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 25775
_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-1H TOCSY' . . . 25775 1
2 '2D 1H-1H NOESY' . . . 25775 1
3 '2D 1H-15N HSQC' . . . 25775 1
4 '2D 1H-13C HSQC' . . . 25775 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 1 1 GLU HA H 1 4.144 0.02 . 1 . . . A 1 GLU HA . 25775 1
2 . 1 1 1 1 GLU HB2 H 1 2.184 0.02 . 1 . . . A 1 GLU HB2 . 25775 1
3 . 1 1 1 1 GLU HB3 H 1 2.184 0.02 . 1 . . . A 1 GLU HB3 . 25775 1
4 . 1 1 1 1 GLU HG2 H 1 2.616 0.02 . 1 . . . A 1 GLU HG2 . 25775 1
5 . 1 1 1 1 GLU HG3 H 1 2.616 0.02 . 1 . . . A 1 GLU HG3 . 25775 1
6 . 1 1 1 1 GLU CA C 13 55.071 0.3 . 1 . . . A 1 GLU CA . 25775 1
7 . 1 1 1 1 GLU CB C 13 29.047 0.3 . 1 . . . A 1 GLU CB . 25775 1
8 . 1 1 1 1 GLU CG C 13 32.510 0.3 . 1 . . . A 1 GLU CG . 25775 1
9 . 1 1 2 2 CYS H H 1 8.654 0.02 . 1 . . . A 2 CYS H . 25775 1
10 . 1 1 2 2 CYS HA H 1 4.658 0.02 . 1 . . . A 2 CYS HA . 25775 1
11 . 1 1 2 2 CYS HB2 H 1 2.814 0.02 . 2 . . . A 2 CYS HB2 . 25775 1
12 . 1 1 2 2 CYS HB3 H 1 3.097 0.02 . 2 . . . A 2 CYS HB3 . 25775 1
13 . 1 1 2 2 CYS CA C 13 54.925 0.3 . 1 . . . A 2 CYS CA . 25775 1
14 . 1 1 2 2 CYS CB C 13 41.735 0.3 . 1 . . . A 2 CYS CB . 25775 1
15 . 1 1 2 2 CYS N N 15 120.899 0.2 . 1 . . . A 2 CYS N . 25775 1
16 . 1 1 3 3 ARG H H 1 8.889 0.02 . 1 . . . A 3 ARG H . 25775 1
17 . 1 1 3 3 ARG HA H 1 4.429 0.02 . 1 . . . A 3 ARG HA . 25775 1
18 . 1 1 3 3 ARG HB2 H 1 1.671 0.02 . 2 . . . A 3 ARG HB2 . 25775 1
19 . 1 1 3 3 ARG HB3 H 1 2.011 0.02 . 2 . . . A 3 ARG HB3 . 25775 1
20 . 1 1 3 3 ARG HG2 H 1 1.970 0.02 . 2 . . . A 3 ARG HG2 . 25775 1
21 . 1 1 3 3 ARG HG3 H 1 1.769 0.02 . 2 . . . A 3 ARG HG3 . 25775 1
22 . 1 1 3 3 ARG HD2 H 1 3.250 0.02 . 2 . . . A 3 ARG HD2 . 25775 1
23 . 1 1 3 3 ARG HD3 H 1 3.220 0.02 . 2 . . . A 3 ARG HD3 . 25775 1
24 . 1 1 3 3 ARG HE H 1 7.228 0.02 . 1 . . . A 3 ARG HE . 25775 1
25 . 1 1 3 3 ARG CA C 13 55.196 0.3 . 1 . . . A 3 ARG CA . 25775 1
26 . 1 1 3 3 ARG CB C 13 31.600 0.3 . 1 . . . A 3 ARG CB . 25775 1
27 . 1 1 3 3 ARG CG C 13 27.228 0.3 . 1 . . . A 3 ARG CG . 25775 1
28 . 1 1 3 3 ARG CD C 13 43.194 0.3 . 1 . . . A 3 ARG CD . 25775 1
29 . 1 1 3 3 ARG N N 15 120.390 0.2 . 1 . . . A 3 ARG N . 25775 1
30 . 1 1 3 3 ARG NE N 15 85.900 0.2 . 1 . . . A 3 ARG NE . 25775 1
31 . 1 1 4 4 TYR H H 1 8.224 0.02 . 1 . . . A 4 TYR H . 25775 1
32 . 1 1 4 4 TYR HA H 1 4.250 0.02 . 1 . . . A 4 TYR HA . 25775 1
33 . 1 1 4 4 TYR HB2 H 1 3.155 0.02 . 2 . . . A 4 TYR HB2 . 25775 1
34 . 1 1 4 4 TYR HB3 H 1 2.913 0.02 . 2 . . . A 4 TYR HB3 . 25775 1
35 . 1 1 4 4 TYR HD1 H 1 7.149 0.02 . 1 . . . A 4 TYR HD1 . 25775 1
36 . 1 1 4 4 TYR HD2 H 1 7.149 0.02 . 1 . . . A 4 TYR HD2 . 25775 1
37 . 1 1 4 4 TYR HE1 H 1 6.924 0.02 . 1 . . . A 4 TYR HE1 . 25775 1
38 . 1 1 4 4 TYR HE2 H 1 6.924 0.02 . 1 . . . A 4 TYR HE2 . 25775 1
39 . 1 1 4 4 TYR CA C 13 55.999 0.3 . 1 . . . A 4 TYR CA . 25775 1
40 . 1 1 4 4 TYR CB C 13 39.026 0.3 . 1 . . . A 4 TYR CB . 25775 1
41 . 1 1 4 4 TYR CD1 C 13 133.028 0.3 . 1 . . . A 4 TYR CD1 . 25775 1
42 . 1 1 4 4 TYR CE2 C 13 118.944 0.3 . 1 . . . A 4 TYR CE2 . 25775 1
43 . 1 1 4 4 TYR N N 15 122.181 0.2 . 1 . . . A 4 TYR N . 25775 1
44 . 1 1 5 5 LEU H H 1 6.651 0.02 . 1 . . . A 5 LEU H . 25775 1
45 . 1 1 5 5 LEU HA H 1 3.367 0.02 . 1 . . . A 5 LEU HA . 25775 1
46 . 1 1 5 5 LEU HB2 H 1 1.156 0.02 . 2 . . . A 5 LEU HB2 . 25775 1
47 . 1 1 5 5 LEU HB3 H 1 0.699 0.02 . 2 . . . A 5 LEU HB3 . 25775 1
48 . 1 1 5 5 LEU HG H 1 0.549 0.02 . 1 . . . A 5 LEU HG . 25775 1
49 . 1 1 5 5 LEU HD11 H 1 0.182 0.02 . 1 . . . A 5 LEU HD11 . 25775 1
50 . 1 1 5 5 LEU HD12 H 1 0.182 0.02 . 1 . . . A 5 LEU HD12 . 25775 1
51 . 1 1 5 5 LEU HD13 H 1 0.182 0.02 . 1 . . . A 5 LEU HD13 . 25775 1
52 . 1 1 5 5 LEU HD21 H 1 0.307 0.02 . 1 . . . A 5 LEU HD21 . 25775 1
53 . 1 1 5 5 LEU HD22 H 1 0.307 0.02 . 1 . . . A 5 LEU HD22 . 25775 1
54 . 1 1 5 5 LEU HD23 H 1 0.307 0.02 . 1 . . . A 5 LEU HD23 . 25775 1
55 . 1 1 5 5 LEU CA C 13 56.665 0.3 . 1 . . . A 5 LEU CA . 25775 1
56 . 1 1 5 5 LEU CB C 13 42.253 0.3 . 1 . . . A 5 LEU CB . 25775 1
57 . 1 1 5 5 LEU CG C 13 26.879 0.3 . 1 . . . A 5 LEU CG . 25775 1
58 . 1 1 5 5 LEU CD1 C 13 25.557 0.3 . 1 . . . A 5 LEU CD1 . 25775 1
59 . 1 1 5 5 LEU CD2 C 13 23.198 0.3 . 1 . . . A 5 LEU CD2 . 25775 1
60 . 1 1 5 5 LEU N N 15 121.370 0.2 . 1 . . . A 5 LEU N . 25775 1
61 . 1 1 6 6 PHE H H 1 8.869 0.02 . 1 . . . A 6 PHE H . 25775 1
62 . 1 1 6 6 PHE HA H 1 3.768 0.02 . 1 . . . A 6 PHE HA . 25775 1
63 . 1 1 6 6 PHE HB2 H 1 3.386 0.02 . 2 . . . A 6 PHE HB2 . 25775 1
64 . 1 1 6 6 PHE HB3 H 1 3.100 0.02 . 2 . . . A 6 PHE HB3 . 25775 1
65 . 1 1 6 6 PHE HD1 H 1 6.647 0.02 . 1 . . . A 6 PHE HD1 . 25775 1
66 . 1 1 6 6 PHE HD2 H 1 6.647 0.02 . 1 . . . A 6 PHE HD2 . 25775 1
67 . 1 1 6 6 PHE HE1 H 1 7.223 0.02 . 1 . . . A 6 PHE HE1 . 25775 1
68 . 1 1 6 6 PHE HE2 H 1 7.223 0.02 . 1 . . . A 6 PHE HE2 . 25775 1
69 . 1 1 6 6 PHE HZ H 1 7.150 0.02 . 1 . . . A 6 PHE HZ . 25775 1
70 . 1 1 6 6 PHE CA C 13 60.279 0.3 . 1 . . . A 6 PHE CA . 25775 1
71 . 1 1 6 6 PHE CB C 13 36.071 0.3 . 1 . . . A 6 PHE CB . 25775 1
72 . 1 1 6 6 PHE CD2 C 13 131.139 0.3 . 1 . . . A 6 PHE CD2 . 25775 1
73 . 1 1 6 6 PHE CE1 C 13 131.288 0.3 . 1 . . . A 6 PHE CE1 . 25775 1
74 . 1 1 6 6 PHE CZ C 13 129.814 0.3 . 1 . . . A 6 PHE CZ . 25775 1
75 . 1 1 6 6 PHE N N 15 117.688 0.2 . 1 . . . A 6 PHE N . 25775 1
76 . 1 1 7 7 GLY H H 1 9.113 0.02 . 1 . . . A 7 GLY H . 25775 1
77 . 1 1 7 7 GLY HA2 H 1 4.181 0.02 . 2 . . . A 7 GLY HA2 . 25775 1
78 . 1 1 7 7 GLY HA3 H 1 3.473 0.02 . 2 . . . A 7 GLY HA3 . 25775 1
79 . 1 1 7 7 GLY CA C 13 45.380 0.3 . 1 . . . A 7 GLY CA . 25775 1
80 . 1 1 7 7 GLY N N 15 110.878 0.2 . 1 . . . A 7 GLY N . 25775 1
81 . 1 1 8 8 GLY H H 1 8.729 0.02 . 1 . . . A 8 GLY H . 25775 1
82 . 1 1 8 8 GLY HA2 H 1 3.779 0.02 . 2 . . . A 8 GLY HA2 . 25775 1
83 . 1 1 8 8 GLY HA3 H 1 4.470 0.02 . 2 . . . A 8 GLY HA3 . 25775 1
84 . 1 1 8 8 GLY CA C 13 46.075 0.3 . 1 . . . A 8 GLY CA . 25775 1
85 . 1 1 8 8 GLY N N 15 111.369 0.2 . 1 . . . A 8 GLY N . 25775 1
86 . 1 1 9 9 CYS H H 1 7.894 0.02 . 1 . . . A 9 CYS H . 25775 1
87 . 1 1 9 9 CYS HA H 1 4.948 0.02 . 1 . . . A 9 CYS HA . 25775 1
88 . 1 1 9 9 CYS HB2 H 1 3.202 0.02 . 1 . . . A 9 CYS HB2 . 25775 1
89 . 1 1 9 9 CYS HB3 H 1 3.202 0.02 . 1 . . . A 9 CYS HB3 . 25775 1
90 . 1 1 9 9 CYS CA C 13 53.667 0.3 . 1 . . . A 9 CYS CA . 25775 1
91 . 1 1 9 9 CYS CB C 13 47.288 0.3 . 1 . . . A 9 CYS CB . 25775 1
92 . 1 1 9 9 CYS N N 15 115.842 0.2 . 1 . . . A 9 CYS N . 25775 1
93 . 1 1 10 10 SER H H 1 8.986 0.02 . 1 . . . A 10 SER H . 25775 1
94 . 1 1 10 10 SER HA H 1 4.591 0.02 . 1 . . . A 10 SER HA . 25775 1
95 . 1 1 10 10 SER HB2 H 1 3.899 0.02 . 2 . . . A 10 SER HB2 . 25775 1
96 . 1 1 10 10 SER HB3 H 1 3.861 0.02 . 2 . . . A 10 SER HB3 . 25775 1
97 . 1 1 10 10 SER CA C 13 58.794 0.3 . 1 . . . A 10 SER CA . 25775 1
98 . 1 1 10 10 SER CB C 13 64.468 0.3 . 1 . . . A 10 SER CB . 25775 1
99 . 1 1 10 10 SER N N 15 113.651 0.2 . 1 . . . A 10 SER N . 25775 1
100 . 1 1 11 11 SER H H 1 8.009 0.02 . 1 . . . A 11 SER H . 25775 1
101 . 1 1 11 11 SER HA H 1 4.668 0.02 . 1 . . . A 11 SER HA . 25775 1
102 . 1 1 11 11 SER HB2 H 1 3.798 0.02 . 2 . . . A 11 SER HB2 . 25775 1
103 . 1 1 11 11 SER HB3 H 1 4.024 0.02 . 2 . . . A 11 SER HB3 . 25775 1
104 . 1 1 11 11 SER CA C 13 56.868 0.3 . 1 . . . A 11 SER CA . 25775 1
105 . 1 1 11 11 SER CB C 13 65.742 0.3 . 1 . . . A 11 SER CB . 25775 1
106 . 1 1 11 11 SER N N 15 115.967 0.2 . 1 . . . A 11 SER N . 25775 1
107 . 1 1 12 12 THR H H 1 9.412 0.02 . 1 . . . A 12 THR H . 25775 1
108 . 1 1 12 12 THR HA H 1 3.808 0.02 . 1 . . . A 12 THR HA . 25775 1
109 . 1 1 12 12 THR HB H 1 4.258 0.02 . 1 . . . A 12 THR HB . 25775 1
110 . 1 1 12 12 THR HG21 H 1 1.379 0.02 . 1 . . . A 12 THR HG21 . 25775 1
111 . 1 1 12 12 THR HG22 H 1 1.379 0.02 . 1 . . . A 12 THR HG22 . 25775 1
112 . 1 1 12 12 THR HG23 H 1 1.379 0.02 . 1 . . . A 12 THR HG23 . 25775 1
113 . 1 1 12 12 THR CA C 13 67.368 0.3 . 1 . . . A 12 THR CA . 25775 1
114 . 1 1 12 12 THR CB C 13 69.100 0.3 . 1 . . . A 12 THR CB . 25775 1
115 . 1 1 12 12 THR CG2 C 13 23.651 0.3 . 1 . . . A 12 THR CG2 . 25775 1
116 . 1 1 12 12 THR N N 15 123.963 0.2 . 1 . . . A 12 THR N . 25775 1
117 . 1 1 13 13 SER H H 1 8.728 0.02 . 1 . . . A 13 SER H . 25775 1
118 . 1 1 13 13 SER HA H 1 4.012 0.02 . 1 . . . A 13 SER HA . 25775 1
119 . 1 1 13 13 SER HB2 H 1 3.852 0.02 . 1 . . . A 13 SER HB2 . 25775 1
120 . 1 1 13 13 SER HB3 H 1 3.852 0.02 . 1 . . . A 13 SER HB3 . 25775 1
121 . 1 1 13 13 SER CA C 13 60.968 0.3 . 1 . . . A 13 SER CA . 25775 1
122 . 1 1 13 13 SER CB C 13 62.880 0.3 . 1 . . . A 13 SER CB . 25775 1
123 . 1 1 13 13 SER N N 15 121.263 0.2 . 1 . . . A 13 SER N . 25775 1
124 . 1 1 14 14 ASP H H 1 8.619 0.02 . 1 . . . A 14 ASP H . 25775 1
125 . 1 1 14 14 ASP HA H 1 4.237 0.02 . 1 . . . A 14 ASP HA . 25775 1
126 . 1 1 14 14 ASP HB2 H 1 2.546 0.02 . 2 . . . A 14 ASP HB2 . 25775 1
127 . 1 1 14 14 ASP HB3 H 1 2.347 0.02 . 2 . . . A 14 ASP HB3 . 25775 1
128 . 1 1 14 14 ASP CA C 13 54.990 0.3 . 1 . . . A 14 ASP CA . 25775 1
129 . 1 1 14 14 ASP CB C 13 37.416 0.3 . 1 . . . A 14 ASP CB . 25775 1
130 . 1 1 14 14 ASP N N 15 118.050 0.2 . 1 . . . A 14 ASP N . 25775 1
131 . 1 1 15 15 CYS H H 1 8.058 0.02 . 1 . . . A 15 CYS H . 25775 1
132 . 1 1 15 15 CYS HA H 1 5.121 0.02 . 1 . . . A 15 CYS HA . 25775 1
133 . 1 1 15 15 CYS HB2 H 1 3.138 0.02 . 2 . . . A 15 CYS HB2 . 25775 1
134 . 1 1 15 15 CYS HB3 H 1 2.866 0.02 . 2 . . . A 15 CYS HB3 . 25775 1
135 . 1 1 15 15 CYS CA C 13 53.598 0.3 . 1 . . . A 15 CYS CA . 25775 1
136 . 1 1 15 15 CYS CB C 13 40.960 0.3 . 1 . . . A 15 CYS CB . 25775 1
137 . 1 1 15 15 CYS N N 15 117.779 0.2 . 1 . . . A 15 CYS N . 25775 1
138 . 1 1 16 16 CYS H H 1 9.093 0.02 . 1 . . . A 16 CYS H . 25775 1
139 . 1 1 16 16 CYS HA H 1 4.580 0.02 . 1 . . . A 16 CYS HA . 25775 1
140 . 1 1 16 16 CYS HB2 H 1 3.378 0.02 . 2 . . . A 16 CYS HB2 . 25775 1
141 . 1 1 16 16 CYS HB3 H 1 2.264 0.02 . 2 . . . A 16 CYS HB3 . 25775 1
142 . 1 1 16 16 CYS CA C 13 53.616 0.3 . 1 . . . A 16 CYS CA . 25775 1
143 . 1 1 16 16 CYS CB C 13 39.385 0.3 . 1 . . . A 16 CYS CB . 25775 1
144 . 1 1 16 16 CYS N N 15 120.718 0.2 . 1 . . . A 16 CYS N . 25775 1
145 . 1 1 17 17 LYS H H 1 7.907 0.02 . 1 . . . A 17 LYS H . 25775 1
146 . 1 1 17 17 LYS HA H 1 3.939 0.02 . 1 . . . A 17 LYS HA . 25775 1
147 . 1 1 17 17 LYS HB2 H 1 1.651 0.02 . 2 . . . A 17 LYS HB2 . 25775 1
148 . 1 1 17 17 LYS HB3 H 1 1.451 0.02 . 2 . . . A 17 LYS HB3 . 25775 1
149 . 1 1 17 17 LYS HG2 H 1 1.227 0.02 . 2 . . . A 17 LYS HG2 . 25775 1
150 . 1 1 17 17 LYS HG3 H 1 1.000 0.02 . 2 . . . A 17 LYS HG3 . 25775 1
151 . 1 1 17 17 LYS HD2 H 1 1.576 0.02 . 1 . . . A 17 LYS HD2 . 25775 1
152 . 1 1 17 17 LYS HD3 H 1 1.576 0.02 . 1 . . . A 17 LYS HD3 . 25775 1
153 . 1 1 17 17 LYS HE2 H 1 2.894 0.02 . 2 . . . A 17 LYS HE2 . 25775 1
154 . 1 1 17 17 LYS HE3 H 1 2.909 0.02 . 2 . . . A 17 LYS HE3 . 25775 1
155 . 1 1 17 17 LYS CA C 13 58.078 0.3 . 1 . . . A 17 LYS CA . 25775 1
156 . 1 1 17 17 LYS CB C 13 32.479 0.3 . 1 . . . A 17 LYS CB . 25775 1
157 . 1 1 17 17 LYS CG C 13 24.545 0.3 . 1 . . . A 17 LYS CG . 25775 1
158 . 1 1 17 17 LYS CD C 13 29.111 0.3 . 1 . . . A 17 LYS CD . 25775 1
159 . 1 1 17 17 LYS CE C 13 41.949 0.3 . 1 . . . A 17 LYS CE . 25775 1
160 . 1 1 17 17 LYS N N 15 117.710 0.2 . 1 . . . A 17 LYS N . 25775 1
161 . 1 1 18 18 HIS H H 1 8.578 0.02 . 1 . . . A 18 HIS H . 25775 1
162 . 1 1 18 18 HIS HA H 1 4.200 0.02 . 1 . . . A 18 HIS HA . 25775 1
163 . 1 1 18 18 HIS HB2 H 1 3.867 0.02 . 2 . . . A 18 HIS HB2 . 25775 1
164 . 1 1 18 18 HIS HB3 H 1 3.469 0.02 . 2 . . . A 18 HIS HB3 . 25775 1
165 . 1 1 18 18 HIS HD2 H 1 7.212 0.02 . 1 . . . A 18 HIS HD2 . 25775 1
166 . 1 1 18 18 HIS HE1 H 1 8.606 0.02 . 1 . . . A 18 HIS HE1 . 25775 1
167 . 1 1 18 18 HIS CA C 13 57.848 0.3 . 1 . . . A 18 HIS CA . 25775 1
168 . 1 1 18 18 HIS CB C 13 26.901 0.3 . 1 . . . A 18 HIS CB . 25775 1
169 . 1 1 18 18 HIS CD2 C 13 119.695 0.3 . 1 . . . A 18 HIS CD2 . 25775 1
170 . 1 1 18 18 HIS CE1 C 13 136.313 0.3 . 1 . . . A 18 HIS CE1 . 25775 1
171 . 1 1 18 18 HIS N N 15 112.192 0.2 . 1 . . . A 18 HIS N . 25775 1
172 . 1 1 19 19 LEU H H 1 7.894 0.02 . 1 . . . A 19 LEU H . 25775 1
173 . 1 1 19 19 LEU HA H 1 5.056 0.02 . 1 . . . A 19 LEU HA . 25775 1
174 . 1 1 19 19 LEU HB2 H 1 2.019 0.02 . 2 . . . A 19 LEU HB2 . 25775 1
175 . 1 1 19 19 LEU HB3 H 1 1.078 0.02 . 2 . . . A 19 LEU HB3 . 25775 1
176 . 1 1 19 19 LEU HG H 1 1.240 0.02 . 1 . . . A 19 LEU HG . 25775 1
177 . 1 1 19 19 LEU HD11 H 1 0.551 0.02 . 1 . . . A 19 LEU HD11 . 25775 1
178 . 1 1 19 19 LEU HD12 H 1 0.551 0.02 . 1 . . . A 19 LEU HD12 . 25775 1
179 . 1 1 19 19 LEU HD13 H 1 0.551 0.02 . 1 . . . A 19 LEU HD13 . 25775 1
180 . 1 1 19 19 LEU HD21 H 1 -0.061 0.02 . 1 . . . A 19 LEU HD21 . 25775 1
181 . 1 1 19 19 LEU HD22 H 1 -0.061 0.02 . 1 . . . A 19 LEU HD22 . 25775 1
182 . 1 1 19 19 LEU HD23 H 1 -0.061 0.02 . 1 . . . A 19 LEU HD23 . 25775 1
183 . 1 1 19 19 LEU CA C 13 54.039 0.3 . 1 . . . A 19 LEU CA . 25775 1
184 . 1 1 19 19 LEU CB C 13 44.366 0.3 . 1 . . . A 19 LEU CB . 25775 1
185 . 1 1 19 19 LEU CG C 13 27.072 0.3 . 1 . . . A 19 LEU CG . 25775 1
186 . 1 1 19 19 LEU CD1 C 13 25.898 0.3 . 1 . . . A 19 LEU CD1 . 25775 1
187 . 1 1 19 19 LEU CD2 C 13 24.837 0.3 . 1 . . . A 19 LEU CD2 . 25775 1
188 . 1 1 19 19 LEU N N 15 118.755 0.2 . 1 . . . A 19 LEU N . 25775 1
189 . 1 1 20 20 SER H H 1 9.339 0.02 . 1 . . . A 20 SER H . 25775 1
190 . 1 1 20 20 SER HA H 1 4.848 0.02 . 1 . . . A 20 SER HA . 25775 1
191 . 1 1 20 20 SER HB2 H 1 3.767 0.02 . 1 . . . A 20 SER HB2 . 25775 1
192 . 1 1 20 20 SER HB3 H 1 3.767 0.02 . 1 . . . A 20 SER HB3 . 25775 1
193 . 1 1 20 20 SER CA C 13 56.143 0.3 . 1 . . . A 20 SER CA . 25775 1
194 . 1 1 20 20 SER CB C 13 65.870 0.3 . 1 . . . A 20 SER CB . 25775 1
195 . 1 1 20 20 SER N N 15 113.497 0.2 . 1 . . . A 20 SER N . 25775 1
196 . 1 1 21 21 CYS H H 1 8.700 0.02 . 1 . . . A 21 CYS H . 25775 1
197 . 1 1 21 21 CYS HA H 1 4.638 0.02 . 1 . . . A 21 CYS HA . 25775 1
198 . 1 1 21 21 CYS HB2 H 1 2.801 0.02 . 2 . . . A 21 CYS HB2 . 25775 1
199 . 1 1 21 21 CYS HB3 H 1 2.462 0.02 . 2 . . . A 21 CYS HB3 . 25775 1
200 . 1 1 21 21 CYS CA C 13 53.379 0.3 . 1 . . . A 21 CYS CA . 25775 1
201 . 1 1 21 21 CYS CB C 13 41.159 0.3 . 1 . . . A 21 CYS CB . 25775 1
202 . 1 1 21 21 CYS N N 15 123.504 0.2 . 1 . . . A 21 CYS N . 25775 1
203 . 1 1 22 22 ARG H H 1 8.425 0.02 . 1 . . . A 22 ARG H . 25775 1
204 . 1 1 22 22 ARG HA H 1 4.184 0.02 . 1 . . . A 22 ARG HA . 25775 1
205 . 1 1 22 22 ARG HB2 H 1 1.786 0.02 . 2 . . . A 22 ARG HB2 . 25775 1
206 . 1 1 22 22 ARG HB3 H 1 1.505 0.02 . 2 . . . A 22 ARG HB3 . 25775 1
207 . 1 1 22 22 ARG HG2 H 1 1.479 0.02 . 2 . . . A 22 ARG HG2 . 25775 1
208 . 1 1 22 22 ARG HG3 H 1 1.406 0.02 . 2 . . . A 22 ARG HG3 . 25775 1
209 . 1 1 22 22 ARG HD2 H 1 2.807 0.02 . 2 . . . A 22 ARG HD2 . 25775 1
210 . 1 1 22 22 ARG HD3 H 1 2.600 0.02 . 2 . . . A 22 ARG HD3 . 25775 1
211 . 1 1 22 22 ARG HE H 1 7.703 0.02 . 1 . . . A 22 ARG HE . 25775 1
212 . 1 1 22 22 ARG CA C 13 56.079 0.3 . 1 . . . A 22 ARG CA . 25775 1
213 . 1 1 22 22 ARG CB C 13 30.375 0.3 . 1 . . . A 22 ARG CB . 25775 1
214 . 1 1 22 22 ARG CG C 13 26.783 0.3 . 1 . . . A 22 ARG CG . 25775 1
215 . 1 1 22 22 ARG CD C 13 42.800 0.3 . 1 . . . A 22 ARG CD . 25775 1
216 . 1 1 22 22 ARG N N 15 131.352 0.2 . 1 . . . A 22 ARG N . 25775 1
217 . 1 1 22 22 ARG NE N 15 84.070 0.2 . 1 . . . A 22 ARG NE . 25775 1
218 . 1 1 23 23 SER H H 1 8.191 0.02 . 1 . . . A 23 SER H . 25775 1
219 . 1 1 23 23 SER HA H 1 4.259 0.02 . 1 . . . A 23 SER HA . 25775 1
220 . 1 1 23 23 SER HB2 H 1 3.848 0.02 . 2 . . . A 23 SER HB2 . 25775 1
221 . 1 1 23 23 SER HB3 H 1 3.886 0.02 . 2 . . . A 23 SER HB3 . 25775 1
222 . 1 1 23 23 SER CA C 13 60.879 0.3 . 1 . . . A 23 SER CA . 25775 1
223 . 1 1 23 23 SER CB C 13 63.926 0.3 . 1 . . . A 23 SER CB . 25775 1
224 . 1 1 23 23 SER N N 15 116.579 0.2 . 1 . . . A 23 SER N . 25775 1
225 . 1 1 24 24 ASP H H 1 7.746 0.02 . 1 . . . A 24 ASP H . 25775 1
226 . 1 1 24 24 ASP HA H 1 4.591 0.02 . 1 . . . A 24 ASP HA . 25775 1
227 . 1 1 24 24 ASP HB2 H 1 2.940 0.02 . 2 . . . A 24 ASP HB2 . 25775 1
228 . 1 1 24 24 ASP HB3 H 1 2.904 0.02 . 2 . . . A 24 ASP HB3 . 25775 1
229 . 1 1 24 24 ASP CA C 13 55.687 0.3 . 1 . . . A 24 ASP CA . 25775 1
230 . 1 1 24 24 ASP CB C 13 39.538 0.3 . 1 . . . A 24 ASP CB . 25775 1
231 . 1 1 24 24 ASP N N 15 118.399 0.2 . 1 . . . A 24 ASP N . 25775 1
232 . 1 1 25 25 TRP H H 1 7.962 0.02 . 1 . . . A 25 TRP H . 25775 1
233 . 1 1 25 25 TRP HA H 1 4.671 0.02 . 1 . . . A 25 TRP HA . 25775 1
234 . 1 1 25 25 TRP HB2 H 1 3.182 0.02 . 2 . . . A 25 TRP HB2 . 25775 1
235 . 1 1 25 25 TRP HB3 H 1 2.300 0.02 . 2 . . . A 25 TRP HB3 . 25775 1
236 . 1 1 25 25 TRP HD1 H 1 7.002 0.02 . 1 . . . A 25 TRP HD1 . 25775 1
237 . 1 1 25 25 TRP HE1 H 1 10.067 0.02 . 1 . . . A 25 TRP HE1 . 25775 1
238 . 1 1 25 25 TRP HE3 H 1 7.528 0.02 . 1 . . . A 25 TRP HE3 . 25775 1
239 . 1 1 25 25 TRP HZ2 H 1 7.470 0.02 . 1 . . . A 25 TRP HZ2 . 25775 1
240 . 1 1 25 25 TRP HZ3 H 1 7.143 0.02 . 1 . . . A 25 TRP HZ3 . 25775 1
241 . 1 1 25 25 TRP HH2 H 1 7.247 0.02 . 1 . . . A 25 TRP HH2 . 25775 1
242 . 1 1 25 25 TRP CA C 13 54.658 0.3 . 1 . . . A 25 TRP CA . 25775 1
243 . 1 1 25 25 TRP CB C 13 31.044 0.3 . 1 . . . A 25 TRP CB . 25775 1
244 . 1 1 25 25 TRP CD1 C 13 126.088 0.3 . 1 . . . A 25 TRP CD1 . 25775 1
245 . 1 1 25 25 TRP CE3 C 13 120.980 0.3 . 1 . . . A 25 TRP CE3 . 25775 1
246 . 1 1 25 25 TRP CZ2 C 13 114.596 0.3 . 1 . . . A 25 TRP CZ2 . 25775 1
247 . 1 1 25 25 TRP CZ3 C 13 121.895 0.3 . 1 . . . A 25 TRP CZ3 . 25775 1
248 . 1 1 25 25 TRP CH2 C 13 124.746 0.3 . 1 . . . A 25 TRP CH2 . 25775 1
249 . 1 1 25 25 TRP N N 15 120.253 0.2 . 1 . . . A 25 TRP N . 25775 1
250 . 1 1 25 25 TRP NE1 N 15 128.723 0.2 . 1 . . . A 25 TRP NE1 . 25775 1
251 . 1 1 26 26 LYS H H 1 8.161 0.02 . 1 . . . A 26 LYS H . 25775 1
252 . 1 1 26 26 LYS HA H 1 3.910 0.02 . 1 . . . A 26 LYS HA . 25775 1
253 . 1 1 26 26 LYS HB2 H 1 2.274 0.02 . 2 . . . A 26 LYS HB2 . 25775 1
254 . 1 1 26 26 LYS HB3 H 1 2.080 0.02 . 2 . . . A 26 LYS HB3 . 25775 1
255 . 1 1 26 26 LYS HG2 H 1 1.296 0.02 . 2 . . . A 26 LYS HG2 . 25775 1
256 . 1 1 26 26 LYS HG3 H 1 1.327 0.02 . 2 . . . A 26 LYS HG3 . 25775 1
257 . 1 1 26 26 LYS HD2 H 1 1.700 0.02 . 2 . . . A 26 LYS HD2 . 25775 1
258 . 1 1 26 26 LYS HD3 H 1 1.651 0.02 . 2 . . . A 26 LYS HD3 . 25775 1
259 . 1 1 26 26 LYS HE2 H 1 3.031 0.02 . 1 . . . A 26 LYS HE2 . 25775 1
260 . 1 1 26 26 LYS HE3 H 1 3.031 0.02 . 1 . . . A 26 LYS HE3 . 25775 1
261 . 1 1 26 26 LYS CA C 13 56.647 0.3 . 1 . . . A 26 LYS CA . 25775 1
262 . 1 1 26 26 LYS CB C 13 27.985 0.3 . 1 . . . A 26 LYS CB . 25775 1
263 . 1 1 26 26 LYS CG C 13 24.565 0.3 . 1 . . . A 26 LYS CG . 25775 1
264 . 1 1 26 26 LYS CD C 13 28.731 0.3 . 1 . . . A 26 LYS CD . 25775 1
265 . 1 1 26 26 LYS CE C 13 42.468 0.3 . 1 . . . A 26 LYS CE . 25775 1
266 . 1 1 26 26 LYS N N 15 114.205 0.2 . 1 . . . A 26 LYS N . 25775 1
267 . 1 1 27 27 TYR H H 1 6.879 0.02 . 1 . . . A 27 TYR H . 25775 1
268 . 1 1 27 27 TYR HA H 1 5.522 0.02 . 1 . . . A 27 TYR HA . 25775 1
269 . 1 1 27 27 TYR HB2 H 1 2.643 0.02 . 2 . . . A 27 TYR HB2 . 25775 1
270 . 1 1 27 27 TYR HB3 H 1 2.793 0.02 . 2 . . . A 27 TYR HB3 . 25775 1
271 . 1 1 27 27 TYR HD1 H 1 6.936 0.02 . 1 . . . A 27 TYR HD1 . 25775 1
272 . 1 1 27 27 TYR HD2 H 1 6.936 0.02 . 1 . . . A 27 TYR HD2 . 25775 1
273 . 1 1 27 27 TYR HE1 H 1 6.621 0.02 . 1 . . . A 27 TYR HE1 . 25775 1
274 . 1 1 27 27 TYR HE2 H 1 6.621 0.02 . 1 . . . A 27 TYR HE2 . 25775 1
275 . 1 1 27 27 TYR CA C 13 55.854 0.3 . 1 . . . A 27 TYR CA . 25775 1
276 . 1 1 27 27 TYR CB C 13 41.270 0.3 . 1 . . . A 27 TYR CB . 25775 1
277 . 1 1 27 27 TYR CD2 C 13 133.897 0.3 . 1 . . . A 27 TYR CD2 . 25775 1
278 . 1 1 27 27 TYR CE2 C 13 118.030 0.3 . 1 . . . A 27 TYR CE2 . 25775 1
279 . 1 1 27 27 TYR N N 15 111.730 0.2 . 1 . . . A 27 TYR N . 25775 1
280 . 1 1 28 28 CYS H H 1 8.916 0.02 . 1 . . . A 28 CYS H . 25775 1
281 . 1 1 28 28 CYS HA H 1 4.863 0.02 . 1 . . . A 28 CYS HA . 25775 1
282 . 1 1 28 28 CYS HB2 H 1 2.520 0.02 . 2 . . . A 28 CYS HB2 . 25775 1
283 . 1 1 28 28 CYS HB3 H 1 2.996 0.02 . 2 . . . A 28 CYS HB3 . 25775 1
284 . 1 1 28 28 CYS CA C 13 55.737 0.3 . 1 . . . A 28 CYS CA . 25775 1
285 . 1 1 28 28 CYS CB C 13 41.013 0.3 . 1 . . . A 28 CYS CB . 25775 1
286 . 1 1 28 28 CYS N N 15 119.698 0.2 . 1 . . . A 28 CYS N . 25775 1
287 . 1 1 29 29 ALA H H 1 9.484 0.02 . 1 . . . A 29 ALA H . 25775 1
288 . 1 1 29 29 ALA HA H 1 4.644 0.02 . 1 . . . A 29 ALA HA . 25775 1
289 . 1 1 29 29 ALA HB1 H 1 1.484 0.02 . 1 . . . A 29 ALA HB1 . 25775 1
290 . 1 1 29 29 ALA HB2 H 1 1.484 0.02 . 1 . . . A 29 ALA HB2 . 25775 1
291 . 1 1 29 29 ALA HB3 H 1 1.484 0.02 . 1 . . . A 29 ALA HB3 . 25775 1
292 . 1 1 29 29 ALA CA C 13 50.518 0.3 . 1 . . . A 29 ALA CA . 25775 1
293 . 1 1 29 29 ALA CB C 13 23.048 0.3 . 1 . . . A 29 ALA CB . 25775 1
294 . 1 1 29 29 ALA N N 15 128.521 0.2 . 1 . . . A 29 ALA N . 25775 1
295 . 1 1 30 30 TRP H H 1 7.950 0.02 . 1 . . . A 30 TRP H . 25775 1
296 . 1 1 30 30 TRP HA H 1 4.746 0.02 . 1 . . . A 30 TRP HA . 25775 1
297 . 1 1 30 30 TRP HB2 H 1 3.411 0.02 . 2 . . . A 30 TRP HB2 . 25775 1
298 . 1 1 30 30 TRP HB3 H 1 3.099 0.02 . 2 . . . A 30 TRP HB3 . 25775 1
299 . 1 1 30 30 TRP HD1 H 1 7.290 0.02 . 1 . . . A 30 TRP HD1 . 25775 1
300 . 1 1 30 30 TRP HE1 H 1 10.115 0.02 . 1 . . . A 30 TRP HE1 . 25775 1
301 . 1 1 30 30 TRP HE3 H 1 7.680 0.02 . 1 . . . A 30 TRP HE3 . 25775 1
302 . 1 1 30 30 TRP HZ2 H 1 7.330 0.02 . 1 . . . A 30 TRP HZ2 . 25775 1
303 . 1 1 30 30 TRP HZ3 H 1 7.088 0.02 . 1 . . . A 30 TRP HZ3 . 25775 1
304 . 1 1 30 30 TRP HH2 H 1 7.209 0.02 . 1 . . . A 30 TRP HH2 . 25775 1
305 . 1 1 30 30 TRP CB C 13 29.998 0.3 . 1 . . . A 30 TRP CB . 25775 1
306 . 1 1 30 30 TRP CD1 C 13 127.698 0.3 . 1 . . . A 30 TRP CD1 . 25775 1
307 . 1 1 30 30 TRP CE3 C 13 121.371 0.3 . 1 . . . A 30 TRP CE3 . 25775 1
308 . 1 1 30 30 TRP CZ2 C 13 114.523 0.3 . 1 . . . A 30 TRP CZ2 . 25775 1
309 . 1 1 30 30 TRP CZ3 C 13 121.913 0.3 . 1 . . . A 30 TRP CZ3 . 25775 1
310 . 1 1 30 30 TRP CH2 C 13 124.662 0.3 . 1 . . . A 30 TRP CH2 . 25775 1
311 . 1 1 30 30 TRP N N 15 120.346 0.2 . 1 . . . A 30 TRP N . 25775 1
312 . 1 1 30 30 TRP NE1 N 15 129.652 0.2 . 1 . . . A 30 TRP NE1 . 25775 1
313 . 1 1 31 31 ASP H H 1 8.669 0.02 . 1 . . . A 31 ASP H . 25775 1
314 . 1 1 31 31 ASP HA H 1 4.642 0.02 . 1 . . . A 31 ASP HA . 25775 1
315 . 1 1 31 31 ASP HB2 H 1 2.723 0.02 . 2 . . . A 31 ASP HB2 . 25775 1
316 . 1 1 31 31 ASP HB3 H 1 2.753 0.02 . 2 . . . A 31 ASP HB3 . 25775 1
317 . 1 1 31 31 ASP CA C 13 55.142 0.3 . 1 . . . A 31 ASP CA . 25775 1
318 . 1 1 31 31 ASP CB C 13 38.948 0.3 . 1 . . . A 31 ASP CB . 25775 1
319 . 1 1 31 31 ASP N N 15 123.675 0.2 . 1 . . . A 31 ASP N . 25775 1
320 . 1 1 32 32 GLY H H 1 7.944 0.02 . 1 . . . A 32 GLY H . 25775 1
321 . 1 1 32 32 GLY HA2 H 1 3.645 0.02 . 2 . . . A 32 GLY HA2 . 25775 1
322 . 1 1 32 32 GLY HA3 H 1 3.965 0.02 . 2 . . . A 32 GLY HA3 . 25775 1
323 . 1 1 32 32 GLY CA C 13 45.546 0.3 . 1 . . . A 32 GLY CA . 25775 1
324 . 1 1 32 32 GLY N N 15 109.050 0.2 . 1 . . . A 32 GLY N . 25775 1
325 . 1 1 33 33 THR H H 1 7.944 0.02 . 1 . . . A 33 THR H . 25775 1
326 . 1 1 33 33 THR HA H 1 4.316 0.02 . 1 . . . A 33 THR HA . 25775 1
327 . 1 1 33 33 THR HB H 1 4.237 0.02 . 1 . . . A 33 THR HB . 25775 1
328 . 1 1 33 33 THR HG21 H 1 1.120 0.02 . 1 . . . A 33 THR HG21 . 25775 1
329 . 1 1 33 33 THR HG22 H 1 1.120 0.02 . 1 . . . A 33 THR HG22 . 25775 1
330 . 1 1 33 33 THR HG23 H 1 1.120 0.02 . 1 . . . A 33 THR HG23 . 25775 1
331 . 1 1 33 33 THR CA C 13 62.025 0.3 . 1 . . . A 33 THR CA . 25775 1
332 . 1 1 33 33 THR CB C 13 69.946 0.3 . 1 . . . A 33 THR CB . 25775 1
333 . 1 1 33 33 THR CG2 C 13 21.585 0.3 . 1 . . . A 33 THR CG2 . 25775 1
334 . 1 1 33 33 THR N N 15 112.503 0.2 . 1 . . . A 33 THR N . 25775 1
335 . 1 1 34 34 PHE H H 1 8.067 0.02 . 1 . . . A 34 PHE H . 25775 1
336 . 1 1 34 34 PHE HA H 1 4.624 0.02 . 1 . . . A 34 PHE HA . 25775 1
337 . 1 1 34 34 PHE HB2 H 1 2.927 0.02 . 2 . . . A 34 PHE HB2 . 25775 1
338 . 1 1 34 34 PHE HB3 H 1 3.050 0.02 . 2 . . . A 34 PHE HB3 . 25775 1
339 . 1 1 34 34 PHE HD1 H 1 7.132 0.02 . 1 . . . A 34 PHE HD1 . 25775 1
340 . 1 1 34 34 PHE HD2 H 1 7.132 0.02 . 1 . . . A 34 PHE HD2 . 25775 1
341 . 1 1 34 34 PHE HE1 H 1 7.212 0.02 . 1 . . . A 34 PHE HE1 . 25775 1
342 . 1 1 34 34 PHE HE2 H 1 7.212 0.02 . 1 . . . A 34 PHE HE2 . 25775 1
343 . 1 1 34 34 PHE HZ H 1 7.226 0.02 . 1 . . . A 34 PHE HZ . 25775 1
344 . 1 1 34 34 PHE CA C 13 57.395 0.3 . 1 . . . A 34 PHE CA . 25775 1
345 . 1 1 34 34 PHE CB C 13 40.002 0.3 . 1 . . . A 34 PHE CB . 25775 1
346 . 1 1 34 34 PHE CD1 C 13 132.136 0.3 . 1 . . . A 34 PHE CD1 . 25775 1
347 . 1 1 34 34 PHE CE1 C 13 131.292 0.3 . 1 . . . A 34 PHE CE1 . 25775 1
348 . 1 1 34 34 PHE CZ C 13 129.526 0.3 . 1 . . . A 34 PHE CZ . 25775 1
349 . 1 1 34 34 PHE N N 15 121.576 0.2 . 1 . . . A 34 PHE N . 25775 1
350 . 1 1 35 35 SER H H 1 8.047 0.02 . 1 . . . A 35 SER H . 25775 1
351 . 1 1 35 35 SER HA H 1 4.223 0.02 . 1 . . . A 35 SER HA . 25775 1
352 . 1 1 35 35 SER HB2 H 1 3.754 0.02 . 2 . . . A 35 SER HB2 . 25775 1
353 . 1 1 35 35 SER HB3 H 1 3.825 0.02 . 2 . . . A 35 SER HB3 . 25775 1
354 . 1 1 35 35 SER CA C 13 58.518 0.3 . 1 . . . A 35 SER CA . 25775 1
355 . 1 1 35 35 SER CB C 13 64.283 0.3 . 1 . . . A 35 SER CB . 25775 1
356 . 1 1 35 35 SER N N 15 119.305 0.2 . 1 . . . A 35 SER N . 25775 1
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