CA . 52882 2
82 . 2 . 2 43 43 ASN CB C 13 36.736 0.067 . 1 . . . . . 23 ASN CB . 52882 2
83 . 2 . 2 43 43 ASN N N 15 114.070 0.039 . 1 . . . . . 23 ASN N . 52882 2
84 . 2 . 2 44 44 ASN H H 1 8.006 0.002 . 1 . . . . . 24 ASN H . 52882 2
85 . 2 . 2 44 44 ASN C C 13 171.575 0.000 . 1 . . . . . 24 ASN C . 52882 2
86 . 2 . 2 44 44 ASN CA C 13 51.701 0.149 . 1 . . . . . 24 ASN CA . 52882 2
87 . 2 . 2 44 44 ASN CB C 13 33.223 0.065 . 1 . . . . . 24 ASN CB . 52882 2
88 . 2 . 2 44 44 ASN N N 15 112.699 0.021 . 1 . . . . . 24 ASN N . 52882 2
89 . 2 . 2 45 45 PHE H H 1 8.376 0.003 . 1 . . . . . 25 PHE H . 52882 2
90 . 2 . 2 45 45 PHE C C 13 173.301 0.000 . 1 . . . . . 25 PHE C . 52882 2
91 . 2 . 2 45 45 PHE CA C 13 54.580 0.023 . 1 . . . . . 25 PHE CA . 52882 2
92 . 2 . 2 45 45 PHE CB C 13 37.716 0.033 . 1 . . . . . 25 PHE CB . 52882 2
93 . 2 . 2 45 45 PHE N N 15 116.697 0.058 . 1 . . . . . 25 PHE N . 52882 2
94 . 2 . 2 46 46 ARG H H 1 8.955 0.003 . 1 . . . . . 26 ARG H . 52882 2
95 . 2 . 2 46 46 ARG C C 13 172.003 0.000 . 1 . . . . . 26 ARG C . 52882 2
96 . 2 . 2 46 46 ARG CA C 13 52.183 0.034 . 1 . . . . . 26 ARG CA . 52882 2
97 . 2 . 2 46 46 ARG CB C 13 26.223 0.011 . 1 . . . . . 26 ARG CB . 52882 2
98 . 2 . 2 46 46 ARG N N 15 123.955 0.037 . 1 . . . . . 26 ARG N . 52882 2
99 . 2 . 2 47 47 ALA H H 1 9.030 0.008 . 1 . . . . . 27 ALA H . 52882 2
100 . 2 . 2 47 47 ALA C C 13 174.479 0.000 . 1 . . . . . 27 ALA C . 52882 2
101 . 2 . 2 47 47 ALA CA C 13 47.547 0.067 . 1 . . . . . 27 ALA CA . 52882 2
102 . 2 . 2 47 47 ALA CB C 13 19.873 0.000 . 1 . . . . . 27 ALA CB . 52882 2
103 . 2 . 2 47 47 ALA N N 15 128.797 0.054 . 1 . . . . . 27 ALA N . 52882 2
104 . 2 . 2 48 48 THR H H 1 9.107 0.005 . 1 . . . . . 28 THR H . 52882 2
105 . 2 . 2 48 48 THR C C 13 170.092 0.000 . 1 . . . . . 28 THR C . 52882 2
106 . 2 . 2 48 48 THR CA C 13 59.262 0.080 . 1 . . . . . 28 THR CA . 52882 2
107 . 2 . 2 48 48 THR CB C 13 68.010 0.000 . 1 . . . . . 28 THR CB . 52882 2
108 . 2 . 2 48 48 THR N N 15 119.241 0.050 . 1 . . . . . 28 THR N . 52882 2
109 . 2 . 2 49 49 LYS H H 1 8.735 0.008 . 1 . . . . . 29 LYS H . 52882 2
110 . 2 . 2 49 49 LYS C C 13 173.045 0.000 . 1 . . . . . 29 LYS C . 52882 2
111 . 2 . 2 49 49 LYS CA C 13 52.383 0.000 . 1 . . . . . 29 LYS CA . 52882 2
112 . 2 . 2 49 49 LYS CB C 13 30.002 0.038 . 1 . . . . . 29 LYS CB . 52882 2
113 . 2 . 2 49 49 LYS N N 15 127.659 0.042 . 1 . . . . . 29 LYS N . 52882 2
114 . 2 . 2 50 50 LEU H H 1 8.879 0.003 . 1 . . . . . 30 LEU H . 52882 2
115 . 2 . 2 50 50 LEU CA C 13 51.301 0.000 . 1 . . . . . 30 LEU CA . 52882 2
116 . 2 . 2 50 50 LEU CB C 13 38.936 0.000 . 1 . . . . . 30 LEU CB . 52882 2
117 . 2 . 2 50 50 LEU N N 15 126.109 0.027 . 1 . . . . . 30 LEU N . 52882 2
118 . 2 . 2 51 51 ALA H H 1 8.099 0.008 . 1 . . . . . 31 ALA H . 52882 2
119 . 2 . 2 51 51 ALA C C 13 174.833 0.000 . 1 . . . . . 31 ALA C . 52882 2
120 . 2 . 2 51 51 ALA CA C 13 49.258 0.000 . 1 . . . . . 31 ALA CA . 52882 2
121 . 2 . 2 51 51 ALA CB C 13 16.350 0.000 . 1 . . . . . 31 ALA CB . 52882 2
122 . 2 . 2 51 51 ALA N N 15 123.200 0.049 . 1 . . . . . 31 ALA N . 52882 2
123 . 2 . 2 52 52 THR H H 1 8.418 0.004 . 1 . . . . . 32 THR H . 52882 2
124 . 2 . 2 52 52 THR C C 13 172.440 0.000 . 1 . . . . . 32 THR C . 52882 2
125 . 2 . 2 52 52 THR CA C 13 58.021 0.000 . 1 . . . . . 32 THR CA . 52882 2
126 . 2 . 2 52 52 THR CB C 13 67.370 0.076 . 1 . . . . . 32 THR CB . 52882 2
127 . 2 . 2 52 52 THR N N 15 115.651 0.084 . 1 . . . . . 32 THR N . 52882 2
128 . 2 . 2 53 53 THR H H 1 8.501 0.002 . 1 . . . . . 33 THR H . 52882 2
129 . 2 . 2 53 53 THR C C 13 172.766 0.000 . 1 . . . . . 33 THR C . 52882 2
130 . 2 . 2 53 53 THR CA C 13 58.526 0.000 . 1 . . . . . 33 THR CA . 52882 2
131 . 2 . 2 53 53 THR CB C 13 67.124 0.022 . 1 . . . . . 33 THR CB . 52882 2
132 . 2 . 2 53 53 THR N N 15 115.174 0.065 . 1 . . . . . 33 THR N . 52882 2
133 . 2 . 2 54 54 GLY H H 1 8.611 0.010 . 1 . . . . . 34 GLY H . 52882 2
134 . 2 . 2 54 54 GLY C C 13 172.074 0.000 . 1 . . . . . 34 GLY C . 52882 2
135 . 2 . 2 54 54 GLY CA C 13 42.172 0.000 . 1 . . . . . 34 GLY CA . 52882 2
136 . 2 . 2 54 54 GLY N N 15 111.056 0.152 . 1 . . . . . 34 GLY N . 52882 2
137 . 2 . 2 56 56 PHE H H 1 8.363 0.000 . 1 . . . . . 36 PHE H . 52882 2
138 . 2 . 2 56 56 PHE CA C 13 55.695 0.045 . 1 . . . . . 36 PHE CA . 52882 2
139 . 2 . 2 56 56 PHE CB C 13 35.824 0.000 . 1 . . . . . 36 PHE CB . 52882 2
140 . 2 . 2 56 56 PHE N N 15 120.424 0.000 . 1 . . . . . 36 PHE N . 52882 2
141 . 2 . 2 57 57 LEU H H 1 8.379 0.005 . 1 . . . . . 37 LEU H . 52882 2
142 . 2 . 2 57 57 LEU C C 13 174.908 0.000 . 1 . . . . . 37 LEU C . 52882 2
143 . 2 . 2 57 57 LEU CA C 13 52.588 0.008 . 1 . . . . . 37 LEU CA . 52882 2
144 . 2 . 2 57 57 LEU CB C 13 37.885 0.002 . 1 . . . . . 37 LEU CB . 52882 2
145 . 2 . 2 57 57 LEU N N 15 120.580 0.065 . 1 . . . . . 37 LEU N . 52882 2
146 . 2 . 2 58 58 ARG H H 1 8.045 0.009 . 1 . . . . . 38 ARG H . 52882 2
147 . 2 . 2 58 58 ARG C C 13 173.463 0.008 . 1 . . . . . 38 ARG C . 52882 2
148 . 2 . 2 58 58 ARG CA C 13 53.179 0.064 . 1 . . . . . 38 ARG CA . 52882 2
149 . 2 . 2 58 58 ARG CB C 13 26.827 0.013 . 1 . . . . . 38 ARG CB . 52882 2
150 . 2 . 2 58 58 ARG N N 15 118.587 0.060 . 1 . . . . . 38 ARG N . 52882 2
151 . 2 . 2 59 59 ALA H H 1 8.193 0.002 . 1 . . . . . 39 ALA H . 52882 2
152 . 2 . 2 59 59 ALA C C 13 175.582 0.001 . 1 . . . . . 39 ALA C . 52882 2
153 . 2 . 2 59 59 ALA CA C 13 49.323 0.049 . 1 . . . . . 39 ALA CA . 52882 2
154 . 2 . 2 59 59 ALA CB C 13 16.093 0.024 . 1 . . . . . 39 ALA CB . 52882 2
155 . 2 . 2 59 59 ALA N N 15 123.432 0.050 . 1 . . . . . 39 ALA N . 52882 2
156 . 2 . 2 60 60 GLY H H 1 8.381 0.003 . 1 . . . . . 40 GLY H . 52882 2
157 . 2 . 2 60 60 GLY C C 13 171.209 0.000 . 1 . . . . . 40 GLY C . 52882 2
158 . 2 . 2 60 60 GLY CA C 13 42.369 0.000 . 1 . . . . . 40 GLY CA . 52882 2
159 . 2 . 2 60 60 GLY N N 15 108.494 0.043 . 1 . . . . . 40 GLY N . 52882 2
160 . 2 . 2 64 64 PHE H H 1 9.778 0.002 . 1 . . . . . 44 PHE H . 52882 2
161 . 2 . 2 64 64 PHE C C 13 172.456 0.000 . 1 . . . . . 44 PHE C . 52882 2
162 . 2 . 2 64 64 PHE CA C 13 53.457 0.072 . 1 . . . . . 44 PHE CA . 52882 2
163 . 2 . 2 64 64 PHE CB C 13 39.021 0.030 . 1 . . . . . 44 PHE CB . 52882 2
164 . 2 . 2 64 64 PHE N N 15 124.180 0.012 . 1 . . . . . 44 PHE N . 52882 2
165 . 2 . 2 65 65 LEU H H 1 8.939 0.005 . 1 . . . . . 45 LEU H . 52882 2
166 . 2 . 2 65 65 LEU CA C 13 50.599 0.000 . 1 . . . . . 45 LEU CA . 52882 2
167 . 2 . 2 65 65 LEU CB C 13 40.600 0.000 . 1 . . . . . 45 LEU CB . 52882 2
168 . 2 . 2 65 65 LEU N N 15 119.121 0.025 . 1 . . . . . 45 LEU N . 52882 2
169 . 2 . 2 66 66 CYS H H 1 9.176 0.003 . 1 . . . . . 46 CYS H . 52882 2
170 . 2 . 2 66 66 CYS C C 13 171.093 0.000 . 1 . . . . . 46 CYS C . 52882 2
171 . 2 . 2 66 66 CYS CA C 13 55.679 0.096 . 1 . . . . . 46 CYS CA . 52882 2
172 . 2 . 2 66 66 CYS CB C 13 26.509 0.207 . 1 . . . . . 46 CYS CB . 52882 2
173 . 2 . 2 66 66 CYS N N 15 123.792 0.014 . 1 . . . . . 46 CYS N . 52882 2
174 . 2 . 2 67 67 GLY H H 1 9.250 0.004 . 1 . . . . . 47 GLY H . 52882 2
175 . 2 . 2 67 67 GLY C C 13 170.917 0.000 . 1 . . . . . 47 GLY C . 52882 2
176 . 2 . 2 67 67 GLY CA C 13 42.374 0.003 . 1 . . . . . 47 GLY CA . 52882 2
177 . 2 . 2 67 67 GLY N N 15 117.634 0.070 . 1 . . . . . 47 GLY N . 52882 2
178 . 2 . 2 68 68 VAL H H 1 9.096 0.001 . 1 . . . . . 48 VAL H . 52882 2
179 . 2 . 2 68 68 VAL C C 13 171.600 0.000 . 1 . . . . . 48 VAL C . 52882 2
180 . 2 . 2 68 68 VAL CA C 13 56.090 0.044 . 1 . . . . . 48 VAL CA . 52882 2
181 . 2 . 2 68 68 VAL CB C 13 32.596 0.086 . 1 . . . . . 48 VAL CB . 52882 2
182 . 2 . 2 68 68 VAL N N 15 121.773 0.037 . 1 . . . . . 48 VAL N . 52882 2
183 . 2 . 2 69 69 ASN H H 1 8.477 0.001 . 1 . . . . . 49 ASN H . 52882 2
184 . 2 . 2 69 69 ASN C C 13 175.249 0.000 . 1 . . . . . 49 ASN C . 52882 2
185 . 2 . 2 69 69 ASN CA C 13 51.475 0.037 . 1 . . . . . 49 ASN CA . 52882 2
186 . 2 . 2 69 69 ASN CB C 13 36.237 0.000 . 1 . . . . . 49 ASN CB . 52882 2
187 . 2 . 2 69 69 ASN N N 15 122.749 0.061 . 1 . . . . . 49 ASN N . 52882 2
188 . 2 . 2 70 70 ASP H H 1 8.740 0.001 . 1 . . . . . 50 ASP H . 52882 2
189 . 2 . 2 70 70 ASP C C 13 175.192 0.000 . 1 . . . . . 50 ASP C . 52882 2
190 . 2 . 2 70 70 ASP CA C 13 54.193 0.036 . 1 . . . . . 50 ASP CA . 52882 2
191 . 2 . 2 70 70 ASP CB C 13 36.595 0.000 . 1 . . . . . 50 ASP CB . 52882 2
192 . 2 . 2 70 70 ASP N N 15 122.155 0.016 . 1 . . . . . 50 ASP N . 52882 2
193 . 2 . 2 71 71 ASP H H 1 8.501 0.003 . 1 . . . . . 51 ASP H . 52882 2
194 . 2 . 2 71 71 ASP C C 13 174.983 0.000 . 1 . . . . . 51 ASP C . 52882 2
195 . 2 . 2 71 71 ASP CA C 13 51.990 0.000 . 1 . . . . . 51 ASP CA . 52882 2
196 . 2 . 2 71 71 ASP CB C 13 36.641 0.000 . 1 . . . . . 51 ASP CB . 52882 2
197 . 2 . 2 71 71 ASP N N 15 117.304 0.074 . 1 . . . . . 51 ASP N . 52882 2
198 . 2 . 2 72 72 ARG H H 1 8.390 0.001 . 1 . . . . . 52 ARG H . 52882 2
199 . 2 . 2 72 72 ARG C C 13 173.949 0.000 . 1 . . . . . 52 ARG C . 52882 2
200 . 2 . 2 72 72 ARG CA C 13 53.537 0.000 . 1 . . . . . 52 ARG CA . 52882 2
201 . 2 . 2 72 72 ARG CB C 13 28.121 0.000 . 1 . . . . . 52 ARG CB . 52882 2
202 . 2 . 2 72 72 ARG N N 15 117.354 0.049 . 1 . . . . . 52 ARG N . 52882 2
203 . 2 . 2 73 73 VAL H H 1 7.337 0.001 . 1 . . . . . 53 VAL H . 52882 2
204 . 2 . 2 73 73 VAL C C 13 174.923 0.000 . 1 . . . . . 53 VAL C . 52882 2
205 . 2 . 2 73 73 VAL CA C 13 63.830 0.033 . 1 . . . . . 53 VAL CA . 52882 2
206 . 2 . 2 73 73 VAL CB C 13 28.107 0.025 . 1 . . . . . 53 VAL CB . 52882 2
207 . 2 . 2 73 73 VAL N N 15 121.917 0.013 . 1 . . . . . 53 VAL N . 52882 2
208 . 2 . 2 74 74 ASP H H 1 8.540 0.002 . 1 . . . . . 54 ASP H . 52882 2
209 . 2 . 2 74 74 ASP C C 13 177.004 0.000 . 1 . . . . . 54 ASP C . 52882 2
210 . 2 . 2 74 74 ASP CA C 13 54.981 0.000 . 1 . . . . . 54 ASP CA . 52882 2
211 . 2 . 2 74 74 ASP CB C 13 36.064 0.029 . 1 . . . . . 54 ASP CB . 52882 2
212 . 2 . 2 74 74 ASP N N 15 118.283 0.097 . 1 . . . . . 54 ASP N . 52882 2
213 . 2 . 2 75 75 GLU H H 1 7.736 0.002 . 1 . . . . . 55 GLU H . 52882 2
214 . 2 . 2 75 75 GLU CA C 13 56.204 0.000 . 1 . . . . . 55 GLU CA . 52882 2
215 . 2 . 2 75 75 GLU CB C 13 26.320 0.000 . 1 . . . . . 55 GLU CB . 52882 2
216 . 2 . 2 75 75 GLU N N 15 120.604 0.040 . 1 . . . . . 55 GLU N . 52882 2
217 . 2 . 2 77 77 LEU CA C 13 55.111 0.000 . 1 . . . . . 57 LEU CA . 52882 2
218 . 2 . 2 77 77 LEU CB C 13 36.615 0.000 . 1 . . . . . 57 LEU CB . 52882 2
219 . 2 . 2 78 78 SER H H 1 7.697 0.003 . 1 . . . . . 58 SER H . 52882 2
220 . 2 . 2 78 78 SER C C 13 174.719 0.000 . 1 . . . . . 58 SER C . 52882 2
221 . 2 . 2 78 78 SER CA C 13 58.095 0.000 . 1 . . . . . 58 SER CA . 52882 2
222 . 2 . 2 78 78 SER CB C 13 59.348 0.006 . 1 . . . . . 58 SER CB . 52882 2
223 . 2 . 2 78 78 SER N N 15 113.416 0.019 . 1 . . . . . 58 SER N . 52882 2
224 . 2 . 2 79 79 VAL H H 1 7.586 0.002 . 1 . . . . . 59 VAL H . 52882 2
225 . 2 . 2 79 79 VAL CA C 13 63.022 0.000 . 1 . . . . . 59 VAL CA . 52882 2
226 . 2 . 2 79 79 VAL CB C 13 28.063 0.000 . 1 . . . . . 59 VAL CB . 52882 2
227 . 2 . 2 79 79 VAL N N 15 121.772 0.012 . 1 . . . . . 59 VAL N . 52882 2
228 . 2 . 2 80 80 ILE H H 1 8.127 0.001 . 1 . . . . . 60 ILE H . 52882 2
229 . 2 . 2 80 80 ILE C C 13 175.045 0.000 . 1 . . . . . 60 ILE C . 52882 2
230 . 2 . 2 80 80 ILE CA C 13 62.782 0.053 . 1 . . . . . 60 ILE CA . 52882 2
231 . 2 . 2 80 80 ILE CB C 13 34.150 0.000 . 1 . . . . . 60 ILE CB . 52882 2
232 . 2 . 2 80 80 ILE N N 15 120.815 0.046 . 1 . . . . . 60 ILE N . 52882 2
233 . 2 . 2 81 81 ASN H H 1 8.262 0.001 . 1 . . . . . 61 ASN H . 52882 2
234 . 2 . 2 81 81 ASN CA C 13 53.400 0.000 . 1 . . . . . 61 ASN CA . 52882 2
235 . 2 . 2 81 81 ASN CB C 13 34.931 0.000 . 1 . . . . . 61 ASN CB . 52882 2
236 . 2 . 2 81 81 ASN N N 15 118.285 0.016 . 1 . . . . . 61 ASN N . 52882 2
237 . 2 . 2 82 82 GLN H H 1 8.251 0.003 . 1 . . . . . 62 GLN H . 52882 2
238 . 2 . 2 82 82 GLN C C 13 175.432 0.000 . 1 . . . . . 62 GLN C . 52882 2
239 . 2 . 2 82 82 GLN CA C 13 55.737 0.000 . 1 . . . . . 62 GLN CA . 52882 2
240 . 2 . 2 82 82 GLN CB C 13 25.310 0.000 . 1 . . . . . 62 GLN CB . 52882 2
241 . 2 . 2 82 82 GLN N N 15 116.510 0.029 . 1 . . . . . 62 GLN N . 52882 2
242 . 2 . 2 83 83 THR H H 1 7.502 0.004 . 1 . . . . . 63 THR H . 52882 2
243 . 2 . 2 83 83 THR C C 13 173.490 0.000 . 1 . . . . . 63 THR C . 52882 2
244 . 2 . 2 83 83 THR CA C 13 62.327 0.000 . 1 . . . . . 63 THR CA . 52882 2
245 . 2 . 2 83 83 THR CB C 13 66.651 0.000 . 1 . . . . . 63 THR CB . 52882 2
246 . 2 . 2 83 83 THR N N 15 110.595 0.045 . 1 . . . . . 63 THR N . 52882 2
247 . 2 . 2 84 84 CYS H H 1 8.148 0.001 . 1 . . . . . 64 CYS H . 52882 2
248 . 2 . 2 84 84 CYS C C 13 172.852 0.000 . 1 . . . . . 64 CYS C . 52882 2
249 . 2 . 2 84 84 CYS CA C 13 56.305 0.065 . 1 . . . . . 64 CYS CA . 52882 2
250 . 2 . 2 84 84 CYS CB C 13 27.105 0.132 . 1 . . . . . 64 CYS CB . 52882 2
251 . 2 . 2 84 84 CYS N N 15 114.951 0.080 . 1 . . . . . 64 CYS N . 52882 2
252 . 2 . 2 85 85 GLY H H 1 7.914 0.005 . 1 . . . . . 65 GLY H . 52882 2
253 . 2 . 2 85 85 GLY C C 13 171.274 0.028 . 1 . . . . . 65 GLY C . 52882 2
254 . 2 . 2 85 85 GLY CA C 13 42.107 0.005 . 1 . . . . . 65 GLY CA . 52882 2
255 . 2 . 2 85 85 GLY N N 15 107.413 0.050 . 1 . . . . . 65 GLY N . 52882 2
256 . 2 . 2 86 86 ASN H H 1 8.981 0.002 . 1 . . . . . 66 ASN H . 52882 2
257 . 2 . 2 86 86 ASN C C 13 173.304 0.003 . 1 . . . . . 66 ASN C . 52882 2
258 . 2 . 2 86 86 ASN CA C 13 50.964 0.017 . 1 . . . . . 66 ASN CA . 52882 2
259 . 2 . 2 86 86 ASN CB C 13 35.989 0.022 . 1 . . . . . 66 ASN CB . 52882 2
260 . 2 . 2 86 86 ASN N N 15 119.503 0.052 . 1 . . . . . 66 ASN N . 52882 2
261 . 2 . 2 87 87 ARG H H 1 8.528 0.002 . 1 . . . . . 67 ARG H . 52882 2
262 . 2 . 2 87 87 ARG CA C 13 52.875 0.000 . 1 . . . . . 67 ARG CA . 52882 2
263 . 2 . 2 87 87 ARG CB C 13 27.376 0.000 . 1 . . . . . 67 ARG CB . 52882 2
264 . 2 . 2 87 87 ARG N N 15 122.502 0.143 . 1 . . . . . 67 ARG N . 52882 2
265 . 2 . 2 89 89 GLN C C 13 175.473 0.025 . 1 . . . . . 69 GLN C . 52882 2
266 . 2 . 2 89 89 GLN CA C 13 56.396 0.000 . 1 . . . . . 69 GLN CA . 52882 2
267 . 2 . 2 89 89 GLN CB C 13 24.469 0.000 . 1 . . . . . 69 GLN CB . 52882 2
268 . 2 . 2 90 90 LEU H H 1 8.350 0.001 . 1 . . . . . 70 LEU H . 52882 2
269 . 2 . 2 90 90 LEU C C 13 175.103 0.003 . 1 . . . . . 70 LEU C . 52882 2
270 . 2 . 2 90 90 LEU CA C 13 52.276 0.112 . 1 . . . . . 70 LEU CA . 52882 2
271 . 2 . 2 90 90 LEU CB C 13 38.618 0.002 . 1 . . . . . 70 LEU CB . 52882 2
272 . 2 . 2 90 90 LEU N N 15 122.127 0.010 . 1 . . . . . 70 LEU N . 52882 2
273 . 2 . 2 91 91 VAL H H 1 8.225 0.002 . 1 . . . . . 71 VAL H . 52882 2
274 . 2 . 2 91 91 VAL C C 13 173.785 0.008 . 1 . . . . . 71 VAL C . 52882 2
275 . 2 . 2 91 91 VAL CA C 13 58.790 0.013 . 1 . . . . . 71 VAL CA . 52882 2
276 . 2 . 2 91 91 VAL CB C 13 29.462 0.065 . 1 . . . . . 71 VAL CB . 52882 2
277 . 2 . 2 91 91 VAL N N 15 121.643 0.189 . 1 . . . . . 71 VAL N . 52882 2
278 . 2 . 2 92 92 SER H H 1 8.403 0.002 . 1 . . . . . 72 SER H . 52882 2
279 . 2 . 2 92 92 SER C C 13 170.580 0.000 . 1 . . . . . 72 SER C . 52882 2
280 . 2 . 2 92 92 SER CA C 13 53.160 0.000 . 1 . . . . . 72 SER CA . 52882 2
281 . 2 . 2 92 92 SER CB C 13 60.113 0.000 . 1 . . . . . 72 SER CB . 52882 2
282 . 2 . 2 92 92 SER N N 15 121.032 0.023 . 1 . . . . . 72 SER N . 52882 2
283 . 2 . 2 93 93 PRO C C 13 174.606 0.000 . 1 . . . . . 73 PRO C . 52882 2
284 . 2 . 2 93 93 PRO CA C 13 60.084 0.016 . 1 . . . . . 73 PRO CA . 52882 2
285 . 2 . 2 93 93 PRO CB C 13 28.517 0.000 . 1 . . . . . 73 PRO CB . 52882 2
286 . 2 . 2 94 94 ILE H H 1 8.149 0.003 . 1 . . . . . 74 ILE H . 52882 2
287 . 2 . 2 94 94 ILE C C 13 174.172 0.000 . 1 . . . . . 74 ILE C . 52882 2
288 . 2 . 2 94 94 ILE CA C 13 57.981 0.004 . 1 . . . . . 74 ILE CA . 52882 2
289 . 2 . 2 94 94 ILE CB C 13 35.081 0.000 . 1 . . . . . 74 ILE CB . 52882 2
290 . 2 . 2 94 94 ILE N N 15 120.179 0.055 . 1 . . . . . 74 ILE N . 52882 2
291 . 2 . 2 95 95 THR H H 1 8.180 0.003 . 1 . . . . . 75 THR H . 52882 2
292 . 2 . 2 95 95 THR CA C 13 56.617 0.000 . 1 . . . . . 75 THR CA . 52882 2
293 . 2 . 2 95 95 THR CB C 13 66.639 0.000 . 1 . . . . . 75 THR CB . 52882 2
294 . 2 . 2 95 95 THR N N 15 120.368 0.059 . 1 . . . . . 75 THR N . 52882 2
295 . 2 . 2 96 96 PRO CA C 13 60.195 0.000 . 1 . . . . . 76 PRO CA . 52882 2
296 . 2 . 2 97 97 MET H H 1 8.469 0.003 . 1 . . . . . 77 MET H . 52882 2
297 . 2 . 2 97 97 MET C C 13 174.847 0.010 . 1 . . . . . 77 MET C . 52882 2
298 . 2 . 2 97 97 MET CA C 13 52.707 0.045 . 1 . . . . . 77 MET CA . 52882 2
299 . 2 . 2 97 97 MET CB C 13 29.281 0.106 . 1 . . . . . 77 MET CB . 52882 2
300 . 2 . 2 97 97 MET N N 15 120.329 0.046 . 1 . . . . . 77 MET N . 52882 2
301 . 2 . 2 98 98 GLY H H 1 8.443 0.003 . 1 . . . . . 78 GLY H . 52882 2
302 . 2 . 2 98 98 GLY C C 13 172.512 0.000 . 1 . . . . . 78 GLY C . 52882 2
303 . 2 . 2 98 98 GLY CA C 13 42.300 0.000 . 1 . . . . . 78 GLY CA . 52882 2
304 . 2 . 2 98 98 GLY N N 15 110.059 0.052 . 1 . . . . . 78 GLY N . 52882 2
305 . 2 . 2 99 99 GLY H H 1 8.287 0.003 . 1 . . . . . 79 GLY H . 52882 2
306 . 2 . 2 99 99 GLY C C 13 172.111 0.008 . 1 . . . . . 79 GLY C . 52882 2
307 . 2 . 2 99 99 GLY CA C 13 42.105 0.011 . 1 . . . . . 79 GLY CA . 52882 2
308 . 2 . 2 99 99 GLY N N 15 108.620 0.031 . 1 . . . . . 79 GLY N . 52882 2
309 . 2 . 2 100 100 SER H H 1 8.268 0.005 . 1 . . . . . 80 SER H . 52882 2
310 . 2 . 2 100 100 SER C C 13 172.585 0.019 . 1 . . . . . 80 SER C . 52882 2
311 . 2 . 2 100 100 SER CA C 13 55.242 0.065 . 1 . . . . . 80 SER CA . 52882 2
312 . 2 . 2 100 100 SER CB C 13 60.771 0.014 . 1 . . . . . 80 SER CB . 52882 2
313 . 2 . 2 100 100 SER N N 15 115.257 0.036 . 1 . . . . . 80 SER N . 52882 2
314 . 2 . 2 101 101 ALA H H 1 8.482 0.002 . 1 . . . . . 81 ALA H . 52882 2
315 . 2 . 2 101 101 ALA C C 13 175.603 0.001 . 1 . . . . . 81 ALA C . 52882 2
316 . 2 . 2 101 101 ALA CA C 13 49.957 0.040 . 1 . . . . . 81 ALA CA . 52882 2
317 . 2 . 2 101 101 ALA CB C 13 15.679 0.004 . 1 . . . . . 81 ALA CB . 52882 2
318 . 2 . 2 101 101 ALA N N 15 125.534 0.023 . 1 . . . . . 81 ALA N . 52882 2
319 . 2 . 2 102 102 ASP H H 1 8.206 0.005 . 1 . . . . . 82 ASP H . 52882 2
320 . 2 . 2 102 102 ASP C C 13 174.151 0.009 . 1 . . . . . 82 ASP C . 52882 2
321 . 2 . 2 102 102 ASP CA C 13 51.591 0.037 . 1 . . . . . 82 ASP CA . 52882 2
322 . 2 . 2 102 102 ASP CB C 13 37.857 0.007 . 1 . . . . . 82 ASP CB . 52882 2
323 . 2 . 2 102 102 ASP N N 15 118.307 0.132 . 1 . . . . . 82 ASP N . 52882 2
324 . 2 . 2 103 103 SER H H 1 8.032 0.001 . 1 . . . . . 83 SER H . 52882 2
325 . 2 . 2 103 103 SER C C 13 171.764 0.006 . 1 . . . . . 83 SER C . 52882 2
326 . 2 . 2 103 103 SER CA C 13 55.393 0.061 . 1 . . . . . 83 SER CA . 52882 2
327 . 2 . 2 103 103 SER CB C 13 60.630 0.009 . 1 . . . . . 83 SER CB . 52882 2
328 . 2 . 2 103 103 SER N N 15 114.943 0.020 . 1 . . . . . 83 SER N . 52882 2
329 . 2 . 2 104 104 TYR H H 1 8.097 0.009 . 1 . . . . . 84 TYR H . 52882 2
330 . 2 . 2 104 104 TYR C C 13 172.709 0.002 . 1 . . . . . 84 TYR C . 52882 2
331 . 2 . 2 104 104 TYR CA C 13 54.836 0.000 . 1 . . . . . 84 TYR CA . 52882 2
332 . 2 . 2 104 104 TYR CB C 13 35.272 0.000 . 1 . . . . . 84 TYR CB . 52882 2
333 . 2 . 2 104 104 TYR N N 15 122.183 0.061 . 1 . . . . . 84 TYR N . 52882 2
334 . 2 . 2 105 105 ILE H H 1 7.882 0.002 . 1 . . . . . 85 ILE H . 52882 2
335 . 2 . 2 105 105 ILE C C 13 171.821 0.000 . 1 . . . . . 85 ILE C . 52882 2
336 . 2 . 2 105 105 ILE CA C 13 54.896 0.000 . 1 . . . . . 85 ILE CA . 52882 2
337 . 2 . 2 105 105 ILE CB C 13 35.343 0.000 . 1 . . . . . 85 ILE CB . 52882 2
338 . 2 . 2 105 105 ILE N N 15 125.929 0.062 . 1 . . . . . 85 ILE N . 52882 2
339 . 2 . 2 109 109 VAL C C 13 173.866 0.000 . 1 . . . . . 89 VAL C . 52882 2
340 . 2 . 2 109 109 VAL CA C 13 59.140 0.001 . 1 . . . . . 89 VAL CA . 52882 2
341 . 2 . 2 109 109 VAL CB C 13 29.605 0.000 . 1 . . . . . 89 VAL CB . 52882 2
342 . 2 . 2 110 110 GLU H H 1 8.468 0.003 . 1 . . . . . 90 GLU H . 52882 2
343 . 2 . 2 110 110 GLU C C 13 174.193 0.000 . 1 . . . . . 90 GLU C . 52882 2
344 . 2 . 2 110 110 GLU CA C 13 53.497 0.027 . 1 . . . . . 90 GLU CA . 52882 2
345 . 2 . 2 110 110 GLU CB C 13 26.821 0.002 . 1 . . . . . 90 GLU CB . 52882 2
346 . 2 . 2 110 110 GLU N N 15 122.965 0.053 . 1 . . . . . 90 GLU N . 52882 2
347 . 2 . 2 111 111 VAL H H 1 8.158 0.009 . 1 . . . . . 91 VAL H . 52882 2
348 . 2 . 2 111 111 VAL CA C 13 58.732 0.019 . 1 . . . . . 91 VAL CA . 52882 2
349 . 2 . 2 111 111 VAL CB C 13 29.772 0.000 . 1 . . . . . 91 VAL CB . 52882 2
350 . 2 . 2 111 111 VAL N N 15 120.051 0.098 . 1 . . . . . 91 VAL N . 52882 2
351 . 2 . 2 112 112 GLU H H 1 8.405 0.002 . 1 . . . . . 92 GLU H . 52882 2
352 . 2 . 2 112 112 GLU C C 13 173.907 0.000 . 1 . . . . . 92 GLU C . 52882 2
353 . 2 . 2 112 112 GLU CA C 13 53.293 0.015 . 1 . . . . . 92 GLU CA . 52882 2
354 . 2 . 2 112 112 GLU CB C 13 26.885 0.008 . 1 . . . . . 92 GLU CB . 52882 2
355 . 2 . 2 112 112 GLU N N 15 123.809 0.038 . 1 . . . . . 92 GLU N . 52882 2
356 . 2 . 2 113 113 VAL H H 1 8.397 0.007 . 1 . . . . . 93 VAL H . 52882 2
357 . 2 . 2 113 113 VAL C C 13 174.191 0.007 . 1 . . . . . 93 VAL C . 52882 2
358 . 2 . 2 113 113 VAL CA C 13 58.835 0.037 . 1 . . . . . 93 VAL CA . 52882 2
359 . 2 . 2 113 113 VAL CB C 13 29.695 0.014 . 1 . . . . . 93 VAL CB . 52882 2
360 . 2 . 2 113 113 VAL N N 15 120.506 0.048 . 1 . . . . . 93 VAL N . 52882 2
361 . 2 . 2 114 114 GLY H H 1 8.630 0.001 . 1 . . . . . 94 GLY H . 52882 2
362 . 2 . 2 114 114 GLY C C 13 172.098 0.003 . 1 . . . . . 94 GLY C . 52882 2
363 . 2 . 2 114 114 GLY CA C 13 44.364 0.009 . 1 . . . . . 94 GLY CA . 52882 2
364 . 2 . 2 114 114 GLY N N 15 111.336 0.024 . 1 . . . . . 94 GLY N . 52882 2
365 . 2 . 2 115 115 GLY H H 1 8.316 0.001 . 1 . . . . . 95 GLY H . 52882 2
366 . 2 . 2 115 115 GLY C C 13 171.372 0.000 . 1 . . . . . 95 GLY C . 52882 2
367 . 2 . 2 115 115 GLY CA C 13 42.296 0.069 . 1 . . . . . 95 GLY CA . 52882 2
368 . 2 . 2 115 115 GLY N N 15 109.697 0.019 . 1 . . . . . 95 GLY N . 52882 2
369 . 2 . 2 116 116 ALA H H 1 8.341 0.001 . 1 . . . . . 96 ALA H . 52882 2
370 . 2 . 2 116 116 ALA C C 13 173.472 0.000 . 1 . . . . . 96 ALA C . 52882 2
371 . 2 . 2 116 116 ALA CA C 13 48.102 0.025 . 1 . . . . . 96 ALA CA . 52882 2
372 . 2 . 2 116 116 ALA CB C 13 19.543 0.009 . 1 . . . . . 96 ALA CB . 52882 2
373 . 2 . 2 116 116 ALA N N 15 121.472 0.014 . 1 . . . . . 96 ALA N . 52882 2
374 . 2 . 2 117 117 THR H H 1 8.649 0.003 . 1 . . . . . 97 THR H . 52882 2
375 . 2 . 2 117 117 THR C C 13 171.128 0.000 . 1 . . . . . 97 THR C . 52882 2
376 . 2 . 2 117 117 THR CA C 13 58.728 0.000 . 1 . . . . . 97 THR CA . 52882 2
377 . 2 . 2 117 117 THR CB C 13 67.897 0.013 . 1 . . . . . 97 THR CB . 52882 2
378 . 2 . 2 117 117 THR N N 15 117.754 0.022 . 1 . . . . . 97 THR N . 52882 2
379 . 2 . 2 118 118 VAL H H 1 8.807 0.005 . 1 . . . . . 98 VAL H . 52882 2
380 . 2 . 2 118 118 VAL CA C 13 57.586 0.000 . 1 . . . . . 98 VAL CA . 52882 2
381 . 2 . 2 118 118 VAL N N 15 124.278 0.112 . 1 . . . . . 98 VAL N . 52882 2
382 . 2 . 2 119 119 PHE H H 1 9.429 0.000 . 1 . . . . . 99 PHE H . 52882 2
383 . 2 . 2 119 119 PHE N N 15 123.687 0.000 . 1 . . . . . 99 PHE N . 52882 2
384 . 2 . 2 121 121 MET H H 1 9.843 0.000 . 1 . . . . . 101 MET H . 52882 2
385 . 2 . 2 121 121 MET N N 15 127.021 0.000 . 1 . . . . . 101 MET N . 52882 2
386 . 2 . 2 122 122 PRO C C 13 172.011 0.000 . 1 . . . . . 102 PRO C . 52882 2
387 . 2 . 2 122 122 PRO CA C 13 59.785 0.000 . 1 . . . . . 102 PRO CA . 52882 2
388 . 2 . 2 122 122 PRO CB C 13 28.951 0.000 . 1 . . . . . 102 PRO CB . 52882 2
389 . 2 . 2 123 123 VAL H H 1 7.760 0.002 . 1 . . . . . 103 VAL H . 52882 2
390 . 2 . 2 123 123 VAL CA C 13 58.370 0.000 . 1 . . . . . 103 VAL CA . 52882 2
391 . 2 . 2 123 123 VAL CB C 13 31.825 0.000 . 1 . . . . . 103 VAL CB . 52882 2
392 . 2 . 2 123 123 VAL N N 15 115.537 0.018 . 1 . . . . . 103 VAL N . 52882 2
393 . 2 . 2 124 124 ASP H H 1 9.283 0.000 . 1 . . . . . 104 ASP H . 52882 2
394 . 2 . 2 124 124 ASP C C 13 174.480 0.000 . 1 . . . . . 104 ASP C . 52882 2
395 . 2 . 2 124 124 ASP N N 15 128.457 0.000 . 1 . . . . . 104 ASP N . 52882 2
396 . 2 . 2 125 125 ALA H H 1 7.945 0.001 . 1 . . . . . 105 ALA H . 52882 2
397 . 2 . 2 125 125 ALA C C 13 170.800 0.000 . 1 . . . . . 105 ALA C . 52882 2
398 . 2 . 2 125 125 ALA CA C 13 48.968 0.049 . 1 . . . . . 105 ALA CA . 52882 2
399 . 2 . 2 125 125 ALA CB C 13 18.976 0.021 . 1 . . . . . 105 ALA CB . 52882 2
400 . 2 . 2 125 125 ALA N N 15 118.069 0.101 . 1 . . . . . 105 ALA N . 52882 2
401 . 2 . 2 126 126 PHE H H 1 8.220 0.004 . 1 . . . . . 106 PHE H . 52882 2
402 . 2 . 2 126 126 PHE C C 13 170.650 0.000 . 1 . . . . . 106 PHE C . 52882 2
403 . 2 . 2 126 126 PHE CA C 13 52.423 0.074 . 1 . . . . . 106 PHE CA . 52882 2
404 . 2 . 2 126 126 PHE CB C 13 39.886 0.000 . 1 . . . . . 106 PHE CB . 52882 2
405 . 2 . 2 126 126 PHE N N 15 122.540 0.048 . 1 . . . . . 106 PHE N . 52882 2
406 . 2 . 2 127 127 HIS H H 1 8.361 0.006 . 1 . . . . . 107 HIS H . 52882 2
407 . 2 . 2 127 127 HIS C C 13 169.864 0.000 . 1 . . . . . 107 HIS C . 52882 2
408 . 2 . 2 127 127 HIS CA C 13 51.301 0.000 . 1 . . . . . 107 HIS CA . 52882 2
409 . 2 . 2 127 127 HIS CB C 13 31.433 0.033 . 1 . . . . . 107 HIS CB . 52882 2
410 . 2 . 2 127 127 HIS N N 15 124.796 0.080 . 1 . . . . . 107 HIS N . 52882 2
411 . 2 . 2 128 128 GLN H H 1 7.918 0.007 . 1 . . . . . 108 GLN H . 52882 2
412 . 2 . 2 128 128 GLN C C 13 171.829 0.000 . 1 . . . . . 108 GLN C . 52882 2
413 . 2 . 2 128 128 GLN CA C 13 51.269 0.013 . 1 . . . . . 108 GLN CA . 52882 2
414 . 2 . 2 128 128 GLN CB C 13 27.738 0.000 . 1 . . . . . 108 GLN CB . 52882 2
415 . 2 . 2 128 128 GLN N N 15 120.579 0.008 . 1 . . . . . 108 GLN N . 52882 2
416 . 2 . 2 129 129 PHE H H 1 8.802 0.001 . 1 . . . . . 109 PHE H . 52882 2
417 . 2 . 2 129 129 PHE CA C 13 54.440 0.000 . 1 . . . . . 109 PHE CA . 52882 2
418 . 2 . 2 129 129 PHE CB C 13 37.954 0.000 . 1 . . . . . 109 PHE CB . 52882 2
419 . 2 . 2 129 129 PHE N N 15 129.540 0.014 . 1 . . . . . 109 PHE N . 52882 2
stop_
save_