Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11371
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11371 1
2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11371 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 $OPAL . . 11371 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 2 2 GLN C C 13 175.994 0.300 . 1 . . . . 2 GLN C . 11371 1
2 . 1 1 2 2 GLN CA C 13 55.775 0.300 . 1 . . . . 2 GLN CA . 11371 1
3 . 1 1 2 2 GLN CB C 13 30.106 0.300 . 1 . . . . 2 GLN CB . 11371 1
4 . 1 1 3 3 LYS H H 1 8.533 0.030 . 1 . . . . 3 LYS H . 11371 1
5 . 1 1 3 3 LYS C C 13 176.444 0.300 . 1 . . . . 3 LYS C . 11371 1
6 . 1 1 3 3 LYS CA C 13 56.382 0.300 . 1 . . . . 3 LYS CA . 11371 1
7 . 1 1 3 3 LYS CB C 13 33.077 0.300 . 1 . . . . 3 LYS CB . 11371 1
8 . 1 1 3 3 LYS N N 15 123.810 0.300 . 1 . . . . 3 LYS N . 11371 1
9 . 1 1 4 4 LYS H H 1 8.457 0.030 . 1 . . . . 4 LYS H . 11371 1
10 . 1 1 4 4 LYS C C 13 175.973 0.300 . 1 . . . . 4 LYS C . 11371 1
11 . 1 1 4 4 LYS CA C 13 56.236 0.300 . 1 . . . . 4 LYS CA . 11371 1
12 . 1 1 4 4 LYS CB C 13 33.129 0.300 . 1 . . . . 4 LYS CB . 11371 1
13 . 1 1 4 4 LYS N N 15 123.655 0.300 . 1 . . . . 4 LYS N . 11371 1
14 . 1 1 5 5 ASP H H 1 8.437 0.030 . 1 . . . . 5 ASP H . 11371 1
15 . 1 1 5 5 ASP C C 13 176.757 0.300 . 1 . . . . 5 ASP C . 11371 1
16 . 1 1 5 5 ASP CA C 13 54.184 0.300 . 1 . . . . 5 ASP CA . 11371 1
17 . 1 1 5 5 ASP CB C 13 41.259 0.300 . 1 . . . . 5 ASP CB . 11371 1
18 . 1 1 5 5 ASP N N 15 122.429 0.300 . 1 . . . . 5 ASP N . 11371 1
19 . 1 1 6 6 THR H H 1 8.222 0.030 . 1 . . . . 6 THR H . 11371 1
20 . 1 1 6 6 THR C C 13 175.539 0.300 . 1 . . . . 6 THR C . 11371 1
21 . 1 1 6 6 THR CA C 13 61.144 0.300 . 1 . . . . 6 THR CA . 11371 1
22 . 1 1 6 6 THR CB C 13 69.191 0.300 . 1 . . . . 6 THR CB . 11371 1
23 . 1 1 6 6 THR N N 15 114.849 0.300 . 1 . . . . 6 THR N . 11371 1
24 . 1 1 7 7 SER H H 1 8.311 0.030 . 1 . . . . 7 SER H . 11371 1
25 . 1 1 7 7 SER C C 13 174.477 0.300 . 1 . . . . 7 SER C . 11371 1
26 . 1 1 7 7 SER CA C 13 60.144 0.300 . 1 . . . . 7 SER CA . 11371 1
27 . 1 1 7 7 SER CB C 13 63.387 0.300 . 1 . . . . 7 SER CB . 11371 1
28 . 1 1 7 7 SER N N 15 118.739 0.300 . 1 . . . . 7 SER N . 11371 1
29 . 1 1 8 8 ASN H H 1 8.252 0.030 . 1 . . . . 8 ASN H . 11371 1
30 . 1 1 8 8 ASN C C 13 174.169 0.300 . 1 . . . . 8 ASN C . 11371 1
31 . 1 1 8 8 ASN CA C 13 52.866 0.300 . 1 . . . . 8 ASN CA . 11371 1
32 . 1 1 8 8 ASN CB C 13 38.705 0.300 . 1 . . . . 8 ASN CB . 11371 1
33 . 1 1 8 8 ASN N N 15 119.472 0.300 . 1 . . . . 8 ASN N . 11371 1
34 . 1 1 9 9 HIS H H 1 7.393 0.030 . 1 . . . . 9 HIS H . 11371 1
35 . 1 1 9 9 HIS C C 13 172.238 0.300 . 1 . . . . 9 HIS C . 11371 1
36 . 1 1 9 9 HIS CA C 13 53.915 0.300 . 1 . . . . 9 HIS CA . 11371 1
37 . 1 1 9 9 HIS CB C 13 32.206 0.300 . 1 . . . . 9 HIS CB . 11371 1
38 . 1 1 9 9 HIS N N 15 119.150 0.300 . 1 . . . . 9 HIS N . 11371 1
39 . 1 1 10 10 PHE H H 1 8.368 0.030 . 1 . . . . 10 PHE H . 11371 1
40 . 1 1 10 10 PHE C C 13 175.087 0.300 . 1 . . . . 10 PHE C . 11371 1
41 . 1 1 10 10 PHE CA C 13 58.434 0.300 . 1 . . . . 10 PHE CA . 11371 1
42 . 1 1 10 10 PHE CB C 13 40.842 0.300 . 1 . . . . 10 PHE CB . 11371 1
43 . 1 1 10 10 PHE N N 15 117.509 0.300 . 1 . . . . 10 PHE N . 11371 1
44 . 1 1 11 11 HIS H H 1 8.839 0.030 . 1 . . . . 11 HIS H . 11371 1
45 . 1 1 11 11 HIS C C 13 174.253 0.300 . 1 . . . . 11 HIS C . 11371 1
46 . 1 1 11 11 HIS CA C 13 56.602 0.300 . 1 . . . . 11 HIS CA . 11371 1
47 . 1 1 11 11 HIS CB C 13 33.233 0.300 . 1 . . . . 11 HIS CB . 11371 1
48 . 1 1 11 11 HIS N N 15 124.319 0.300 . 1 . . . . 11 HIS N . 11371 1
49 . 1 1 12 12 VAL H H 1 9.776 0.030 . 1 . . . . 12 VAL H . 11371 1
50 . 1 1 12 12 VAL C C 13 175.278 0.300 . 1 . . . . 12 VAL C . 11371 1
51 . 1 1 12 12 VAL CA C 13 62.219 0.300 . 1 . . . . 12 VAL CA . 11371 1
52 . 1 1 12 12 VAL CB C 13 33.915 0.300 . 1 . . . . 12 VAL CB . 11371 1
53 . 1 1 12 12 VAL N N 15 126.476 0.300 . 1 . . . . 12 VAL N . 11371 1
54 . 1 1 13 13 PHE H H 1 9.132 0.030 . 1 . . . . 13 PHE H . 11371 1
55 . 1 1 13 13 PHE C C 13 172.825 0.300 . 1 . . . . 13 PHE C . 11371 1
56 . 1 1 13 13 PHE CA C 13 57.285 0.300 . 1 . . . . 13 PHE CA . 11371 1
57 . 1 1 13 13 PHE CB C 13 40.841 0.300 . 1 . . . . 13 PHE CB . 11371 1
58 . 1 1 13 13 PHE N N 15 127.970 0.300 . 1 . . . . 13 PHE N . 11371 1
59 . 1 1 14 14 VAL H H 1 7.824 0.030 . 1 . . . . 14 VAL H . 11371 1
60 . 1 1 14 14 VAL C C 13 173.619 0.300 . 1 . . . . 14 VAL C . 11371 1
61 . 1 1 14 14 VAL CA C 13 59.606 0.300 . 1 . . . . 14 VAL CA . 11371 1
62 . 1 1 14 14 VAL CB C 13 32.660 0.300 . 1 . . . . 14 VAL CB . 11371 1
63 . 1 1 14 14 VAL N N 15 126.964 0.300 . 1 . . . . 14 VAL N . 11371 1
64 . 1 1 15 15 GLY H H 1 8.796 0.030 . 1 . . . . 15 GLY H . 11371 1
65 . 1 1 15 15 GLY C C 13 172.331 0.300 . 1 . . . . 15 GLY C . 11371 1
66 . 1 1 15 15 GLY CA C 13 43.489 0.300 . 1 . . . . 15 GLY CA . 11371 1
67 . 1 1 15 15 GLY N N 15 111.361 0.300 . 1 . . . . 15 GLY N . 11371 1
68 . 1 1 16 16 ASP H H 1 8.406 0.030 . 1 . . . . 16 ASP H . 11371 1
69 . 1 1 16 16 ASP C C 13 174.011 0.300 . 1 . . . . 16 ASP C . 11371 1
70 . 1 1 16 16 ASP CA C 13 55.524 0.300 . 1 . . . . 16 ASP CA . 11371 1
71 . 1 1 16 16 ASP CB C 13 38.861 0.300 . 1 . . . . 16 ASP CB . 11371 1
72 . 1 1 16 16 ASP N N 15 115.421 0.300 . 1 . . . . 16 ASP N . 11371 1
73 . 1 1 17 17 LEU C C 13 178.287 0.300 . 1 . . . . 17 LEU C . 11371 1
74 . 1 1 17 17 LEU CA C 13 53.194 0.300 . 1 . . . . 17 LEU CA . 11371 1
75 . 1 1 17 17 LEU CB C 13 43.030 0.300 . 1 . . . . 17 LEU CB . 11371 1
76 . 1 1 18 18 SER H H 1 8.887 0.030 . 1 . . . . 18 SER H . 11371 1
77 . 1 1 18 18 SER C C 13 174.703 0.300 . 1 . . . . 18 SER C . 11371 1
78 . 1 1 18 18 SER CA C 13 56.993 0.300 . 1 . . . . 18 SER CA . 11371 1
79 . 1 1 18 18 SER CB C 13 63.042 0.300 . 1 . . . . 18 SER CB . 11371 1
80 . 1 1 18 18 SER N N 15 120.856 0.300 . 1 . . . . 18 SER N . 11371 1
81 . 1 1 19 19 PRO C C 13 176.260 0.300 . 1 . . . . 19 PRO C . 11371 1
82 . 1 1 19 19 PRO CA C 13 65.467 0.300 . 1 . . . . 19 PRO CA . 11371 1
83 . 1 1 19 19 PRO CB C 13 31.982 0.300 . 1 . . . . 19 PRO CB . 11371 1
84 . 1 1 20 20 GLU H H 1 8.913 0.030 . 1 . . . . 20 GLU H . 11371 1
85 . 1 1 20 20 GLU C C 13 176.757 0.300 . 1 . . . . 20 GLU C . 11371 1
86 . 1 1 20 20 GLU CA C 13 56.651 0.300 . 1 . . . . 20 GLU CA . 11371 1
87 . 1 1 20 20 GLU CB C 13 29.116 0.300 . 1 . . . . 20 GLU CB . 11371 1
88 . 1 1 20 20 GLU N N 15 116.021 0.300 . 1 . . . . 20 GLU N . 11371 1
89 . 1 1 21 21 ILE H H 1 7.334 0.030 . 1 . . . . 21 ILE H . 11371 1
90 . 1 1 21 21 ILE C C 13 176.899 0.300 . 1 . . . . 21 ILE C . 11371 1
91 . 1 1 21 21 ILE CA C 13 59.435 0.300 . 1 . . . . 21 ILE CA . 11371 1
92 . 1 1 21 21 ILE CB C 13 35.213 0.300 . 1 . . . . 21 ILE CB . 11371 1
93 . 1 1 21 21 ILE N N 15 121.577 0.300 . 1 . . . . 21 ILE N . 11371 1
94 . 1 1 22 22 THR H H 1 9.366 0.030 . 1 . . . . 22 THR H . 11371 1
95 . 1 1 22 22 THR C C 13 176.276 0.300 . 1 . . . . 22 THR C . 11371 1
96 . 1 1 22 22 THR CA C 13 60.046 0.300 . 1 . . . . 22 THR CA . 11371 1
97 . 1 1 22 22 THR CB C 13 73.657 0.300 . 1 . . . . 22 THR CB . 11371 1
98 . 1 1 22 22 THR N N 15 120.890 0.300 . 1 . . . . 22 THR N . 11371 1
99 . 1 1 23 23 THR H H 1 9.003 0.030 . 1 . . . . 23 THR H . 11371 1
100 . 1 1 23 23 THR C C 13 175.474 0.300 . 1 . . . . 23 THR C . 11371 1
101 . 1 1 23 23 THR CA C 13 66.957 0.300 . 1 . . . . 23 THR CA . 11371 1
102 . 1 1 23 23 THR CB C 13 68.983 0.300 . 1 . . . . 23 THR CB . 11371 1
103 . 1 1 23 23 THR N N 15 118.103 0.300 . 1 . . . . 23 THR N . 11371 1
104 . 1 1 24 24 GLU H H 1 8.399 0.030 . 1 . . . . 24 GLU H . 11371 1
105 . 1 1 24 24 GLU C C 13 179.186 0.300 . 1 . . . . 24 GLU C . 11371 1
106 . 1 1 24 24 GLU CA C 13 60.436 0.300 . 1 . . . . 24 GLU CA . 11371 1
107 . 1 1 24 24 GLU CB C 13 28.595 0.300 . 1 . . . . 24 GLU CB . 11371 1
108 . 1 1 24 24 GLU N N 15 119.972 0.300 . 1 . . . . 24 GLU N . 11371 1
109 . 1 1 25 25 ASP H H 1 7.708 0.030 . 1 . . . . 25 ASP H . 11371 1
110 . 1 1 25 25 ASP C C 13 179.813 0.300 . 1 . . . . 25 ASP C . 11371 1
111 . 1 1 25 25 ASP CA C 13 57.505 0.300 . 1 . . . . 25 ASP CA . 11371 1
112 . 1 1 25 25 ASP CB C 13 41.675 0.300 . 1 . . . . 25 ASP CB . 11371 1
113 . 1 1 25 25 ASP N N 15 120.119 0.300 . 1 . . . . 25 ASP N . 11371 1
114 . 1 1 26 26 ILE H H 1 7.890 0.030 . 1 . . . . 26 ILE H . 11371 1
115 . 1 1 26 26 ILE C C 13 177.464 0.300 . 1 . . . . 26 ILE C . 11371 1
116 . 1 1 26 26 ILE CA C 13 64.221 0.300 . 1 . . . . 26 ILE CA . 11371 1
117 . 1 1 26 26 ILE CB C 13 37.142 0.300 . 1 . . . . 26 ILE CB . 11371 1
118 . 1 1 26 26 ILE N N 15 118.420 0.300 . 1 . . . . 26 ILE N . 11371 1
119 . 1 1 27 27 LYS H H 1 8.285 0.030 . 1 . . . . 27 LYS H . 11371 1
120 . 1 1 27 27 LYS C C 13 177.780 0.300 . 1 . . . . 27 LYS C . 11371 1
121 . 1 1 27 27 LYS CA C 13 60.998 0.300 . 1 . . . . 27 LYS CA . 11371 1
122 . 1 1 27 27 LYS CB C 13 32.139 0.300 . 1 . . . . 27 LYS CB . 11371 1
123 . 1 1 27 27 LYS N N 15 121.557 0.300 . 1 . . . . 27 LYS N . 11371 1
124 . 1 1 28 28 ALA H H 1 7.759 0.030 . 1 . . . . 28 ALA H . 11371 1
125 . 1 1 28 28 ALA C C 13 180.283 0.300 . 1 . . . . 28 ALA C . 11371 1
126 . 1 1 28 28 ALA CA C 13 54.843 0.300 . 1 . . . . 28 ALA CA . 11371 1
127 . 1 1 28 28 ALA CB C 13 18.225 0.300 . 1 . . . . 28 ALA CB . 11371 1
128 . 1 1 28 28 ALA N N 15 118.306 0.300 . 1 . . . . 28 ALA N . 11371 1
129 . 1 1 29 29 ALA H H 1 7.814 0.030 . 1 . . . . 29 ALA H . 11371 1
130 . 1 1 29 29 ALA C C 13 177.793 0.300 . 1 . . . . 29 ALA C . 11371 1
131 . 1 1 29 29 ALA CA C 13 53.940 0.300 . 1 . . . . 29 ALA CA . 11371 1
132 . 1 1 29 29 ALA CB C 13 18.931 0.300 . 1 . . . . 29 ALA CB . 11371 1
133 . 1 1 29 29 ALA N N 15 118.004 0.300 . 1 . . . . 29 ALA N . 11371 1
134 . 1 1 30 30 PHE H H 1 7.967 0.030 . 1 . . . . 30 PHE H . 11371 1
135 . 1 1 30 30 PHE C C 13 175.416 0.300 . 1 . . . . 30 PHE C . 11371 1
136 . 1 1 30 30 PHE CA C 13 59.532 0.300 . 1 . . . . 30 PHE CA . 11371 1
137 . 1 1 30 30 PHE CB C 13 40.321 0.300 . 1 . . . . 30 PHE CB . 11371 1
138 . 1 1 30 30 PHE N N 15 112.047 0.300 . 1 . . . . 30 PHE N . 11371 1
139 . 1 1 31 31 ALA H H 1 8.049 0.030 . 1 . . . . 31 ALA H . 11371 1
140 . 1 1 31 31 ALA C C 13 176.379 0.300 . 1 . . . . 31 ALA C . 11371 1
141 . 1 1 31 31 ALA CA C 13 55.720 0.300 . 1 . . . . 31 ALA CA . 11371 1
142 . 1 1 31 31 ALA CB C 13 16.765 0.300 . 1 . . . . 31 ALA CB . 11371 1
143 . 1 1 31 31 ALA N N 15 125.067 0.300 . 1 . . . . 31 ALA N . 11371 1
144 . 1 1 32 32 PRO C C 13 177.374 0.300 . 1 . . . . 32 PRO C . 11371 1
145 . 1 1 32 32 PRO CA C 13 65.175 0.300 . 1 . . . . 32 PRO CA . 11371 1
146 . 1 1 32 32 PRO CB C 13 31.461 0.300 . 1 . . . . 32 PRO CB . 11371 1
147 . 1 1 33 33 PHE H H 1 7.699 0.030 . 1 . . . . 33 PHE H . 11371 1
148 . 1 1 33 33 PHE C C 13 174.558 0.300 . 1 . . . . 33 PHE C . 11371 1
149 . 1 1 33 33 PHE CA C 13 59.508 0.300 . 1 . . . . 33 PHE CA . 11371 1
150 . 1 1 33 33 PHE CB C 13 39.018 0.300 . 1 . . . . 33 PHE CB . 11371 1
151 . 1 1 33 33 PHE N N 15 112.643 0.300 . 1 . . . . 33 PHE N . 11371 1
152 . 1 1 34 34 GLY H H 1 7.600 0.030 . 1 . . . . 34 GLY H . 11371 1
153 . 1 1 34 34 GLY C C 13 171.592 0.300 . 1 . . . . 34 GLY C . 11371 1
154 . 1 1 34 34 GLY CA C 13 44.383 0.300 . 1 . . . . 34 GLY CA . 11371 1
155 . 1 1 34 34 GLY N N 15 104.638 0.300 . 1 . . . . 34 GLY N . 11371 1
156 . 1 1 35 35 ARG H H 1 8.243 0.030 . 1 . . . . 35 ARG H . 11371 1
157 . 1 1 35 35 ARG C C 13 176.972 0.300 . 1 . . . . 35 ARG C . 11371 1
158 . 1 1 35 35 ARG CA C 13 57.897 0.300 . 1 . . . . 35 ARG CA . 11371 1
159 . 1 1 35 35 ARG CB C 13 31.044 0.300 . 1 . . . . 35 ARG CB . 11371 1
160 . 1 1 35 35 ARG N N 15 117.026 0.300 . 1 . . . . 35 ARG N . 11371 1
161 . 1 1 36 36 ILE H H 1 8.507 0.030 . 1 . . . . 36 ILE H . 11371 1
162 . 1 1 36 36 ILE C C 13 176.743 0.300 . 1 . . . . 36 ILE C . 11371 1
163 . 1 1 36 36 ILE CA C 13 60.412 0.300 . 1 . . . . 36 ILE CA . 11371 1
164 . 1 1 36 36 ILE CB C 13 40.790 0.300 . 1 . . . . 36 ILE CB . 11371 1
165 . 1 1 36 36 ILE N N 15 127.973 0.300 . 1 . . . . 36 ILE N . 11371 1
166 . 1 1 37 37 SER H H 1 8.843 0.030 . 1 . . . . 37 SER H . 11371 1
167 . 1 1 37 37 SER C C 13 174.613 0.300 . 1 . . . . 37 SER C . 11371 1
168 . 1 1 37 37 SER CA C 13 57.995 0.300 . 1 . . . . 37 SER CA . 11371 1
169 . 1 1 37 37 SER CB C 13 63.050 0.300 . 1 . . . . 37 SER CB . 11371 1
170 . 1 1 37 37 SER N N 15 123.260 0.300 . 1 . . . . 37 SER N . 11371 1
171 . 1 1 38 38 ASP H H 1 7.271 0.030 . 1 . . . . 38 ASP H . 11371 1
172 . 1 1 38 38 ASP C C 13 172.760 0.300 . 1 . . . . 38 ASP C . 11371 1
173 . 1 1 38 38 ASP CA C 13 53.794 0.300 . 1 . . . . 38 ASP CA . 11371 1
174 . 1 1 38 38 ASP CB C 13 43.708 0.300 . 1 . . . . 38 ASP CB . 11371 1
175 . 1 1 38 38 ASP N N 15 119.571 0.300 . 1 . . . . 38 ASP N . 11371 1
176 . 1 1 39 39 ALA H H 1 7.971 0.030 . 1 . . . . 39 ALA H . 11371 1
177 . 1 1 39 39 ALA C C 13 175.238 0.300 . 1 . . . . 39 ALA C . 11371 1
178 . 1 1 39 39 ALA CA C 13 51.693 0.300 . 1 . . . . 39 ALA CA . 11371 1
179 . 1 1 39 39 ALA CB C 13 22.602 0.300 . 1 . . . . 39 ALA CB . 11371 1
180 . 1 1 39 39 ALA N N 15 121.400 0.300 . 1 . . . . 39 ALA N . 11371 1
181 . 1 1 40 40 ARG H H 1 8.642 0.030 . 1 . . . . 40 ARG H . 11371 1
182 . 1 1 40 40 ARG C C 13 174.267 0.300 . 1 . . . . 40 ARG C . 11371 1
183 . 1 1 40 40 ARG CA C 13 55.772 0.300 . 1 . . . . 40 ARG CA . 11371 1
184 . 1 1 40 40 ARG CB C 13 33.129 0.300 . 1 . . . . 40 ARG CB . 11371 1
185 . 1 1 40 40 ARG N N 15 115.941 0.300 . 1 . . . . 40 ARG N . 11371 1
186 . 1 1 41 41 VAL H H 1 7.681 0.030 . 1 . . . . 41 VAL H . 11371 1
187 . 1 1 41 41 VAL C C 13 175.716 0.300 . 1 . . . . 41 VAL C . 11371 1
188 . 1 1 41 41 VAL CA C 13 62.927 0.300 . 1 . . . . 41 VAL CA . 11371 1
189 . 1 1 41 41 VAL CB C 13 32.985 0.300 . 1 . . . . 41 VAL CB . 11371 1
190 . 1 1 41 41 VAL N N 15 123.134 0.300 . 1 . . . . 41 VAL N . 11371 1
191 . 1 1 42 42 VAL H H 1 8.518 0.030 . 1 . . . . 42 VAL H . 11371 1
192 . 1 1 42 42 VAL C C 13 174.160 0.300 . 1 . . . . 42 VAL C . 11371 1
193 . 1 1 42 42 VAL CA C 13 63.862 0.300 . 1 . . . . 42 VAL CA . 11371 1
194 . 1 1 42 42 VAL CB C 13 30.893 0.300 . 1 . . . . 42 VAL CB . 11371 1
195 . 1 1 42 42 VAL N N 15 130.219 0.300 . 1 . . . . 42 VAL N . 11371 1
196 . 1 1 43 43 LYS H H 1 8.162 0.030 . 1 . . . . 43 LYS H . 11371 1
197 . 1 1 43 43 LYS C C 13 176.211 0.300 . 1 . . . . 43 LYS C . 11371 1
198 . 1 1 43 43 LYS CA C 13 54.282 0.300 . 1 . . . . 43 LYS CA . 11371 1
199 . 1 1 43 43 LYS CB C 13 35.161 0.300 . 1 . . . . 43 LYS CB . 11371 1
200 . 1 1 43 43 LYS N N 15 125.490 0.300 . 1 . . . . 43 LYS N . 11371 1
201 . 1 1 44 44 ALA H H 1 8.630 0.030 . 1 . . . . 44 ALA H . 11371 1
202 . 1 1 44 44 ALA C C 13 178.291 0.300 . 1 . . . . 44 ALA C . 11371 1
203 . 1 1 44 44 ALA CA C 13 51.586 0.300 . 1 . . . . 44 ALA CA . 11371 1
204 . 1 1 44 44 ALA CB C 13 18.850 0.300 . 1 . . . . 44 ALA CB . 11371 1
205 . 1 1 44 44 ALA N N 15 125.018 0.300 . 1 . . . . 44 ALA N . 11371 1
206 . 1 1 46 46 ALA CA C 13 55.075 0.300 . 1 . . . . 46 ALA CA . 11371 1
207 . 1 1 46 46 ALA CB C 13 19.026 0.300 . 1 . . . . 46 ALA CB . 11371 1
208 . 1 1 47 47 THR H H 1 7.135 0.030 . 1 . . . . 47 THR H . 11371 1
209 . 1 1 47 47 THR C C 13 176.020 0.300 . 1 . . . . 47 THR C . 11371 1
210 . 1 1 47 47 THR CA C 13 60.900 0.300 . 1 . . . . 47 THR CA . 11371 1
211 . 1 1 47 47 THR CB C 13 70.918 0.300 . 1 . . . . 47 THR CB . 11371 1
212 . 1 1 47 47 THR N N 15 103.152 0.300 . 1 . . . . 47 THR N . 11371 1
213 . 1 1 48 48 GLY H H 1 8.263 0.030 . 1 . . . . 48 GLY H . 11371 1
214 . 1 1 48 48 GLY C C 13 173.657 0.300 . 1 . . . . 48 GLY C . 11371 1
215 . 1 1 48 48 GLY CA C 13 45.784 0.300 . 1 . . . . 48 GLY CA . 11371 1
216 . 1 1 48 48 GLY N N 15 110.824 0.300 . 1 . . . . 48 GLY N . 11371 1
217 . 1 1 49 49 LYS H H 1 7.755 0.030 . 1 . . . . 49 LYS H . 11371 1
218 . 1 1 49 49 LYS C C 13 176.450 0.300 . 1 . . . . 49 LYS C . 11371 1
219 . 1 1 49 49 LYS CA C 13 55.601 0.300 . 1 . . . . 49 LYS CA . 11371 1
220 . 1 1 49 49 LYS CB C 13 33.546 0.300 . 1 . . . . 49 LYS CB . 11371 1
221 . 1 1 49 49 LYS N N 15 119.158 0.300 . 1 . . . . 49 LYS N . 11371 1
222 . 1 1 50 50 SER H H 1 8.674 0.030 . 1 . . . . 50 SER H . 11371 1
223 . 1 1 50 50 SER C C 13 176.609 0.300 . 1 . . . . 50 SER C . 11371 1
224 . 1 1 50 50 SER CA C 13 58.242 0.300 . 1 . . . . 50 SER CA . 11371 1
225 . 1 1 50 50 SER CB C 13 64.217 0.300 . 1 . . . . 50 SER CB . 11371 1
226 . 1 1 50 50 SER N N 15 115.796 0.300 . 1 . . . . 50 SER N . 11371 1
227 . 1 1 51 51 LYS H H 1 9.157 0.030 . 1 . . . . 51 LYS H . 11371 1
228 . 1 1 51 51 LYS C C 13 177.109 0.300 . 1 . . . . 51 LYS C . 11371 1
229 . 1 1 51 51 LYS CA C 13 56.431 0.300 . 1 . . . . 51 LYS CA . 11371 1
230 . 1 1 51 51 LYS CB C 13 33.025 0.300 . 1 . . . . 51 LYS CB . 11371 1
231 . 1 1 51 51 LYS N N 15 125.306 0.300 . 1 . . . . 51 LYS N . 11371 1
232 . 1 1 52 52 GLY H H 1 9.141 0.030 . 1 . . . . 52 GLY H . 11371 1
233 . 1 1 52 52 GLY C C 13 172.717 0.300 . 1 . . . . 52 GLY C . 11371 1
234 . 1 1 52 52 GLY CA C 13 45.662 0.300 . 1 . . . . 52 GLY CA . 11371 1
235 . 1 1 52 52 GLY N N 15 107.582 0.300 . 1 . . . . 52 GLY N . 11371 1
236 . 1 1 53 53 TYR H H 1 7.220 0.030 . 1 . . . . 53 TYR H . 11371 1
237 . 1 1 53 53 TYR C C 13 172.310 0.300 . 1 . . . . 53 TYR C . 11371 1
238 . 1 1 53 53 TYR CA C 13 55.308 0.300 . 1 . . . . 53 TYR CA . 11371 1
239 . 1 1 53 53 TYR CB C 13 40.425 0.300 . 1 . . . . 53 TYR CB . 11371 1
240 . 1 1 53 53 TYR N N 15 113.435 0.300 . 1 . . . . 53 TYR N . 11371 1
241 . 1 1 54 54 GLY H H 1 8.870 0.030 . 1 . . . . 54 GLY H . 11371 1
242 . 1 1 54 54 GLY C C 13 169.495 0.300 . 1 . . . . 54 GLY C . 11371 1
243 . 1 1 54 54 GLY CA C 13 45.149 0.300 . 1 . . . . 54 GLY CA . 11371 1
244 . 1 1 54 54 GLY N N 15 106.384 0.300 . 1 . . . . 54 GLY N . 11371 1
245 . 1 1 55 55 PHE H H 1 8.486 0.030 . 1 . . . . 55 PHE H . 11371 1
246 . 1 1 55 55 PHE C C 13 174.546 0.300 . 1 . . . . 55 PHE C . 11371 1
247 . 1 1 55 55 PHE CA C 13 55.967 0.300 . 1 . . . . 55 PHE CA . 11371 1
248 . 1 1 55 55 PHE CB C 13 44.515 0.300 . 1 . . . . 55 PHE CB . 11371 1
249 . 1 1 55 55 PHE N N 15 114.086 0.300 . 1 . . . . 55 PHE N . 11371 1
250 . 1 1 56 56 VAL H H 1 8.948 0.030 . 1 . . . . 56 VAL H . 11371 1
251 . 1 1 56 56 VAL C C 13 173.733 0.300 . 1 . . . . 56 VAL C . 11371 1
252 . 1 1 56 56 VAL CA C 13 61.290 0.300 . 1 . . . . 56 VAL CA . 11371 1
253 . 1 1 56 56 VAL CB C 13 35.005 0.300 . 1 . . . . 56 VAL CB . 11371 1
254 . 1 1 56 56 VAL N N 15 120.105 0.300 . 1 . . . . 56 VAL N . 11371 1
255 . 1 1 57 57 SER H H 1 8.742 0.030 . 1 . . . . 57 SER H . 11371 1
256 . 1 1 57 57 SER C C 13 172.786 0.300 . 1 . . . . 57 SER C . 11371 1
257 . 1 1 57 57 SER CA C 13 57.423 0.300 . 1 . . . . 57 SER CA . 11371 1
258 . 1 1 57 57 SER CB C 13 64.189 0.300 . 1 . . . . 57 SER CB . 11371 1
259 . 1 1 57 57 SER N N 15 122.302 0.300 . 1 . . . . 57 SER N . 11371 1
260 . 1 1 58 58 PHE H H 1 9.261 0.030 . 1 . . . . 58 PHE H . 11371 1
261 . 1 1 58 58 PHE C C 13 175.784 0.300 . 1 . . . . 58 PHE C . 11371 1
262 . 1 1 58 58 PHE CA C 13 57.066 0.300 . 1 . . . . 58 PHE CA . 11371 1
263 . 1 1 58 58 PHE CB C 13 42.561 0.300 . 1 . . . . 58 PHE CB . 11371 1
264 . 1 1 58 58 PHE N N 15 122.081 0.300 . 1 . . . . 58 PHE N . 11371 1
265 . 1 1 59 59 PHE H H 1 7.718 0.030 . 1 . . . . 59 PHE H . 11371 1
266 . 1 1 59 59 PHE C C 13 175.844 0.300 . 1 . . . . 59 PHE C . 11371 1
267 . 1 1 59 59 PHE CA C 13 61.389 0.300 . 1 . . . . 59 PHE CA . 11371 1
268 . 1 1 59 59 PHE CB C 13 40.060 0.300 . 1 . . . . 59 PHE CB . 11371 1
269 . 1 1 59 59 PHE N N 15 117.945 0.300 . 1 . . . . 59 PHE N . 11371 1
270 . 1 1 60 60 ASN H H 1 8.649 0.030 . 1 . . . . 60 ASN H . 11371 1
271 . 1 1 60 60 ASN C C 13 174.809 0.300 . 1 . . . . 60 ASN C . 11371 1
272 . 1 1 60 60 ASN CA C 13 51.620 0.300 . 1 . . . . 60 ASN CA . 11371 1
273 . 1 1 60 60 ASN CB C 13 40.737 0.300 . 1 . . . . 60 ASN CB . 11371 1
274 . 1 1 60 60 ASN N N 15 114.173 0.300 . 1 . . . . 60 ASN N . 11371 1
275 . 1 1 61 61 LYS H H 1 8.168 0.030 . 1 . . . . 61 LYS H . 11371 1
276 . 1 1 61 61 LYS C C 13 177.094 0.300 . 1 . . . . 61 LYS C . 11371 1
277 . 1 1 61 61 LYS CA C 13 60.168 0.300 . 1 . . . . 61 LYS CA . 11371 1
278 . 1 1 61 61 LYS CB C 13 32.347 0.300 . 1 . . . . 61 LYS CB . 11371 1
279 . 1 1 61 61 LYS N N 15 126.585 0.300 . 1 . . . . 61 LYS N . 11371 1
280 . 1 1 62 62 TRP H H 1 7.571 0.030 . 1 . . . . 62 TRP H . 11371 1
281 . 1 1 62 62 TRP C C 13 177.868 0.300 . 1 . . . . 62 TRP C . 11371 1
282 . 1 1 62 62 TRP CA C 13 59.508 0.300 . 1 . . . . 62 TRP CA . 11371 1
283 . 1 1 62 62 TRP CB C 13 27.813 0.300 . 1 . . . . 62 TRP CB . 11371 1
284 . 1 1 62 62 TRP N N 15 116.614 0.300 . 1 . . . . 62 TRP N . 11371 1
285 . 1 1 63 63 ASP H H 1 6.880 0.030 . 1 . . . . 63 ASP H . 11371 1
286 . 1 1 63 63 ASP C C 13 176.509 0.300 . 1 . . . . 63 ASP C . 11371 1
287 . 1 1 63 63 ASP CA C 13 56.870 0.300 . 1 . . . . 63 ASP CA . 11371 1
288 . 1 1 63 63 ASP CB C 13 40.685 0.300 . 1 . . . . 63 ASP CB . 11371 1
289 . 1 1 63 63 ASP N N 15 121.286 0.300 . 1 . . . . 63 ASP N . 11371 1
290 . 1 1 64 64 ALA H H 1 6.595 0.030 . 1 . . . . 64 ALA H . 11371 1
291 . 1 1 64 64 ALA C C 13 177.978 0.300 . 1 . . . . 64 ALA C . 11371 1
292 . 1 1 64 64 ALA CA C 13 54.502 0.300 . 1 . . . . 64 ALA CA . 11371 1
293 . 1 1 64 64 ALA CB C 13 19.163 0.300 . 1 . . . . 64 ALA CB . 11371 1
294 . 1 1 64 64 ALA N N 15 119.718 0.300 . 1 . . . . 64 ALA N . 11371 1
295 . 1 1 65 65 GLU H H 1 8.303 0.030 . 1 . . . . 65 GLU H . 11371 1
296 . 1 1 65 65 GLU C C 13 178.936 0.300 . 1 . . . . 65 GLU C . 11371 1
297 . 1 1 65 65 GLU CA C 13 59.654 0.300 . 1 . . . . 65 GLU CA . 11371 1
298 . 1 1 65 65 GLU CB C 13 30.159 0.300 . 1 . . . . 65 GLU CB . 11371 1
299 . 1 1 65 65 GLU N N 15 117.123 0.300 . 1 . . . . 65 GLU N . 11371 1
300 . 1 1 66 66 ASN H H 1 7.921 0.030 . 1 . . . . 66 ASN H . 11371 1
301 . 1 1 66 66 ASN C C 13 176.316 0.300 . 1 . . . . 66 ASN C . 11371 1
302 . 1 1 66 66 ASN CA C 13 55.796 0.300 . 1 . . . . 66 ASN CA . 11371 1
303 . 1 1 66 66 ASN CB C 13 38.463 0.300 . 1 . . . . 66 ASN CB . 11371 1
304 . 1 1 66 66 ASN N N 15 117.954 0.300 . 1 . . . . 66 ASN N . 11371 1
305 . 1 1 67 67 ALA H H 1 7.873 0.030 . 1 . . . . 67 ALA H . 11371 1
306 . 1 1 67 67 ALA C C 13 179.337 0.300 . 1 . . . . 67 ALA C . 11371 1
307 . 1 1 67 67 ALA CA C 13 55.026 0.300 . 1 . . . . 67 ALA CA . 11371 1
308 . 1 1 67 67 ALA CB C 13 18.798 0.300 . 1 . . . . 67 ALA CB . 11371 1
309 . 1 1 67 67 ALA N N 15 121.676 0.300 . 1 . . . . 67 ALA N . 11371 1
310 . 1 1 68 68 ILE H H 1 8.079 0.030 . 1 . . . . 68 ILE H . 11371 1
311 . 1 1 68 68 ILE C C 13 179.105 0.300 . 1 . . . . 68 ILE C . 11371 1
312 . 1 1 68 68 ILE CA C 13 66.444 0.300 . 1 . . . . 68 ILE CA . 11371 1
313 . 1 1 68 68 ILE CB C 13 38.288 0.300 . 1 . . . . 68 ILE CB . 11371 1
314 . 1 1 68 68 ILE N N 15 116.549 0.300 . 1 . . . . 68 ILE N . 11371 1
315 . 1 1 69 69 GLN H H 1 7.628 0.030 . 1 . . . . 69 GLN H . 11371 1
316 . 1 1 69 69 GLN C C 13 178.515 0.300 . 1 . . . . 69 GLN C . 11371 1
317 . 1 1 69 69 GLN CA C 13 58.434 0.300 . 1 . . . . 69 GLN CA . 11371 1
318 . 1 1 69 69 GLN CB C 13 28.751 0.300 . 1 . . . . 69 GLN CB . 11371 1
319 . 1 1 69 69 GLN N N 15 117.146 0.300 . 1 . . . . 69 GLN N . 11371 1
320 . 1 1 70 70 GLN H H 1 8.416 0.030 . 1 . . . . 70 GLN H . 11371 1
321 . 1 1 70 70 GLN C C 13 178.320 0.300 . 1 . . . . 70 GLN C . 11371 1
322 . 1 1 70 70 GLN CA C 13 57.603 0.300 . 1 . . . . 70 GLN CA . 11371 1
323 . 1 1 70 70 GLN CB C 13 29.116 0.300 . 1 . . . . 70 GLN CB . 11371 1
324 . 1 1 70 70 GLN N N 15 114.733 0.300 . 1 . . . . 70 GLN N . 11371 1
325 . 1 1 71 71 MET H H 1 7.690 0.030 . 1 . . . . 71 MET H . 11371 1
326 . 1 1 71 71 MET C C 13 177.412 0.300 . 1 . . . . 71 MET C . 11371 1
327 . 1 1 71 71 MET CA C 13 53.794 0.300 . 1 . . . . 71 MET CA . 11371 1
328 . 1 1 71 71 MET CB C 13 30.836 0.300 . 1 . . . . 71 MET CB . 11371 1
329 . 1 1 71 71 MET N N 15 113.210 0.300 . 1 . . . . 71 MET N . 11371 1
330 . 1 1 72 72 GLY H H 1 7.045 0.030 . 1 . . . . 72 GLY H . 11371 1
331 . 1 1 72 72 GLY C C 13 175.532 0.300 . 1 . . . . 72 GLY C . 11371 1
332 . 1 1 72 72 GLY CA C 13 48.838 0.300 . 1 . . . . 72 GLY CA . 11371 1
333 . 1 1 72 72 GLY N N 15 106.997 0.300 . 1 . . . . 72 GLY N . 11371 1
334 . 1 1 73 73 GLY H H 1 8.450 0.030 . 1 . . . . 73 GLY H . 11371 1
335 . 1 1 73 73 GLY C C 13 174.395 0.300 . 1 . . . . 73 GLY C . 11371 1
336 . 1 1 73 73 GLY CA C 13 45.760 0.300 . 1 . . . . 73 GLY CA . 11371 1
337 . 1 1 73 73 GLY N N 15 115.309 0.300 . 1 . . . . 73 GLY N . 11371 1
338 . 1 1 74 74 GLN H H 1 7.610 0.030 . 1 . . . . 74 GLN H . 11371 1
339 . 1 1 74 74 GLN C C 13 174.950 0.300 . 1 . . . . 74 GLN C . 11371 1
340 . 1 1 74 74 GLN CA C 13 55.186 0.300 . 1 . . . . 74 GLN CA . 11371 1
341 . 1 1 74 74 GLN CB C 13 28.699 0.300 . 1 . . . . 74 GLN CB . 11371 1
342 . 1 1 74 74 GLN N N 15 119.032 0.300 . 1 . . . . 74 GLN N . 11371 1
343 . 1 1 75 75 TRP H H 1 8.623 0.030 . 1 . . . . 75 TRP H . 11371 1
344 . 1 1 75 75 TRP C C 13 176.491 0.300 . 1 . . . . 75 TRP C . 11371 1
345 . 1 1 75 75 TRP CA C 13 57.654 0.300 . 1 . . . . 75 TRP CA . 11371 1
346 . 1 1 75 75 TRP CB C 13 28.999 0.300 . 1 . . . . 75 TRP CB . 11371 1
347 . 1 1 75 75 TRP N N 15 120.954 0.300 . 1 . . . . 75 TRP N . 11371 1
348 . 1 1 76 76 LEU H H 1 8.609 0.030 . 1 . . . . 76 LEU H . 11371 1
349 . 1 1 76 76 LEU C C 13 176.726 0.300 . 1 . . . . 76 LEU C . 11371 1
350 . 1 1 76 76 LEU CA C 13 54.814 0.300 . 1 . . . . 76 LEU CA . 11371 1
351 . 1 1 76 76 LEU CB C 13 43.935 0.300 . 1 . . . . 76 LEU CB . 11371 1
352 . 1 1 76 76 LEU N N 15 125.830 0.300 . 1 . . . . 76 LEU N . 11371 1
353 . 1 1 77 77 GLY H H 1 9.338 0.030 . 1 . . . . 77 GLY H . 11371 1
354 . 1 1 77 77 GLY C C 13 175.645 0.300 . 1 . . . . 77 GLY C . 11371 1
355 . 1 1 77 77 GLY CA C 13 47.252 0.300 . 1 . . . . 77 GLY CA . 11371 1
356 . 1 1 77 77 GLY N N 15 115.406 0.300 . 1 . . . . 77 GLY N . 11371 1
357 . 1 1 78 78 GLY H H 1 8.758 0.030 . 1 . . . . 78 GLY H . 11371 1
358 . 1 1 78 78 GLY C C 13 173.677 0.300 . 1 . . . . 78 GLY C . 11371 1
359 . 1 1 78 78 GLY CA C 13 45.710 0.300 . 1 . . . . 78 GLY CA . 11371 1
360 . 1 1 78 78 GLY N N 15 107.503 0.300 . 1 . . . . 78 GLY N . 11371 1
361 . 1 1 79 79 ARG H H 1 7.628 0.030 . 1 . . . . 79 ARG H . 11371 1
362 . 1 1 79 79 ARG C C 13 173.740 0.300 . 1 . . . . 79 ARG C . 11371 1
363 . 1 1 79 79 ARG CA C 13 55.099 0.300 . 1 . . . . 79 ARG CA . 11371 1
364 . 1 1 79 79 ARG CB C 13 34.067 0.300 . 1 . . . . 79 ARG CB . 11371 1
365 . 1 1 79 79 ARG N N 15 118.490 0.300 . 1 . . . . 79 ARG N . 11371 1
366 . 1 1 80 80 GLN H H 1 7.828 0.030 . 1 . . . . 80 GLN H . 11371 1
367 . 1 1 80 80 GLN C C 13 176.166 0.300 . 1 . . . . 80 GLN C . 11371 1
368 . 1 1 80 80 GLN CA C 13 55.185 0.300 . 1 . . . . 80 GLN CA . 11371 1
369 . 1 1 80 80 GLN CB C 13 29.689 0.300 . 1 . . . . 80 GLN CB . 11371 1
370 . 1 1 80 80 GLN N N 15 121.688 0.300 . 1 . . . . 80 GLN N . 11371 1
371 . 1 1 81 81 ILE H H 1 8.170 0.030 . 1 . . . . 81 ILE H . 11371 1
372 . 1 1 81 81 ILE C C 13 176.072 0.300 . 1 . . . . 81 ILE C . 11371 1
373 . 1 1 81 81 ILE CA C 13 60.998 0.300 . 1 . . . . 81 ILE CA . 11371 1
374 . 1 1 81 81 ILE CB C 13 39.904 0.300 . 1 . . . . 81 ILE CB . 11371 1
375 . 1 1 81 81 ILE N N 15 118.219 0.300 . 1 . . . . 81 ILE N . 11371 1
376 . 1 1 82 82 ARG H H 1 7.906 0.030 . 1 . . . . 82 ARG H . 11371 1
377 . 1 1 82 82 ARG C C 13 175.264 0.300 . 1 . . . . 82 ARG C . 11371 1
378 . 1 1 82 82 ARG CA C 13 53.892 0.300 . 1 . . . . 82 ARG CA . 11371 1
379 . 1 1 82 82 ARG CB C 13 33.442 0.300 . 1 . . . . 82 ARG CB . 11371 1
380 . 1 1 82 82 ARG N N 15 119.761 0.300 . 1 . . . . 82 ARG N . 11371 1
381 . 1 1 83 83 THR H H 1 8.419 0.030 . 1 . . . . 83 THR H . 11371 1
382 . 1 1 83 83 THR C C 13 174.154 0.300 . 1 . . . . 83 THR C . 11371 1
383 . 1 1 83 83 THR CA C 13 58.385 0.300 . 1 . . . . 83 THR CA . 11371 1
384 . 1 1 83 83 THR CB C 13 71.380 0.300 . 1 . . . . 83 THR CB . 11371 1
385 . 1 1 83 83 THR N N 15 110.761 0.300 . 1 . . . . 83 THR N . 11371 1
386 . 1 1 84 84 ASN H H 1 8.618 0.030 . 1 . . . . 84 ASN H . 11371 1
387 . 1 1 84 84 ASN C C 13 174.242 0.300 . 1 . . . . 84 ASN C . 11371 1
388 . 1 1 84 84 ASN CA C 13 52.621 0.300 . 1 . . . . 84 ASN CA . 11371 1
389 . 1 1 84 84 ASN CB C 13 42.145 0.300 . 1 . . . . 84 ASN CB . 11371 1
390 . 1 1 84 84 ASN N N 15 114.962 0.300 . 1 . . . . 84 ASN N . 11371 1
391 . 1 1 85 85 TRP H H 1 8.780 0.030 . 1 . . . . 85 TRP H . 11371 1
392 . 1 1 85 85 TRP C C 13 177.387 0.300 . 1 . . . . 85 TRP C . 11371 1
393 . 1 1 85 85 TRP CA C 13 58.385 0.300 . 1 . . . . 85 TRP CA . 11371 1
394 . 1 1 85 85 TRP CB C 13 30.315 0.300 . 1 . . . . 85 TRP CB . 11371 1
395 . 1 1 85 85 TRP N N 15 121.948 0.300 . 1 . . . . 85 TRP N . 11371 1
396 . 1 1 86 86 ALA H H 1 8.914 0.030 . 1 . . . . 86 ALA H . 11371 1
397 . 1 1 86 86 ALA C C 13 177.513 0.300 . 1 . . . . 86 ALA C . 11371 1
398 . 1 1 86 86 ALA CA C 13 51.729 0.300 . 1 . . . . 86 ALA CA . 11371 1
399 . 1 1 86 86 ALA CB C 13 19.880 0.300 . 1 . . . . 86 ALA CB . 11371 1
400 . 1 1 86 86 ALA N N 15 125.707 0.300 . 1 . . . . 86 ALA N . 11371 1
401 . 1 1 87 87 THR H H 1 8.552 0.030 . 1 . . . . 87 THR H . 11371 1
402 . 1 1 87 87 THR C C 13 174.203 0.300 . 1 . . . . 87 THR C . 11371 1
403 . 1 1 87 87 THR CA C 13 62.136 0.300 . 1 . . . . 87 THR CA . 11371 1
404 . 1 1 87 87 THR CB C 13 69.621 0.300 . 1 . . . . 87 THR CB . 11371 1
405 . 1 1 87 87 THR N N 15 114.708 0.300 . 1 . . . . 87 THR N . 11371 1
406 . 1 1 88 88 ARG H H 1 8.153 0.030 . 1 . . . . 88 ARG H . 11371 1
407 . 1 1 88 88 ARG C C 13 175.178 0.300 . 1 . . . . 88 ARG C . 11371 1
408 . 1 1 88 88 ARG CA C 13 55.382 0.300 . 1 . . . . 88 ARG CA . 11371 1
409 . 1 1 88 88 ARG CB C 13 31.180 0.300 . 1 . . . . 88 ARG CB . 11371 1
410 . 1 1 88 88 ARG N N 15 122.258 0.300 . 1 . . . . 88 ARG N . 11371 1
411 . 1 1 89 89 LYS H H 1 8.228 0.030 . 1 . . . . 89 LYS H . 11371 1
412 . 1 1 89 89 LYS C C 13 173.774 0.300 . 1 . . . . 89 LYS C . 11371 1
413 . 1 1 89 89 LYS CA C 13 53.981 0.300 . 1 . . . . 89 LYS CA . 11371 1
414 . 1 1 89 89 LYS CB C 13 32.303 0.300 . 1 . . . . 89 LYS CB . 11371 1
415 . 1 1 89 89 LYS N N 15 123.682 0.300 . 1 . . . . 89 LYS N . 11371 1
416 . 1 1 91 91 PRO C C 13 176.066 0.300 . 1 . . . . 91 PRO C . 11371 1
417 . 1 1 91 91 PRO CA C 13 62.519 0.300 . 1 . . . . 91 PRO CA . 11371 1
418 . 1 1 91 91 PRO CB C 13 31.957 0.300 . 1 . . . . 91 PRO CB . 11371 1
419 . 1 1 92 92 ALA H H 1 8.296 0.030 . 1 . . . . 92 ALA H . 11371 1
420 . 1 1 92 92 ALA C C 13 175.523 0.300 . 1 . . . . 92 ALA C . 11371 1
421 . 1 1 92 92 ALA CA C 13 50.286 0.300 . 1 . . . . 92 ALA CA . 11371 1
422 . 1 1 92 92 ALA CB C 13 18.049 0.300 . 1 . . . . 92 ALA CB . 11371 1
423 . 1 1 92 92 ALA N N 15 125.522 0.300 . 1 . . . . 92 ALA N . 11371 1
424 . 1 1 93 93 PRO C C 13 176.887 0.300 . 1 . . . . 93 PRO C . 11371 1
425 . 1 1 93 93 PRO CA C 13 62.941 0.300 . 1 . . . . 93 PRO CA . 11371 1
426 . 1 1 93 93 PRO CB C 13 32.104 0.300 . 1 . . . . 93 PRO CB . 11371 1
427 . 1 1 94 94 LYS H H 1 8.411 0.030 . 1 . . . . 94 LYS H . 11371 1
428 . 1 1 94 94 LYS C C 13 176.710 0.300 . 1 . . . . 94 LYS C . 11371 1
429 . 1 1 94 94 LYS CA C 13 56.504 0.300 . 1 . . . . 94 LYS CA . 11371 1
430 . 1 1 94 94 LYS CB C 13 32.868 0.300 . 1 . . . . 94 LYS CB . 11371 1
431 . 1 1 94 94 LYS N N 15 121.556 0.300 . 1 . . . . 94 LYS N . 11371 1
432 . 1 1 95 95 SER H H 1 8.362 0.030 . 1 . . . . 95 SER H . 11371 1
433 . 1 1 95 95 SER C C 13 174.720 0.300 . 1 . . . . 95 SER C . 11371 1
434 . 1 1 95 95 SER CA C 13 58.312 0.300 . 1 . . . . 95 SER CA . 11371 1
435 . 1 1 95 95 SER CB C 13 64.051 0.300 . 1 . . . . 95 SER CB . 11371 1
436 . 1 1 95 95 SER N N 15 117.026 0.300 . 1 . . . . 95 SER N . 11371 1
437 . 1 1 96 96 THR H H 1 8.135 0.030 . 1 . . . . 96 THR H . 11371 1
438 . 1 1 96 96 THR C C 13 174.270 0.300 . 1 . . . . 96 THR C . 11371 1
439 . 1 1 96 96 THR CA C 13 62.052 0.300 . 1 . . . . 96 THR CA . 11371 1
440 . 1 1 96 96 THR CB C 13 69.590 0.300 . 1 . . . . 96 THR CB . 11371 1
441 . 1 1 96 96 THR N N 15 115.594 0.300 . 1 . . . . 96 THR N . 11371 1
442 . 1 1 97 97 TYR H H 1 8.120 0.030 . 1 . . . . 97 TYR H . 11371 1
443 . 1 1 97 97 TYR C C 13 175.732 0.300 . 1 . . . . 97 TYR C . 11371 1
444 . 1 1 97 97 TYR CA C 13 58.066 0.300 . 1 . . . . 97 TYR CA . 11371 1
445 . 1 1 97 97 TYR CB C 13 38.757 0.300 . 1 . . . . 97 TYR CB . 11371 1
446 . 1 1 97 97 TYR N N 15 121.779 0.300 . 1 . . . . 97 TYR N . 11371 1
447 . 1 1 98 98 GLU H H 1 8.213 0.030 . 1 . . . . 98 GLU H . 11371 1
448 . 1 1 98 98 GLU C C 13 176.103 0.300 . 1 . . . . 98 GLU C . 11371 1
449 . 1 1 98 98 GLU CA C 13 56.480 0.300 . 1 . . . . 98 GLU CA . 11371 1
450 . 1 1 98 98 GLU CB C 13 30.499 0.300 . 1 . . . . 98 GLU CB . 11371 1
451 . 1 1 98 98 GLU N N 15 122.606 0.300 . 1 . . . . 98 GLU N . 11371 1
452 . 1 1 99 99 SER H H 1 8.276 0.030 . 1 . . . . 99 SER H . 11371 1
453 . 1 1 99 99 SER C C 13 174.398 0.300 . 1 . . . . 99 SER C . 11371 1
454 . 1 1 99 99 SER CA C 13 58.457 0.300 . 1 . . . . 99 SER CA . 11371 1
455 . 1 1 99 99 SER CB C 13 63.775 0.300 . 1 . . . . 99 SER CB . 11371 1
456 . 1 1 99 99 SER N N 15 116.731 0.300 . 1 . . . . 99 SER N . 11371 1
457 . 1 1 100 100 ASN H H 1 8.477 0.030 . 1 . . . . 100 ASN H . 11371 1
458 . 1 1 100 100 ASN C C 13 175.333 0.300 . 1 . . . . 100 ASN C . 11371 1
459 . 1 1 100 100 ASN CA C 13 53.452 0.300 . 1 . . . . 100 ASN CA . 11371 1
460 . 1 1 100 100 ASN CB C 13 38.792 0.300 . 1 . . . . 100 ASN CB . 11371 1
461 . 1 1 100 100 ASN N N 15 120.825 0.300 . 1 . . . . 100 ASN N . 11371 1
462 . 1 1 101 101 THR H H 1 8.061 0.030 . 1 . . . . 101 THR H . 11371 1
463 . 1 1 101 101 THR C C 13 174.307 0.300 . 1 . . . . 101 THR C . 11371 1
464 . 1 1 101 101 THR CA C 13 61.950 0.300 . 1 . . . . 101 THR CA . 11371 1
465 . 1 1 101 101 THR CB C 13 69.802 0.300 . 1 . . . . 101 THR CB . 11371 1
466 . 1 1 101 101 THR N N 15 114.259 0.300 . 1 . . . . 101 THR N . 11371 1
467 . 1 1 102 102 LYS H H 1 8.278 0.030 . 1 . . . . 102 LYS H . 11371 1
468 . 1 1 102 102 LYS C C 13 175.512 0.300 . 1 . . . . 102 LYS C . 11371 1
469 . 1 1 102 102 LYS CA C 13 56.382 0.300 . 1 . . . . 102 LYS CA . 11371 1
470 . 1 1 102 102 LYS CB C 13 33.117 0.300 . 1 . . . . 102 LYS CB . 11371 1
471 . 1 1 102 102 LYS N N 15 124.388 0.300 . 1 . . . . 102 LYS N . 11371 1
472 . 1 1 103 103 GLN H H 1 8.007 0.030 . 1 . . . . 103 GLN H . 11371 1
473 . 1 1 103 103 GLN C C 13 180.477 0.300 . 1 . . . . 103 GLN C . 11371 1
474 . 1 1 103 103 GLN CA C 13 57.336 0.300 . 1 . . . . 103 GLN CA . 11371 1
475 . 1 1 103 103 GLN CB C 13 30.447 0.300 . 1 . . . . 103 GLN CB . 11371 1
476 . 1 1 103 103 GLN N N 15 127.252 0.300 . 1 . . . . 103 GLN N . 11371 1
stop_
save_