Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6589
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $CD1_sample
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 $CD1_-_Chromo_1_domain isotropic 6589 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 SER C C 13 172.4 0.0 . 1 . . . . 2 SER C . 6589 1
2 . 1 1 2 2 SER CA C 13 56.2 0.0 . 1 . . . . 2 SER CA . 6589 1
3 . 1 1 2 2 SER CB C 13 61.0 0.0 . 1 . . . . 2 SER CB . 6589 1
4 . 1 1 3 3 GLY H H 1 8.579 0.0 . 1 . . . . 3 GLY H . 6589 1
5 . 1 1 3 3 GLY HA2 H 1 3.857 0.0 . 2 . . . . 3 GLY HA2 . 6589 1
6 . 1 1 3 3 GLY C C 13 171.5 0.0 . 1 . . . . 3 GLY C . 6589 1
7 . 1 1 3 3 GLY CA C 13 42.94 0.0 . 1 . . . . 3 GLY CA . 6589 1
8 . 1 1 3 3 GLY N N 15 110.98 0.0 . 1 . . . . 3 GLY N . 6589 1
9 . 1 1 4 4 GLU H H 1 8.266 0.0 . 1 . . . . 4 GLU H . 6589 1
10 . 1 1 4 4 GLU HA H 1 4.371 0.0 . 1 . . . . 4 GLU HA . 6589 1
11 . 1 1 4 4 GLU HB2 H 1 1.892 0.0 . 1 . . . . 4 GLU HB2 . 6589 1
12 . 1 1 4 4 GLU HB3 H 1 1.892 0.0 . 1 . . . . 4 GLU HB3 . 6589 1
13 . 1 1 4 4 GLU HG2 H 1 2.109 0.0 . 1 . . . . 4 GLU HG2 . 6589 1
14 . 1 1 4 4 GLU HG3 H 1 2.109 0.0 . 1 . . . . 4 GLU HG3 . 6589 1
15 . 1 1 4 4 GLU CA C 13 53.94 0.0 . 1 . . . . 4 GLU CA . 6589 1
16 . 1 1 4 4 GLU CB C 13 28.01 0.0 . 1 . . . . 4 GLU CB . 6589 1
17 . 1 1 4 4 GLU N N 15 119.282 0.0 . 1 . . . . 4 GLU N . 6589 1
18 . 1 1 5 5 VAL H H 1 8.185 0.0 . 1 . . . . 5 VAL H . 6589 1
19 . 1 1 5 5 VAL HA H 1 3.698 0.0 . 1 . . . . 5 VAL HA . 6589 1
20 . 1 1 5 5 VAL HB H 1 2.009 0.0 . 1 . . . . 5 VAL HB . 6589 1
21 . 1 1 5 5 VAL HG11 H 1 0.552 0.0 . 1 . . . . 5 VAL HG1 . 6589 1
22 . 1 1 5 5 VAL HG12 H 1 0.552 0.0 . 1 . . . . 5 VAL HG1 . 6589 1
23 . 1 1 5 5 VAL HG13 H 1 0.552 0.0 . 1 . . . . 5 VAL HG1 . 6589 1
24 . 1 1 5 5 VAL HG21 H 1 0.552 0.0 . 1 . . . . 5 VAL HG2 . 6589 1
25 . 1 1 5 5 VAL HG22 H 1 0.552 0.0 . 1 . . . . 5 VAL HG2 . 6589 1
26 . 1 1 5 5 VAL HG23 H 1 0.552 0.0 . 1 . . . . 5 VAL HG2 . 6589 1
27 . 1 1 5 5 VAL C C 13 172.8 0.0 . 1 . . . . 5 VAL C . 6589 1
28 . 1 1 5 5 VAL CA C 13 60.02 0.0 . 1 . . . . 5 VAL CA . 6589 1
29 . 1 1 5 5 VAL N N 15 122.016 0.0 . 1 . . . . 5 VAL N . 6589 1
30 . 1 1 6 6 ASN H H 1 8.852 0.0 . 1 . . . . 6 ASN H . 6589 1
31 . 1 1 6 6 ASN HA H 1 3.657 0.0 . 1 . . . . 6 ASN HA . 6589 1
32 . 1 1 6 6 ASN HB2 H 1 2.208 0.0 . 2 . . . . 6 ASN HB2 . 6589 1
33 . 1 1 6 6 ASN HB3 H 1 2.349 0.0 . 2 . . . . 6 ASN HB3 . 6589 1
34 . 1 1 6 6 ASN HD21 H 1 7.08 0.0 . 1 . . . . 6 ASN HD21 . 6589 1
35 . 1 1 6 6 ASN HD22 H 1 7.86 0.0 . 1 . . . . 6 ASN HD22 . 6589 1
36 . 1 1 6 6 ASN CA C 13 51.6 0.0 . 1 . . . . 6 ASN CA . 6589 1
37 . 1 1 6 6 ASN N N 15 124.1 0.0 . 1 . . . . 6 ASN N . 6589 1
38 . 1 1 6 6 ASN ND2 N 15 115.0 0.0 . 1 . . . . 6 ASN ND2 . 6589 1
39 . 1 1 7 7 LYS H H 1 7.531 0.0 . 1 . . . . 7 LYS H . 6589 1
40 . 1 1 7 7 LYS HA H 1 4.27 0.0 . 1 . . . . 7 LYS HA . 6589 1
41 . 1 1 7 7 LYS HB2 H 1 1.448 0.0 . 2 . . . . 7 LYS HB2 . 6589 1
42 . 1 1 7 7 LYS HB3 H 1 1.618 0.0 . 2 . . . . 7 LYS HB3 . 6589 1
43 . 1 1 7 7 LYS HG2 H 1 1.083 0.0 . 1 . . . . 7 LYS HG2 . 6589 1
44 . 1 1 7 7 LYS HG3 H 1 1.083 0.0 . 1 . . . . 7 LYS HG3 . 6589 1
45 . 1 1 7 7 LYS C C 13 171.1 0.0 . 1 . . . . 7 LYS C . 6589 1
46 . 1 1 7 7 LYS CA C 13 52.53 0.0 . 1 . . . . 7 LYS CA . 6589 1
47 . 1 1 7 7 LYS CB C 13 32.8 0.0 . 1 . . . . 7 LYS CB . 6589 1
48 . 1 1 7 7 LYS N N 15 116.137 0.0 . 1 . . . . 7 LYS N . 6589 1
49 . 1 1 8 8 ILE H H 1 8.852 0.0 . 1 . . . . 8 ILE H . 6589 1
50 . 1 1 8 8 ILE HA H 1 4.052 0.0 . 1 . . . . 8 ILE HA . 6589 1
51 . 1 1 8 8 ILE HB H 1 1.428 0.0 . 1 . . . . 8 ILE HB . 6589 1
52 . 1 1 8 8 ILE HG21 H 1 0.691 0.0 . 1 . . . . 8 ILE HG21 . 6589 1
53 . 1 1 8 8 ILE HG22 H 1 0.691 0.0 . 1 . . . . 8 ILE HG22 . 6589 1
54 . 1 1 8 8 ILE HG23 H 1 0.691 0.0 . 1 . . . . 8 ILE HG23 . 6589 1
55 . 1 1 8 8 ILE C C 13 174.3 0.0 . 1 . . . . 8 ILE C . 6589 1
56 . 1 1 8 8 ILE CA C 13 59.01 0.0 . 1 . . . . 8 ILE CA . 6589 1
57 . 1 1 8 8 ILE CB C 13 35.7 0.0 . 1 . . . . 8 ILE CB . 6589 1
58 . 1 1 8 8 ILE N N 15 122.973 0.0 . 1 . . . . 8 ILE N . 6589 1
59 . 1 1 9 9 ILE H H 1 8.866 0.0 . 1 . . . . 9 ILE H . 6589 1
60 . 1 1 9 9 ILE HA H 1 4.406 0.0 . 1 . . . . 9 ILE HA . 6589 1
61 . 1 1 9 9 ILE HB H 1 1.873 0.0 . 1 . . . . 9 ILE HB . 6589 1
62 . 1 1 9 9 ILE HG21 H 1 0.551 0.0 . 1 . . . . 9 ILE HG21 . 6589 1
63 . 1 1 9 9 ILE HG22 H 1 0.551 0.0 . 1 . . . . 9 ILE HG22 . 6589 1
64 . 1 1 9 9 ILE HG23 H 1 0.551 0.0 . 1 . . . . 9 ILE HG23 . 6589 1
65 . 1 1 9 9 ILE C C 13 172.8 0.0 . 1 . . . . 9 ILE C . 6589 1
66 . 1 1 9 9 ILE CA C 13 58.74 0.0 . 1 . . . . 9 ILE CA . 6589 1
67 . 1 1 9 9 ILE CB C 13 36.13 0.0 . 1 . . . . 9 ILE CB . 6589 1
68 . 1 1 9 9 ILE N N 15 120.512 0.0 . 1 . . . . 9 ILE N . 6589 1
69 . 1 1 10 10 GLY H H 1 7.286 0.0 . 1 . . . . 10 GLY H . 6589 1
70 . 1 1 10 10 GLY HA2 H 1 4.098 0.0 . 2 . . . . 10 GLY HA1 . 6589 1
71 . 1 1 10 10 GLY HA3 H 1 3.763 0.0 . 2 . . . . 10 GLY HA2 . 6589 1
72 . 1 1 10 10 GLY C C 13 168.4 0.0 . 1 . . . . 10 GLY C . 6589 1
73 . 1 1 10 10 GLY CA C 13 42.99 0.0 . 1 . . . . 10 GLY CA . 6589 1
74 . 1 1 10 10 GLY N N 15 109.573 0.0 . 1 . . . . 10 GLY N . 6589 1
75 . 1 1 11 11 SER H H 1 8.566 0.0 . 1 . . . . 11 SER H . 6589 1
76 . 1 1 11 11 SER HA H 1 5.66 0.0 . 1 . . . . 11 SER HA . 6589 1
77 . 1 1 11 11 SER HB2 H 1 3.78 0.0 . 1 . . . . 11 SER HB2 . 6589 1
78 . 1 1 11 11 SER HB3 H 1 3.78 0.0 . 1 . . . . 11 SER HB3 . 6589 1
79 . 1 1 11 11 SER C C 13 169.6 0.0 . 1 . . . . 11 SER C . 6589 1
80 . 1 1 11 11 SER CA C 13 54.98 0.0 . 1 . . . . 11 SER CA . 6589 1
81 . 1 1 11 11 SER CB C 13 64.29 0.0 . 1 . . . . 11 SER CB . 6589 1
82 . 1 1 11 11 SER N N 15 113.539 0.0 . 1 . . . . 11 SER N . 6589 1
83 . 1 1 12 12 ARG H H 1 8.879 0.0 . 1 . . . . 12 ARG H . 6589 1
84 . 1 1 12 12 ARG HA H 1 4.98 0.0 . 1 . . . . 12 ARG HA . 6589 1
85 . 1 1 12 12 ARG HB2 H 1 1.812 0.0 . 2 . . . . 12 ARG HB2 . 6589 1
86 . 1 1 12 12 ARG HB3 H 1 1.607 0.0 . 2 . . . . 12 ARG HB3 . 6589 1
87 . 1 1 12 12 ARG HG2 H 1 1.491 0.0 . 1 . . . . 12 ARG HG2 . 6589 1
88 . 1 1 12 12 ARG HG3 H 1 1.491 0.0 . 1 . . . . 12 ARG HG3 . 6589 1
89 . 1 1 12 12 ARG C C 13 170.5 0.0 . 1 . . . . 12 ARG C . 6589 1
90 . 1 1 12 12 ARG CA C 13 52.03 0.0 . 1 . . . . 12 ARG CA . 6589 1
91 . 1 1 12 12 ARG CB C 13 29.37 0.0 . 1 . . . . 12 ARG CB . 6589 1
92 . 1 1 12 12 ARG N N 15 118.051 0.0 . 1 . . . . 12 ARG N . 6589 1
93 . 1 1 13 13 THR H H 1 8.215 0.0 . 1 . . . . 13 THR H . 6589 1
94 . 1 1 13 13 THR HA H 1 4.637 0.0 . 1 . . . . 13 THR HA . 6589 1
95 . 1 1 13 13 THR HB H 1 4.003 0.0 . 1 . . . . 13 THR HB . 6589 1
96 . 1 1 13 13 THR HG21 H 1 1.046 0.0 . 1 . . . . 13 THR HG1 . 6589 1
97 . 1 1 13 13 THR HG22 H 1 1.046 0.0 . 1 . . . . 13 THR HG1 . 6589 1
98 . 1 1 13 13 THR HG23 H 1 1.046 0.0 . 1 . . . . 13 THR HG1 . 6589 1
99 . 1 1 13 13 THR C C 13 171.4 0.0 . 1 . . . . 13 THR C . 6589 1
100 . 1 1 13 13 THR CA C 13 59.01 0.0 . 1 . . . . 13 THR CA . 6589 1
101 . 1 1 13 13 THR CB C 13 67.13 0.0 . 1 . . . . 13 THR CB . 6589 1
102 . 1 1 13 13 THR N N 15 114.6 0.0 . 1 . . . . 13 THR N . 6589 1
103 . 1 1 14 14 ALA H H 1 8.416 0.0 . 1 . . . . 14 ALA H . 6589 1
104 . 1 1 14 14 ALA HA H 1 4.36 0.0 . 1 . . . . 14 ALA HA . 6589 1
105 . 1 1 14 14 ALA HB1 H 1 1.02 0.0 . 1 . . . . 14 ALA HB1 . 6589 1
106 . 1 1 14 14 ALA HB2 H 1 1.02 0.0 . 1 . . . . 14 ALA HB2 . 6589 1
107 . 1 1 14 14 ALA HB3 H 1 1.02 0.0 . 1 . . . . 14 ALA HB3 . 6589 1
108 . 1 1 14 14 ALA C C 13 174.1 0.0 . 1 . . . . 14 ALA C . 6589 1
109 . 1 1 14 14 ALA CA C 13 48.11 0.0 . 1 . . . . 14 ALA CA . 6589 1
110 . 1 1 14 14 ALA CB C 13 17.2 0.0 . 1 . . . . 14 ALA CB . 6589 1
111 . 1 1 14 14 ALA N N 15 128.853 0.0 . 1 . . . . 14 ALA N . 6589 1
112 . 1 1 15 15 GLY H H 1 8.089 0.0 . 1 . . . . 15 GLY H . 6589 1
113 . 1 1 15 15 GLY HA2 H 1 3.68 0.0 . 2 . . . . 15 GLY HA1 . 6589 1
114 . 1 1 15 15 GLY HA3 H 1 3.88 0.0 . 2 . . . . 15 GLY HA2 . 6589 1
115 . 1 1 15 15 GLY C C 13 171.5 0.0 . 1 . . . . 15 GLY C . 6589 1
116 . 1 1 15 15 GLY CA C 13 42.66 0.0 . 1 . . . . 15 GLY CA . 6589 1
117 . 1 1 15 15 GLY N N 15 108.753 0.0 . 1 . . . . 15 GLY N . 6589 1
118 . 1 1 16 16 GLU H H 1 8.553 0.0 . 1 . . . . 16 GLU H . 6589 1
119 . 1 1 16 16 GLU HA H 1 3.935 0.0 . 1 . . . . 16 GLU HA . 6589 1
120 . 1 1 16 16 GLU HB2 H 1 1.946 0.0 . 1 . . . . 16 GLU HB2 . 6589 1
121 . 1 1 16 16 GLU HB3 H 1 1.946 0.0 . 1 . . . . 16 GLU HB3 . 6589 1
122 . 1 1 16 16 GLU HG2 H 1 2.134 0.0 . 1 . . . . 16 GLU HG2 . 6589 1
123 . 1 1 16 16 GLU HG3 H 1 2.134 0.0 . 1 . . . . 16 GLU HG3 . 6589 1
124 . 1 1 16 16 GLU C C 13 174.5 0.0 . 1 . . . . 16 GLU C . 6589 1
125 . 1 1 16 16 GLU CA C 13 54.21 0.0 . 1 . . . . 16 GLU CA . 6589 1
126 . 1 1 16 16 GLU CB C 13 25.73 0.0 . 1 . . . . 16 GLU CB . 6589 1
127 . 1 1 16 16 GLU N N 15 120.239 0.0 . 1 . . . . 16 GLU N . 6589 1
128 . 1 1 17 17 GLY H H 1 8.321 0.0 . 1 . . . . 17 GLY H . 6589 1
129 . 1 1 17 17 GLY HA2 H 1 3.581 0.0 . 2 . . . . 17 GLY HA1 . 6589 1
130 . 1 1 17 17 GLY HA3 H 1 3.97 0.0 . 2 . . . . 17 GLY HA2 . 6589 1
131 . 1 1 17 17 GLY C C 13 170.9 0.0 . 1 . . . . 17 GLY C . 6589 1
132 . 1 1 17 17 GLY CA C 13 42.91 0.0 . 1 . . . . 17 GLY CA . 6589 1
133 . 1 1 17 17 GLY N N 15 109.573 0.0 . 1 . . . . 17 GLY N . 6589 1
134 . 1 1 18 18 ALA H H 1 7.572 0.0 . 1 . . . . 18 ALA H . 6589 1
135 . 1 1 18 18 ALA HA H 1 4.452 0.0 . 1 . . . . 18 ALA HA . 6589 1
136 . 1 1 18 18 ALA HB1 H 1 1.238 0.0 . 1 . . . . 18 ALA HB1 . 6589 1
137 . 1 1 18 18 ALA HB2 H 1 1.238 0.0 . 1 . . . . 18 ALA HB2 . 6589 1
138 . 1 1 18 18 ALA HB3 H 1 1.238 0.0 . 1 . . . . 18 ALA HB3 . 6589 1
139 . 1 1 18 18 ALA C C 13 173.5 0.0 . 1 . . . . 18 ALA C . 6589 1
140 . 1 1 18 18 ALA CA C 13 48.87 0.0 . 1 . . . . 18 ALA CA . 6589 1
141 . 1 1 18 18 ALA CB C 13 17.5 0.0 . 1 . . . . 18 ALA CB . 6589 1
142 . 1 1 18 18 ALA N N 15 123.247 0.0 . 1 . . . . 18 ALA N . 6589 1
143 . 1 1 19 19 MET H H 1 8.457 0.0 . 1 . . . . 19 MET H . 6589 1
144 . 1 1 19 19 MET HA H 1 4.943 0.0 . 1 . . . . 19 MET HA . 6589 1
145 . 1 1 19 19 MET HB2 H 1 1.636 0.0 . 2 . . . . 19 MET HB2 . 6589 1
146 . 1 1 19 19 MET HB3 H 1 1.783 0.0 . 2 . . . . 19 MET HB3 . 6589 1
147 . 1 1 19 19 MET HG2 H 1 2.229 0.0 . 2 . . . . 19 MET HG2 . 6589 1
148 . 1 1 19 19 MET HG3 H 1 2.369 0.0 . 2 . . . . 19 MET HG3 . 6589 1
149 . 1 1 19 19 MET C C 13 173.3 0.0 . 1 . . . . 19 MET C . 6589 1
150 . 1 1 19 19 MET CA C 13 51.33 0.0 . 1 . . . . 19 MET CA . 6589 1
151 . 1 1 19 19 MET CB C 13 31.67 0.0 . 1 . . . . 19 MET CB . 6589 1
152 . 1 1 19 19 MET N N 15 120.5 0.0 . 1 . . . . 19 MET N . 6589 1
153 . 1 1 20 20 GLU H H 1 8.553 0.0 . 1 . . . . 20 GLU H . 6589 1
154 . 1 1 20 20 GLU HA H 1 4.813 0.0 . 1 . . . . 20 GLU HA . 6589 1
155 . 1 1 20 20 GLU HB2 H 1 1.946 0.0 . 1 . . . . 20 GLU HB2 . 6589 1
156 . 1 1 20 20 GLU HB3 H 1 1.946 0.0 . 1 . . . . 20 GLU HB3 . 6589 1
157 . 1 1 20 20 GLU HG2 H 1 2.134 0.0 . 1 . . . . 20 GLU HG2 . 6589 1
158 . 1 1 20 20 GLU HG3 H 1 2.134 0.0 . 1 . . . . 20 GLU HG3 . 6589 1
159 . 1 1 20 20 GLU C C 13 171.9 0.0 . 1 . . . . 20 GLU C . 6589 1
160 . 1 1 20 20 GLU CA C 13 51.4 0.0 . 1 . . . . 20 GLU CA . 6589 1
161 . 1 1 20 20 GLU CB C 13 32.02 0.0 . 1 . . . . 20 GLU CB . 6589 1
162 . 1 1 20 20 GLU N N 15 121.5 0.0 . 1 . . . . 20 GLU N . 6589 1
163 . 1 1 21 21 TYR H H 1 9.029 0.0 . 1 . . . . 21 TYR H . 6589 1
164 . 1 1 21 21 TYR HA H 1 5.196 0.0 . 1 . . . . 21 TYR HA . 6589 1
165 . 1 1 21 21 TYR HB2 H 1 2.295 0.0 . 2 . . . . 21 TYR HB2 . 6589 1
166 . 1 1 21 21 TYR HB3 H 1 2.8 0.0 . 2 . . . . 21 TYR HB3 . 6589 1
167 . 1 1 21 21 TYR HD1 H 1 6.966 0.0 . 1 . . . . 21 TYR HD1 . 6589 1
168 . 1 1 21 21 TYR HD2 H 1 6.966 0.0 . 1 . . . . 21 TYR HD2 . 6589 1
169 . 1 1 21 21 TYR HE1 H 1 6.71 0.0 . 1 . . . . 21 TYR HE1 . 6589 1
170 . 1 1 21 21 TYR HE2 H 1 6.71 0.0 . 1 . . . . 21 TYR HE2 . 6589 1
171 . 1 1 21 21 TYR C C 13 170.3 0.0 . 1 . . . . 21 TYR C . 6589 1
172 . 1 1 21 21 TYR CA C 13 53.67 0.0 . 1 . . . . 21 TYR CA . 6589 1
173 . 1 1 21 21 TYR CB C 13 39.62 0.0 . 1 . . . . 21 TYR CB . 6589 1
174 . 1 1 21 21 TYR N N 15 117.504 0.0 . 1 . . . . 21 TYR N . 6589 1
175 . 1 1 22 22 LEU H H 1 7.681 0.0 . 1 . . . . 22 LEU H . 6589 1
176 . 1 1 22 22 LEU HA H 1 3.439 0.0 . 1 . . . . 22 LEU HA . 6589 1
177 . 1 1 22 22 LEU HD11 H 1 0.448 0.0 . 1 . . . . 22 LEU HD11 . 6589 1
178 . 1 1 22 22 LEU HD12 H 1 0.448 0.0 . 1 . . . . 22 LEU HD12 . 6589 1
179 . 1 1 22 22 LEU HD13 H 1 0.448 0.0 . 1 . . . . 22 LEU HD13 . 6589 1
180 . 1 1 22 22 LEU HD21 H 1 0.448 0.0 . 1 . . . . 22 LEU HD21 . 6589 1
181 . 1 1 22 22 LEU HD22 H 1 0.448 0.0 . 1 . . . . 22 LEU HD22 . 6589 1
182 . 1 1 22 22 LEU HD23 H 1 0.448 0.0 . 1 . . . . 22 LEU HD23 . 6589 1
183 . 1 1 22 22 LEU C C 13 171.5 0.0 . 1 . . . . 22 LEU C . 6589 1
184 . 1 1 22 22 LEU CA C 13 50.24 0.0 . 1 . . . . 22 LEU CA . 6589 1
185 . 1 1 22 22 LEU CB C 13 37.17 0.0 . 1 . . . . 22 LEU CB . 6589 1
186 . 1 1 22 22 LEU N N 15 127.349 0.0 . 1 . . . . 22 LEU N . 6589 1
187 . 1 1 23 23 ILE H H 1 8.103 0.0 . 1 . . . . 23 ILE H . 6589 1
188 . 1 1 23 23 ILE HA H 1 3.989 0.0 . 1 . . . . 23 ILE HA . 6589 1
189 . 1 1 23 23 ILE HG21 H 1 0.883 0.0 . 1 . . . . 23 ILE HG21 . 6589 1
190 . 1 1 23 23 ILE HG22 H 1 0.883 0.0 . 1 . . . . 23 ILE HG22 . 6589 1
191 . 1 1 23 23 ILE HG23 H 1 0.883 0.0 . 1 . . . . 23 ILE HG23 . 6589 1
192 . 1 1 23 23 ILE CA C 13 54.98 0.0 . 1 . . . . 23 ILE CA . 6589 1
193 . 1 1 23 23 ILE N N 15 126.93 0.0 . 1 . . . . 23 ILE N . 6589 1
194 . 1 1 25 25 TRP HD1 H 1 6.82 0.0 . 1 . . . . 25 TRP HD1 . 6589 1
195 . 1 1 25 25 TRP HE1 H 1 9.65 0.0 . 1 . . . . 25 TRP HE . 6589 1
196 . 1 1 25 25 TRP HZ2 H 1 7.413 0.0 . 1 . . . . 25 TRP HZ2 . 6589 1
197 . 1 1 25 25 TRP HZ3 H 1 6.79 0.0 . 1 . . . . 25 TRP HZ3 . 6589 1
198 . 1 1 25 25 TRP HH2 H 1 6.889 0.0 . 1 . . . . 25 TRP HH2 . 6589 1
199 . 1 1 25 25 TRP CA C 13 53.2 0.0 . 1 . . . . 25 TRP CA . 6589 1
200 . 1 1 25 25 TRP CB C 13 28.34 0.0 . 1 . . . . 25 TRP CB . 6589 1
201 . 1 1 25 25 TRP NE1 N 15 129.1 0.0 . 1 . . . . 25 TRP NE1 . 6589 1
202 . 1 1 26 26 LYS H H 1 9.03 0.0 . 1 . . . . 26 LYS H . 6589 1
203 . 1 1 26 26 LYS HA H 1 4.024 0.0 . 1 . . . . 26 LYS HA . 6589 1
204 . 1 1 26 26 LYS HB2 H 1 1.69 0.0 . 1 . . . . 26 LYS HB2 . 6589 1
205 . 1 1 26 26 LYS HB3 H 1 1.69 0.0 . 1 . . . . 26 LYS HB3 . 6589 1
206 . 1 1 26 26 LYS C C 13 174.2 0.0 . 1 . . . . 26 LYS C . 6589 1
207 . 1 1 26 26 LYS N N 15 124.5 0.0 . 1 . . . . 26 LYS N . 6589 1
208 . 1 1 27 27 ASP H H 1 8.31 0.0 . 1 . . . . 27 ASP H . 6589 1
209 . 1 1 27 27 ASP HA H 1 4.43 0.0 . 1 . . . . 27 ASP HA . 6589 1
210 . 1 1 27 27 ASP HB2 H 1 2.607 0.0 . 2 . . . . 27 ASP HB2 . 6589 1
211 . 1 1 27 27 ASP HB3 H 1 3.012 0.0 . 2 . . . . 27 ASP HB3 . 6589 1
212 . 1 1 27 27 ASP C C 13 174.8 0.0 . 1 . . . . 27 ASP C . 6589 1
213 . 1 1 27 27 ASP CA C 13 50.94 0.0 . 1 . . . . 27 ASP CA . 6589 1
214 . 1 1 27 27 ASP CB C 13 37.49 0.0 . 1 . . . . 27 ASP CB . 6589 1
215 . 1 1 27 27 ASP N N 15 116.3 0.0 . 1 . . . . 27 ASP N . 6589 1
216 . 1 1 28 28 GLY H H 1 7.789 0.0 . 1 . . . . 28 GLY H . 6589 1
217 . 1 1 28 28 GLY HA2 H 1 3.72 0.0 . 2 . . . . 28 GLY HA1 . 6589 1
218 . 1 1 28 28 GLY HA3 H 1 4.102 0.0 . 2 . . . . 28 GLY HA2 . 6589 1
219 . 1 1 28 28 GLY C C 13 172.3 0.0 . 1 . . . . 28 GLY C . 6589 1
220 . 1 1 28 28 GLY CA C 13 42.77 0.0 . 1 . . . . 28 GLY CA . 6589 1
221 . 1 1 28 28 GLY N N 15 106.6 0.0 . 1 . . . . 28 GLY N . 6589 1
222 . 1 1 29 29 HIS H H 1 7.9 0.0 . 1 . . . . 29 HIS H . 6589 1
223 . 1 1 29 29 HIS HA H 1 4.443 0.0 . 1 . . . . 29 HIS HA . 6589 1
224 . 1 1 29 29 HIS HB2 H 1 2.881 0.0 . 2 . . . . 29 HIS HB2 . 6589 1
225 . 1 1 29 29 HIS HB3 H 1 3.167 0.0 . 2 . . . . 29 HIS HB3 . 6589 1
226 . 1 1 29 29 HIS HD2 H 1 7.031 0.0 . 1 . . . . 29 HIS HD2 . 6589 1
227 . 1 1 29 29 HIS HE1 H 1 8.061 0.0 . 1 . . . . 29 HIS HE1 . 6589 1
228 . 1 1 29 29 HIS C C 13 171.2 0.0 . 1 . . . . 29 HIS C . 6589 1
229 . 1 1 29 29 HIS CA C 13 53.72 0.0 . 1 . . . . 29 HIS CA . 6589 1
230 . 1 1 29 29 HIS CB C 13 24.88 0.0 . 1 . . . . 29 HIS CB . 6589 1
231 . 1 1 29 29 HIS N N 15 119.4 0.0 . 1 . . . . 29 HIS N . 6589 1
232 . 1 1 30 30 SER H H 1 8.457 0.0 . 1 . . . . 30 SER H . 6589 1
233 . 1 1 30 30 SER HA H 1 3.863 0.0 . 1 . . . . 30 SER HA . 6589 1
234 . 1 1 30 30 SER HB2 H 1 3.763 0.0 . 1 . . . . 30 SER HB2 . 6589 1
235 . 1 1 30 30 SER HB3 H 1 3.763 0.0 . 1 . . . . 30 SER HB3 . 6589 1
236 . 1 1 30 30 SER CA C 13 55.36 0.0 . 1 . . . . 30 SER CA . 6589 1
237 . 1 1 30 30 SER CB C 13 59.99 0.0 . 1 . . . . 30 SER CB . 6589 1
238 . 1 1 30 30 SER N N 15 118.4 0.0 . 1 . . . . 30 SER N . 6589 1
239 . 1 1 31 31 PRO HA H 1 4.89 0.0 . 1 . . . . 31 PRO HA . 6589 1
240 . 1 1 31 31 PRO HD2 H 1 3.531 0.0 . 1 . . . . 31 PRO HD2 . 6589 1
241 . 1 1 31 31 PRO HD3 H 1 3.531 0.0 . 1 . . . . 31 PRO HD3 . 6589 1
242 . 1 1 31 31 PRO C C 13 173.8 0.0 . 1 . . . . 31 PRO C . 6589 1
243 . 1 1 31 31 PRO CA C 13 61.65 0.0 . 1 . . . . 31 PRO CA . 6589 1
244 . 1 1 31 31 PRO CB C 13 29.56 0.0 . 1 . . . . 31 PRO CB . 6589 1
245 . 1 1 32 32 SER H H 1 7.692 0.0 . 1 . . . . 32 SER H . 6589 1
246 . 1 1 32 32 SER HA H 1 4.649 0.0 . 1 . . . . 32 SER HA . 6589 1
247 . 1 1 32 32 SER C C 13 169.4 0.0 . 1 . . . . 32 SER C . 6589 1
248 . 1 1 32 32 SER CA C 13 54.11 0.0 . 1 . . . . 32 SER CA . 6589 1
249 . 1 1 32 32 SER CB C 13 62.99 0.0 . 1 . . . . 32 SER CB . 6589 1
250 . 1 1 32 32 SER N N 15 115.4 0.0 . 1 . . . . 32 SER N . 6589 1
251 . 1 1 33 33 TRP H H 1 8.396 0.0 . 1 . . . . 33 TRP H . 6589 1
252 . 1 1 33 33 TRP HA H 1 5.118 0.0 . 1 . . . . 33 TRP HA . 6589 1
253 . 1 1 33 33 TRP HB2 H 1 2.718 0.0 . 2 . . . . 33 TRP HB2 . 6589 1
254 . 1 1 33 33 TRP HB3 H 1 2.853 0.0 . 2 . . . . 33 TRP HB3 . 6589 1
255 . 1 1 33 33 TRP HD1 H 1 7.143 0.0 . 1 . . . . 33 TRP HD1 . 6589 1
256 . 1 1 33 33 TRP HE1 H 1 9.93 0.0 . 1 . . . . 33 TRP HE1 . 6589 1
257 . 1 1 33 33 TRP HZ2 H 1 7.25 0.0 . 1 . . . . 33 TRP HZ2 . 6589 1
258 . 1 1 33 33 TRP HZ3 H 1 6.4 0.0 . 1 . . . . 33 TRP HZ3 . 6589 1
259 . 1 1 33 33 TRP HH2 H 1 6.72 0.0 . 1 . . . . 33 TRP HH2 . 6589 1
260 . 1 1 33 33 TRP CA C 13 53.97 0.0 . 1 . . . . 33 TRP CA . 6589 1
261 . 1 1 33 33 TRP CB C 13 27.5 0.0 . 1 . . . . 33 TRP CB . 6589 1
262 . 1 1 33 33 TRP N N 15 122.3 0.0 . 1 . . . . 33 TRP N . 6589 1
263 . 1 1 33 33 TRP NE1 N 15 129.44 0.0 . 1 . . . . 33 TRP NE1 . 6589 1
264 . 1 1 34 34 VAL HA H 1 4.9 0.0 . 1 . . . . 34 VAL HA . 6589 1
265 . 1 1 34 34 VAL HB H 1 1.96 0.0 . 1 . . . . 34 VAL HB . 6589 1
266 . 1 1 34 34 VAL HG11 H 1 0.84 0.0 . 1 . . . . 34 VAL HG1 . 6589 1
267 . 1 1 34 34 VAL HG12 H 1 0.84 0.0 . 1 . . . . 34 VAL HG1 . 6589 1
268 . 1 1 34 34 VAL HG13 H 1 0.84 0.0 . 1 . . . . 34 VAL HG1 . 6589 1
269 . 1 1 34 34 VAL HG21 H 1 0.84 0.0 . 1 . . . . 34 VAL HG2 . 6589 1
270 . 1 1 34 34 VAL HG22 H 1 0.84 0.0 . 1 . . . . 34 VAL HG2 . 6589 1
271 . 1 1 34 34 VAL HG23 H 1 0.84 0.0 . 1 . . . . 34 VAL HG2 . 6589 1
272 . 1 1 34 34 VAL N N 15 120.0 0.0 . 1 . . . . 34 VAL N . 6589 1
273 . 1 1 35 35 PRO HB2 H 1 2.71 0.0 . 1 . . . . 35 PRO HB2 . 6589 1
274 . 1 1 35 35 PRO HB3 H 1 2.71 0.0 . 1 . . . . 35 PRO HB3 . 6589 1
275 . 1 1 35 35 PRO HG2 H 1 1.46 0.0 . 2 . . . . 35 PRO HG2 . 6589 1
276 . 1 1 35 35 PRO HG3 H 1 1.64 0.0 . 2 . . . . 35 PRO HG3 . 6589 1
277 . 1 1 36 36 SER H H 1 8.286 0.0 . 1 . . . . 36 SER H . 6589 1
278 . 1 1 36 36 SER HA H 1 3.997 0.0 . 1 . . . . 36 SER HA . 6589 1
279 . 1 1 36 36 SER HB3 H 1 3.739 0.0 . 2 . . . . 36 SER HB3 . 6589 1
280 . 1 1 36 36 SER C C 13 173.4 0.0 . 1 . . . . 36 SER C . 6589 1
281 . 1 1 36 36 SER CA C 13 58.87 0.0 . 1 . . . . 36 SER CA . 6589 1
282 . 1 1 36 36 SER CB C 13 60.07 0.0 . 1 . . . . 36 SER CB . 6589 1
283 . 1 1 36 36 SER N N 15 116.1 0.0 . 1 . . . . 36 SER N . 6589 1
284 . 1 1 37 37 SER H H 1 7.984 0.0 . 1 . . . . 37 SER H . 6589 1
285 . 1 1 37 37 SER HB2 H 1 3.837 0.0 . 1 . . . . 37 SER HB2 . 6589 1
286 . 1 1 37 37 SER HB3 H 1 3.837 0.0 . 1 . . . . 37 SER HB3 . 6589 1
287 . 1 1 37 37 SER C C 13 172.5 0.0 . 1 . . . . 37 SER C . 6589 1
288 . 1 1 37 37 SER CA C 13 57.13 0.0 . 1 . . . . 37 SER CA . 6589 1
289 . 1 1 37 37 SER CB C 13 59.74 0.0 . 1 . . . . 37 SER CB . 6589 1
290 . 1 1 37 37 SER N N 15 114.8 0.0 . 2 . . . . 37 SER N . 6589 1
291 . 1 1 38 38 TYR H H 1 8.059 0.0 . 1 . . . . 38 TYR H . 6589 1
292 . 1 1 38 38 TYR HA H 1 4.226 0.0 . 1 . . . . 38 TYR HA . 6589 1
293 . 1 1 38 38 TYR HB2 H 1 3.06 0.0 . 2 . . . . 38 TYR HB2 . 6589 1
294 . 1 1 38 38 TYR HB3 H 1 3.125 0.0 . 2 . . . . 38 TYR HB3 . 6589 1
295 . 1 1 38 38 TYR HD1 H 1 6.997 0.0 . 1 . . . . 38 TYR HD1 . 6589 1
296 . 1 1 38 38 TYR HD2 H 1 6.997 0.0 . 1 . . . . 38 TYR HD2 . 6589 1
297 . 1 1 38 38 TYR HE1 H 1 6.778 0.0 . 1 . . . . 38 TYR HE1 . 6589 1
298 . 1 1 38 38 TYR HE2 H 1 6.778 0.0 . 1 . . . . 38 TYR HE2 . 6589 1
299 . 1 1 38 38 TYR CA C 13 57.07 0.0 . 1 . . . . 38 TYR CA . 6589 1
300 . 1 1 38 38 TYR N N 15 122.6 0.0 . 1 . . . . 38 TYR N . 6589 1
301 . 1 1 39 39 ILE H H 1 7.238 0.0 . 1 . . . . 39 ILE H . 6589 1
302 . 1 1 39 39 ILE HA H 1 4.066 0.0 . 1 . . . . 39 ILE HA . 6589 1
303 . 1 1 39 39 ILE HB H 1 1.886 0.0 . 1 . . . . 39 ILE HB . 6589 1
304 . 1 1 39 39 ILE HG21 H 1 0.714 0.0 . 1 . . . . 39 ILE HG21 . 6589 1
305 . 1 1 39 39 ILE HG22 H 1 0.714 0.0 . 1 . . . . 39 ILE HG22 . 6589 1
306 . 1 1 39 39 ILE HG23 H 1 0.714 0.0 . 1 . . . . 39 ILE HG23 . 6589 1
307 . 1 1 39 39 ILE C C 13 172.5 0.0 . 1 . . . . 39 ILE C . 6589 1
308 . 1 1 39 39 ILE N N 15 115.1 0.0 . 1 . . . . 39 ILE N . 6589 1
309 . 1 1 40 40 ALA H H 1 7.89 0.0 . 1 . . . . 40 ALA H . 6589 1
310 . 1 1 40 40 ALA HA H 1 4.021 0.0 . 1 . . . . 40 ALA HA . 6589 1
311 . 1 1 40 40 ALA HB1 H 1 1.304 0.0 . 1 . . . . 40 ALA HB1 . 6589 1
312 . 1 1 40 40 ALA HB2 H 1 1.304 0.0 . 1 . . . . 40 ALA HB2 . 6589 1
313 . 1 1 40 40 ALA HB3 H 1 1.304 0.0 . 1 . . . . 40 ALA HB3 . 6589 1
314 . 1 1 40 40 ALA C C 13 174.8 0.0 . 1 . . . . 40 ALA C . 6589 1
315 . 1 1 40 40 ALA CA C 13 49.8 0.0 . 1 . . . . 40 ALA CA . 6589 1
316 . 1 1 40 40 ALA CB C 13 16.66 0.0 . 1 . . . . 40 ALA CB . 6589 1
317 . 1 1 40 40 ALA N N 15 126.9 0.0 . 1 . . . . 40 ALA N . 6589 1
318 . 1 1 41 41 ALA H H 1 8.109 0.0 . 1 . . . . 41 ALA H . 6589 1
319 . 1 1 41 41 ALA HA H 1 4.121 0.0 . 1 . . . . 41 ALA HA . 6589 1
320 . 1 1 41 41 ALA HB1 H 1 1.281 0.0 . 1 . . . . 41 ALA HB1 . 6589 1
321 . 1 1 41 41 ALA HB2 H 1 1.281 0.0 . 1 . . . . 41 ALA HB2 . 6589 1
322 . 1 1 41 41 ALA HB3 H 1 1.281 0.0 . 1 . . . . 41 ALA HB3 . 6589 1
323 . 1 1 41 41 ALA CA C 13 50.15 0.0 . 1 . . . . 41 ALA CA . 6589 1
324 . 1 1 41 41 ALA CB C 13 16.3 0.0 . 1 . . . . 41 ALA CB . 6589 1
325 . 1 1 41 41 ALA N N 15 122.7 0.0 . 1 . . . . 41 ALA N . 6589 1
326 . 1 1 42 42 ASP H H 1 8.161 0.0 . 1 . . . . 42 ASP H . 6589 1
327 . 1 1 42 42 ASP HA H 1 4.429 0.0 . 1 . . . . 42 ASP HA . 6589 1
328 . 1 1 42 42 ASP HB2 H 1 2.521 0.0 . 1 . . . . 42 ASP HB2 . 6589 1
329 . 1 1 42 42 ASP HB3 H 1 2.521 0.0 . 1 . . . . 42 ASP HB3 . 6589 1
330 . 1 1 42 42 ASP C C 13 173.4 0.0 . 1 . . . . 42 ASP C . 6589 1
331 . 1 1 42 42 ASP CA C 13 51.68 0.0 . 1 . . . . 42 ASP CA . 6589 1
332 . 1 1 42 42 ASP CB C 13 37.9 0.0 . 1 . . . . 42 ASP CB . 6589 1
333 . 1 1 42 42 ASP N N 15 117.4 0.0 . 1 . . . . 42 ASP N . 6589 1
334 . 1 1 43 43 VAL H H 1 7.69 0.0 . 1 . . . . 43 VAL H . 6589 1
335 . 1 1 43 43 VAL HA H 1 3.984 0.0 . 1 . . . . 43 VAL HA . 6589 1
336 . 1 1 43 43 VAL HB H 1 1.954 0.0 . 1 . . . . 43 VAL HB . 6589 1
337 . 1 1 43 43 VAL HG11 H 1 0.764 0.0 . 1 . . . . 43 VAL HG1 . 6589 1
338 . 1 1 43 43 VAL HG12 H 1 0.764 0.0 . 1 . . . . 43 VAL HG1 . 6589 1
339 . 1 1 43 43 VAL HG13 H 1 0.764 0.0 . 1 . . . . 43 VAL HG1 . 6589 1
340 . 1 1 43 43 VAL HG21 H 1 0.764 0.0 . 1 . . . . 43 VAL HG2 . 6589 1
341 . 1 1 43 43 VAL HG22 H 1 0.764 0.0 . 1 . . . . 43 VAL HG2 . 6589 1
342 . 1 1 43 43 VAL HG23 H 1 0.764 0.0 . 1 . . . . 43 VAL HG2 . 6589 1
343 . 1 1 43 43 VAL C C 13 173.6 0.0 . 1 . . . . 43 VAL C . 6589 1
344 . 1 1 43 43 VAL CA C 13 59.91 0.0 . 1 . . . . 43 VAL CA . 6589 1
345 . 1 1 43 43 VAL CB C 13 29.95 0.0 . 1 . . . . 43 VAL CB . 6589 1
346 . 1 1 43 43 VAL N N 15 119.8 0.0 . 1 . . . . 43 VAL N . 6589 1
347 . 1 1 44 44 VAL H H 1 7.997 0.0 . 1 . . . . 44 VAL H . 6589 1
348 . 1 1 44 44 VAL HA H 1 3.93 0.0 . 1 . . . . 44 VAL HA . 6589 1
349 . 1 1 44 44 VAL HB H 1 1.914 0.0 . 1 . . . . 44 VAL HB . 6589 1
350 . 1 1 44 44 VAL HG11 H 1 0.769 0.0 . 1 . . . . 44 VAL HG1 . 6589 1
351 . 1 1 44 44 VAL HG12 H 1 0.769 0.0 . 1 . . . . 44 VAL HG1 . 6589 1
352 . 1 1 44 44 VAL HG13 H 1 0.769 0.0 . 1 . . . . 44 VAL HG1 . 6589 1
353 . 1 1 44 44 VAL HG21 H 1 0.769 0.0 . 1 . . . . 44 VAL HG2 . 6589 1
354 . 1 1 44 44 VAL HG22 H 1 0.769 0.0 . 1 . . . . 44 VAL HG2 . 6589 1
355 . 1 1 44 44 VAL HG23 H 1 0.769 0.0 . 1 . . . . 44 VAL HG2 . 6589 1
356 . 1 1 44 44 VAL C C 13 173.4 0.0 . 1 . . . . 44 VAL C . 6589 1
357 . 1 1 44 44 VAL CA C 13 59.85 0.0 . 1 . . . . 44 VAL CA . 6589 1
358 . 1 1 44 44 VAL CB C 13 29.8 0.0 . 1 . . . . 44 VAL CB . 6589 1
359 . 1 1 44 44 VAL N N 15 123.7 0.0 . 1 . . . . 44 VAL N . 6589 1
360 . 1 1 45 45 SER H H 1 8.171 0.0 . 1 . . . . 45 SER H . 6589 1
361 . 1 1 45 45 SER HA H 1 4.325 0.0 . 1 . . . . 45 SER HA . 6589 1
362 . 1 1 45 45 SER HB2 H 1 3.635 0.0 . 1 . . . . 45 SER HB2 . 6589 1
363 . 1 1 45 45 SER HB3 H 1 3.635 0.0 . 1 . . . . 45 SER HB3 . 6589 1
364 . 1 1 45 45 SER C C 13 171.4 0.0 . 1 . . . . 45 SER C . 6589 1
365 . 1 1 45 45 SER CA C 13 55.71 0.0 . 1 . . . . 45 SER CA . 6589 1
366 . 1 1 45 45 SER CB C 13 61.22 0.0 . 1 . . . . 45 SER CB . 6589 1
367 . 1 1 45 45 SER N N 15 118.87 0.0 . 1 . . . . 45 SER N . 6589 1
368 . 1 1 46 46 GLU H H 1 8.103 0.0 . 1 . . . . 46 GLU H . 6589 1
369 . 1 1 46 46 GLU HA H 1 4.125 0.0 . 1 . . . . 46 GLU HA . 6589 1
370 . 1 1 46 46 GLU HB2 H 1 1.737 0.0 . 1 . . . . 46 GLU HB2 . 6589 1
371 . 1 1 46 46 GLU HB3 H 1 1.737 0.0 . 1 . . . . 46 GLU HB3 . 6589 1
372 . 1 1 46 46 GLU HG2 H 1 2.023 0.0 . 1 . . . . 46 GLU HG2 . 6589 1
373 . 1 1 46 46 GLU HG3 H 1 2.023 0.0 . 1 . . . . 46 GLU HG3 . 6589 1
374 . 1 1 46 46 GLU C C 13 172.2 0.0 . 1 . . . . 46 GLU C . 6589 1
375 . 1 1 46 46 GLU CA C 13 53.75 0.0 . 1 . . . . 46 GLU CA . 6589 1
376 . 1 1 46 46 GLU CB C 13 27.72 0.0 . 1 . . . . 46 GLU CB . 6589 1
377 . 1 1 46 46 GLU N N 15 122.7 0.0 . 1 . . . . 46 GLU N . 6589 1
378 . 1 1 47 47 TYR H H 1 7.504 0.0 . 1 . . . . 47 TYR H . 6589 1
379 . 1 1 47 47 TYR HA H 1 4.229 0.0 . 1 . . . . 47 TYR HA . 6589 1
380 . 1 1 47 47 TYR HB2 H 1 2.696 0.0 . 2 . . . . 47 TYR HB2 . 6589 1
381 . 1 1 47 47 TYR HB3 H 1 2.909 0.0 . 2 . . . . 47 TYR HB3 . 6589 1
382 . 1 1 47 47 TYR HD1 H 1 7.004 0.0 . 1 . . . . 47 TYR HD1 . 6589 1
383 . 1 1 47 47 TYR HD2 H 1 7.004 0.0 . 1 . . . . 47 TYR HD2 . 6589 1
384 . 1 1 47 47 TYR HE1 H 1 6.665 0.0 . 1 . . . . 47 TYR HE1 . 6589 1
385 . 1 1 47 47 TYR HE2 H 1 6.665 0.0 . 1 . . . . 47 TYR HE2 . 6589 1
386 . 1 1 47 47 TYR CA C 13 56.48 0.0 . 1 . . . . 47 TYR CA . 6589 1
387 . 1 1 47 47 TYR CB C 13 36.81 0.0 . 1 . . . . 47 TYR CB . 6589 1
388 . 1 1 47 47 TYR N N 15 125.024 0.0 . 1 . . . . 47 TYR N . 6589 1
stop_
save_