Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 18109
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 18109 1
3 '3D CBCA(CO)NH' . . . 18109 1
5 '3D HNCACB' . . . 18109 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 52 52 HIS H H 1 9.405 0.002 . 1 . . . . 52 HIS HN . 18109 1
2 . 1 1 52 52 HIS C C 13 171.560 0.006 . 1 . . . . 52 HIS C . 18109 1
3 . 1 1 52 52 HIS CA C 13 55.016 0.005 . 1 . . . . 52 HIS CA . 18109 1
4 . 1 1 52 52 HIS CB C 13 32.296 0.007 . 1 . . . . 52 HIS CB . 18109 1
5 . 1 1 52 52 HIS N N 15 126.512 0.003 . 1 . . . . 52 HIS N . 18109 1
6 . 1 1 53 53 LEU H H 1 9.408 0.005 . 1 . . . . 53 LEU HN . 18109 1
7 . 1 1 53 53 LEU C C 13 173.359 0.004 . 1 . . . . 53 LEU C . 18109 1
8 . 1 1 53 53 LEU CA C 13 54.152 0.002 . 1 . . . . 53 LEU CA . 18109 1
9 . 1 1 53 53 LEU CB C 13 44.860 0.005 . 1 . . . . 53 LEU CB . 18109 1
10 . 1 1 53 53 LEU N N 15 132.056 0.007 . 1 . . . . 53 LEU N . 18109 1
11 . 1 1 54 54 THR H H 1 9.197 0.004 . 1 . . . . 54 THR HN . 18109 1
12 . 1 1 54 54 THR C C 13 174.211 0.003 . 1 . . . . 54 THR C . 18109 1
13 . 1 1 54 54 THR CA C 13 61.361 0.004 . 1 . . . . 54 THR CA . 18109 1
14 . 1 1 54 54 THR CB C 13 71.426 0.006 . 1 . . . . 54 THR CB . 18109 1
15 . 1 1 54 54 THR N N 15 121.585 0.008 . 1 . . . . 54 THR N . 18109 1
16 . 1 1 55 55 TYR H H 1 9.021 0.002 . 1 . . . . 55 TYR HN . 18109 1
17 . 1 1 55 55 TYR C C 13 174.349 0.009 . 1 . . . . 55 TYR C . 18109 1
18 . 1 1 55 55 TYR CA C 13 56.302 0.002 . 1 . . . . 55 TYR CA . 18109 1
19 . 1 1 55 55 TYR CB C 13 42.749 0.001 . 1 . . . . 55 TYR CB . 18109 1
20 . 1 1 55 55 TYR N N 15 126.047 0.006 . 1 . . . . 55 TYR N . 18109 1
21 . 1 1 56 56 GLU H H 1 8.839 0.004 . 1 . . . . 56 GLU HN . 18109 1
22 . 1 1 56 56 GLU C C 13 175.510 0.001 . 1 . . . . 56 GLU C . 18109 1
23 . 1 1 56 56 GLU CA C 13 56.031 0.006 . 1 . . . . 56 GLU CA . 18109 1
24 . 1 1 56 56 GLU CB C 13 35.741 0.002 . 1 . . . . 56 GLU CB . 18109 1
25 . 1 1 56 56 GLU N N 15 118.604 0.002 . 1 . . . . 56 GLU N . 18109 1
26 . 1 1 57 57 ILE H H 1 9.197 0.006 . 1 . . . . 57 ILE HN . 18109 1
27 . 1 1 57 57 ILE C C 13 175.005 0.009 . 1 . . . . 57 ILE C . 18109 1
28 . 1 1 57 57 ILE CA C 13 57.569 0.003 . 1 . . . . 57 ILE CA . 18109 1
29 . 1 1 57 57 ILE CB C 13 37.253 0.009 . 1 . . . . 57 ILE CB . 18109 1
30 . 1 1 57 57 ILE N N 15 121.585 0.007 . 1 . . . . 57 ILE N . 18109 1
31 . 1 1 58 58 PHE H H 1 8.006 0.004 . 1 . . . . 58 PHE HN . 18109 1
32 . 1 1 58 58 PHE C C 13 174.700 0.004 . 1 . . . . 58 PHE C . 18109 1
33 . 1 1 58 58 PHE CA C 13 54.667 0.004 . 1 . . . . 58 PHE CA . 18109 1
34 . 1 1 58 58 PHE CB C 13 41.574 0.002 . 1 . . . . 58 PHE CB . 18109 1
35 . 1 1 58 58 PHE N N 15 123.827 0.001 . 1 . . . . 58 PHE N . 18109 1
36 . 1 1 59 59 GLY H H 1 9.032 0.001 . 1 . . . . 59 GLY HN . 18109 1
37 . 1 1 59 59 GLY C C 13 173.024 0.001 . 1 . . . . 59 GLY C . 18109 1
38 . 1 1 59 59 GLY CA C 13 45.596 0.004 . 1 . . . . 59 GLY CA . 18109 1
39 . 1 1 59 59 GLY N N 15 106.485 0.002 . 1 . . . . 59 GLY N . 18109 1
40 . 1 1 61 61 PRO CA C 13 64.732 0.005 . 1 . . . . 61 PRO CA . 18109 1
41 . 1 1 61 61 PRO CB C 13 31.580 0.007 . 1 . . . . 61 PRO CB . 18109 1
42 . 1 1 62 62 GLY H H 1 8.621 0.010 . 1 . . . . 62 GLY HN . 18109 1
43 . 1 1 62 62 GLY C C 13 177.204 0.005 . 1 . . . . 62 GLY C . 18109 1
44 . 1 1 62 62 GLY CA C 13 45.083 0.001 . 1 . . . . 62 GLY CA . 18109 1
45 . 1 1 62 62 GLY N N 15 113.354 0.007 . 1 . . . . 62 GLY N . 18109 1
46 . 1 1 63 63 THR H H 1 7.667 0.001 . 1 . . . . 63 THR HN . 18109 1
47 . 1 1 63 63 THR C C 13 174.675 0.005 . 1 . . . . 63 THR C . 18109 1
48 . 1 1 63 63 THR CA C 13 65.261 0.003 . 1 . . . . 63 THR CA . 18109 1
49 . 1 1 63 63 THR CB C 13 69.429 0.004 . 1 . . . . 63 THR CB . 18109 1
50 . 1 1 63 63 THR N N 15 117.221 0.003 . 1 . . . . 63 THR N . 18109 1
51 . 1 1 64 64 VAL H H 1 8.388 0.003 . 1 . . . . 64 VAL HN . 18109 1
52 . 1 1 64 64 VAL C C 13 173.319 0.009 . 1 . . . . 64 VAL C . 18109 1
53 . 1 1 64 64 VAL CA C 13 60.297 0.001 . 1 . . . . 64 VAL CA . 18109 1
54 . 1 1 64 64 VAL CB C 13 34.379 0.002 . 1 . . . . 64 VAL CB . 18109 1
55 . 1 1 64 64 VAL N N 15 127.791 0.009 . 1 . . . . 64 VAL N . 18109 1
56 . 1 1 65 65 ALA H H 1 9.279 0.005 . 1 . . . . 65 ALA HN . 18109 1
57 . 1 1 65 65 ALA C C 13 175.201 0.003 . 1 . . . . 65 ALA C . 18109 1
58 . 1 1 65 65 ALA CA C 13 49.941 0.007 . 1 . . . . 65 ALA CA . 18109 1
59 . 1 1 65 65 ALA CB C 13 24.604 0.008 . 1 . . . . 65 ALA CB . 18109 1
60 . 1 1 65 65 ALA N N 15 127.599 0.005 . 1 . . . . 65 ALA N . 18109 1
61 . 1 1 66 66 ASP H H 1 8.296 0.005 . 1 . . . . 66 ASP HN . 18109 1
62 . 1 1 66 66 ASP C C 13 174.420 0.001 . 1 . . . . 66 ASP C . 18109 1
63 . 1 1 66 66 ASP CA C 13 53.257 0.010 . 1 . . . . 66 ASP CA . 18109 1
64 . 1 1 66 66 ASP CB C 13 41.416 0.010 . 1 . . . . 66 ASP CB . 18109 1
65 . 1 1 66 66 ASP N N 15 120.082 0.006 . 1 . . . . 66 ASP N . 18109 1
66 . 1 1 67 67 ILE H H 1 8.908 0.009 . 1 . . . . 67 ILE HN . 18109 1
67 . 1 1 67 67 ILE C C 13 176.214 0.009 . 1 . . . . 67 ILE C . 18109 1
68 . 1 1 67 67 ILE CA C 13 60.154 0.003 . 1 . . . . 67 ILE CA . 18109 1
69 . 1 1 67 67 ILE N N 15 126.775 0.005 . 1 . . . . 67 ILE N . 18109 1
70 . 1 1 68 68 SER H H 1 8.635 0.009 . 1 . . . . 68 SER HN . 18109 1
71 . 1 1 68 68 SER C C 13 175.217 0.009 . 1 . . . . 68 SER C . 18109 1
72 . 1 1 68 68 SER CA C 13 57.050 0.001 . 1 . . . . 68 SER CA . 18109 1
73 . 1 1 68 68 SER CB C 13 64.108 0.006 . 1 . . . . 68 SER CB . 18109 1
74 . 1 1 68 68 SER N N 15 121.726 0.002 . 1 . . . . 68 SER N . 18109 1
75 . 1 1 69 69 TYR H H 1 8.766 0.004 . 1 . . . . 69 TYR HN . 18109 1
76 . 1 1 69 69 TYR C C 13 173.378 0.004 . 1 . . . . 69 TYR C . 18109 1
77 . 1 1 69 69 TYR CA C 13 55.030 0.009 . 1 . . . . 69 TYR CA . 18109 1
78 . 1 1 69 69 TYR CB C 13 42.056 0.008 . 1 . . . . 69 TYR CB . 18109 1
79 . 1 1 69 69 TYR N N 15 124.426 0.007 . 1 . . . . 69 TYR N . 18109 1
80 . 1 1 70 70 PHE CA C 13 56.893 0.008 . 1 . . . . 70 PHE CA . 18109 1
81 . 1 1 70 70 PHE CB C 13 39.834 0.008 . 1 . . . . 70 PHE CB . 18109 1
82 . 1 1 71 71 ASP H H 1 8.647 0.008 . 1 . . . . 71 ASP HN . 18109 1
83 . 1 1 71 71 ASP C C 13 176.624 0.001 . 1 . . . . 71 ASP C . 18109 1
84 . 1 1 71 71 ASP CA C 13 52.492 0.007 . 1 . . . . 71 ASP CA . 18109 1
85 . 1 1 71 71 ASP CB C 13 42.045 0.001 . 1 . . . . 71 ASP CB . 18109 1
86 . 1 1 71 71 ASP N N 15 125.780 0.009 . 1 . . . . 71 ASP N . 18109 1
87 . 1 1 72 72 VAL H H 1 8.394 0.004 . 1 . . . . 72 VAL HN . 18109 1
88 . 1 1 72 72 VAL C C 13 177.370 0.001 . 1 . . . . 72 VAL C . 18109 1
89 . 1 1 72 72 VAL CA C 13 64.461 0.005 . 1 . . . . 72 VAL CA . 18109 1
90 . 1 1 72 72 VAL N N 15 115.966 0.002 . 1 . . . . 72 VAL N . 18109 1
91 . 1 1 73 73 ASN H H 1 8.334 0.008 . 1 . . . . 73 ASN HN . 18109 1
92 . 1 1 73 73 ASN C C 13 175.139 0.002 . 1 . . . . 73 ASN C . 18109 1
93 . 1 1 73 73 ASN CA C 13 52.905 0.002 . 1 . . . . 73 ASN CA . 18109 1
94 . 1 1 73 73 ASN CB C 13 38.843 0.003 . 1 . . . . 73 ASN CB . 18109 1
95 . 1 1 73 73 ASN N N 15 119.555 0.001 . 1 . . . . 73 ASN N . 18109 1
96 . 1 1 74 74 SER H H 1 8.611 0.005 . 1 . . . . 74 SER HN . 18109 1
97 . 1 1 74 74 SER C C 13 174.889 0.007 . 1 . . . . 74 SER C . 18109 1
98 . 1 1 74 74 SER CA C 13 59.355 0.002 . 1 . . . . 74 SER CA . 18109 1
99 . 1 1 74 74 SER CB C 13 61.632 0.006 . 1 . . . . 74 SER CB . 18109 1
100 . 1 1 74 74 SER N N 15 112.417 0.002 . 1 . . . . 74 SER N . 18109 1
101 . 1 1 75 75 GLU H H 1 8.130 0.009 . 1 . . . . 75 GLU HN . 18109 1
102 . 1 1 75 75 GLU C C 13 172.547 0.008 . 1 . . . . 75 GLU C . 18109 1
103 . 1 1 75 75 GLU CA C 13 52.446 0.003 . 1 . . . . 75 GLU CA . 18109 1
104 . 1 1 75 75 GLU CB C 13 30.287 0.007 . 1 . . . . 75 GLU CB . 18109 1
105 . 1 1 75 75 GLU N N 15 119.181 0.001 . 1 . . . . 75 GLU N . 18109 1
106 . 1 1 76 76 PRO CA C 13 61.721 0.005 . 1 . . . . 76 PRO CA . 18109 1
107 . 1 1 76 76 PRO CB C 13 31.315 0.008 . 1 . . . . 76 PRO CB . 18109 1
108 . 1 1 77 77 GLN H H 1 8.704 0.008 . 1 . . . . 77 GLN HN . 18109 1
109 . 1 1 77 77 GLN C C 13 176.501 0.009 . 1 . . . . 77 GLN C . 18109 1
110 . 1 1 77 77 GLN CA C 13 52.808 0.009 . 1 . . . . 77 GLN CA . 18109 1
111 . 1 1 77 77 GLN CB C 13 29.877 0.002 . 1 . . . . 77 GLN CB . 18109 1
112 . 1 1 77 77 GLN N N 15 122.371 0.010 . 1 . . . . 77 GLN N . 18109 1
113 . 1 1 78 78 ARG H H 1 8.401 0.002 . 1 . . . . 78 ARG HN . 18109 1
114 . 1 1 78 78 ARG C C 13 174.365 0.006 . 1 . . . . 78 ARG C . 18109 1
115 . 1 1 78 78 ARG CA C 13 54.608 0.001 . 1 . . . . 78 ARG CA . 18109 1
116 . 1 1 78 78 ARG CB C 13 33.391 0.001 . 1 . . . . 78 ARG CB . 18109 1
117 . 1 1 78 78 ARG N N 15 120.631 0.006 . 1 . . . . 78 ARG N . 18109 1
118 . 1 1 79 79 VAL H H 1 9.149 0.004 . 1 . . . . 79 VAL HN . 18109 1
119 . 1 1 79 79 VAL C C 13 176.384 0.005 . 1 . . . . 79 VAL C . 18109 1
120 . 1 1 79 79 VAL CA C 13 61.689 0.004 . 1 . . . . 79 VAL CA . 18109 1
121 . 1 1 79 79 VAL CB C 13 33.623 0.002 . 1 . . . . 79 VAL CB . 18109 1
122 . 1 1 79 79 VAL N N 15 126.083 0.002 . 1 . . . . 79 VAL N . 18109 1
123 . 1 1 80 80 ASP H H 1 8.625 0.010 . 1 . . . . 80 ASP HN . 18109 1
124 . 1 1 80 80 ASP C C 13 174.088 0.009 . 1 . . . . 80 ASP C . 18109 1
125 . 1 1 80 80 ASP CA C 13 53.264 0.002 . 1 . . . . 80 ASP CA . 18109 1
126 . 1 1 80 80 ASP CB C 13 41.789 0.003 . 1 . . . . 80 ASP CB . 18109 1
127 . 1 1 80 80 ASP N N 15 127.135 0.003 . 1 . . . . 80 ASP N . 18109 1
128 . 1 1 81 81 GLY H H 1 9.056 0.008 . 1 . . . . 81 GLY HN . 18109 1
129 . 1 1 81 81 GLY C C 13 177.421 0.002 . 1 . . . . 81 GLY C . 18109 1
130 . 1 1 81 81 GLY CA C 13 47.682 0.006 . 1 . . . . 81 GLY CA . 18109 1
131 . 1 1 81 81 GLY N N 15 113.975 0.010 . 1 . . . . 81 GLY N . 18109 1
132 . 1 1 82 82 ALA H H 1 8.610 0.005 . 1 . . . . 82 ALA HN . 18109 1
133 . 1 1 82 82 ALA C C 13 175.019 0.002 . 1 . . . . 82 ALA C . 18109 1
134 . 1 1 82 82 ALA CA C 13 52.067 0.003 . 1 . . . . 82 ALA CA . 18109 1
135 . 1 1 82 82 ALA CB C 13 19.314 0.010 . 1 . . . . 82 ALA CB . 18109 1
136 . 1 1 82 82 ALA N N 15 123.446 0.004 . 1 . . . . 82 ALA N . 18109 1
137 . 1 1 83 83 VAL H H 1 8.447 0.008 . 1 . . . . 83 VAL HN . 18109 1
138 . 1 1 83 83 VAL C C 13 176.632 0.001 . 1 . . . . 83 VAL C . 18109 1
139 . 1 1 83 83 VAL CA C 13 62.613 0.007 . 1 . . . . 83 VAL CA . 18109 1
140 . 1 1 83 83 VAL CB C 13 31.635 0.010 . 1 . . . . 83 VAL CB . 18109 1
141 . 1 1 83 83 VAL N N 15 124.299 0.010 . 1 . . . . 83 VAL N . 18109 1
142 . 1 1 84 84 LEU H H 1 7.639 0.008 . 1 . . . . 84 LEU HN . 18109 1
143 . 1 1 84 84 LEU C C 13 176.379 0.001 . 1 . . . . 84 LEU C . 18109 1
144 . 1 1 84 84 LEU CA C 13 53.830 0.008 . 1 . . . . 84 LEU CA . 18109 1
145 . 1 1 84 84 LEU CB C 13 38.322 0.004 . 1 . . . . 84 LEU CB . 18109 1
146 . 1 1 84 84 LEU N N 15 125.085 0.008 . 1 . . . . 84 LEU N . 18109 1
147 . 1 1 85 85 PRO CA C 13 62.677 0.003 . 1 . . . . 85 PRO CA . 18109 1
148 . 1 1 85 85 PRO CB C 13 35.217 0.006 . 1 . . . . 85 PRO CB . 18109 1
149 . 1 1 86 86 TRP H H 1 8.751 0.003 . 1 . . . . 86 TRP HN . 18109 1
150 . 1 1 86 86 TRP C C 13 176.501 0.005 . 1 . . . . 86 TRP C . 18109 1
151 . 1 1 86 86 TRP CA C 13 56.861 0.005 . 1 . . . . 86 TRP CA . 18109 1
152 . 1 1 86 86 TRP CB C 13 33.799 0.007 . 1 . . . . 86 TRP CB . 18109 1
153 . 1 1 86 86 TRP N N 15 123.282 0.002 . 1 . . . . 86 TRP N . 18109 1
154 . 1 1 87 87 SER H H 1 7.383 0.004 . 1 . . . . 87 SER HN . 18109 1
155 . 1 1 87 87 SER C C 13 174.477 0.004 . 1 . . . . 87 SER C . 18109 1
156 . 1 1 87 87 SER CA C 13 56.604 0.008 . 1 . . . . 87 SER CA . 18109 1
157 . 1 1 87 87 SER CB C 13 66.566 0.007 . 1 . . . . 87 SER CB . 18109 1
158 . 1 1 87 87 SER N N 15 120.324 0.002 . 1 . . . . 87 SER N . 18109 1
159 . 1 1 88 88 LEU H H 1 7.863 0.003 . 1 . . . . 88 LEU HN . 18109 1
160 . 1 1 88 88 LEU C C 13 171.207 0.002 . 1 . . . . 88 LEU C . 18109 1
161 . 1 1 88 88 LEU CA C 13 54.816 0.008 . 1 . . . . 88 LEU CA . 18109 1
162 . 1 1 88 88 LEU CB C 13 47.100 0.002 . 1 . . . . 88 LEU CB . 18109 1
163 . 1 1 88 88 LEU N N 15 120.876 0.002 . 1 . . . . 88 LEU N . 18109 1
164 . 1 1 89 89 HIS H H 1 8.443 0.009 . 1 . . . . 89 HIS HN . 18109 1
165 . 1 1 89 89 HIS C C 13 173.758 0.005 . 1 . . . . 89 HIS C . 18109 1
166 . 1 1 89 89 HIS CA C 13 54.688 0.004 . 1 . . . . 89 HIS CA . 18109 1
167 . 1 1 89 89 HIS CB C 13 32.548 0.002 . 1 . . . . 89 HIS CB . 18109 1
168 . 1 1 89 89 HIS N N 15 125.317 0.002 . 1 . . . . 89 HIS N . 18109 1
169 . 1 1 90 90 ILE H H 1 9.591 0.006 . 1 . . . . 90 ILE HN . 18109 1
170 . 1 1 90 90 ILE C C 13 175.112 0.006 . 1 . . . . 90 ILE C . 18109 1
171 . 1 1 90 90 ILE CA C 13 60.656 0.003 . 1 . . . . 90 ILE CA . 18109 1
172 . 1 1 90 90 ILE CB C 13 41.853 0.009 . 1 . . . . 90 ILE CB . 18109 1
173 . 1 1 90 90 ILE N N 15 125.183 0.002 . 1 . . . . 90 ILE N . 18109 1
174 . 1 1 91 91 THR H H 1 8.494 0.001 . 1 . . . . 91 THR HN . 18109 1
175 . 1 1 91 91 THR C C 13 174.339 0.007 . 1 . . . . 91 THR C . 18109 1
176 . 1 1 91 91 THR CA C 13 60.560 0.001 . 1 . . . . 91 THR CA . 18109 1
177 . 1 1 91 91 THR CB C 13 70.316 0.008 . 1 . . . . 91 THR CB . 18109 1
178 . 1 1 91 91 THR N N 15 121.219 0.007 . 1 . . . . 91 THR N . 18109 1
179 . 1 1 92 92 THR H H 1 8.730 0.002 . 1 . . . . 92 THR HN . 18109 1
180 . 1 1 92 92 THR C C 13 173.834 0.005 . 1 . . . . 92 THR C . 18109 1
181 . 1 1 92 92 THR CA C 13 59.279 0.004 . 1 . . . . 92 THR CA . 18109 1
182 . 1 1 92 92 THR CB C 13 69.963 0.010 . 1 . . . . 92 THR CB . 18109 1
183 . 1 1 92 92 THR N N 15 117.645 0.007 . 1 . . . . 92 THR N . 18109 1
184 . 1 1 94 94 ASP CA C 13 54.152 0.005 . 1 . . . . 94 ASP CA . 18109 1
185 . 1 1 94 94 ASP CB C 13 41.689 0.007 . 1 . . . . 94 ASP CB . 18109 1
186 . 1 1 95 95 ALA H H 1 8.080 0.001 . 1 . . . . 95 ALA HN . 18109 1
187 . 1 1 95 95 ALA C C 13 175.161 0.008 . 1 . . . . 95 ALA C . 18109 1
188 . 1 1 95 95 ALA CA C 13 52.503 0.004 . 1 . . . . 95 ALA CA . 18109 1
189 . 1 1 95 95 ALA CB C 13 19.530 0.002 . 1 . . . . 95 ALA CB . 18109 1
190 . 1 1 95 95 ALA N N 15 123.405 0.002 . 1 . . . . 95 ALA N . 18109 1
191 . 1 1 96 96 ALA H H 1 8.139 0.008 . 1 . . . . 96 ALA HN . 18109 1
192 . 1 1 96 96 ALA C C 13 177.072 0.001 . 1 . . . . 96 ALA C . 18109 1
193 . 1 1 96 96 ALA CA C 13 52.312 0.003 . 1 . . . . 96 ALA CA . 18109 1
194 . 1 1 96 96 ALA CB C 13 19.404 0.005 . 1 . . . . 96 ALA CB . 18109 1
195 . 1 1 96 96 ALA N N 15 121.842 0.004 . 1 . . . . 96 ALA N . 18109 1
196 . 1 1 97 97 VAL H H 1 7.586 0.007 . 1 . . . . 97 VAL HN . 18109 1
197 . 1 1 97 97 VAL C C 13 176.981 0.002 . 1 . . . . 97 VAL C . 18109 1
198 . 1 1 97 97 VAL CA C 13 62.127 0.003 . 1 . . . . 97 VAL CA . 18109 1
199 . 1 1 97 97 VAL CB C 13 33.377 0.007 . 1 . . . . 97 VAL CB . 18109 1
200 . 1 1 97 97 VAL N N 15 119.316 0.008 . 1 . . . . 97 VAL N . 18109 1
201 . 1 1 98 98 MET H H 1 8.129 0.004 . 1 . . . . 98 MET HN . 18109 1
202 . 1 1 98 98 MET C C 13 174.476 0.007 . 1 . . . . 98 MET C . 18109 1
203 . 1 1 98 98 MET CA C 13 54.422 0.001 . 1 . . . . 98 MET CA . 18109 1
204 . 1 1 98 98 MET CB C 13 33.489 0.005 . 1 . . . . 98 MET CB . 18109 1
205 . 1 1 98 98 MET N N 15 124.733 0.008 . 1 . . . . 98 MET N . 18109 1
206 . 1 1 99 99 GLY H H 1 8.440 0.005 . 1 . . . . 99 GLY HN . 18109 1
207 . 1 1 99 99 GLY C C 13 174.643 0.008 . 1 . . . . 99 GLY C . 18109 1
208 . 1 1 99 99 GLY CA C 13 45.691 0.007 . 1 . . . . 99 GLY CA . 18109 1
209 . 1 1 99 99 GLY N N 15 107.986 0.003 . 1 . . . . 99 GLY N . 18109 1
210 . 1 1 100 100 ASN H H 1 8.511 0.008 . 1 . . . . 100 ASN HN . 18109 1
211 . 1 1 100 100 ASN C C 13 172.443 0.008 . 1 . . . . 100 ASN C . 18109 1
212 . 1 1 100 100 ASN CA C 13 53.464 0.009 . 1 . . . . 100 ASN CA . 18109 1
213 . 1 1 100 100 ASN CB C 13 40.502 0.005 . 1 . . . . 100 ASN CB . 18109 1
214 . 1 1 100 100 ASN N N 15 126.559 0.001 . 1 . . . . 100 ASN N . 18109 1
215 . 1 1 101 101 ILE H H 1 8.966 0.009 . 1 . . . . 101 ILE HN . 18109 1
216 . 1 1 101 101 ILE C C 13 172.509 0.006 . 1 . . . . 101 ILE C . 18109 1
217 . 1 1 101 101 ILE CA C 13 59.667 0.006 . 1 . . . . 101 ILE CA . 18109 1
218 . 1 1 101 101 ILE CB C 13 40.835 0.002 . 1 . . . . 101 ILE CB . 18109 1
219 . 1 1 101 101 ILE N N 15 124.340 0.005 . 1 . . . . 101 ILE N . 18109 1
220 . 1 1 102 102 VAL H H 1 8.760 0.003 . 1 . . . . 102 VAL HN . 18109 1
221 . 1 1 102 102 VAL C C 13 171.062 0.003 . 1 . . . . 102 VAL C . 18109 1
222 . 1 1 102 102 VAL CA C 13 59.632 0.005 . 1 . . . . 102 VAL CA . 18109 1
223 . 1 1 102 102 VAL CB C 13 35.427 0.004 . 1 . . . . 102 VAL CB . 18109 1
224 . 1 1 102 102 VAL N N 15 122.838 0.004 . 1 . . . . 102 VAL N . 18109 1
225 . 1 1 103 103 ALA H H 1 8.233 0.004 . 1 . . . . 103 ALA HN . 18109 1
226 . 1 1 103 103 ALA C C 13 174.024 0.001 . 1 . . . . 103 ALA C . 18109 1
227 . 1 1 103 103 ALA CA C 13 50.956 0.001 . 1 . . . . 103 ALA CA . 18109 1
228 . 1 1 103 103 ALA CB C 13 24.772 0.007 . 1 . . . . 103 ALA CB . 18109 1
229 . 1 1 103 103 ALA N N 15 122.104 0.004 . 1 . . . . 103 ALA N . 18109 1
230 . 1 1 104 104 GLN H H 1 8.401 0.009 . 1 . . . . 104 GLN HN . 18109 1
231 . 1 1 104 104 GLN C C 13 173.901 0.005 . 1 . . . . 104 GLN C . 18109 1
232 . 1 1 104 104 GLN CA C 13 54.263 0.005 . 1 . . . . 104 GLN CA . 18109 1
233 . 1 1 104 104 GLN CB C 13 32.034 0.004 . 1 . . . . 104 GLN CB . 18109 1
234 . 1 1 104 104 GLN N N 15 120.631 0.004 . 1 . . . . 104 GLN N . 18109 1
235 . 1 1 105 105 GLY H H 1 8.929 0.004 . 1 . . . . 105 GLY HN . 18109 1
236 . 1 1 105 105 GLY C C 13 175.094 0.009 . 1 . . . . 105 GLY C . 18109 1
237 . 1 1 105 105 GLY CA C 13 44.529 0.009 . 1 . . . . 105 GLY CA . 18109 1
238 . 1 1 105 105 GLY N N 15 115.985 0.001 . 1 . . . . 105 GLY N . 18109 1
239 . 1 1 106 106 ASN H H 1 7.797 0.002 . 1 . . . . 106 ASN HN . 18109 1
240 . 1 1 106 106 ASN C C 13 173.643 0.001 . 1 . . . . 106 ASN C . 18109 1
241 . 1 1 106 106 ASN CA C 13 51.607 0.008 . 1 . . . . 106 ASN CA . 18109 1
242 . 1 1 106 106 ASN CB C 13 38.327 0.008 . 1 . . . . 106 ASN CB . 18109 1
243 . 1 1 106 106 ASN N N 15 115.218 0.002 . 1 . . . . 106 ASN N . 18109 1
244 . 1 1 107 107 SER H H 1 8.491 0.001 . 1 . . . . 107 SER HN . 18109 1
245 . 1 1 107 107 SER C C 13 175.984 0.009 . 1 . . . . 107 SER C . 18109 1
246 . 1 1 107 107 SER CA C 13 56.460 0.003 . 1 . . . . 107 SER CA . 18109 1
247 . 1 1 107 107 SER CB C 13 65.300 0.006 . 1 . . . . 107 SER CB . 18109 1
248 . 1 1 107 107 SER N N 15 118.363 0.003 . 1 . . . . 107 SER N . 18109 1
249 . 1 1 108 108 ASP H H 1 8.303 0.001 . 1 . . . . 108 ASP HN . 18109 1
250 . 1 1 108 108 ASP C C 13 173.736 0.007 . 1 . . . . 108 ASP C . 18109 1
251 . 1 1 108 108 ASP CA C 13 53.828 0.008 . 1 . . . . 108 ASP CA . 18109 1
252 . 1 1 108 108 ASP CB C 13 40.047 0.009 . 1 . . . . 108 ASP CB . 18109 1
253 . 1 1 108 108 ASP N N 15 118.003 0.003 . 1 . . . . 108 ASP N . 18109 1
254 . 1 1 109 109 SER H H 1 7.419 0.007 . 1 . . . . 109 SER HN . 18109 1
255 . 1 1 109 109 SER C C 13 175.977 0.007 . 1 . . . . 109 SER C . 18109 1
256 . 1 1 109 109 SER CA C 13 57.183 0.003 . 1 . . . . 109 SER CA . 18109 1
257 . 1 1 109 109 SER CB C 13 64.846 0.006 . 1 . . . . 109 SER CB . 18109 1
258 . 1 1 109 109 SER N N 15 110.418 0.003 . 1 . . . . 109 SER N . 18109 1
259 . 1 1 110 110 ILE H H 1 8.145 0.005 . 1 . . . . 110 ILE HN . 18109 1
260 . 1 1 110 110 ILE C C 13 172.732 0.005 . 1 . . . . 110 ILE C . 18109 1
261 . 1 1 110 110 ILE CA C 13 61.314 0.001 . 1 . . . . 110 ILE CA . 18109 1
262 . 1 1 110 110 ILE CB C 13 39.980 0.001 . 1 . . . . 110 ILE CB . 18109 1
263 . 1 1 110 110 ILE N N 15 121.333 0.007 . 1 . . . . 110 ILE N . 18109 1
264 . 1 1 111 111 GLY H H 1 8.608 0.008 . 1 . . . . 111 GLY HN . 18109 1
265 . 1 1 111 111 GLY C C 13 171.606 0.007 . 1 . . . . 111 GLY C . 18109 1
266 . 1 1 111 111 GLY CA C 13 44.072 0.006 . 1 . . . . 111 GLY CA . 18109 1
267 . 1 1 111 111 GLY N N 15 111.458 0.002 . 1 . . . . 111 GLY N . 18109 1
268 . 1 1 112 112 CYS H H 1 8.235 0.001 . 1 . . . . 112 CYS HN . 18109 1
269 . 1 1 112 112 CYS C C 13 170.769 0.001 . 1 . . . . 112 CYS C . 18109 1
270 . 1 1 112 112 CYS CA C 13 50.865 0.004 . 1 . . . . 112 CYS CA . 18109 1
271 . 1 1 112 112 CYS CB C 13 46.082 0.002 . 1 . . . . 112 CYS CB . 18109 1
272 . 1 1 112 112 CYS N N 15 112.973 0.002 . 1 . . . . 112 CYS N . 18109 1
273 . 1 1 113 113 ARG H H 1 9.020 0.002 . 1 . . . . 113 ARG HN . 18109 1
274 . 1 1 113 113 ARG C C 13 172.527 0.004 . 1 . . . . 113 ARG C . 18109 1
275 . 1 1 113 113 ARG CA C 13 55.661 0.001 . 1 . . . . 113 ARG CA . 18109 1
276 . 1 1 113 113 ARG CB C 13 35.308 0.003 . 1 . . . . 113 ARG CB . 18109 1
277 . 1 1 113 113 ARG N N 15 120.456 0.003 . 1 . . . . 113 ARG N . 18109 1
278 . 1 1 114 114 ILE H H 1 8.938 0.008 . 1 . . . . 114 ILE HN . 18109 1
279 . 1 1 114 114 ILE C C 13 176.770 0.010 . 1 . . . . 114 ILE C . 18109 1
280 . 1 1 114 114 ILE CA C 13 60.679 0.004 . 1 . . . . 114 ILE CA . 18109 1
281 . 1 1 114 114 ILE CB C 13 40.640 0.004 . 1 . . . . 114 ILE CB . 18109 1
282 . 1 1 114 114 ILE N N 15 123.705 0.003 . 1 . . . . 114 ILE N . 18109 1
283 . 1 1 115 115 THR H H 1 8.752 0.002 . 1 . . . . 115 THR HN . 18109 1
284 . 1 1 115 115 THR C C 13 175.068 0.004 . 1 . . . . 115 THR C . 18109 1
285 . 1 1 115 115 THR CA C 13 61.577 0.003 . 1 . . . . 115 THR CA . 18109 1
286 . 1 1 115 115 THR CB C 13 69.700 0.005 . 1 . . . . 115 THR CB . 18109 1
287 . 1 1 115 115 THR N N 15 126.850 0.008 . 1 . . . . 115 THR N . 18109 1
288 . 1 1 116 116 VAL H H 1 9.049 0.006 . 1 . . . . 116 VAL HN . 18109 1
289 . 1 1 116 116 VAL C C 13 173.410 0.005 . 1 . . . . 116 VAL C . 18109 1
290 . 1 1 116 116 VAL CA C 13 60.900 0.006 . 1 . . . . 116 VAL CA . 18109 1
291 . 1 1 116 116 VAL CB C 13 34.359 0.007 . 1 . . . . 116 VAL CB . 18109 1
292 . 1 1 116 116 VAL N N 15 125.632 0.004 . 1 . . . . 116 VAL N . 18109 1
293 . 1 1 117 117 ASP CA C 13 56.082 0.005 . 1 . . . . 117 ASP CA . 18109 1
294 . 1 1 117 117 ASP CB C 13 39.595 0.002 . 1 . . . . 117 ASP CB . 18109 1
295 . 1 1 118 118 GLY H H 1 8.590 0.006 . 1 . . . . 118 GLY HN . 18109 1
296 . 1 1 118 118 GLY C C 13 176.212 0.003 . 1 . . . . 118 GLY C . 18109 1
297 . 1 1 118 118 GLY CA C 13 45.253 0.003 . 1 . . . . 118 GLY CA . 18109 1
298 . 1 1 118 118 GLY N N 15 102.511 0.001 . 1 . . . . 118 GLY N . 18109 1
299 . 1 1 119 119 LYS H H 1 7.821 0.006 . 1 . . . . 119 LYS HN . 18109 1
300 . 1 1 119 119 LYS C C 13 177.250 0.007 . 1 . . . . 119 LYS C . 18109 1
301 . 1 1 119 119 LYS CA C 13 53.994 0.002 . 1 . . . . 119 LYS CA . 18109 1
302 . 1 1 119 119 LYS CB C 13 34.226 0.007 . 1 . . . . 119 LYS CB . 18109 1
303 . 1 1 119 119 LYS N N 15 121.052 0.009 . 1 . . . . 119 LYS N . 18109 1
304 . 1 1 120 120 VAL H H 1 9.113 0.003 . 1 . . . . 120 VAL HN . 18109 1
305 . 1 1 120 120 VAL C C 13 175.773 0.003 . 1 . . . . 120 VAL C . 18109 1
306 . 1 1 120 120 VAL CA C 13 65.032 0.010 . 1 . . . . 120 VAL CA . 18109 1
307 . 1 1 120 120 VAL CB C 13 31.352 0.003 . 1 . . . . 120 VAL CB . 18109 1
308 . 1 1 120 120 VAL N N 15 127.727 0.009 . 1 . . . . 120 VAL N . 18109 1
309 . 1 1 121 121 ARG H H 1 8.948 0.007 . 1 . . . . 121 ARG HN . 18109 1
310 . 1 1 121 121 ARG C C 13 176.643 0.008 . 1 . . . . 121 ARG C . 18109 1
311 . 1 1 121 121 ARG CA C 13 53.723 0.003 . 1 . . . . 121 ARG CA . 18109 1
312 . 1 1 121 121 ARG CB C 13 32.541 0.002 . 1 . . . . 121 ARG CB . 18109 1
313 . 1 1 121 121 ARG N N 15 127.209 0.008 . 1 . . . . 121 ARG N . 18109 1
314 . 1 1 122 122 ALA H H 1 7.698 0.004 . 1 . . . . 122 ALA HN . 18109 1
315 . 1 1 122 122 ALA C C 13 175.706 0.002 . 1 . . . . 122 ALA C . 18109 1
316 . 1 1 122 122 ALA CA C 13 52.368 0.002 . 1 . . . . 122 ALA CA . 18109 1
317 . 1 1 122 122 ALA CB C 13 23.018 0.008 . 1 . . . . 122 ALA CB . 18109 1
318 . 1 1 122 122 ALA N N 15 120.256 0.006 . 1 . . . . 122 ALA N . 18109 1
319 . 1 1 123 123 GLU H H 1 8.386 0.010 . 1 . . . . 123 GLU HN . 18109 1
320 . 1 1 123 123 GLU C C 13 174.973 0.001 . 1 . . . . 123 GLU C . 18109 1
321 . 1 1 123 123 GLU CA C 13 56.313 0.005 . 1 . . . . 123 GLU CA . 18109 1
322 . 1 1 123 123 GLU N N 15 122.328 0.008 . 1 . . . . 123 GLU N . 18109 1
323 . 1 1 124 124 ARG CA C 13 57.204 0.009 . 1 . . . . 124 ARG CA . 18109 1
324 . 1 1 124 124 ARG CB C 13 32.544 0.001 . 1 . . . . 124 ARG CB . 18109 1
325 . 1 1 125 125 VAL H H 1 8.934 0.001 . 1 . . . . 125 VAL HN . 18109 1
326 . 1 1 125 125 VAL C C 13 174.794 0.010 . 1 . . . . 125 VAL C . 18109 1
327 . 1 1 125 125 VAL CA C 13 61.079 0.003 . 1 . . . . 125 VAL CA . 18109 1
328 . 1 1 125 125 VAL N N 15 130.155 0.009 . 1 . . . . 125 VAL N . 18109 1
329 . 1 1 126 126 SER H H 1 8.947 0.005 . 1 . . . . 126 SER HN . 18109 1
330 . 1 1 126 126 SER C C 13 175.220 0.009 . 1 . . . . 126 SER C . 18109 1
331 . 1 1 126 126 SER CA C 13 55.974 0.005 . 1 . . . . 126 SER CA . 18109 1
332 . 1 1 126 126 SER CB C 13 65.862 0.008 . 1 . . . . 126 SER CB . 18109 1
333 . 1 1 126 126 SER N N 15 122.379 0.003 . 1 . . . . 126 SER N . 18109 1
334 . 1 1 127 127 ASN H H 1 8.660 0.003 . 1 . . . . 127 ASN HN . 18109 1
335 . 1 1 127 127 ASN C C 13 172.856 0.009 . 1 . . . . 127 ASN C . 18109 1
336 . 1 1 127 127 ASN CA C 13 52.530 0.010 . 1 . . . . 127 ASN CA . 18109 1
337 . 1 1 127 127 ASN CB C 13 39.920 0.008 . 1 . . . . 127 ASN CB . 18109 1
338 . 1 1 127 127 ASN N N 15 125.324 0.009 . 1 . . . . 127 ASN N . 18109 1
339 . 1 1 128 128 GLU H H 1 7.635 0.010 . 1 . . . . 128 GLU HN . 18109 1
340 . 1 1 128 128 GLU C C 13 173.524 0.004 . 1 . . . . 128 GLU C . 18109 1
341 . 1 1 128 128 GLU CA C 13 54.949 0.002 . 1 . . . . 128 GLU CA . 18109 1
342 . 1 1 128 128 GLU CB C 13 31.219 0.007 . 1 . . . . 128 GLU CB . 18109 1
343 . 1 1 128 128 GLU N N 15 120.936 0.005 . 1 . . . . 128 GLU N . 18109 1
344 . 1 1 129 129 VAL H H 1 8.069 0.005 . 1 . . . . 129 VAL HN . 18109 1
345 . 1 1 129 129 VAL C C 13 173.657 0.002 . 1 . . . . 129 VAL C . 18109 1
346 . 1 1 129 129 VAL CA C 13 64.109 0.009 . 1 . . . . 129 VAL CA . 18109 1
347 . 1 1 129 129 VAL CB C 13 31.488 0.001 . 1 . . . . 129 VAL CB . 18109 1
348 . 1 1 129 129 VAL N N 15 119.528 0.001 . 1 . . . . 129 VAL N . 18109 1
349 . 1 1 130 130 ASN H H 1 8.221 0.006 . 1 . . . . 130 ASN HN . 18109 1
350 . 1 1 130 130 ASN C C 13 176.831 0.005 . 1 . . . . 130 ASN C . 18109 1
351 . 1 1 130 130 ASN CA C 13 54.237 0.001 . 1 . . . . 130 ASN CA . 18109 1
352 . 1 1 130 130 ASN CB C 13 37.074 0.004 . 1 . . . . 130 ASN CB . 18109 1
353 . 1 1 130 130 ASN N N 15 123.643 0.008 . 1 . . . . 130 ASN N . 18109 1
354 . 1 1 131 131 ALA H H 1 7.612 0.003 . 1 . . . . 131 ALA HN . 18109 1
355 . 1 1 131 131 ALA C C 13 175.382 0.001 . 1 . . . . 131 ALA C . 18109 1
356 . 1 1 131 131 ALA CA C 13 54.281 0.004 . 1 . . . . 131 ALA CA . 18109 1
357 . 1 1 131 131 ALA CB C 13 20.170 0.006 . 1 . . . . 131 ALA CB . 18109 1
358 . 1 1 131 131 ALA N N 15 121.390 0.008 . 1 . . . . 131 ALA N . 18109 1
359 . 1 1 134 134 TYR CA C 13 53.371 0.009 . 1 . . . . 134 TYR CA . 18109 1
360 . 1 1 134 134 TYR CB C 13 38.941 0.004 . 1 . . . . 134 TYR CB . 18109 1
361 . 1 1 135 135 CYS H H 1 8.248 0.003 . 1 . . . . 135 CYS HN . 18109 1
362 . 1 1 135 135 CYS C C 13 175.088 0.005 . 1 . . . . 135 CYS C . 18109 1
363 . 1 1 135 135 CYS CA C 13 54.260 0.004 . 1 . . . . 135 CYS CA . 18109 1
364 . 1 1 135 135 CYS CB C 13 41.739 0.004 . 1 . . . . 135 CYS CB . 18109 1
365 . 1 1 135 135 CYS N N 15 120.283 0.005 . 1 . . . . 135 CYS N . 18109 1
366 . 1 1 138 138 LYS CA C 13 62.388 0.001 . 1 . . . . 138 LYS CA . 18109 1
367 . 1 1 138 138 LYS CB C 13 32.851 0.002 . 1 . . . . 138 LYS CB . 18109 1
368 . 1 1 139 139 SER H H 1 7.948 0.003 . 1 . . . . 139 SER HN . 18109 1
369 . 1 1 139 139 SER CA C 13 59.821 0.010 . 1 . . . . 139 SER CA . 18109 1
370 . 1 1 139 139 SER CB C 13 64.636 0.009 . 1 . . . . 139 SER CB . 18109 1
371 . 1 1 139 139 SER N N 15 124.771 0.006 . 1 . . . . 139 SER N . 18109 1
372 . 1 1 140 140 ALA CA C 13 52.641 0.006 . 1 . . . . 140 ALA CA . 18109 1
373 . 1 1 140 140 ALA CB C 13 19.427 0.010 . 1 . . . . 140 ALA CB . 18109 1
stop_
save_