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 11150
_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 13C-separated NOESY' 1 $sample_1 isotropic 11150 1
2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11150 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 $XWINNMR . . 11150 1
2 $NMRPipe . . 11150 1
3 $NMRVIEW . . 11150 1
4 $Kujira . . 11150 1
5 $CYANA . . 11150 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 7 7 GLY HA2 H 1 3.970 0.030 . 1 . . . . 7 GLY HA2 . 11150 1
2 . 1 1 7 7 GLY HA3 H 1 3.970 0.030 . 1 . . . . 7 GLY HA3 . 11150 1
3 . 1 1 7 7 GLY C C 13 174.208 0.300 . 1 . . . . 7 GLY C . 11150 1
4 . 1 1 7 7 GLY CA C 13 45.642 0.300 . 1 . . . . 7 GLY CA . 11150 1
5 . 1 1 8 8 TRP H H 1 8.077 0.030 . 1 . . . . 8 TRP H . 11150 1
6 . 1 1 8 8 TRP HA H 1 4.995 0.030 . 1 . . . . 8 TRP HA . 11150 1
7 . 1 1 8 8 TRP HB2 H 1 3.143 0.030 . 2 . . . . 8 TRP HB2 . 11150 1
8 . 1 1 8 8 TRP HB3 H 1 3.581 0.030 . 2 . . . . 8 TRP HB3 . 11150 1
9 . 1 1 8 8 TRP HD1 H 1 7.235 0.030 . 1 . . . . 8 TRP HD1 . 11150 1
10 . 1 1 8 8 TRP HE1 H 1 10.175 0.030 . 1 . . . . 8 TRP HE1 . 11150 1
11 . 1 1 8 8 TRP HE3 H 1 7.650 0.030 . 1 . . . . 8 TRP HE3 . 11150 1
12 . 1 1 8 8 TRP HH2 H 1 7.254 0.030 . 1 . . . . 8 TRP HH2 . 11150 1
13 . 1 1 8 8 TRP HZ2 H 1 7.526 0.030 . 1 . . . . 8 TRP HZ2 . 11150 1
14 . 1 1 8 8 TRP HZ3 H 1 7.115 0.030 . 1 . . . . 8 TRP HZ3 . 11150 1
15 . 1 1 8 8 TRP C C 13 175.052 0.300 . 1 . . . . 8 TRP C . 11150 1
16 . 1 1 8 8 TRP CA C 13 57.629 0.300 . 1 . . . . 8 TRP CA . 11150 1
17 . 1 1 8 8 TRP CB C 13 30.106 0.300 . 1 . . . . 8 TRP CB . 11150 1
18 . 1 1 8 8 TRP CD1 C 13 127.113 0.300 . 1 . . . . 8 TRP CD1 . 11150 1
19 . 1 1 8 8 TRP CE3 C 13 120.554 0.300 . 1 . . . . 8 TRP CE3 . 11150 1
20 . 1 1 8 8 TRP CH2 C 13 124.705 0.300 . 1 . . . . 8 TRP CH2 . 11150 1
21 . 1 1 8 8 TRP CZ2 C 13 115.157 0.300 . 1 . . . . 8 TRP CZ2 . 11150 1
22 . 1 1 8 8 TRP CZ3 C 13 122.378 0.300 . 1 . . . . 8 TRP CZ3 . 11150 1
23 . 1 1 8 8 TRP N N 15 118.332 0.300 . 1 . . . . 8 TRP N . 11150 1
24 . 1 1 8 8 TRP NE1 N 15 129.243 0.300 . 1 . . . . 8 TRP NE1 . 11150 1
25 . 1 1 9 9 THR H H 1 7.495 0.030 . 1 . . . . 9 THR H . 11150 1
26 . 1 1 9 9 THR HA H 1 4.650 0.030 . 1 . . . . 9 THR HA . 11150 1
27 . 1 1 9 9 THR HB H 1 4.146 0.030 . 1 . . . . 9 THR HB . 11150 1
28 . 1 1 9 9 THR HG21 H 1 1.059 0.030 . 1 . . . . 9 THR HG2 . 11150 1
29 . 1 1 9 9 THR HG22 H 1 1.059 0.030 . 1 . . . . 9 THR HG2 . 11150 1
30 . 1 1 9 9 THR HG23 H 1 1.059 0.030 . 1 . . . . 9 THR HG2 . 11150 1
31 . 1 1 9 9 THR C C 13 174.574 0.300 . 1 . . . . 9 THR C . 11150 1
32 . 1 1 9 9 THR CA C 13 59.458 0.300 . 1 . . . . 9 THR CA . 11150 1
33 . 1 1 9 9 THR CB C 13 71.298 0.300 . 1 . . . . 9 THR CB . 11150 1
34 . 1 1 9 9 THR CG2 C 13 21.685 0.300 . 1 . . . . 9 THR CG2 . 11150 1
35 . 1 1 9 9 THR N N 15 108.301 0.300 . 1 . . . . 9 THR N . 11150 1
36 . 1 1 10 10 CYS H H 1 9.791 0.030 . 1 . . . . 10 CYS H . 11150 1
37 . 1 1 10 10 CYS HA H 1 4.760 0.030 . 1 . . . . 10 CYS HA . 11150 1
38 . 1 1 10 10 CYS HB2 H 1 2.391 0.030 . 2 . . . . 10 CYS HB2 . 11150 1
39 . 1 1 10 10 CYS HB3 H 1 2.954 0.030 . 2 . . . . 10 CYS HB3 . 11150 1
40 . 1 1 10 10 CYS C C 13 173.774 0.300 . 1 . . . . 10 CYS C . 11150 1
41 . 1 1 10 10 CYS CA C 13 54.411 0.300 . 1 . . . . 10 CYS CA . 11150 1
42 . 1 1 10 10 CYS CB C 13 40.647 0.300 . 1 . . . . 10 CYS CB . 11150 1
43 . 1 1 10 10 CYS N N 15 118.419 0.300 . 1 . . . . 10 CYS N . 11150 1
44 . 1 1 11 11 ASN H H 1 6.916 0.030 . 1 . . . . 11 ASN H . 11150 1
45 . 1 1 11 11 ASN HA H 1 4.620 0.030 . 1 . . . . 11 ASN HA . 11150 1
46 . 1 1 11 11 ASN HB2 H 1 3.045 0.030 . 1 . . . . 11 ASN HB2 . 11150 1
47 . 1 1 11 11 ASN HB3 H 1 3.045 0.030 . 1 . . . . 11 ASN HB3 . 11150 1
48 . 1 1 11 11 ASN HD21 H 1 7.710 0.030 . 2 . . . . 11 ASN HD21 . 11150 1
49 . 1 1 11 11 ASN HD22 H 1 7.125 0.030 . 2 . . . . 11 ASN HD22 . 11150 1
50 . 1 1 11 11 ASN C C 13 174.679 0.300 . 1 . . . . 11 ASN C . 11150 1
51 . 1 1 11 11 ASN CA C 13 51.760 0.300 . 1 . . . . 11 ASN CA . 11150 1
52 . 1 1 11 11 ASN CB C 13 40.367 0.300 . 1 . . . . 11 ASN CB . 11150 1
53 . 1 1 11 11 ASN N N 15 115.171 0.300 . 1 . . . . 11 ASN N . 11150 1
54 . 1 1 11 11 ASN ND2 N 15 113.689 0.300 . 1 . . . . 11 ASN ND2 . 11150 1
55 . 1 1 12 12 LYS HA H 1 3.988 0.030 . 1 . . . . 12 LYS HA . 11150 1
56 . 1 1 12 12 LYS HB2 H 1 1.703 0.030 . 2 . . . . 12 LYS HB2 . 11150 1
57 . 1 1 12 12 LYS HB3 H 1 1.600 0.030 . 2 . . . . 12 LYS HB3 . 11150 1
58 . 1 1 12 12 LYS HD2 H 1 1.546 0.030 . 1 . . . . 12 LYS HD2 . 11150 1
59 . 1 1 12 12 LYS HD3 H 1 1.546 0.030 . 1 . . . . 12 LYS HD3 . 11150 1
60 . 1 1 12 12 LYS HE2 H 1 2.867 0.030 . 1 . . . . 12 LYS HE2 . 11150 1
61 . 1 1 12 12 LYS HE3 H 1 2.867 0.030 . 1 . . . . 12 LYS HE3 . 11150 1
62 . 1 1 12 12 LYS HG2 H 1 1.195 0.030 . 2 . . . . 12 LYS HG2 . 11150 1
63 . 1 1 12 12 LYS HG3 H 1 1.058 0.030 . 2 . . . . 12 LYS HG3 . 11150 1
64 . 1 1 12 12 LYS C C 13 177.597 0.300 . 1 . . . . 12 LYS C . 11150 1
65 . 1 1 12 12 LYS CA C 13 59.582 0.300 . 1 . . . . 12 LYS CA . 11150 1
66 . 1 1 12 12 LYS CB C 13 31.909 0.300 . 1 . . . . 12 LYS CB . 11150 1
67 . 1 1 12 12 LYS CD C 13 28.993 0.300 . 1 . . . . 12 LYS CD . 11150 1
68 . 1 1 12 12 LYS CE C 13 42.118 0.300 . 1 . . . . 12 LYS CE . 11150 1
69 . 1 1 12 12 LYS CG C 13 24.125 0.300 . 1 . . . . 12 LYS CG . 11150 1
70 . 1 1 13 13 PHE H H 1 7.901 0.030 . 1 . . . . 13 PHE H . 11150 1
71 . 1 1 13 13 PHE HA H 1 4.420 0.030 . 1 . . . . 13 PHE HA . 11150 1
72 . 1 1 13 13 PHE HB2 H 1 3.264 0.030 . 2 . . . . 13 PHE HB2 . 11150 1
73 . 1 1 13 13 PHE HB3 H 1 3.147 0.030 . 2 . . . . 13 PHE HB3 . 11150 1
74 . 1 1 13 13 PHE HD1 H 1 7.268 0.030 . 1 . . . . 13 PHE HD1 . 11150 1
75 . 1 1 13 13 PHE HD2 H 1 7.268 0.030 . 1 . . . . 13 PHE HD2 . 11150 1
76 . 1 1 13 13 PHE HE1 H 1 7.390 0.030 . 1 . . . . 13 PHE HE1 . 11150 1
77 . 1 1 13 13 PHE HE2 H 1 7.390 0.030 . 1 . . . . 13 PHE HE2 . 11150 1
78 . 1 1 13 13 PHE HZ H 1 7.325 0.030 . 1 . . . . 13 PHE HZ . 11150 1
79 . 1 1 13 13 PHE C C 13 177.225 0.300 . 1 . . . . 13 PHE C . 11150 1
80 . 1 1 13 13 PHE CA C 13 59.646 0.300 . 1 . . . . 13 PHE CA . 11150 1
81 . 1 1 13 13 PHE CB C 13 38.401 0.300 . 1 . . . . 13 PHE CB . 11150 1
82 . 1 1 13 13 PHE CD1 C 13 131.695 0.300 . 1 . . . . 13 PHE CD1 . 11150 1
83 . 1 1 13 13 PHE CD2 C 13 131.695 0.300 . 1 . . . . 13 PHE CD2 . 11150 1
84 . 1 1 13 13 PHE CE1 C 13 131.607 0.300 . 1 . . . . 13 PHE CE1 . 11150 1
85 . 1 1 13 13 PHE CE2 C 13 131.607 0.300 . 1 . . . . 13 PHE CE2 . 11150 1
86 . 1 1 13 13 PHE CZ C 13 130.098 0.300 . 1 . . . . 13 PHE CZ . 11150 1
87 . 1 1 13 13 PHE N N 15 117.375 0.300 . 1 . . . . 13 PHE N . 11150 1
88 . 1 1 14 14 ARG H H 1 7.843 0.030 . 1 . . . . 14 ARG H . 11150 1
89 . 1 1 14 14 ARG HA H 1 4.264 0.030 . 1 . . . . 14 ARG HA . 11150 1
90 . 1 1 14 14 ARG HB2 H 1 1.576 0.030 . 2 . . . . 14 ARG HB2 . 11150 1
91 . 1 1 14 14 ARG HB3 H 1 2.226 0.030 . 2 . . . . 14 ARG HB3 . 11150 1
92 . 1 1 14 14 ARG HD2 H 1 3.515 0.030 . 2 . . . . 14 ARG HD2 . 11150 1
93 . 1 1 14 14 ARG HD3 H 1 3.177 0.030 . 2 . . . . 14 ARG HD3 . 11150 1
94 . 1 1 14 14 ARG HE H 1 8.603 0.030 . 1 . . . . 14 ARG HE . 11150 1
95 . 1 1 14 14 ARG HG2 H 1 1.753 0.030 . 2 . . . . 14 ARG HG2 . 11150 1
96 . 1 1 14 14 ARG HG3 H 1 2.244 0.030 . 2 . . . . 14 ARG HG3 . 11150 1
97 . 1 1 14 14 ARG C C 13 176.660 0.300 . 1 . . . . 14 ARG C . 11150 1
98 . 1 1 14 14 ARG CA C 13 57.771 0.300 . 1 . . . . 14 ARG CA . 11150 1
99 . 1 1 14 14 ARG CB C 13 33.888 0.300 . 1 . . . . 14 ARG CB . 11150 1
100 . 1 1 14 14 ARG CD C 13 43.833 0.300 . 1 . . . . 14 ARG CD . 11150 1
101 . 1 1 14 14 ARG CG C 13 27.198 0.300 . 1 . . . . 14 ARG CG . 11150 1
102 . 1 1 14 14 ARG N N 15 116.277 0.300 . 1 . . . . 14 ARG N . 11150 1
103 . 1 1 14 14 ARG NE N 15 85.045 0.300 . 1 . . . . 14 ARG NE . 11150 1
104 . 1 1 15 15 CYS H H 1 7.473 0.030 . 1 . . . . 15 CYS H . 11150 1
105 . 1 1 15 15 CYS HA H 1 4.739 0.030 . 1 . . . . 15 CYS HA . 11150 1
106 . 1 1 15 15 CYS HB2 H 1 2.790 0.030 . 2 . . . . 15 CYS HB2 . 11150 1
107 . 1 1 15 15 CYS HB3 H 1 3.331 0.030 . 2 . . . . 15 CYS HB3 . 11150 1
108 . 1 1 15 15 CYS C C 13 176.639 0.300 . 1 . . . . 15 CYS C . 11150 1
109 . 1 1 15 15 CYS CA C 13 56.391 0.300 . 1 . . . . 15 CYS CA . 11150 1
110 . 1 1 15 15 CYS CB C 13 36.172 0.300 . 1 . . . . 15 CYS CB . 11150 1
111 . 1 1 15 15 CYS N N 15 117.190 0.300 . 1 . . . . 15 CYS N . 11150 1
112 . 1 1 16 16 GLY H H 1 8.874 0.030 . 1 . . . . 16 GLY H . 11150 1
113 . 1 1 16 16 GLY HA2 H 1 3.941 0.030 . 2 . . . . 16 GLY HA2 . 11150 1
114 . 1 1 16 16 GLY HA3 H 1 4.163 0.030 . 2 . . . . 16 GLY HA3 . 11150 1
115 . 1 1 16 16 GLY C C 13 174.679 0.300 . 1 . . . . 16 GLY C . 11150 1
116 . 1 1 16 16 GLY CA C 13 46.055 0.300 . 1 . . . . 16 GLY CA . 11150 1
117 . 1 1 16 16 GLY N N 15 112.960 0.300 . 1 . . . . 16 GLY N . 11150 1
118 . 1 1 17 17 GLU H H 1 7.886 0.030 . 1 . . . . 17 GLU H . 11150 1
119 . 1 1 17 17 GLU HA H 1 4.199 0.030 . 1 . . . . 17 GLU HA . 11150 1
120 . 1 1 17 17 GLU HB2 H 1 2.033 0.030 . 2 . . . . 17 GLU HB2 . 11150 1
121 . 1 1 17 17 GLU HB3 H 1 2.432 0.030 . 2 . . . . 17 GLU HB3 . 11150 1
122 . 1 1 17 17 GLU HG2 H 1 2.141 0.030 . 2 . . . . 17 GLU HG2 . 11150 1
123 . 1 1 17 17 GLU HG3 H 1 1.982 0.030 . 2 . . . . 17 GLU HG3 . 11150 1
124 . 1 1 17 17 GLU C C 13 176.086 0.300 . 1 . . . . 17 GLU C . 11150 1
125 . 1 1 17 17 GLU CA C 13 55.259 0.300 . 1 . . . . 17 GLU CA . 11150 1
126 . 1 1 17 17 GLU CB C 13 28.867 0.300 . 1 . . . . 17 GLU CB . 11150 1
127 . 1 1 17 17 GLU CG C 13 34.465 0.300 . 1 . . . . 17 GLU CG . 11150 1
128 . 1 1 17 17 GLU N N 15 118.746 0.300 . 1 . . . . 17 GLU N . 11150 1
129 . 1 1 18 18 LYS H H 1 8.333 0.030 . 1 . . . . 18 LYS H . 11150 1
130 . 1 1 18 18 LYS HA H 1 4.319 0.030 . 1 . . . . 18 LYS HA . 11150 1
131 . 1 1 18 18 LYS HB2 H 1 1.736 0.030 . 1 . . . . 18 LYS HB2 . 11150 1
132 . 1 1 18 18 LYS HB3 H 1 1.736 0.030 . 1 . . . . 18 LYS HB3 . 11150 1
133 . 1 1 18 18 LYS HD2 H 1 1.690 0.030 . 1 . . . . 18 LYS HD2 . 11150 1
134 . 1 1 18 18 LYS HD3 H 1 1.690 0.030 . 1 . . . . 18 LYS HD3 . 11150 1
135 . 1 1 18 18 LYS HE2 H 1 2.987 0.030 . 1 . . . . 18 LYS HE2 . 11150 1
136 . 1 1 18 18 LYS HE3 H 1 2.987 0.030 . 1 . . . . 18 LYS HE3 . 11150 1
137 . 1 1 18 18 LYS HG2 H 1 1.530 0.030 . 2 . . . . 18 LYS HG2 . 11150 1
138 . 1 1 18 18 LYS HG3 H 1 1.457 0.030 . 2 . . . . 18 LYS HG3 . 11150 1
139 . 1 1 18 18 LYS C C 13 176.787 0.300 . 1 . . . . 18 LYS C . 11150 1
140 . 1 1 18 18 LYS CA C 13 55.613 0.300 . 1 . . . . 18 LYS CA . 11150 1
141 . 1 1 18 18 LYS CB C 13 32.580 0.300 . 1 . . . . 18 LYS CB . 11150 1
142 . 1 1 18 18 LYS CD C 13 29.040 0.300 . 1 . . . . 18 LYS CD . 11150 1
143 . 1 1 18 18 LYS CE C 13 42.213 0.300 . 1 . . . . 18 LYS CE . 11150 1
144 . 1 1 18 18 LYS CG C 13 25.020 0.300 . 1 . . . . 18 LYS CG . 11150 1
145 . 1 1 18 18 LYS N N 15 122.140 0.300 . 1 . . . . 18 LYS N . 11150 1
146 . 1 1 19 19 ARG H H 1 8.546 0.030 . 1 . . . . 19 ARG H . 11150 1
147 . 1 1 19 19 ARG HA H 1 4.200 0.030 . 1 . . . . 19 ARG HA . 11150 1
148 . 1 1 19 19 ARG HB2 H 1 1.779 0.030 . 2 . . . . 19 ARG HB2 . 11150 1
149 . 1 1 19 19 ARG HB3 H 1 1.683 0.030 . 2 . . . . 19 ARG HB3 . 11150 1
150 . 1 1 19 19 ARG HD2 H 1 3.183 0.030 . 2 . . . . 19 ARG HD2 . 11150 1
151 . 1 1 19 19 ARG HD3 H 1 2.952 0.030 . 2 . . . . 19 ARG HD3 . 11150 1
152 . 1 1 19 19 ARG HE H 1 8.457 0.030 . 1 . . . . 19 ARG HE . 11150 1
153 . 1 1 19 19 ARG HG2 H 1 1.522 0.030 . 2 . . . . 19 ARG HG2 . 11150 1
154 . 1 1 19 19 ARG HG3 H 1 1.408 0.030 . 2 . . . . 19 ARG HG3 . 11150 1
155 . 1 1 19 19 ARG C C 13 176.416 0.300 . 1 . . . . 19 ARG C . 11150 1
156 . 1 1 19 19 ARG CA C 13 56.887 0.300 . 1 . . . . 19 ARG CA . 11150 1
157 . 1 1 19 19 ARG CB C 13 30.157 0.300 . 1 . . . . 19 ARG CB . 11150 1
158 . 1 1 19 19 ARG CD C 13 42.540 0.300 . 1 . . . . 19 ARG CD . 11150 1
159 . 1 1 19 19 ARG CG C 13 27.990 0.300 . 1 . . . . 19 ARG CG . 11150 1
160 . 1 1 19 19 ARG N N 15 124.385 0.300 . 1 . . . . 19 ARG N . 11150 1
161 . 1 1 19 19 ARG NE N 15 84.269 0.300 . 1 . . . . 19 ARG NE . 11150 1
162 . 1 1 20 20 LEU H H 1 8.415 0.030 . 1 . . . . 20 LEU H . 11150 1
163 . 1 1 20 20 LEU HA H 1 4.496 0.030 . 1 . . . . 20 LEU HA . 11150 1
164 . 1 1 20 20 LEU HB2 H 1 1.659 0.030 . 2 . . . . 20 LEU HB2 . 11150 1
165 . 1 1 20 20 LEU HB3 H 1 1.590 0.030 . 2 . . . . 20 LEU HB3 . 11150 1
166 . 1 1 20 20 LEU HD11 H 1 0.950 0.030 . 1 . . . . 20 LEU HD1 . 11150 1
167 . 1 1 20 20 LEU HD12 H 1 0.950 0.030 . 1 . . . . 20 LEU HD1 . 11150 1
168 . 1 1 20 20 LEU HD13 H 1 0.950 0.030 . 1 . . . . 20 LEU HD1 . 11150 1
169 . 1 1 20 20 LEU HD21 H 1 0.891 0.030 . 1 . . . . 20 LEU HD2 . 11150 1
170 . 1 1 20 20 LEU HD22 H 1 0.891 0.030 . 1 . . . . 20 LEU HD2 . 11150 1
171 . 1 1 20 20 LEU HD23 H 1 0.891 0.030 . 1 . . . . 20 LEU HD2 . 11150 1
172 . 1 1 20 20 LEU HG H 1 1.658 0.030 . 1 . . . . 20 LEU HG . 11150 1
173 . 1 1 20 20 LEU C C 13 174.436 0.300 . 1 . . . . 20 LEU C . 11150 1
174 . 1 1 20 20 LEU CA C 13 54.552 0.300 . 1 . . . . 20 LEU CA . 11150 1
175 . 1 1 20 20 LEU CB C 13 43.495 0.300 . 1 . . . . 20 LEU CB . 11150 1
176 . 1 1 20 20 LEU CD1 C 13 25.330 0.300 . 2 . . . . 20 LEU CD1 . 11150 1
177 . 1 1 20 20 LEU CD2 C 13 23.233 0.300 . 2 . . . . 20 LEU CD2 . 11150 1
178 . 1 1 20 20 LEU CG C 13 26.916 0.300 . 1 . . . . 20 LEU CG . 11150 1
179 . 1 1 20 20 LEU N N 15 127.169 0.300 . 1 . . . . 20 LEU N . 11150 1
180 . 1 1 21 21 THR H H 1 8.155 0.030 . 1 . . . . 21 THR H . 11150 1
181 . 1 1 21 21 THR HA H 1 4.178 0.030 . 1 . . . . 21 THR HA . 11150 1
182 . 1 1 21 21 THR HB H 1 4.142 0.030 . 1 . . . . 21 THR HB . 11150 1
183 . 1 1 21 21 THR HG21 H 1 1.204 0.030 . 1 . . . . 21 THR HG2 . 11150 1
184 . 1 1 21 21 THR HG22 H 1 1.204 0.030 . 1 . . . . 21 THR HG2 . 11150 1
185 . 1 1 21 21 THR HG23 H 1 1.204 0.030 . 1 . . . . 21 THR HG2 . 11150 1
186 . 1 1 21 21 THR CA C 13 62.877 0.300 . 1 . . . . 21 THR CA . 11150 1
187 . 1 1 21 21 THR CB C 13 69.565 0.300 . 1 . . . . 21 THR CB . 11150 1
188 . 1 1 21 21 THR CG2 C 13 21.722 0.300 . 1 . . . . 21 THR CG2 . 11150 1
189 . 1 1 21 21 THR N N 15 120.568 0.300 . 1 . . . . 21 THR N . 11150 1
190 . 1 1 22 22 ARG HA H 1 4.350 0.030 . 1 . . . . 22 ARG HA . 11150 1
191 . 1 1 22 22 ARG HB2 H 1 1.853 0.030 . 2 . . . . 22 ARG HB2 . 11150 1
192 . 1 1 22 22 ARG HB3 H 1 1.734 0.030 . 2 . . . . 22 ARG HB3 . 11150 1
193 . 1 1 22 22 ARG HD2 H 1 3.165 0.030 . 1 . . . . 22 ARG HD2 . 11150 1
194 . 1 1 22 22 ARG HD3 H 1 3.165 0.030 . 1 . . . . 22 ARG HD3 . 11150 1
195 . 1 1 22 22 ARG HG2 H 1 1.596 0.030 . 2 . . . . 22 ARG HG2 . 11150 1
196 . 1 1 22 22 ARG HG3 H 1 1.549 0.030 . 2 . . . . 22 ARG HG3 . 11150 1
197 . 1 1 22 22 ARG C C 13 175.505 0.300 . 1 . . . . 22 ARG C . 11150 1
198 . 1 1 22 22 ARG CA C 13 56.135 0.300 . 1 . . . . 22 ARG CA . 11150 1
199 . 1 1 22 22 ARG CB C 13 30.096 0.300 . 1 . . . . 22 ARG CB . 11150 1
200 . 1 1 22 22 ARG CD C 13 43.318 0.300 . 1 . . . . 22 ARG CD . 11150 1
201 . 1 1 22 22 ARG CG C 13 27.214 0.300 . 1 . . . . 22 ARG CG . 11150 1
202 . 1 1 23 23 SER H H 1 8.025 0.030 . 1 . . . . 23 SER H . 11150 1
203 . 1 1 23 23 SER HA H 1 4.422 0.030 . 1 . . . . 23 SER HA . 11150 1
204 . 1 1 23 23 SER HB2 H 1 3.878 0.030 . 1 . . . . 23 SER HB2 . 11150 1
205 . 1 1 23 23 SER HB3 H 1 3.878 0.030 . 1 . . . . 23 SER HB3 . 11150 1
206 . 1 1 23 23 SER C C 13 174.073 0.300 . 1 . . . . 23 SER C . 11150 1
207 . 1 1 23 23 SER CA C 13 57.792 0.300 . 1 . . . . 23 SER CA . 11150 1
208 . 1 1 23 23 SER CB C 13 64.392 0.300 . 1 . . . . 23 SER CB . 11150 1
209 . 1 1 23 23 SER N N 15 117.226 0.300 . 1 . . . . 23 SER N . 11150 1
210 . 1 1 24 24 LEU H H 1 8.357 0.030 . 1 . . . . 24 LEU H . 11150 1
211 . 1 1 24 24 LEU HA H 1 3.911 0.030 . 1 . . . . 24 LEU HA . 11150 1
212 . 1 1 24 24 LEU HB2 H 1 0.397 0.030 . 2 . . . . 24 LEU HB2 . 11150 1
213 . 1 1 24 24 LEU HB3 H 1 1.058 0.030 . 2 . . . . 24 LEU HB3 . 11150 1
214 . 1 1 24 24 LEU HD11 H 1 0.324 0.030 . 1 . . . . 24 LEU HD1 . 11150 1
215 . 1 1 24 24 LEU HD12 H 1 0.324 0.030 . 1 . . . . 24 LEU HD1 . 11150 1
216 . 1 1 24 24 LEU HD13 H 1 0.324 0.030 . 1 . . . . 24 LEU HD1 . 11150 1
217 . 1 1 24 24 LEU HD21 H 1 0.611 0.030 . 1 . . . . 24 LEU HD2 . 11150 1
218 . 1 1 24 24 LEU HD22 H 1 0.611 0.030 . 1 . . . . 24 LEU HD2 . 11150 1
219 . 1 1 24 24 LEU HD23 H 1 0.611 0.030 . 1 . . . . 24 LEU HD2 . 11150 1
220 . 1 1 24 24 LEU HG H 1 1.363 0.030 . 1 . . . . 24 LEU HG . 11150 1
221 . 1 1 24 24 LEU C C 13 176.913 0.300 . 1 . . . . 24 LEU C . 11150 1
222 . 1 1 24 24 LEU CA C 13 56.786 0.300 . 1 . . . . 24 LEU CA . 11150 1
223 . 1 1 24 24 LEU CB C 13 40.785 0.300 . 1 . . . . 24 LEU CB . 11150 1
224 . 1 1 24 24 LEU CD1 C 13 24.247 0.300 . 2 . . . . 24 LEU CD1 . 11150 1
225 . 1 1 24 24 LEU CD2 C 13 22.348 0.300 . 2 . . . . 24 LEU CD2 . 11150 1
226 . 1 1 24 24 LEU CG C 13 26.580 0.300 . 1 . . . . 24 LEU CG . 11150 1
227 . 1 1 24 24 LEU N N 15 123.169 0.300 . 1 . . . . 24 LEU N . 11150 1
228 . 1 1 25 25 CYS H H 1 7.603 0.030 . 1 . . . . 25 CYS H . 11150 1
229 . 1 1 25 25 CYS HA H 1 4.727 0.030 . 1 . . . . 25 CYS HA . 11150 1
230 . 1 1 25 25 CYS HB2 H 1 3.226 0.030 . 2 . . . . 25 CYS HB2 . 11150 1
231 . 1 1 25 25 CYS HB3 H 1 3.434 0.030 . 2 . . . . 25 CYS HB3 . 11150 1
232 . 1 1 25 25 CYS C C 13 171.317 0.300 . 1 . . . . 25 CYS C . 11150 1
233 . 1 1 25 25 CYS CA C 13 54.764 0.300 . 1 . . . . 25 CYS CA . 11150 1
234 . 1 1 25 25 CYS CB C 13 42.622 0.300 . 1 . . . . 25 CYS CB . 11150 1
235 . 1 1 25 25 CYS N N 15 110.770 0.300 . 1 . . . . 25 CYS N . 11150 1
236 . 1 1 26 26 ALA H H 1 8.994 0.030 . 1 . . . . 26 ALA H . 11150 1
237 . 1 1 26 26 ALA HA H 1 4.630 0.030 . 1 . . . . 26 ALA HA . 11150 1
238 . 1 1 26 26 ALA HB1 H 1 1.410 0.030 . 1 . . . . 26 ALA HB . 11150 1
239 . 1 1 26 26 ALA HB2 H 1 1.410 0.030 . 1 . . . . 26 ALA HB . 11150 1
240 . 1 1 26 26 ALA HB3 H 1 1.410 0.030 . 1 . . . . 26 ALA HB . 11150 1
241 . 1 1 26 26 ALA C C 13 176.849 0.300 . 1 . . . . 26 ALA C . 11150 1
242 . 1 1 26 26 ALA CA C 13 51.730 0.300 . 1 . . . . 26 ALA CA . 11150 1
243 . 1 1 26 26 ALA CB C 13 23.691 0.300 . 1 . . . . 26 ALA CB . 11150 1
244 . 1 1 26 26 ALA N N 15 123.657 0.300 . 1 . . . . 26 ALA N . 11150 1
245 . 1 1 27 27 CYS H H 1 8.747 0.030 . 1 . . . . 27 CYS H . 11150 1
246 . 1 1 27 27 CYS HA H 1 5.142 0.030 . 1 . . . . 27 CYS HA . 11150 1
247 . 1 1 27 27 CYS HB2 H 1 2.821 0.030 . 2 . . . . 27 CYS HB2 . 11150 1
248 . 1 1 27 27 CYS HB3 H 1 3.529 0.030 . 2 . . . . 27 CYS HB3 . 11150 1
249 . 1 1 27 27 CYS C C 13 173.397 0.300 . 1 . . . . 27 CYS C . 11150 1
250 . 1 1 27 27 CYS CA C 13 54.941 0.300 . 1 . . . . 27 CYS CA . 11150 1
251 . 1 1 27 27 CYS CB C 13 44.321 0.300 . 1 . . . . 27 CYS CB . 11150 1
252 . 1 1 27 27 CYS N N 15 116.189 0.300 . 1 . . . . 27 CYS N . 11150 1
253 . 1 1 28 28 SER H H 1 7.089 0.030 . 1 . . . . 28 SER H . 11150 1
254 . 1 1 28 28 SER HA H 1 4.479 0.030 . 1 . . . . 28 SER HA . 11150 1
255 . 1 1 28 28 SER HB2 H 1 4.015 0.030 . 1 . . . . 28 SER HB2 . 11150 1
256 . 1 1 28 28 SER HB3 H 1 4.015 0.030 . 1 . . . . 28 SER HB3 . 11150 1
257 . 1 1 28 28 SER C C 13 174.721 0.300 . 1 . . . . 28 SER C . 11150 1
258 . 1 1 28 28 SER CA C 13 56.938 0.300 . 1 . . . . 28 SER CA . 11150 1
259 . 1 1 28 28 SER CB C 13 64.990 0.300 . 1 . . . . 28 SER CB . 11150 1
260 . 1 1 28 28 SER N N 15 114.101 0.300 . 1 . . . . 28 SER N . 11150 1
261 . 1 1 29 29 ASP H H 1 9.005 0.030 . 1 . . . . 29 ASP H . 11150 1
262 . 1 1 29 29 ASP HA H 1 4.478 0.030 . 1 . . . . 29 ASP HA . 11150 1
263 . 1 1 29 29 ASP HB2 H 1 2.635 0.030 . 2 . . . . 29 ASP HB2 . 11150 1
264 . 1 1 29 29 ASP HB3 H 1 2.862 0.030 . 2 . . . . 29 ASP HB3 . 11150 1
265 . 1 1 29 29 ASP C C 13 177.050 0.300 . 1 . . . . 29 ASP C . 11150 1
266 . 1 1 29 29 ASP CA C 13 56.922 0.300 . 1 . . . . 29 ASP CA . 11150 1
267 . 1 1 29 29 ASP CB C 13 40.214 0.300 . 1 . . . . 29 ASP CB . 11150 1
268 . 1 1 29 29 ASP N N 15 120.000 0.300 . 1 . . . . 29 ASP N . 11150 1
269 . 1 1 30 30 ASP H H 1 7.903 0.030 . 1 . . . . 30 ASP H . 11150 1
270 . 1 1 30 30 ASP HA H 1 4.724 0.030 . 1 . . . . 30 ASP HA . 11150 1
271 . 1 1 30 30 ASP HB2 H 1 3.237 0.030 . 2 . . . . 30 ASP HB2 . 11150 1
272 . 1 1 30 30 ASP HB3 H 1 2.618 0.030 . 2 . . . . 30 ASP HB3 . 11150 1
273 . 1 1 30 30 ASP C C 13 178.814 0.300 . 1 . . . . 30 ASP C . 11150 1
274 . 1 1 30 30 ASP CA C 13 53.314 0.300 . 1 . . . . 30 ASP CA . 11150 1
275 . 1 1 30 30 ASP CB C 13 40.442 0.300 . 1 . . . . 30 ASP CB . 11150 1
276 . 1 1 30 30 ASP N N 15 117.519 0.300 . 1 . . . . 30 ASP N . 11150 1
277 . 1 1 31 31 CYS H H 1 7.904 0.030 . 1 . . . . 31 CYS H . 11150 1
278 . 1 1 31 31 CYS HA H 1 3.982 0.030 . 1 . . . . 31 CYS HA . 11150 1
279 . 1 1 31 31 CYS HB2 H 1 2.540 0.030 . 2 . . . . 31 CYS HB2 . 11150 1
280 . 1 1 31 31 CYS HB3 H 1 3.125 0.030 . 2 . . . . 31 CYS HB3 . 11150 1
281 . 1 1 31 31 CYS C C 13 176.205 0.300 . 1 . . . . 31 CYS C . 11150 1
282 . 1 1 31 31 CYS CA C 13 59.230 0.300 . 1 . . . . 31 CYS CA . 11150 1
283 . 1 1 31 31 CYS CB C 13 40.026 0.300 . 1 . . . . 31 CYS CB . 11150 1
284 . 1 1 31 31 CYS N N 15 120.010 0.300 . 1 . . . . 31 CYS N . 11150 1
285 . 1 1 32 32 LYS H H 1 8.116 0.030 . 1 . . . . 32 LYS H . 11150 1
286 . 1 1 32 32 LYS HA H 1 4.014 0.030 . 1 . . . . 32 LYS HA . 11150 1
287 . 1 1 32 32 LYS HB2 H 1 1.945 0.030 . 2 . . . . 32 LYS HB2 . 11150 1
288 . 1 1 32 32 LYS HB3 H 1 1.839 0.030 . 2 . . . . 32 LYS HB3 . 11150 1
289 . 1 1 32 32 LYS HD2 H 1 1.777 0.030 . 1 . . . . 32 LYS HD2 . 11150 1
290 . 1 1 32 32 LYS HD3 H 1 1.777 0.030 . 1 . . . . 32 LYS HD3 . 11150 1
291 . 1 1 32 32 LYS HE2 H 1 3.061 0.030 . 1 . . . . 32 LYS HE2 . 11150 1
292 . 1 1 32 32 LYS HE3 H 1 3.061 0.030 . 1 . . . . 32 LYS HE3 . 11150 1
293 . 1 1 32 32 LYS HG2 H 1 1.568 0.030 . 2 . . . . 32 LYS HG2 . 11150 1
294 . 1 1 32 32 LYS HG3 H 1 1.455 0.030 . 2 . . . . 32 LYS HG3 . 11150 1
295 . 1 1 32 32 LYS C C 13 179.407 0.300 . 1 . . . . 32 LYS C . 11150 1
296 . 1 1 32 32 LYS CA C 13 59.750 0.300 . 1 . . . . 32 LYS CA . 11150 1
297 . 1 1 32 32 LYS CB C 13 31.419 0.300 . 1 . . . . 32 LYS CB . 11150 1
298 . 1 1 32 32 LYS CD C 13 29.191 0.300 . 1 . . . . 32 LYS CD . 11150 1
299 . 1 1 32 32 LYS CE C 13 42.147 0.300 . 1 . . . . 32 LYS CE . 11150 1
300 . 1 1 32 32 LYS CG C 13 24.948 0.300 . 1 . . . . 32 LYS CG . 11150 1
301 . 1 1 32 32 LYS N N 15 124.710 0.300 . 1 . . . . 32 LYS N . 11150 1
302 . 1 1 33 33 ASP H H 1 7.723 0.030 . 1 . . . . 33 ASP H . 11150 1
303 . 1 1 33 33 ASP HA H 1 4.394 0.030 . 1 . . . . 33 ASP HA . 11150 1
304 . 1 1 33 33 ASP HB2 H 1 2.684 0.030 . 1 . . . . 33 ASP HB2 . 11150 1
305 . 1 1 33 33 ASP HB3 H 1 2.684 0.030 . 1 . . . . 33 ASP HB3 . 11150 1
306 . 1 1 33 33 ASP C C 13 177.839 0.300 . 1 . . . . 33 ASP C . 11150 1
307 . 1 1 33 33 ASP CA C 13 56.701 0.300 . 1 . . . . 33 ASP CA . 11150 1
308 . 1 1 33 33 ASP CB C 13 40.900 0.300 . 1 . . . . 33 ASP CB . 11150 1
309 . 1 1 33 33 ASP N N 15 119.843 0.300 . 1 . . . . 33 ASP N . 11150 1
310 . 1 1 34 34 GLN H H 1 7.613 0.030 . 1 . . . . 34 GLN H . 11150 1
311 . 1 1 34 34 GLN HA H 1 4.155 0.030 . 1 . . . . 34 GLN HA . 11150 1
312 . 1 1 34 34 GLN HB2 H 1 1.787 0.030 . 2 . . . . 34 GLN HB2 . 11150 1
313 . 1 1 34 34 GLN HB3 H 1 2.087 0.030 . 2 . . . . 34 GLN HB3 . 11150 1
314 . 1 1 34 34 GLN HE21 H 1 6.673 0.030 . 2 . . . . 34 GLN HE21 . 11150 1
315 . 1 1 34 34 GLN HE22 H 1 7.313 0.030 . 2 . . . . 34 GLN HE22 . 11150 1
316 . 1 1 34 34 GLN HG2 H 1 2.212 0.030 . 2 . . . . 34 GLN HG2 . 11150 1
317 . 1 1 34 34 GLN HG3 H 1 2.153 0.030 . 2 . . . . 34 GLN HG3 . 11150 1
318 . 1 1 34 34 GLN C C 13 176.648 0.300 . 1 . . . . 34 GLN C . 11150 1
319 . 1 1 34 34 GLN CA C 13 56.356 0.300 . 1 . . . . 34 GLN CA . 11150 1
320 . 1 1 34 34 GLN CB C 13 28.877 0.300 . 1 . . . . 34 GLN CB . 11150 1
321 . 1 1 34 34 GLN CG C 13 33.420 0.300 . 1 . . . . 34 GLN CG . 11150 1
322 . 1 1 34 34 GLN N N 15 115.833 0.300 . 1 . . . . 34 GLN N . 11150 1
323 . 1 1 34 34 GLN NE2 N 15 111.972 0.300 . 1 . . . . 34 GLN NE2 . 11150 1
324 . 1 1 35 35 GLY H H 1 8.124 0.030 . 1 . . . . 35 GLY H . 11150 1
325 . 1 1 35 35 GLY HA2 H 1 4.109 0.030 . 2 . . . . 35 GLY HA2 . 11150 1
326 . 1 1 35 35 GLY HA3 H 1 3.966 0.030 . 2 . . . . 35 GLY HA3 . 11150 1
327 . 1 1 35 35 GLY C C 13 175.054 0.300 . 1 . . . . 35 GLY C . 11150 1
328 . 1 1 35 35 GLY CA C 13 45.957 0.300 . 1 . . . . 35 GLY CA . 11150 1
329 . 1 1 35 35 GLY N N 15 108.025 0.300 . 1 . . . . 35 GLY N . 11150 1
330 . 1 1 36 36 ASP H H 1 8.406 0.030 . 1 . . . . 36 ASP H . 11150 1
331 . 1 1 36 36 ASP HA H 1 4.890 0.030 . 1 . . . . 36 ASP HA . 11150 1
332 . 1 1 36 36 ASP HB2 H 1 2.244 0.030 . 2 . . . . 36 ASP HB2 . 11150 1
333 . 1 1 36 36 ASP HB3 H 1 3.104 0.030 . 2 . . . . 36 ASP HB3 . 11150 1
334 . 1 1 36 36 ASP C C 13 176.239 0.300 . 1 . . . . 36 ASP C . 11150 1
335 . 1 1 36 36 ASP CA C 13 51.970 0.300 . 1 . . . . 36 ASP CA . 11150 1
336 . 1 1 36 36 ASP CB C 13 40.925 0.300 . 1 . . . . 36 ASP CB . 11150 1
337 . 1 1 36 36 ASP N N 15 118.575 0.300 . 1 . . . . 36 ASP N . 11150 1
338 . 1 1 37 37 CYS H H 1 8.102 0.030 . 1 . . . . 37 CYS H . 11150 1
339 . 1 1 37 37 CYS HA H 1 5.087 0.030 . 1 . . . . 37 CYS HA . 11150 1
340 . 1 1 37 37 CYS HB2 H 1 2.721 0.030 . 2 . . . . 37 CYS HB2 . 11150 1
341 . 1 1 37 37 CYS HB3 H 1 3.166 0.030 . 2 . . . . 37 CYS HB3 . 11150 1
342 . 1 1 37 37 CYS C C 13 178.399 0.300 . 1 . . . . 37 CYS C . 11150 1
343 . 1 1 37 37 CYS CA C 13 54.941 0.300 . 1 . . . . 37 CYS CA . 11150 1
344 . 1 1 37 37 CYS CB C 13 40.264 0.300 . 1 . . . . 37 CYS CB . 11150 1
345 . 1 1 37 37 CYS N N 15 118.507 0.300 . 1 . . . . 37 CYS N . 11150 1
346 . 1 1 38 38 CYS H H 1 8.558 0.030 . 1 . . . . 38 CYS H . 11150 1
347 . 1 1 38 38 CYS HA H 1 4.848 0.030 . 1 . . . . 38 CYS HA . 11150 1
348 . 1 1 38 38 CYS HB2 H 1 3.345 0.030 . 2 . . . . 38 CYS HB2 . 11150 1
349 . 1 1 38 38 CYS HB3 H 1 3.611 0.030 . 2 . . . . 38 CYS HB3 . 11150 1
350 . 1 1 38 38 CYS C C 13 176.963 0.300 . 1 . . . . 38 CYS C . 11150 1
351 . 1 1 38 38 CYS CA C 13 55.083 0.300 . 1 . . . . 38 CYS CA . 11150 1
352 . 1 1 38 38 CYS CB C 13 41.106 0.300 . 1 . . . . 38 CYS CB . 11150 1
353 . 1 1 38 38 CYS N N 15 120.758 0.300 . 1 . . . . 38 CYS N . 11150 1
354 . 1 1 39 39 ILE H H 1 9.172 0.030 . 1 . . . . 39 ILE H . 11150 1
355 . 1 1 39 39 ILE HA H 1 4.124 0.030 . 1 . . . . 39 ILE HA . 11150 1
356 . 1 1 39 39 ILE HB H 1 2.108 0.030 . 1 . . . . 39 ILE HB . 11150 1
357 . 1 1 39 39 ILE HD11 H 1 0.956 0.030 . 1 . . . . 39 ILE HD1 . 11150 1
358 . 1 1 39 39 ILE HD12 H 1 0.956 0.030 . 1 . . . . 39 ILE HD1 . 11150 1
359 . 1 1 39 39 ILE HD13 H 1 0.956 0.030 . 1 . . . . 39 ILE HD1 . 11150 1
360 . 1 1 39 39 ILE HG12 H 1 1.402 0.030 . 2 . . . . 39 ILE HG12 . 11150 1
361 . 1 1 39 39 ILE HG13 H 1 1.576 0.030 . 2 . . . . 39 ILE HG13 . 11150 1
362 . 1 1 39 39 ILE HG21 H 1 1.055 0.030 . 1 . . . . 39 ILE HG2 . 11150 1
363 . 1 1 39 39 ILE HG22 H 1 1.055 0.030 . 1 . . . . 39 ILE HG2 . 11150 1
364 . 1 1 39 39 ILE HG23 H 1 1.055 0.030 . 1 . . . . 39 ILE HG2 . 11150 1
365 . 1 1 39 39 ILE C C 13 175.658 0.300 . 1 . . . . 39 ILE C . 11150 1
366 . 1 1 39 39 ILE CA C 13 64.032 0.300 . 1 . . . . 39 ILE CA . 11150 1
367 . 1 1 39 39 ILE CB C 13 38.330 0.300 . 1 . . . . 39 ILE CB . 11150 1
368 . 1 1 39 39 ILE CD1 C 13 13.546 0.300 . 1 . . . . 39 ILE CD1 . 11150 1
369 . 1 1 39 39 ILE CG1 C 13 28.213 0.300 . 1 . . . . 39 ILE CG1 . 11150 1
370 . 1 1 39 39 ILE CG2 C 13 17.185 0.300 . 1 . . . . 39 ILE CG2 . 11150 1
371 . 1 1 39 39 ILE N N 15 122.045 0.300 . 1 . . . . 39 ILE N . 11150 1
372 . 1 1 40 40 ASN H H 1 7.925 0.030 . 1 . . . . 40 ASN H . 11150 1
373 . 1 1 40 40 ASN HA H 1 5.026 0.030 . 1 . . . . 40 ASN HA . 11150 1
374 . 1 1 40 40 ASN HB2 H 1 2.784 0.030 . 2 . . . . 40 ASN HB2 . 11150 1
375 . 1 1 40 40 ASN HB3 H 1 3.244 0.030 . 2 . . . . 40 ASN HB3 . 11150 1
376 . 1 1 40 40 ASN HD21 H 1 7.187 0.030 . 2 . . . . 40 ASN HD21 . 11150 1
377 . 1 1 40 40 ASN HD22 H 1 7.964 0.030 . 2 . . . . 40 ASN HD22 . 11150 1
378 . 1 1 40 40 ASN C C 13 175.797 0.300 . 1 . . . . 40 ASN C . 11150 1
379 . 1 1 40 40 ASN CA C 13 51.899 0.300 . 1 . . . . 40 ASN CA . 11150 1
380 . 1 1 40 40 ASN CB C 13 37.879 0.300 . 1 . . . . 40 ASN CB . 11150 1
381 . 1 1 40 40 ASN N N 15 117.515 0.300 . 1 . . . . 40 ASN N . 11150 1
382 . 1 1 40 40 ASN ND2 N 15 112.176 0.300 . 1 . . . . 40 ASN ND2 . 11150 1
383 . 1 1 41 41 TYR H H 1 7.900 0.030 . 1 . . . . 41 TYR H . 11150 1
384 . 1 1 41 41 TYR HA H 1 3.706 0.030 . 1 . . . . 41 TYR HA . 11150 1
385 . 1 1 41 41 TYR HB2 H 1 3.050 0.030 . 2 . . . . 41 TYR HB2 . 11150 1
386 . 1 1 41 41 TYR HB3 H 1 3.441 0.030 . 2 . . . . 41 TYR HB3 . 11150 1
387 . 1 1 41 41 TYR HD1 H 1 7.168 0.030 . 1 . . . . 41 TYR HD1 . 11150 1
388 . 1 1 41 41 TYR HD2 H 1 7.168 0.030 . 1 . . . . 41 TYR HD2 . 11150 1
389 . 1 1 41 41 TYR HE1 H 1 6.738 0.030 . 1 . . . . 41 TYR HE1 . 11150 1
390 . 1 1 41 41 TYR HE2 H 1 6.738 0.030 . 1 . . . . 41 TYR HE2 . 11150 1
391 . 1 1 41 41 TYR C C 13 177.097 0.300 . 1 . . . . 41 TYR C . 11150 1
392 . 1 1 41 41 TYR CA C 13 63.222 0.300 . 1 . . . . 41 TYR CA . 11150 1
393 . 1 1 41 41 TYR CB C 13 39.740 0.300 . 1 . . . . 41 TYR CB . 11150 1
394 . 1 1 41 41 TYR CD1 C 13 133.317 0.300 . 1 . . . . 41 TYR CD1 . 11150 1
395 . 1 1 41 41 TYR CD2 C 13 133.317 0.300 . 1 . . . . 41 TYR CD2 . 11150 1
396 . 1 1 41 41 TYR CE1 C 13 118.480 0.300 . 1 . . . . 41 TYR CE1 . 11150 1
397 . 1 1 41 41 TYR CE2 C 13 118.480 0.300 . 1 . . . . 41 TYR CE2 . 11150 1
398 . 1 1 41 41 TYR N N 15 121.018 0.300 . 1 . . . . 41 TYR N . 11150 1
399 . 1 1 42 42 SER H H 1 8.958 0.030 . 1 . . . . 42 SER H . 11150 1
400 . 1 1 42 42 SER HA H 1 3.921 0.030 . 1 . . . . 42 SER HA . 11150 1
401 . 1 1 42 42 SER HB2 H 1 3.810 0.030 . 1 . . . . 42 SER HB2 . 11150 1
402 . 1 1 42 42 SER HB3 H 1 3.810 0.030 . 1 . . . . 42 SER HB3 . 11150 1
403 . 1 1 42 42 SER C C 13 175.723 0.300 . 1 . . . . 42 SER C . 11150 1
404 . 1 1 42 42 SER CA C 13 62.505 0.300 . 1 . . . . 42 SER CA . 11150 1
405 . 1 1 42 42 SER CB C 13 61.864 0.300 . 1 . . . . 42 SER CB . 11150 1
406 . 1 1 42 42 SER N N 15 114.014 0.300 . 1 . . . . 42 SER N . 11150 1
407 . 1 1 43 43 SER H H 1 7.616 0.030 . 1 . . . . 43 SER H . 11150 1
408 . 1 1 43 43 SER HA H 1 4.307 0.030 . 1 . . . . 43 SER HA . 11150 1
409 . 1 1 43 43 SER HB2 H 1 3.868 0.030 . 2 . . . . 43 SER HB2 . 11150 1
410 . 1 1 43 43 SER HB3 H 1 3.831 0.030 . 2 . . . . 43 SER HB3 . 11150 1
411 . 1 1 43 43 SER C C 13 175.695 0.300 . 1 . . . . 43 SER C . 11150 1
412 . 1 1 43 43 SER CA C 13 60.091 0.300 . 1 . . . . 43 SER CA . 11150 1
413 . 1 1 43 43 SER CB C 13 63.300 0.300 . 1 . . . . 43 SER CB . 11150 1
414 . 1 1 43 43 SER N N 15 114.556 0.300 . 1 . . . . 43 SER N . 11150 1
415 . 1 1 44 44 VAL H H 1 7.611 0.030 . 1 . . . . 44 VAL H . 11150 1
416 . 1 1 44 44 VAL HA H 1 3.991 0.030 . 1 . . . . 44 VAL HA . 11150 1
417 . 1 1 44 44 VAL HB H 1 1.709 0.030 . 1 . . . . 44 VAL HB . 11150 1
418 . 1 1 44 44 VAL HG11 H 1 0.618 0.030 . 1 . . . . 44 VAL HG1 . 11150 1
419 . 1 1 44 44 VAL HG12 H 1 0.618 0.030 . 1 . . . . 44 VAL HG1 . 11150 1
420 . 1 1 44 44 VAL HG13 H 1 0.618 0.030 . 1 . . . . 44 VAL HG1 . 11150 1
421 . 1 1 44 44 VAL HG21 H 1 0.860 0.030 . 1 . . . . 44 VAL HG2 . 11150 1
422 . 1 1 44 44 VAL HG22 H 1 0.860 0.030 . 1 . . . . 44 VAL HG2 . 11150 1
423 . 1 1 44 44 VAL HG23 H 1 0.860 0.030 . 1 . . . . 44 VAL HG2 . 11150 1
424 . 1 1 44 44 VAL C C 13 176.768 0.300 . 1 . . . . 44 VAL C . 11150 1
425 . 1 1 44 44 VAL CA C 13 64.319 0.300 . 1 . . . . 44 VAL CA . 11150 1
426 . 1 1 44 44 VAL CB C 13 33.273 0.300 . 1 . . . . 44 VAL CB . 11150 1
427 . 1 1 44 44 VAL CG1 C 13 21.194 0.300 . 2 . . . . 44 VAL CG1 . 11150 1
428 . 1 1 44 44 VAL CG2 C 13 22.666 0.300 . 2 . . . . 44 VAL CG2 . 11150 1
429 . 1 1 44 44 VAL N N 15 117.833 0.300 . 1 . . . . 44 VAL N . 11150 1
430 . 1 1 45 45 CYS H H 1 8.209 0.030 . 1 . . . . 45 CYS H . 11150 1
431 . 1 1 45 45 CYS HA H 1 4.890 0.030 . 1 . . . . 45 CYS HA . 11150 1
432 . 1 1 45 45 CYS HB2 H 1 1.839 0.030 . 2 . . . . 45 CYS HB2 . 11150 1
433 . 1 1 45 45 CYS HB3 H 1 3.076 0.030 . 2 . . . . 45 CYS HB3 . 11150 1
434 . 1 1 45 45 CYS C C 13 175.809 0.300 . 1 . . . . 45 CYS C . 11150 1
435 . 1 1 45 45 CYS CA C 13 52.500 0.300 . 1 . . . . 45 CYS CA . 11150 1
436 . 1 1 45 45 CYS CB C 13 36.298 0.300 . 1 . . . . 45 CYS CB . 11150 1
437 . 1 1 45 45 CYS N N 15 114.986 0.300 . 1 . . . . 45 CYS N . 11150 1
438 . 1 1 46 46 GLN H H 1 7.276 0.030 . 1 . . . . 46 GLN H . 11150 1
439 . 1 1 46 46 GLN HA H 1 4.474 0.030 . 1 . . . . 46 GLN HA . 11150 1
440 . 1 1 46 46 GLN HB2 H 1 2.182 0.030 . 2 . . . . 46 GLN HB2 . 11150 1
441 . 1 1 46 46 GLN HB3 H 1 2.094 0.030 . 2 . . . . 46 GLN HB3 . 11150 1
442 . 1 1 46 46 GLN HE21 H 1 7.460 0.030 . 2 . . . . 46 GLN HE21 . 11150 1
443 . 1 1 46 46 GLN HE22 H 1 6.894 0.030 . 2 . . . . 46 GLN HE22 . 11150 1
444 . 1 1 46 46 GLN HG2 H 1 2.102 0.030 . 1 . . . . 46 GLN HG2 . 11150 1
445 . 1 1 46 46 GLN HG3 H 1 2.102 0.030 . 1 . . . . 46 GLN HG3 . 11150 1
446 . 1 1 46 46 GLN C C 13 176.178 0.300 . 1 . . . . 46 GLN C . 11150 1
447 . 1 1 46 46 GLN CA C 13 55.628 0.300 . 1 . . . . 46 GLN CA . 11150 1
448 . 1 1 46 46 GLN CB C 13 29.605 0.300 . 1 . . . . 46 GLN CB . 11150 1
449 . 1 1 46 46 GLN CG C 13 33.965 0.300 . 1 . . . . 46 GLN CG . 11150 1
450 . 1 1 46 46 GLN N N 15 118.265 0.300 . 1 . . . . 46 GLN N . 11150 1
451 . 1 1 46 46 GLN NE2 N 15 112.412 0.300 . 1 . . . . 46 GLN NE2 . 11150 1
452 . 1 1 47 47 GLY H H 1 7.977 0.030 . 1 . . . . 47 GLY H . 11150 1
453 . 1 1 47 47 GLY HA2 H 1 3.926 0.030 . 1 . . . . 47 GLY HA2 . 11150 1
454 . 1 1 47 47 GLY HA3 H 1 3.926 0.030 . 1 . . . . 47 GLY HA3 . 11150 1
455 . 1 1 47 47 GLY C C 13 174.307 0.300 . 1 . . . . 47 GLY C . 11150 1
456 . 1 1 47 47 GLY CA C 13 45.664 0.300 . 1 . . . . 47 GLY CA . 11150 1
457 . 1 1 47 47 GLY N N 15 108.870 0.300 . 1 . . . . 47 GLY N . 11150 1
458 . 1 1 48 48 GLU H H 1 8.259 0.030 . 1 . . . . 48 GLU H . 11150 1
459 . 1 1 48 48 GLU HA H 1 4.250 0.030 . 1 . . . . 48 GLU HA . 11150 1
460 . 1 1 48 48 GLU HB2 H 1 1.988 0.030 . 2 . . . . 48 GLU HB2 . 11150 1
461 . 1 1 48 48 GLU HB3 H 1 1.866 0.030 . 2 . . . . 48 GLU HB3 . 11150 1
462 . 1 1 48 48 GLU HG2 H 1 2.210 0.030 . 1 . . . . 48 GLU HG2 . 11150 1
463 . 1 1 48 48 GLU HG3 H 1 2.210 0.030 . 1 . . . . 48 GLU HG3 . 11150 1
464 . 1 1 48 48 GLU C C 13 176.685 0.300 . 1 . . . . 48 GLU C . 11150 1
465 . 1 1 48 48 GLU CA C 13 56.628 0.300 . 1 . . . . 48 GLU CA . 11150 1
466 . 1 1 48 48 GLU CB C 13 30.291 0.300 . 1 . . . . 48 GLU CB . 11150 1
467 . 1 1 48 48 GLU CG C 13 36.213 0.300 . 1 . . . . 48 GLU CG . 11150 1
468 . 1 1 48 48 GLU N N 15 120.798 0.300 . 1 . . . . 48 GLU N . 11150 1
469 . 1 1 49 49 LYS H H 1 8.433 0.030 . 1 . . . . 49 LYS H . 11150 1
470 . 1 1 49 49 LYS C C 13 176.865 0.300 . 1 . . . . 49 LYS C . 11150 1
471 . 1 1 49 49 LYS N N 15 122.848 0.300 . 1 . . . . 49 LYS N . 11150 1
472 . 1 1 53 53 PRO HA H 1 4.479 0.030 . 1 . . . . 53 PRO HA . 11150 1
473 . 1 1 53 53 PRO HB2 H 1 2.299 0.030 . 2 . . . . 53 PRO HB2 . 11150 1
474 . 1 1 53 53 PRO HB3 H 1 1.984 0.030 . 2 . . . . 53 PRO HB3 . 11150 1
475 . 1 1 53 53 PRO HD2 H 1 3.629 0.030 . 1 . . . . 53 PRO HD2 . 11150 1
476 . 1 1 53 53 PRO HD3 H 1 3.629 0.030 . 1 . . . . 53 PRO HD3 . 11150 1
477 . 1 1 53 53 PRO HG2 H 1 2.021 0.030 . 1 . . . . 53 PRO HG2 . 11150 1
478 . 1 1 53 53 PRO HG3 H 1 2.021 0.030 . 1 . . . . 53 PRO HG3 . 11150 1
479 . 1 1 53 53 PRO CA C 13 63.363 0.300 . 1 . . . . 53 PRO CA . 11150 1
480 . 1 1 53 53 PRO CB C 13 32.117 0.300 . 1 . . . . 53 PRO CB . 11150 1
481 . 1 1 53 53 PRO CD C 13 49.838 0.300 . 1 . . . . 53 PRO CD . 11150 1
482 . 1 1 53 53 PRO CG C 13 27.127 0.300 . 1 . . . . 53 PRO CG . 11150 1
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