Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 25734
_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 'Origin nmrStar file /ebi/msd/pdb_root/Processing/prepare/5aaq/ebi/ndp52.nmr_3.data.csh'
_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 NOESY 1 $sample_1 solution 25734 1
2 TOCSY 1 $sample_1 solution 25734 1
3 DQF-COSY 1 $sample_1 solution 25734 1
4 HSQC 1 $sample_1 solution 25734 1
5 HNCACB 1 $sample_1 solution 25734 1
6 CBCACONH 1 $sample_1 solution 25734 1
7 HNCO 1 $sample_1 solution 25734 1
8 HNCACO 1 $sample_1 solution 25734 1
9 HNHB 1 $sample_1 solution 25734 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
3 $CNS . . 25734 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 4 4 SER H H 1 8.438 0.01 . 1 . 1 . . 4 SER H . 25734 1
2 . 1 1 4 4 SER HA H 1 4.700 0.01 . 1 . 2 . . 4 SER HA . 25734 1
3 . 1 1 4 4 SER HB2 H 1 3.811 0.01 . 1 . 3 . . 4 SER HB2 . 25734 1
4 . 1 1 4 4 SER HB3 H 1 3.811 0.01 . 1 . 4 . . 4 SER HB3 . 25734 1
5 . 1 1 5 5 PRO HA H 1 4.392 0.01 . 1 . 6 . . 5 PRO HA . 25734 1
6 . 1 1 5 5 PRO HB2 H 1 1.881 0.01 . 2 . 9 . . 5 PRO HB2 . 25734 1
7 . 1 1 5 5 PRO HB3 H 1 2.252 0.01 . 2 . 10 . . 5 PRO HB3 . 25734 1
8 . 1 1 5 5 PRO HG2 H 1 1.964 0.01 . 1 . 11 . . 5 PRO HG2 . 25734 1
9 . 1 1 5 5 PRO HG3 H 1 1.964 0.01 . 1 . 12 . . 5 PRO HG3 . 25734 1
10 . 1 1 5 5 PRO HD2 H 1 3.691 0.01 . 2 . 13 . . 5 PRO HD2 . 25734 1
11 . 1 1 5 5 PRO HD3 H 1 3.781 0.01 . 2 . 14 . . 5 PRO HD3 . 25734 1
12 . 1 1 5 5 PRO C C 13 176.850 0.10 . 1 . 7 . . 5 PRO C . 25734 1
13 . 1 1 5 5 PRO CA C 13 63.310 0.10 . 1 . 5 . . 5 PRO CA . 25734 1
14 . 1 1 5 5 PRO CB C 13 32.040 0.10 . 1 . 8 . . 5 PRO CB . 25734 1
15 . 1 1 6 6 LEU H H 1 8.215 0.01 . 1 . 16 . . 6 LEU H . 25734 1
16 . 1 1 6 6 LEU HA H 1 4.269 0.01 . 1 . 18 . . 6 LEU HA . 25734 1
17 . 1 1 6 6 LEU HB2 H 1 1.557 0.01 . 1 . 24 . . 6 LEU HB2 . 25734 1
18 . 1 1 6 6 LEU HB3 H 1 1.557 0.01 . 1 . 25 . . 6 LEU HB3 . 25734 1
19 . 1 1 6 6 LEU HG H 1 1.619 0.01 . 1 . 21 . . 6 LEU HG . 25734 1
20 . 1 1 6 6 LEU HD11 H 1 0.875 0.01 . 2 . 22 . . 6 LEU HD11 . 25734 1
21 . 1 1 6 6 LEU HD12 H 1 0.875 0.01 . 2 . 22 . . 6 LEU HD12 . 25734 1
22 . 1 1 6 6 LEU HD13 H 1 0.875 0.01 . 2 . 22 . . 6 LEU HD13 . 25734 1
23 . 1 1 6 6 LEU HD21 H 1 0.827 0.01 . 2 . 23 . . 6 LEU HD21 . 25734 1
24 . 1 1 6 6 LEU HD22 H 1 0.827 0.01 . 2 . 23 . . 6 LEU HD22 . 25734 1
25 . 1 1 6 6 LEU HD23 H 1 0.827 0.01 . 2 . 23 . . 6 LEU HD23 . 25734 1
26 . 1 1 6 6 LEU C C 13 177.380 0.10 . 1 . 19 . . 6 LEU C . 25734 1
27 . 1 1 6 6 LEU CA C 13 55.210 0.10 . 1 . 17 . . 6 LEU CA . 25734 1
28 . 1 1 6 6 LEU CB C 13 42.110 0.10 . 1 . 20 . . 6 LEU CB . 25734 1
29 . 1 1 6 6 LEU N N 15 120.940 0.10 . 1 . 15 . . 6 LEU N . 25734 1
30 . 1 1 7 7 SER H H 1 8.167 0.01 . 1 . 27 . . 7 SER H . 25734 1
31 . 1 1 7 7 SER HA H 1 4.404 0.01 . 1 . 29 . . 7 SER HA . 25734 1
32 . 1 1 7 7 SER HB2 H 1 3.797 0.01 . 1 . 32 . . 7 SER HB2 . 25734 1
33 . 1 1 7 7 SER HB3 H 1 3.797 0.01 . 1 . 33 . . 7 SER HB3 . 25734 1
34 . 1 1 7 7 SER C C 13 174.120 0.10 . 1 . 30 . . 7 SER C . 25734 1
35 . 1 1 7 7 SER CA C 13 58.050 0.10 . 1 . 28 . . 7 SER CA . 25734 1
36 . 1 1 7 7 SER CB C 13 63.630 0.10 . 1 . 31 . . 7 SER CB . 25734 1
37 . 1 1 7 7 SER N N 15 116.190 0.10 . 1 . 26 . . 7 SER N . 25734 1
38 . 1 1 8 8 ILE H H 1 8.042 0.01 . 1 . 35 . . 8 ILE H . 25734 1
39 . 1 1 8 8 ILE HA H 1 4.137 0.01 . 1 . 37 . . 8 ILE HA . 25734 1
40 . 1 1 8 8 ILE HB H 1 1.807 0.01 . 1 . 40 . . 8 ILE HB . 25734 1
41 . 1 1 8 8 ILE HG12 H 1 1.398 0.01 . 2 . 41 . . 8 ILE HG12 . 25734 1
42 . 1 1 8 8 ILE HG13 H 1 1.132 0.01 . 2 . 42 . . 8 ILE HG13 . 25734 1
43 . 1 1 8 8 ILE HG21 H 1 0.839 0.01 . 1 . 43 . . 8 ILE HG21 . 25734 1
44 . 1 1 8 8 ILE HG22 H 1 0.839 0.01 . 1 . 43 . . 8 ILE HG22 . 25734 1
45 . 1 1 8 8 ILE HG23 H 1 0.839 0.01 . 1 . 43 . . 8 ILE HG23 . 25734 1
46 . 1 1 8 8 ILE HD11 H 1 0.807 0.01 . 1 . 44 . . 8 ILE HD11 . 25734 1
47 . 1 1 8 8 ILE HD12 H 1 0.807 0.01 . 1 . 44 . . 8 ILE HD12 . 25734 1
48 . 1 1 8 8 ILE HD13 H 1 0.807 0.01 . 1 . 44 . . 8 ILE HD13 . 25734 1
49 . 1 1 8 8 ILE C C 13 175.850 0.10 . 1 . 38 . . 8 ILE C . 25734 1
50 . 1 1 8 8 ILE CA C 13 60.800 0.10 . 1 . 36 . . 8 ILE CA . 25734 1
51 . 1 1 8 8 ILE CB C 13 38.740 0.10 . 1 . 39 . . 8 ILE CB . 25734 1
52 . 1 1 8 8 ILE N N 15 122.450 0.10 . 1 . 34 . . 8 ILE N . 25734 1
53 . 1 1 9 9 LYS H H 1 8.372 0.01 . 1 . 46 . . 9 LYS H . 25734 1
54 . 1 1 9 9 LYS HA H 1 4.292 0.01 . 1 . 48 . . 9 LYS HA . 25734 1
55 . 1 1 9 9 LYS HB2 H 1 1.758 0.01 . 2 . 51 . . 9 LYS HB2 . 25734 1
56 . 1 1 9 9 LYS HB3 H 1 1.675 0.01 . 2 . 52 . . 9 LYS HB3 . 25734 1
57 . 1 1 9 9 LYS HG2 H 1 1.336 0.01 . 2 . 53 . . 9 LYS HG2 . 25734 1
58 . 1 1 9 9 LYS HG3 H 1 1.384 0.01 . 2 . 54 . . 9 LYS HG3 . 25734 1
59 . 1 1 9 9 LYS HD2 H 1 1.626 0.01 . 1 . 55 . . 9 LYS HD2 . 25734 1
60 . 1 1 9 9 LYS HD3 H 1 1.626 0.01 . 1 . 56 . . 9 LYS HD3 . 25734 1
61 . 1 1 9 9 LYS HE2 H 1 2.935 0.01 . 1 . 57 . . 9 LYS HE2 . 25734 1
62 . 1 1 9 9 LYS HE3 H 1 2.935 0.01 . 1 . 58 . . 9 LYS HE3 . 25734 1
63 . 1 1 9 9 LYS C C 13 175.730 0.10 . 1 . 49 . . 9 LYS C . 25734 1
64 . 1 1 9 9 LYS CA C 13 55.890 0.10 . 1 . 47 . . 9 LYS CA . 25734 1
65 . 1 1 9 9 LYS CB C 13 33.060 0.10 . 1 . 50 . . 9 LYS CB . 25734 1
66 . 1 1 9 9 LYS N N 15 125.860 0.10 . 1 . 45 . . 9 LYS N . 25734 1
67 . 1 1 10 10 LYS H H 1 8.299 0.01 . 1 . 60 . . 10 LYS H . 25734 1
68 . 1 1 10 10 LYS HA H 1 4.330 0.01 . 1 . 62 . . 10 LYS HA . 25734 1
69 . 1 1 10 10 LYS HB2 H 1 1.629 0.01 . 1 . 65 . . 10 LYS HB2 . 25734 1
70 . 1 1 10 10 LYS HB3 H 1 1.629 0.01 . 1 . 66 . . 10 LYS HB3 . 25734 1
71 . 1 1 10 10 LYS HG2 H 1 1.315 0.01 . 1 . 67 . . 10 LYS HG2 . 25734 1
72 . 1 1 10 10 LYS HG3 H 1 1.315 0.01 . 1 . 68 . . 10 LYS HG3 . 25734 1
73 . 1 1 10 10 LYS HD2 H 1 1.406 0.01 . 1 . 69 . . 10 LYS HD2 . 25734 1
74 . 1 1 10 10 LYS HD3 H 1 1.406 0.01 . 1 . 70 . . 10 LYS HD3 . 25734 1
75 . 1 1 10 10 LYS HE2 H 1 2.943 0.01 . 1 . 71 . . 10 LYS HE2 . 25734 1
76 . 1 1 10 10 LYS HE3 H 1 2.943 0.01 . 1 . 72 . . 10 LYS HE3 . 25734 1
77 . 1 1 10 10 LYS C C 13 175.680 0.10 . 1 . 63 . . 10 LYS C . 25734 1
78 . 1 1 10 10 LYS CA C 13 55.500 0.10 . 1 . 61 . . 10 LYS CA . 25734 1
79 . 1 1 10 10 LYS CB C 13 33.610 0.10 . 1 . 64 . . 10 LYS CB . 25734 1
80 . 1 1 10 10 LYS N N 15 123.000 0.10 . 1 . 59 . . 10 LYS N . 25734 1
81 . 1 1 11 11 CYS H H 1 8.637 0.01 . 1 . 74 . . 11 CYS H . 25734 1
82 . 1 1 11 11 CYS HA H 1 4.537 0.01 . 1 . 76 . . 11 CYS HA . 25734 1
83 . 1 1 11 11 CYS HB2 H 1 2.939 0.01 . 2 . 79 . . 11 CYS HB2 . 25734 1
84 . 1 1 11 11 CYS HB3 H 1 3.143 0.01 . 2 . 80 . . 11 CYS HB3 . 25734 1
85 . 1 1 11 11 CYS C C 13 175.720 0.10 . 1 . 77 . . 11 CYS C . 25734 1
86 . 1 1 11 11 CYS CA C 13 56.770 0.10 . 1 . 75 . . 11 CYS CA . 25734 1
87 . 1 1 11 11 CYS CB C 13 31.160 0.10 . 1 . 78 . . 11 CYS CB . 25734 1
88 . 1 1 11 11 CYS N N 15 126.710 0.10 . 1 . 73 . . 11 CYS N . 25734 1
89 . 1 1 12 12 PRO HA H 1 4.481 0.01 . 1 . 82 . . 12 PRO HA . 25734 1
90 . 1 1 12 12 PRO HB2 H 1 2.240 0.01 . 2 . 85 . . 12 PRO HB2 . 25734 1
91 . 1 1 12 12 PRO HB3 H 1 1.953 0.01 . 2 . 86 . . 12 PRO HB3 . 25734 1
92 . 1 1 12 12 PRO HG2 H 1 1.866 0.01 . 2 . 87 . . 12 PRO HG2 . 25734 1
93 . 1 1 12 12 PRO HG3 H 1 2.074 0.01 . 2 . 88 . . 12 PRO HG3 . 25734 1
94 . 1 1 12 12 PRO HD2 H 1 3.900 0.01 . 2 . 89 . . 12 PRO HD2 . 25734 1
95 . 1 1 12 12 PRO HD3 H 1 3.991 0.01 . 2 . 90 . . 12 PRO HD3 . 25734 1
96 . 1 1 12 12 PRO C C 13 176.450 0.10 . 1 . 83 . . 12 PRO C . 25734 1
97 . 1 1 12 12 PRO CA C 13 63.760 0.10 . 1 . 81 . . 12 PRO CA . 25734 1
98 . 1 1 12 12 PRO CB C 13 32.170 0.10 . 1 . 84 . . 12 PRO CB . 25734 1
99 . 1 1 13 13 ILE H H 1 8.899 0.01 . 1 . 92 . . 13 ILE H . 25734 1
100 . 1 1 13 13 ILE HA H 1 3.873 0.01 . 1 . 94 . . 13 ILE HA . 25734 1
101 . 1 1 13 13 ILE HB H 1 1.190 0.01 . 1 . 97 . . 13 ILE HB . 25734 1
102 . 1 1 13 13 ILE HG12 H 1 1.168 0.01 . 2 . 98 . . 13 ILE HG12 . 25734 1
103 . 1 1 13 13 ILE HG13 H 1 0.820 0.01 . 2 . 99 . . 13 ILE HG13 . 25734 1
104 . 1 1 13 13 ILE HG21 H 1 0.624 0.01 . 1 . 101 . . 13 ILE HG21 . 25734 1
105 . 1 1 13 13 ILE HG22 H 1 0.624 0.01 . 1 . 101 . . 13 ILE HG22 . 25734 1
106 . 1 1 13 13 ILE HG23 H 1 0.624 0.01 . 1 . 101 . . 13 ILE HG23 . 25734 1
107 . 1 1 13 13 ILE HD11 H 1 0.380 0.01 . 1 . 103 . . 13 ILE HD11 . 25734 1
108 . 1 1 13 13 ILE HD12 H 1 0.380 0.01 . 1 . 103 . . 13 ILE HD12 . 25734 1
109 . 1 1 13 13 ILE HD13 H 1 0.380 0.01 . 1 . 103 . . 13 ILE HD13 . 25734 1
110 . 1 1 13 13 ILE C C 13 177.130 0.10 . 1 . 95 . . 13 ILE C . 25734 1
111 . 1 1 13 13 ILE CA C 13 63.070 0.10 . 1 . 93 . . 13 ILE CA . 25734 1
112 . 1 1 13 13 ILE CB C 13 39.490 0.10 . 1 . 96 . . 13 ILE CB . 25734 1
113 . 1 1 13 13 ILE CG2 C 13 15.720 0.10 . 1 . 100 . . 13 ILE CG2 . 25734 1
114 . 1 1 13 13 ILE CD1 C 13 10.870 0.10 . 1 . 102 . . 13 ILE CD1 . 25734 1
115 . 1 1 13 13 ILE N N 15 122.610 0.10 . 1 . 91 . . 13 ILE N . 25734 1
116 . 1 1 14 14 CYS H H 1 8.346 0.01 . 1 . 105 . . 14 CYS H . 25734 1
117 . 1 1 14 14 CYS HA H 1 4.549 0.01 . 1 . 107 . . 14 CYS HA . 25734 1
118 . 1 1 14 14 CYS HB2 H 1 2.940 0.01 . 2 . 109 . . 14 CYS HB2 . 25734 1
119 . 1 1 14 14 CYS HB3 H 1 3.016 0.01 . 2 . 110 . . 14 CYS HB3 . 25734 1
120 . 1 1 14 14 CYS CA C 13 60.070 0.10 . 1 . 106 . . 14 CYS CA . 25734 1
121 . 1 1 14 14 CYS CB C 13 28.660 0.10 . 1 . 108 . . 14 CYS CB . 25734 1
122 . 1 1 14 14 CYS N N 15 122.420 0.10 . 1 . 104 . . 14 CYS N . 25734 1
123 . 1 1 15 15 LYS HA H 1 4.054 0.01 . 1 . 111 . . 15 LYS HA . 25734 1
124 . 1 1 15 15 LYS C C 13 176.680 0.10 . 1 . 112 . . 15 LYS C . 25734 1
125 . 1 1 16 16 ALA H H 1 8.244 0.01 . 1 . 114 . . 16 ALA H . 25734 1
126 . 1 1 16 16 ALA HA H 1 4.127 0.01 . 1 . 116 . . 16 ALA HA . 25734 1
127 . 1 1 16 16 ALA HB1 H 1 1.409 0.01 . 1 . 119 . . 16 ALA HB1 . 25734 1
128 . 1 1 16 16 ALA HB2 H 1 1.409 0.01 . 1 . 119 . . 16 ALA HB2 . 25734 1
129 . 1 1 16 16 ALA HB3 H 1 1.409 0.01 . 1 . 119 . . 16 ALA HB3 . 25734 1
130 . 1 1 16 16 ALA C C 13 177.700 0.10 . 1 . 117 . . 16 ALA C . 25734 1
131 . 1 1 16 16 ALA CA C 13 53.870 0.10 . 1 . 115 . . 16 ALA CA . 25734 1
132 . 1 1 16 16 ALA CB C 13 19.500 0.10 . 1 . 118 . . 16 ALA CB . 25734 1
133 . 1 1 16 16 ALA N N 15 122.120 0.10 . 1 . 113 . . 16 ALA N . 25734 1
134 . 1 1 17 17 ASP H H 1 8.338 0.01 . 1 . 121 . . 17 ASP H . 25734 1
135 . 1 1 17 17 ASP HA H 1 4.613 0.01 . 1 . 123 . . 17 ASP HA . 25734 1
136 . 1 1 17 17 ASP HB2 H 1 2.638 0.01 . 2 . 126 . . 17 ASP HB2 . 25734 1
137 . 1 1 17 17 ASP HB3 H 1 2.662 0.01 . 2 . 127 . . 17 ASP HB3 . 25734 1
138 . 1 1 17 17 ASP C C 13 175.840 0.10 . 1 . 124 . . 17 ASP C . 25734 1
139 . 1 1 17 17 ASP CA C 13 54.020 0.10 . 1 . 122 . . 17 ASP CA . 25734 1
140 . 1 1 17 17 ASP CB C 13 40.550 0.10 . 1 . 125 . . 17 ASP CB . 25734 1
141 . 1 1 17 17 ASP N N 15 115.630 0.10 . 1 . 120 . . 17 ASP N . 25734 1
142 . 1 1 18 18 ASP H H 1 7.691 0.01 . 1 . 129 . . 18 ASP H . 25734 1
143 . 1 1 18 18 ASP HA H 1 4.592 0.01 . 1 . 131 . . 18 ASP HA . 25734 1
144 . 1 1 18 18 ASP HB2 H 1 2.708 0.01 . 1 . 134 . . 18 ASP HB2 . 25734 1
145 . 1 1 18 18 ASP HB3 H 1 2.708 0.01 . 1 . 135 . . 18 ASP HB3 . 25734 1
146 . 1 1 18 18 ASP C C 13 175.800 0.10 . 1 . 132 . . 18 ASP C . 25734 1
147 . 1 1 18 18 ASP CA C 13 54.090 0.10 . 1 . 130 . . 18 ASP CA . 25734 1
148 . 1 1 18 18 ASP CB C 13 41.810 0.10 . 1 . 133 . . 18 ASP CB . 25734 1
149 . 1 1 18 18 ASP N N 15 119.640 0.10 . 1 . 128 . . 18 ASP N . 25734 1
150 . 1 1 19 19 ILE H H 1 8.453 0.01 . 1 . 137 . . 19 ILE H . 25734 1
151 . 1 1 19 19 ILE HA H 1 4.055 0.01 . 1 . 139 . . 19 ILE HA . 25734 1
152 . 1 1 19 19 ILE HB H 1 1.767 0.01 . 1 . 142 . . 19 ILE HB . 25734 1
153 . 1 1 19 19 ILE HG12 H 1 1.474 0.01 . 2 . 143 . . 19 ILE HG12 . 25734 1
154 . 1 1 19 19 ILE HG13 H 1 1.151 0.01 . 2 . 144 . . 19 ILE HG13 . 25734 1
155 . 1 1 19 19 ILE HG21 H 1 0.784 0.01 . 1 . 145 . . 19 ILE HG21 . 25734 1
156 . 1 1 19 19 ILE HG22 H 1 0.784 0.01 . 1 . 145 . . 19 ILE HG22 . 25734 1
157 . 1 1 19 19 ILE HG23 H 1 0.784 0.01 . 1 . 145 . . 19 ILE HG23 . 25734 1
158 . 1 1 19 19 ILE HD11 H 1 0.816 0.01 . 1 . 146 . . 19 ILE HD11 . 25734 1
159 . 1 1 19 19 ILE HD12 H 1 0.816 0.01 . 1 . 146 . . 19 ILE HD12 . 25734 1
160 . 1 1 19 19 ILE HD13 H 1 0.816 0.01 . 1 . 146 . . 19 ILE HD13 . 25734 1
161 . 1 1 19 19 ILE C C 13 175.050 0.10 . 1 . 140 . . 19 ILE C . 25734 1
162 . 1 1 19 19 ILE CA C 13 60.810 0.10 . 1 . 138 . . 19 ILE CA . 25734 1
163 . 1 1 19 19 ILE CB C 13 37.540 0.10 . 1 . 141 . . 19 ILE CB . 25734 1
164 . 1 1 19 19 ILE N N 15 120.690 0.10 . 1 . 136 . . 19 ILE N . 25734 1
165 . 1 1 21 21 ASP H H 1 7.961 0.01 . 1 . 147 . . 21 ASP H . 25734 1
166 . 1 1 21 21 ASP HA H 1 4.620 0.01 . 1 . 149 . . 21 ASP HA . 25734 1
167 . 1 1 21 21 ASP HB2 H 1 2.424 0.01 . 1 . 152 . . 21 ASP HB2 . 25734 1
168 . 1 1 21 21 ASP HB3 H 1 2.424 0.01 . 1 . 153 . . 21 ASP HB3 . 25734 1
169 . 1 1 21 21 ASP C C 13 176.430 0.10 . 1 . 150 . . 21 ASP C . 25734 1
170 . 1 1 21 21 ASP CA C 13 53.310 0.10 . 1 . 148 . . 21 ASP CA . 25734 1
171 . 1 1 21 21 ASP CB C 13 40.460 0.10 . 1 . 151 . . 21 ASP CB . 25734 1
172 . 1 1 22 22 HIS H H 1 9.129 0.01 . 1 . 155 . . 22 HIS H . 25734 1
173 . 1 1 22 22 HIS HA H 1 4.617 0.01 . 1 . 157 . . 22 HIS HA . 25734 1
174 . 1 1 22 22 HIS HB2 H 1 3.144 0.01 . 1 . 162 . . 22 HIS HB2 . 25734 1
175 . 1 1 22 22 HIS HB3 H 1 3.144 0.01 . 1 . 163 . . 22 HIS HB3 . 25734 1
176 . 1 1 22 22 HIS HD2 H 1 7.145 0.01 . 1 . 160 . . 22 HIS HD2 . 25734 1
177 . 1 1 22 22 HIS HE1 H 1 7.893 0.01 . 1 . 161 . . 22 HIS HE1 . 25734 1
178 . 1 1 22 22 HIS C C 13 176.270 0.10 . 1 . 158 . . 22 HIS C . 25734 1
179 . 1 1 22 22 HIS CA C 13 59.130 0.10 . 1 . 156 . . 22 HIS CA . 25734 1
180 . 1 1 22 22 HIS CB C 13 31.110 0.10 . 1 . 159 . . 22 HIS CB . 25734 1
181 . 1 1 22 22 HIS N N 15 122.190 0.10 . 1 . 154 . . 22 HIS N . 25734 1
182 . 1 1 23 23 THR H H 1 8.444 0.01 . 1 . 165 . . 23 THR H . 25734 1
183 . 1 1 23 23 THR HA H 1 4.298 0.01 . 1 . 167 . . 23 THR HA . 25734 1
184 . 1 1 23 23 THR HB H 1 4.442 0.01 . 1 . 170 . . 23 THR HB . 25734 1
185 . 1 1 23 23 THR HG21 H 1 1.252 0.01 . 1 . 171 . . 23 THR HG21 . 25734 1
186 . 1 1 23 23 THR HG22 H 1 1.252 0.01 . 1 . 171 . . 23 THR HG22 . 25734 1
187 . 1 1 23 23 THR HG23 H 1 1.252 0.01 . 1 . 171 . . 23 THR HG23 . 25734 1
188 . 1 1 23 23 THR C C 13 175.160 0.10 . 1 . 168 . . 23 THR C . 25734 1
189 . 1 1 23 23 THR CA C 13 61.680 0.10 . 1 . 166 . . 23 THR CA . 25734 1
190 . 1 1 23 23 THR CB C 13 70.040 0.10 . 1 . 169 . . 23 THR CB . 25734 1
191 . 1 1 23 23 THR N N 15 115.160 0.10 . 1 . 164 . . 23 THR N . 25734 1
192 . 1 1 24 24 LEU H H 1 8.498 0.01 . 1 . 173 . . 24 LEU H . 25734 1
193 . 1 1 24 24 LEU HA H 1 4.149 0.01 . 1 . 175 . . 24 LEU HA . 25734 1
194 . 1 1 24 24 LEU HB2 H 1 1.535 0.01 . 2 . 178 . . 24 LEU HB2 . 25734 1
195 . 1 1 24 24 LEU HB3 H 1 1.631 0.01 . 2 . 179 . . 24 LEU HB3 . 25734 1
196 . 1 1 24 24 LEU HG H 1 1.592 0.01 . 1 . 180 . . 24 LEU HG . 25734 1
197 . 1 1 24 24 LEU HD11 H 1 0.879 0.01 . 2 . 181 . . 24 LEU HD11 . 25734 1
198 . 1 1 24 24 LEU HD12 H 1 0.879 0.01 . 2 . 181 . . 24 LEU HD12 . 25734 1
199 . 1 1 24 24 LEU HD13 H 1 0.879 0.01 . 2 . 181 . . 24 LEU HD13 . 25734 1
200 . 1 1 24 24 LEU HD21 H 1 0.827 0.01 . 2 . 182 . . 24 LEU HD21 . 25734 1
201 . 1 1 24 24 LEU HD22 H 1 0.827 0.01 . 2 . 182 . . 24 LEU HD22 . 25734 1
202 . 1 1 24 24 LEU HD23 H 1 0.827 0.01 . 2 . 182 . . 24 LEU HD23 . 25734 1
203 . 1 1 24 24 LEU C C 13 178.460 0.10 . 1 . 176 . . 24 LEU C . 25734 1
204 . 1 1 24 24 LEU CA C 13 56.760 0.10 . 1 . 174 . . 24 LEU CA . 25734 1
205 . 1 1 24 24 LEU CB C 13 41.710 0.10 . 1 . 177 . . 24 LEU CB . 25734 1
206 . 1 1 24 24 LEU N N 15 123.330 0.10 . 1 . 172 . . 24 LEU N . 25734 1
207 . 1 1 25 25 GLU H H 1 8.433 0.01 . 1 . 184 . . 25 GLU H . 25734 1
208 . 1 1 25 25 GLU HA H 1 4.059 0.01 . 1 . 186 . . 25 GLU HA . 25734 1
209 . 1 1 25 25 GLU HB2 H 1 1.952 0.01 . 1 . 189 . . 25 GLU HB2 . 25734 1
210 . 1 1 25 25 GLU HB3 H 1 1.952 0.01 . 1 . 190 . . 25 GLU HB3 . 25734 1
211 . 1 1 25 25 GLU HG2 H 1 2.235 0.01 . 1 . 191 . . 25 GLU HG2 . 25734 1
212 . 1 1 25 25 GLU HG3 H 1 2.235 0.01 . 1 . 192 . . 25 GLU HG3 . 25734 1
213 . 1 1 25 25 GLU C C 13 178.030 0.10 . 1 . 187 . . 25 GLU C . 25734 1
214 . 1 1 25 25 GLU CA C 13 58.350 0.10 . 1 . 185 . . 25 GLU CA . 25734 1
215 . 1 1 25 25 GLU CB C 13 29.490 0.10 . 1 . 188 . . 25 GLU CB . 25734 1
216 . 1 1 25 25 GLU N N 15 119.020 0.10 . 1 . 183 . . 25 GLU N . 25734 1
217 . 1 1 26 26 GLN H H 1 8.018 0.01 . 1 . 194 . . 26 GLN H . 25734 1
218 . 1 1 26 26 GLN HA H 1 4.108 0.01 . 1 . 196 . . 26 GLN HA . 25734 1
219 . 1 1 26 26 GLN HB2 H 1 1.984 0.01 . 2 . 199 . . 26 GLN HB2 . 25734 1
220 . 1 1 26 26 GLN HB3 H 1 2.165 0.01 . 2 . 200 . . 26 GLN HB3 . 25734 1
221 . 1 1 26 26 GLN HG2 H 1 2.399 0.01 . 2 . 201 . . 26 GLN HG2 . 25734 1
222 . 1 1 26 26 GLN HG3 H 1 2.365 0.01 . 2 . 202 . . 26 GLN HG3 . 25734 1
223 . 1 1 26 26 GLN HE21 H 1 6.876 0.01 . 1 . 203 . . 26 GLN HE21 . 25734 1
224 . 1 1 26 26 GLN HE22 H 1 7.527 0.01 . 1 . 204 . . 26 GLN HE22 . 25734 1
225 . 1 1 26 26 GLN C C 13 177.380 0.10 . 1 . 197 . . 26 GLN C . 25734 1
226 . 1 1 26 26 GLN CA C 13 57.200 0.10 . 1 . 195 . . 26 GLN CA . 25734 1
227 . 1 1 26 26 GLN CB C 13 29.130 0.10 . 1 . 198 . . 26 GLN CB . 25734 1
228 . 1 1 26 26 GLN N N 15 119.270 0.10 . 1 . 193 . . 26 GLN N . 25734 1
229 . 1 1 27 27 GLN H H 1 8.227 0.01 . 1 . 206 . . 27 GLN H . 25734 1
230 . 1 1 27 27 GLN HA H 1 4.026 0.01 . 1 . 208 . . 27 GLN HA . 25734 1
231 . 1 1 27 27 GLN HB2 H 1 2.068 0.01 . 1 . 211 . . 27 GLN HB2 . 25734 1
232 . 1 1 27 27 GLN HB3 H 1 2.068 0.01 . 1 . 212 . . 27 GLN HB3 . 25734 1
233 . 1 1 27 27 GLN HG2 H 1 2.464 0.01 . 1 . 213 . . 27 GLN HG2 . 25734 1
234 . 1 1 27 27 GLN HG3 H 1 2.464 0.01 . 1 . 214 . . 27 GLN HG3 . 25734 1
235 . 1 1 27 27 GLN HE21 H 1 6.821 0.01 . 1 . 215 . . 27 GLN HE21 . 25734 1
236 . 1 1 27 27 GLN HE22 H 1 7.268 0.01 . 1 . 216 . . 27 GLN HE22 . 25734 1
237 . 1 1 27 27 GLN C C 13 176.380 0.10 . 1 . 209 . . 27 GLN C . 25734 1
238 . 1 1 27 27 GLN CA C 13 57.080 0.10 . 1 . 207 . . 27 GLN CA . 25734 1
239 . 1 1 27 27 GLN CB C 13 29.000 0.10 . 1 . 210 . . 27 GLN CB . 25734 1
240 . 1 1 27 27 GLN N N 15 118.950 0.10 . 1 . 205 . . 27 GLN N . 25734 1
241 . 1 1 28 28 GLN H H 1 8.074 0.01 . 1 . 218 . . 28 GLN H . 25734 1
242 . 1 1 28 28 GLN HA H 1 4.212 0.01 . 1 . 220 . . 28 GLN HA . 25734 1
243 . 1 1 28 28 GLN HB2 H 1 1.975 0.01 . 2 . 223 . . 28 GLN HB2 . 25734 1
244 . 1 1 28 28 GLN HB3 H 1 2.071 0.01 . 2 . 224 . . 28 GLN HB3 . 25734 1
245 . 1 1 28 28 GLN HG2 H 1 2.404 0.01 . 2 . 225 . . 28 GLN HG2 . 25734 1
246 . 1 1 28 28 GLN HG3 H 1 2.333 0.01 . 2 . 226 . . 28 GLN HG3 . 25734 1
247 . 1 1 28 28 GLN HE21 H 1 6.823 0.01 . 1 . 227 . . 28 GLN HE21 . 25734 1
248 . 1 1 28 28 GLN HE22 H 1 7.455 0.01 . 1 . 228 . . 28 GLN HE22 . 25734 1
249 . 1 1 28 28 GLN C C 13 175.970 0.10 . 1 . 221 . . 28 GLN C . 25734 1
250 . 1 1 28 28 GLN CA C 13 56.000 0.10 . 1 . 219 . . 28 GLN CA . 25734 1
251 . 1 1 28 28 GLN CB C 13 29.190 0.10 . 1 . 222 . . 28 GLN CB . 25734 1
252 . 1 1 28 28 GLN N N 15 118.400 0.10 . 1 . 217 . . 28 GLN N . 25734 1
253 . 1 1 29 29 MET H H 1 7.990 0.01 . 1 . 230 . . 29 MET H . 25734 1
254 . 1 1 29 29 MET HA H 1 4.365 0.01 . 1 . 232 . . 29 MET HA . 25734 1
255 . 1 1 29 29 MET HB2 H 1 2.024 0.01 . 2 . 235 . . 29 MET HB2 . 25734 1
256 . 1 1 29 29 MET HB3 H 1 1.981 0.01 . 2 . 236 . . 29 MET HB3 . 25734 1
257 . 1 1 29 29 MET HG2 H 1 2.581 0.01 . 2 . 237 . . 29 MET HG2 . 25734 1
258 . 1 1 29 29 MET HG3 H 1 2.505 0.01 . 2 . 238 . . 29 MET HG3 . 25734 1
259 . 1 1 29 29 MET HE1 H 1 2.030 0.01 . 1 . 240 . . 29 MET HE1 . 25734 1
260 . 1 1 29 29 MET HE2 H 1 2.030 0.01 . 1 . 240 . . 29 MET HE2 . 25734 1
261 . 1 1 29 29 MET HE3 H 1 2.030 0.01 . 1 . 240 . . 29 MET HE3 . 25734 1
262 . 1 1 29 29 MET C C 13 175.860 0.10 . 1 . 233 . . 29 MET C . 25734 1
263 . 1 1 29 29 MET CA C 13 55.640 0.10 . 1 . 231 . . 29 MET CA . 25734 1
264 . 1 1 29 29 MET CB C 13 32.830 0.10 . 1 . 234 . . 29 MET CB . 25734 1
265 . 1 1 29 29 MET CE C 13 15.110 0.10 . 1 . 239 . . 29 MET CE . 25734 1
266 . 1 1 29 29 MET N N 15 119.900 0.10 . 1 . 229 . . 29 MET N . 25734 1
267 . 1 1 30 30 GLN H H 1 8.191 0.01 . 1 . 242 . . 30 GLN H . 25734 1
268 . 1 1 30 30 GLN HA H 1 4.524 0.01 . 1 . 244 . . 30 GLN HA . 25734 1
269 . 1 1 30 30 GLN HB2 H 1 2.020 0.01 . 2 . 247 . . 30 GLN HB2 . 25734 1
270 . 1 1 30 30 GLN HB3 H 1 1.855 0.01 . 2 . 248 . . 30 GLN HB3 . 25734 1
271 . 1 1 30 30 GLN HG2 H 1 2.317 0.01 . 1 . 249 . . 30 GLN HG2 . 25734 1
272 . 1 1 30 30 GLN HG3 H 1 2.317 0.01 . 1 . 250 . . 30 GLN HG3 . 25734 1
273 . 1 1 30 30 GLN HE21 H 1 6.831 0.01 . 1 . 251 . . 30 GLN HE21 . 25734 1
274 . 1 1 30 30 GLN HE22 H 1 7.497 0.01 . 1 . 252 . . 30 GLN HE22 . 25734 1
275 . 1 1 30 30 GLN C C 13 173.630 0.10 . 1 . 245 . . 30 GLN C . 25734 1
276 . 1 1 30 30 GLN CA C 13 53.740 0.10 . 1 . 243 . . 30 GLN CA . 25734 1
277 . 1 1 30 30 GLN CB C 13 28.810 0.10 . 1 . 246 . . 30 GLN CB . 25734 1
278 . 1 1 30 30 GLN N N 15 122.030 0.10 . 1 . 241 . . 30 GLN N . 25734 1
279 . 1 1 31 31 PRO HA H 1 4.320 0.01 . 1 . 254 . . 31 PRO HA . 25734 1
280 . 1 1 31 31 PRO HB2 H 1 1.706 0.01 . 2 . 257 . . 31 PRO HB2 . 25734 1
281 . 1 1 31 31 PRO HB3 H 1 2.153 0.01 . 2 . 258 . . 31 PRO HB3 . 25734 1
282 . 1 1 31 31 PRO HG2 H 1 1.908 0.01 . 2 . 259 . . 31 PRO HG2 . 25734 1
283 . 1 1 31 31 PRO HG3 H 1 1.861 0.01 . 2 . 260 . . 31 PRO HG3 . 25734 1
284 . 1 1 31 31 PRO HD2 H 1 3.568 0.01 . 2 . 261 . . 31 PRO HD2 . 25734 1
285 . 1 1 31 31 PRO HD3 H 1 3.707 0.01 . 2 . 262 . . 31 PRO HD3 . 25734 1
286 . 1 1 31 31 PRO C C 13 176.390 0.10 . 1 . 255 . . 31 PRO C . 25734 1
287 . 1 1 31 31 PRO CA C 13 62.640 0.10 . 1 . 253 . . 31 PRO CA . 25734 1
288 . 1 1 31 31 PRO CB C 13 32.170 0.10 . 1 . 256 . . 31 PRO CB . 25734 1
289 . 1 1 32 32 LEU H H 1 8.344 0.01 . 1 . 264 . . 32 LEU H . 25734 1
290 . 1 1 32 32 LEU HA H 1 4.159 0.01 . 1 . 266 . . 32 LEU HA . 25734 1
291 . 1 1 32 32 LEU HB2 H 1 1.426 0.01 . 1 . 269 . . 32 LEU HB2 . 25734 1
292 . 1 1 32 32 LEU HB3 H 1 1.512 0.01 . 1 . 270 . . 32 LEU HB3 . 25734 1
293 . 1 1 32 32 LEU HG H 1 1.515 0.01 . 1 . 271 . . 32 LEU HG . 25734 1
294 . 1 1 32 32 LEU HD11 H 1 0.828 0.01 . 2 . 273 . . 32 LEU HD11 . 25734 1
295 . 1 1 32 32 LEU HD12 H 1 0.828 0.01 . 2 . 273 . . 32 LEU HD12 . 25734 1
296 . 1 1 32 32 LEU HD13 H 1 0.828 0.01 . 2 . 273 . . 32 LEU HD13 . 25734 1
297 . 1 1 32 32 LEU HD21 H 1 0.768 0.01 . 2 . 275 . . 32 LEU HD21 . 25734 1
298 . 1 1 32 32 LEU HD22 H 1 0.768 0.01 . 2 . 275 . . 32 LEU HD22 . 25734 1
299 . 1 1 32 32 LEU HD23 H 1 0.768 0.01 . 2 . 275 . . 32 LEU HD23 . 25734 1
300 . 1 1 32 32 LEU C C 13 176.620 0.10 . 1 . 267 . . 32 LEU C . 25734 1
301 . 1 1 32 32 LEU CA C 13 55.210 0.10 . 1 . 265 . . 32 LEU CA . 25734 1
302 . 1 1 32 32 LEU CB C 13 42.250 0.10 . 1 . 268 . . 32 LEU CB . 25734 1
303 . 1 1 32 32 LEU CD1 C 13 23.050 0.10 . 1 . 272 . . 32 LEU CD1 . 25734 1
304 . 1 1 32 32 LEU CD2 C 13 21.590 0.10 . 1 . 274 . . 32 LEU CD2 . 25734 1
305 . 1 1 32 32 LEU N N 15 121.700 0.10 . 1 . 263 . . 32 LEU N . 25734 1
306 . 1 1 33 33 CYS H H 1 7.739 0.01 . 1 . 277 . . 33 CYS H . 25734 1
307 . 1 1 33 33 CYS HA H 1 4.402 0.01 . 1 . 279 . . 33 CYS HA . 25734 1
308 . 1 1 33 33 CYS HB2 H 1 2.716 0.01 . 2 . 282 . . 33 CYS HB2 . 25734 1
309 . 1 1 33 33 CYS HB3 H 1 2.768 0.01 . 2 . 283 . . 33 CYS HB3 . 25734 1
310 . 1 1 33 33 CYS C C 13 172.270 0.10 . 1 . 280 . . 33 CYS C . 25734 1
311 . 1 1 33 33 CYS CA C 13 56.490 0.10 . 1 . 278 . . 33 CYS CA . 25734 1
312 . 1 1 33 33 CYS CB C 13 30.160 0.10 . 1 . 281 . . 33 CYS CB . 25734 1
313 . 1 1 33 33 CYS N N 15 115.700 0.10 . 1 . 276 . . 33 CYS N . 25734 1
314 . 1 1 34 34 PHE H H 1 8.823 0.01 . 1 . 285 . . 34 PHE H . 25734 1
315 . 1 1 34 34 PHE HA H 1 4.509 0.01 . 1 . 287 . . 34 PHE HA . 25734 1
316 . 1 1 34 34 PHE HB2 H 1 1.277 0.01 . 1 . 290 . . 34 PHE HB2 . 25734 1
317 . 1 1 34 34 PHE HB3 H 1 1.739 0.01 . 1 . 291 . . 34 PHE HB3 . 25734 1
318 . 1 1 34 34 PHE HD1 H 1 6.716 0.01 . 1 . 292 . . 34 PHE HD1 . 25734 1
319 . 1 1 34 34 PHE HD2 H 1 6.716 0.01 . 1 . 293 . . 34 PHE HD2 . 25734 1
320 . 1 1 34 34 PHE HE1 H 1 7.184 0.01 . 1 . 294 . . 34 PHE HE1 . 25734 1
321 . 1 1 34 34 PHE HE2 H 1 7.184 0.01 . 1 . 295 . . 34 PHE HE2 . 25734 1
322 . 1 1 34 34 PHE C C 13 174.280 0.10 . 1 . 288 . . 34 PHE C . 25734 1
323 . 1 1 34 34 PHE CA C 13 56.020 0.10 . 1 . 286 . . 34 PHE CA . 25734 1
324 . 1 1 34 34 PHE CB C 13 40.110 0.10 . 1 . 289 . . 34 PHE CB . 25734 1
325 . 1 1 34 34 PHE N N 15 118.890 0.10 . 1 . 284 . . 34 PHE N . 25734 1
326 . 1 1 35 35 ASN H H 1 8.512 0.01 . 1 . 297 . . 35 ASN H . 25734 1
327 . 1 1 35 35 ASN HA H 1 5.348 0.01 . 1 . 299 . . 35 ASN HA . 25734 1
328 . 1 1 35 35 ASN HB2 H 1 2.467 0.01 . 2 . 302 . . 35 ASN HB2 . 25734 1
329 . 1 1 35 35 ASN HB3 H 1 2.441 0.01 . 2 . 303 . . 35 ASN HB3 . 25734 1
330 . 1 1 35 35 ASN HD21 H 1 6.596 0.01 . 1 . 304 . . 35 ASN HD21 . 25734 1
331 . 1 1 35 35 ASN HD22 H 1 7.242 0.01 . 1 . 305 . . 35 ASN HD22 . 25734 1
332 . 1 1 35 35 ASN C C 13 174.280 0.10 . 1 . 300 . . 35 ASN C . 25734 1
333 . 1 1 35 35 ASN CA C 13 51.520 0.10 . 1 . 298 . . 35 ASN CA . 25734 1
334 . 1 1 35 35 ASN CB C 13 40.590 0.10 . 1 . 301 . . 35 ASN CB . 25734 1
335 . 1 1 35 35 ASN N N 15 119.050 0.10 . 1 . 296 . . 35 ASN N . 25734 1
336 . 1 1 36 36 CYS H H 1 9.442 0.01 . 1 . 307 . . 36 CYS H . 25734 1
337 . 1 1 36 36 CYS HA H 1 4.914 0.01 . 1 . 309 . . 36 CYS HA . 25734 1
338 . 1 1 36 36 CYS HB2 H 1 3.537 0.01 . 1 . 312 . . 36 CYS HB2 . 25734 1
339 . 1 1 36 36 CYS HB3 H 1 3.077 0.01 . 1 . 313 . . 36 CYS HB3 . 25734 1
340 . 1 1 36 36 CYS C C 13 175.550 0.10 . 1 . 310 . . 36 CYS C . 25734 1
341 . 1 1 36 36 CYS CA C 13 57.790 0.10 . 1 . 308 . . 36 CYS CA . 25734 1
342 . 1 1 36 36 CYS CB C 13 29.960 0.10 . 1 . 311 . . 36 CYS CB . 25734 1
343 . 1 1 36 36 CYS N N 15 127.250 0.10 . 1 . 306 . . 36 CYS N . 25734 1
344 . 1 1 37 37 PRO HA H 1 4.584 0.01 . 1 . 315 . . 37 PRO HA . 25734 1
345 . 1 1 37 37 PRO HB2 H 1 2.417 0.01 . 2 . 318 . . 37 PRO HB2 . 25734 1
346 . 1 1 37 37 PRO HB3 H 1 2.074 0.01 . 2 . 319 . . 37 PRO HB3 . 25734 1
347 . 1 1 37 37 PRO HG2 H 1 2.242 0.01 . 2 . 320 . . 37 PRO HG2 . 25734 1
348 . 1 1 37 37 PRO HG3 H 1 1.995 0.01 . 2 . 321 . . 37 PRO HG3 . 25734 1
349 . 1 1 37 37 PRO HD2 H 1 4.257 0.01 . 2 . 322 . . 37 PRO HD2 . 25734 1
350 . 1 1 37 37 PRO HD3 H 1 4.374 0.01 . 2 . 323 . . 37 PRO HD3 . 25734 1
351 . 1 1 37 37 PRO C C 13 176.350 0.10 . 1 . 316 . . 37 PRO C . 25734 1
352 . 1 1 37 37 PRO CA C 13 64.060 0.10 . 1 . 314 . . 37 PRO CA . 25734 1
353 . 1 1 37 37 PRO CB C 13 32.160 0.10 . 1 . 317 . . 37 PRO CB . 25734 1
354 . 1 1 38 38 ILE H H 1 9.041 0.01 . 1 . 325 . . 38 ILE H . 25734 1
355 . 1 1 38 38 ILE HA H 1 3.933 0.01 . 1 . 327 . . 38 ILE HA . 25734 1
356 . 1 1 38 38 ILE HB H 1 0.958 0.01 . 1 . 330 . . 38 ILE HB . 25734 1
357 . 1 1 38 38 ILE HG12 H 1 1.172 0.01 . 2 . 331 . . 38 ILE HG12 . 25734 1
358 . 1 1 38 38 ILE HG13 H 1 1.053 0.01 . 2 . 332 . . 38 ILE HG13 . 25734 1
359 . 1 1 38 38 ILE HG21 H 1 0.264 0.01 . 1 . 333 . . 38 ILE HG21 . 25734 1
360 . 1 1 38 38 ILE HG22 H 1 0.264 0.01 . 1 . 333 . . 38 ILE HG22 . 25734 1
361 . 1 1 38 38 ILE HG23 H 1 0.264 0.01 . 1 . 333 . . 38 ILE HG23 . 25734 1
362 . 1 1 38 38 ILE HD11 H 1 0.628 0.01 . 1 . 335 . . 38 ILE HD11 . 25734 1
363 . 1 1 38 38 ILE HD12 H 1 0.628 0.01 . 1 . 335 . . 38 ILE HD12 . 25734 1
364 . 1 1 38 38 ILE HD13 H 1 0.628 0.01 . 1 . 335 . . 38 ILE HD13 . 25734 1
365 . 1 1 38 38 ILE C C 13 176.470 0.10 . 1 . 328 . . 38 ILE C . 25734 1
366 . 1 1 38 38 ILE CA C 13 62.440 0.10 . 1 . 326 . . 38 ILE CA . 25734 1
367 . 1 1 38 38 ILE CB C 13 38.740 0.10 . 1 . 329 . . 38 ILE CB . 25734 1
368 . 1 1 38 38 ILE CD1 C 13 10.370 0.10 . 1 . 334 . . 38 ILE CD1 . 25734 1
369 . 1 1 38 38 ILE N N 15 122.310 0.10 . 1 . 324 . . 38 ILE N . 25734 1
370 . 1 1 39 39 CYS H H 1 8.482 0.01 . 1 . 337 . . 39 CYS H . 25734 1
371 . 1 1 39 39 CYS HA H 1 5.133 0.01 . 1 . 339 . . 39 CYS HA . 25734 1
372 . 1 1 39 39 CYS HB2 H 1 2.743 0.01 . 1 . 342 . . 39 CYS HB2 . 25734 1
373 . 1 1 39 39 CYS HB3 H 1 3.466 0.01 . 1 . 343 . . 39 CYS HB3 . 25734 1
374 . 1 1 39 39 CYS C C 13 175.120 0.10 . 1 . 340 . . 39 CYS C . 25734 1
375 . 1 1 39 39 CYS CA C 13 58.130 0.10 . 1 . 338 . . 39 CYS CA . 25734 1
376 . 1 1 39 39 CYS CB C 13 32.050 0.10 . 1 . 341 . . 39 CYS CB . 25734 1
377 . 1 1 39 39 CYS N N 15 119.500 0.10 . 1 . 336 . . 39 CYS N . 25734 1
378 . 1 1 40 40 ASP H H 1 8.105 0.01 . 1 . 345 . . 40 ASP H . 25734 1
379 . 1 1 40 40 ASP HA H 1 4.682 0.01 . 1 . 347 . . 40 ASP HA . 25734 1
380 . 1 1 40 40 ASP HB2 H 1 2.796 0.01 . 2 . 350 . . 40 ASP HB2 . 25734 1
381 . 1 1 40 40 ASP HB3 H 1 2.918 0.01 . 2 . 351 . . 40 ASP HB3 . 25734 1
382 . 1 1 40 40 ASP C C 13 175.240 0.10 . 1 . 348 . . 40 ASP C . 25734 1
383 . 1 1 40 40 ASP CA C 13 56.090 0.10 . 1 . 346 . . 40 ASP CA . 25734 1
384 . 1 1 40 40 ASP CB C 13 40.570 0.10 . 1 . 349 . . 40 ASP CB . 25734 1
385 . 1 1 40 40 ASP N N 15 119.170 0.10 . 1 . 344 . . 40 ASP N . 25734 1
386 . 1 1 41 41 LYS H H 1 8.155 0.01 . 1 . 353 . . 41 LYS H . 25734 1
387 . 1 1 41 41 LYS HA H 1 4.013 0.01 . 1 . 355 . . 41 LYS HA . 25734 1
388 . 1 1 41 41 LYS HB2 H 1 1.274 0.01 . 2 . 358 . . 41 LYS HB2 . 25734 1
389 . 1 1 41 41 LYS HB3 H 1 1.796 0.01 . 2 . 359 . . 41 LYS HB3 . 25734 1
390 . 1 1 41 41 LYS HG2 H 1 0.827 0.01 . 1 . 360 . . 41 LYS HG2 . 25734 1
391 . 1 1 41 41 LYS HG3 H 1 0.827 0.01 . 1 . 361 . . 41 LYS HG3 . 25734 1
392 . 1 1 41 41 LYS HD2 H 1 1.444 0.01 . 2 . 362 . . 41 LYS HD2 . 25734 1
393 . 1 1 41 41 LYS HD3 H 1 1.190 0.01 . 2 . 363 . . 41 LYS HD3 . 25734 1
394 . 1 1 41 41 LYS HE2 H 1 2.612 0.01 . 2 . 364 . . 41 LYS HE2 . 25734 1
395 . 1 1 41 41 LYS HE3 H 1 2.783 0.01 . 2 . 365 . . 41 LYS HE3 . 25734 1
396 . 1 1 41 41 LYS C C 13 174.950 0.10 . 1 . 356 . . 41 LYS C . 25734 1
397 . 1 1 41 41 LYS CA C 13 58.480 0.10 . 1 . 354 . . 41 LYS CA . 25734 1
398 . 1 1 41 41 LYS CB C 13 34.130 0.10 . 1 . 357 . . 41 LYS CB . 25734 1
399 . 1 1 41 41 LYS N N 15 122.660 0.10 . 1 . 352 . . 41 LYS N . 25734 1
400 . 1 1 42 42 ILE H H 1 7.867 0.01 . 1 . 367 . . 42 ILE H . 25734 1
401 . 1 1 42 42 ILE HA H 1 4.847 0.01 . 1 . 369 . . 42 ILE HA . 25734 1
402 . 1 1 42 42 ILE HB H 1 1.496 0.01 . 1 . 372 . . 42 ILE HB . 25734 1
403 . 1 1 42 42 ILE HG12 H 1 1.568 0.01 . 2 . 373 . . 42 ILE HG12 . 25734 1
404 . 1 1 42 42 ILE HG13 H 1 0.976 0.01 . 2 . 374 . . 42 ILE HG13 . 25734 1
405 . 1 1 42 42 ILE HG21 H 1 0.731 0.01 . 1 . 375 . . 42 ILE HG21 . 25734 1
406 . 1 1 42 42 ILE HG22 H 1 0.731 0.01 . 1 . 375 . . 42 ILE HG22 . 25734 1
407 . 1 1 42 42 ILE HG23 H 1 0.731 0.01 . 1 . 375 . . 42 ILE HG23 . 25734 1
408 . 1 1 42 42 ILE HD11 H 1 0.766 0.01 . 1 . 377 . . 42 ILE HD11 . 25734 1
409 . 1 1 42 42 ILE HD12 H 1 0.766 0.01 . 1 . 377 . . 42 ILE HD12 . 25734 1
410 . 1 1 42 42 ILE HD13 H 1 0.766 0.01 . 1 . 377 . . 42 ILE HD13 . 25734 1
411 . 1 1 42 42 ILE C C 13 175.870 0.10 . 1 . 370 . . 42 ILE C . 25734 1
412 . 1 1 42 42 ILE CA C 13 60.110 0.10 . 1 . 368 . . 42 ILE CA . 25734 1
413 . 1 1 42 42 ILE CB C 13 40.110 0.10 . 1 . 371 . . 42 ILE CB . 25734 1
414 . 1 1 42 42 ILE CD1 C 13 11.750 0.10 . 1 . 376 . . 42 ILE CD1 . 25734 1
415 . 1 1 42 42 ILE N N 15 123.200 0.10 . 1 . 366 . . 42 ILE N . 25734 1
416 . 1 1 43 43 PHE H H 1 9.090 0.01 . 1 . 379 . . 43 PHE H . 25734 1
417 . 1 1 43 43 PHE HA H 1 4.874 0.01 . 1 . 381 . . 43 PHE HA . 25734 1
418 . 1 1 43 43 PHE HB2 H 1 3.110 0.01 . 1 . 384 . . 43 PHE HB2 . 25734 1
419 . 1 1 43 43 PHE HB3 H 1 2.704 0.01 . 1 . 385 . . 43 PHE HB3 . 25734 1
420 . 1 1 43 43 PHE HD1 H 1 7.370 0.01 . 1 . 387 . . 43 PHE HD1 . 25734 1
421 . 1 1 43 43 PHE HD2 H 1 7.370 0.01 . 1 . 388 . . 43 PHE HD2 . 25734 1
422 . 1 1 43 43 PHE HE1 H 1 6.874 0.01 . 1 . 389 . . 43 PHE HE1 . 25734 1
423 . 1 1 43 43 PHE HE2 H 1 6.874 0.01 . 1 . 390 . . 43 PHE HE2 . 25734 1
424 . 1 1 43 43 PHE HZ H 1 6.377 0.01 . 1 . 386 . . 43 PHE HZ . 25734 1
425 . 1 1 43 43 PHE C C 13 172.410 0.10 . 1 . 382 . . 43 PHE C . 25734 1
426 . 1 1 43 43 PHE CA C 13 54.480 0.10 . 1 . 380 . . 43 PHE CA . 25734 1
427 . 1 1 43 43 PHE CB C 13 41.700 0.10 . 1 . 383 . . 43 PHE CB . 25734 1
428 . 1 1 43 43 PHE N N 15 124.750 0.10 . 1 . 378 . . 43 PHE N . 25734 1
429 . 1 1 44 44 PRO HA H 1 4.617 0.01 . 1 . 392 . . 44 PRO HA . 25734 1
430 . 1 1 44 44 PRO HB2 H 1 1.997 0.01 . 2 . 395 . . 44 PRO HB2 . 25734 1
431 . 1 1 44 44 PRO HB3 H 1 2.389 0.01 . 2 . 396 . . 44 PRO HB3 . 25734 1
432 . 1 1 44 44 PRO HG2 H 1 1.960 0.01 . 2 . 397 . . 44 PRO HG2 . 25734 1
433 . 1 1 44 44 PRO HG3 H 1 1.999 0.01 . 2 . 398 . . 44 PRO HG3 . 25734 1
434 . 1 1 44 44 PRO HD2 H 1 3.844 0.01 . 2 . 399 . . 44 PRO HD2 . 25734 1
435 . 1 1 44 44 PRO HD3 H 1 3.770 0.01 . 2 . 400 . . 44 PRO HD3 . 25734 1
436 . 1 1 44 44 PRO C C 13 177.050 0.10 . 1 . 393 . . 44 PRO C . 25734 1
437 . 1 1 44 44 PRO CA C 13 62.440 0.10 . 1 . 391 . . 44 PRO CA . 25734 1
438 . 1 1 44 44 PRO CB C 13 32.950 0.10 . 1 . 394 . . 44 PRO CB . 25734 1
439 . 1 1 45 45 ALA H H 1 8.308 0.01 . 1 . 402 . . 45 ALA H . 25734 1
440 . 1 1 45 45 ALA HA H 1 3.789 0.01 . 1 . 404 . . 45 ALA HA . 25734 1
441 . 1 1 45 45 ALA HB1 H 1 1.109 0.01 . 1 . 407 . . 45 ALA HB1 . 25734 1
442 . 1 1 45 45 ALA HB2 H 1 1.109 0.01 . 1 . 407 . . 45 ALA HB2 . 25734 1
443 . 1 1 45 45 ALA HB3 H 1 1.109 0.01 . 1 . 407 . . 45 ALA HB3 . 25734 1
444 . 1 1 45 45 ALA C C 13 178.270 0.10 . 1 . 405 . . 45 ALA C . 25734 1
445 . 1 1 45 45 ALA CA C 13 54.230 0.10 . 1 . 403 . . 45 ALA CA . 25734 1
446 . 1 1 45 45 ALA CB C 13 18.530 0.10 . 1 . 406 . . 45 ALA CB . 25734 1
447 . 1 1 45 45 ALA N N 15 121.740 0.10 . 1 . 401 . . 45 ALA N . 25734 1
448 . 1 1 46 46 THR H H 1 7.215 0.01 . 1 . 409 . . 46 THR H . 25734 1
449 . 1 1 46 46 THR HA H 1 4.241 0.01 . 1 . 411 . . 46 THR HA . 25734 1
450 . 1 1 46 46 THR HB H 1 4.505 0.01 . 1 . 414 . . 46 THR HB . 25734 1
451 . 1 1 46 46 THR HG21 H 1 1.266 0.01 . 1 . 415 . . 46 THR HG21 . 25734 1
452 . 1 1 46 46 THR HG22 H 1 1.266 0.01 . 1 . 415 . . 46 THR HG22 . 25734 1
453 . 1 1 46 46 THR HG23 H 1 1.266 0.01 . 1 . 415 . . 46 THR HG23 . 25734 1
454 . 1 1 46 46 THR C C 13 175.820 0.10 . 1 . 412 . . 46 THR C . 25734 1
455 . 1 1 46 46 THR CA C 13 62.200 0.10 . 1 . 410 . . 46 THR CA . 25734 1
456 . 1 1 46 46 THR CB C 13 68.450 0.10 . 1 . 413 . . 46 THR CB . 25734 1
457 . 1 1 46 46 THR N N 15 103.500 0.10 . 1 . 408 . . 46 THR N . 25734 1
458 . 1 1 47 47 GLU H H 1 7.920 0.01 . 1 . 417 . . 47 GLU H . 25734 1
459 . 1 1 47 47 GLU HA H 1 4.929 0.01 . 1 . 419 . . 47 GLU HA . 25734 1
460 . 1 1 47 47 GLU HB2 H 1 2.604 0.01 . 2 . 422 . . 47 GLU HB2 . 25734 1
461 . 1 1 47 47 GLU HB3 H 1 1.958 0.01 . 2 . 423 . . 47 GLU HB3 . 25734 1
462 . 1 1 47 47 GLU HG2 H 1 2.169 0.01 . 2 . 424 . . 47 GLU HG2 . 25734 1
463 . 1 1 47 47 GLU HG3 H 1 2.301 0.01 . 2 . 425 . . 47 GLU HG3 . 25734 1
464 . 1 1 47 47 GLU C C 13 175.640 0.10 . 1 . 420 . . 47 GLU C . 25734 1
465 . 1 1 47 47 GLU CA C 13 54.620 0.10 . 1 . 418 . . 47 GLU CA . 25734 1
466 . 1 1 47 47 GLU CB C 13 28.600 0.10 . 1 . 421 . . 47 GLU CB . 25734 1
467 . 1 1 47 47 GLU N N 15 122.600 0.10 . 1 . 416 . . 47 GLU N . 25734 1
468 . 1 1 48 48 LYS H H 1 7.656 0.01 . 1 . 427 . . 48 LYS H . 25734 1
469 . 1 1 48 48 LYS HA H 1 3.448 0.01 . 1 . 429 . . 48 LYS HA . 25734 1
470 . 1 1 48 48 LYS HB2 H 1 1.919 0.01 . 2 . 432 . . 48 LYS HB2 . 25734 1
471 . 1 1 48 48 LYS HB3 H 1 1.758 0.01 . 2 . 433 . . 48 LYS HB3 . 25734 1
472 . 1 1 48 48 LYS HG2 H 1 0.978 0.01 . 2 . 434 . . 48 LYS HG2 . 25734 1
473 . 1 1 48 48 LYS HG3 H 1 1.242 0.01 . 2 . 435 . . 48 LYS HG3 . 25734 1
474 . 1 1 48 48 LYS HD2 H 1 1.674 0.01 . 2 . 436 . . 48 LYS HD2 . 25734 1
475 . 1 1 48 48 LYS HD3 H 1 1.580 0.01 . 2 . 437 . . 48 LYS HD3 . 25734 1
476 . 1 1 48 48 LYS HE2 H 1 2.899 0.01 . 1 . 438 . . 48 LYS HE2 . 25734 1
477 . 1 1 48 48 LYS HE3 H 1 2.899 0.01 . 1 . 439 . . 48 LYS HE3 . 25734 1
478 . 1 1 48 48 LYS C C 13 177.260 0.10 . 1 . 430 . . 48 LYS C . 25734 1
479 . 1 1 48 48 LYS CA C 13 60.550 0.10 . 1 . 428 . . 48 LYS CA . 25734 1
480 . 1 1 48 48 LYS CB C 13 33.190 0.10 . 1 . 431 . . 48 LYS CB . 25734 1
481 . 1 1 48 48 LYS N N 15 120.900 0.10 . 1 . 426 . . 48 LYS N . 25734 1
482 . 1 1 49 49 GLN H H 1 8.534 0.01 . 1 . 441 . . 49 GLN H . 25734 1
483 . 1 1 49 49 GLN HA H 1 3.929 0.01 . 1 . 443 . . 49 GLN HA . 25734 1
484 . 1 1 49 49 GLN HB2 H 1 2.052 0.01 . 2 . 446 . . 49 GLN HB2 . 25734 1
485 . 1 1 49 49 GLN HB3 H 1 1.987 0.01 . 2 . 447 . . 49 GLN HB3 . 25734 1
486 . 1 1 49 49 GLN HG2 H 1 2.321 0.01 . 1 . 448 . . 49 GLN HG2 . 25734 1
487 . 1 1 49 49 GLN HG3 H 1 2.321 0.01 . 1 . 449 . . 49 GLN HG3 . 25734 1
488 . 1 1 49 49 GLN HE21 H 1 6.911 0.01 . 1 . 451 . . 49 GLN HE21 . 25734 1
489 . 1 1 49 49 GLN HE22 H 1 7.697 0.01 . 1 . 452 . . 49 GLN HE22 . 25734 1
490 . 1 1 49 49 GLN C C 13 177.920 0.10 . 1 . 444 . . 49 GLN C . 25734 1
491 . 1 1 49 49 GLN CA C 13 58.920 0.10 . 1 . 442 . . 49 GLN CA . 25734 1
492 . 1 1 49 49 GLN CB C 13 28.130 0.10 . 1 . 445 . . 49 GLN CB . 25734 1
493 . 1 1 49 49 GLN N N 15 116.670 0.10 . 1 . 440 . . 49 GLN N . 25734 1
494 . 1 1 49 49 GLN NE2 N 15 115.060 0.10 . 1 . 450 . . 49 GLN NE2 . 25734 1
495 . 1 1 50 50 ILE H H 1 7.333 0.01 . 1 . 454 . . 50 ILE H . 25734 1
496 . 1 1 50 50 ILE HA H 1 3.770 0.01 . 1 . 456 . . 50 ILE HA . 25734 1
497 . 1 1 50 50 ILE HB H 1 1.954 0.01 . 1 . 459 . . 50 ILE HB . 25734 1
498 . 1 1 50 50 ILE HG12 H 1 1.255 0.01 . 2 . 460 . . 50 ILE HG12 . 25734 1
499 . 1 1 50 50 ILE HG13 H 1 1.643 0.01 . 2 . 461 . . 50 ILE HG13 . 25734 1
500 . 1 1 50 50 ILE HG21 H 1 1.082 0.01 . 1 . 462 . . 50 ILE HG21 . 25734 1
501 . 1 1 50 50 ILE HG22 H 1 1.082 0.01 . 1 . 462 . . 50 ILE HG22 . 25734 1
502 . 1 1 50 50 ILE HG23 H 1 1.082 0.01 . 1 . 462 . . 50 ILE HG23 . 25734 1
503 . 1 1 50 50 ILE HD11 H 1 0.908 0.01 . 1 . 464 . . 50 ILE HD11 . 25734 1
504 . 1 1 50 50 ILE HD12 H 1 0.908 0.01 . 1 . 464 . . 50 ILE HD12 . 25734 1
505 . 1 1 50 50 ILE HD13 H 1 0.908 0.01 . 1 . 464 . . 50 ILE HD13 . 25734 1
506 . 1 1 50 50 ILE C C 13 179.050 0.10 . 1 . 457 . . 50 ILE C . 25734 1
507 . 1 1 50 50 ILE CA C 13 64.260 0.10 . 1 . 455 . . 50 ILE CA . 25734 1
508 . 1 1 50 50 ILE CB C 13 37.780 0.10 . 1 . 458 . . 50 ILE CB . 25734 1
509 . 1 1 50 50 ILE CD1 C 13 10.790 0.10 . 1 . 463 . . 50 ILE CD1 . 25734 1
510 . 1 1 50 50 ILE N N 15 119.360 0.10 . 1 . 453 . . 50 ILE N . 25734 1
511 . 1 1 51 51 PHE H H 1 8.072 0.01 . 1 . 466 . . 51 PHE H . 25734 1
512 . 1 1 51 51 PHE HA H 1 2.976 0.01 . 1 . 468 . . 51 PHE HA . 25734 1
513 . 1 1 51 51 PHE HB2 H 1 2.776 0.01 . 1 . 471 . . 51 PHE HB2 . 25734 1
514 . 1 1 51 51 PHE HB3 H 1 2.414 0.01 . 1 . 472 . . 51 PHE HB3 . 25734 1
515 . 1 1 51 51 PHE HD1 H 1 6.566 0.01 . 1 . 474 . . 51 PHE HD1 . 25734 1
516 . 1 1 51 51 PHE HD2 H 1 6.566 0.01 . 1 . 475 . . 51 PHE HD2 . 25734 1
517 . 1 1 51 51 PHE HE1 H 1 6.989 0.01 . 1 . 476 . . 51 PHE HE1 . 25734 1
518 . 1 1 51 51 PHE HE2 H 1 6.989 0.01 . 1 . 477 . . 51 PHE HE2 . 25734 1
519 . 1 1 51 51 PHE HZ H 1 7.259 0.01 . 1 . 473 . . 51 PHE HZ . 25734 1
520 . 1 1 51 51 PHE C C 13 175.810 0.10 . 1 . 469 . . 51 PHE C . 25734 1
521 . 1 1 51 51 PHE CA C 13 59.750 0.10 . 1 . 467 . . 51 PHE CA . 25734 1
522 . 1 1 51 51 PHE CB C 13 37.760 0.10 . 1 . 470 . . 51 PHE CB . 25734 1
523 . 1 1 51 51 PHE N N 15 122.160 0.10 . 1 . 465 . . 51 PHE N . 25734 1
524 . 1 1 52 52 GLU H H 1 8.338 0.01 . 1 . 479 . . 52 GLU H . 25734 1
525 . 1 1 52 52 GLU HA H 1 3.250 0.01 . 1 . 481 . . 52 GLU HA . 25734 1
526 . 1 1 52 52 GLU HB2 H 1 1.793 0.01 . 2 . 484 . . 52 GLU HB2 . 25734 1
527 . 1 1 52 52 GLU HB3 H 1 1.919 0.01 . 2 . 485 . . 52 GLU HB3 . 25734 1
528 . 1 1 52 52 GLU HG2 H 1 2.412 0.01 . 2 . 486 . . 52 GLU HG2 . 25734 1
529 . 1 1 52 52 GLU HG3 H 1 2.010 0.01 . 2 . 487 . . 52 GLU HG3 . 25734 1
530 . 1 1 52 52 GLU C C 13 179.910 0.10 . 1 . 482 . . 52 GLU C . 25734 1
531 . 1 1 52 52 GLU CA C 13 59.800 0.10 . 1 . 480 . . 52 GLU CA . 25734 1
532 . 1 1 52 52 GLU CB C 13 28.720 0.10 . 1 . 483 . . 52 GLU CB . 25734 1
533 . 1 1 52 52 GLU N N 15 119.090 0.10 . 1 . 478 . . 52 GLU N . 25734 1
534 . 1 1 53 53 ASP H H 1 8.160 0.01 . 1 . 489 . . 53 ASP H . 25734 1
535 . 1 1 53 53 ASP HA H 1 4.375 0.01 . 1 . 491 . . 53 ASP HA . 25734 1
536 . 1 1 53 53 ASP HB2 H 1 2.593 0.01 . 2 . 494 . . 53 ASP HB2 . 25734 1
537 . 1 1 53 53 ASP HB3 H 1 2.671 0.01 . 2 . 495 . . 53 ASP HB3 . 25734 1
538 . 1 1 53 53 ASP C C 13 177.690 0.10 . 1 . 492 . . 53 ASP C . 25734 1
539 . 1 1 53 53 ASP CA C 13 57.250 0.10 . 1 . 490 . . 53 ASP CA . 25734 1
540 . 1 1 53 53 ASP CB C 13 40.470 0.10 . 1 . 493 . . 53 ASP CB . 25734 1
541 . 1 1 53 53 ASP N N 15 119.870 0.10 . 1 . 488 . . 53 ASP N . 25734 1
542 . 1 1 54 54 HIS H H 1 8.072 0.01 . 1 . 497 . . 54 HIS H . 25734 1
543 . 1 1 54 54 HIS HA H 1 3.998 0.01 . 1 . 499 . . 54 HIS HA . 25734 1
544 . 1 1 54 54 HIS HB2 H 1 3.430 0.01 . 2 . 502 . . 54 HIS HB2 . 25734 1
545 . 1 1 54 54 HIS HB3 H 1 3.070 0.01 . 2 . 503 . . 54 HIS HB3 . 25734 1
546 . 1 1 54 54 HIS HD2 H 1 7.027 0.01 . 1 . 504 . . 54 HIS HD2 . 25734 1
547 . 1 1 54 54 HIS HE1 H 1 7.939 0.01 . 1 . 505 . . 54 HIS HE1 . 25734 1
548 . 1 1 54 54 HIS C C 13 177.460 0.10 . 1 . 500 . . 54 HIS C . 25734 1
549 . 1 1 54 54 HIS CA C 13 60.150 0.10 . 1 . 498 . . 54 HIS CA . 25734 1
550 . 1 1 54 54 HIS CB C 13 27.550 0.10 . 1 . 501 . . 54 HIS CB . 25734 1
551 . 1 1 54 54 HIS N N 15 120.490 0.10 . 1 . 496 . . 54 HIS N . 25734 1
552 . 1 1 55 55 VAL H H 1 8.198 0.01 . 1 . 507 . . 55 VAL H . 25734 1
553 . 1 1 55 55 VAL HA H 1 3.447 0.01 . 1 . 509 . . 55 VAL HA . 25734 1
554 . 1 1 55 55 VAL HB H 1 1.737 0.01 . 1 . 512 . . 55 VAL HB . 25734 1
555 . 1 1 55 55 VAL HG11 H 1 0.832 0.01 . 2 . 514 . . 55 VAL HG11 . 25734 1
556 . 1 1 55 55 VAL HG12 H 1 0.832 0.01 . 2 . 514 . . 55 VAL HG12 . 25734 1
557 . 1 1 55 55 VAL HG13 H 1 0.832 0.01 . 2 . 514 . . 55 VAL HG13 . 25734 1
558 . 1 1 55 55 VAL HG21 H 1 0.770 0.01 . 2 . 516 . . 55 VAL HG21 . 25734 1
559 . 1 1 55 55 VAL HG22 H 1 0.770 0.01 . 2 . 516 . . 55 VAL HG22 . 25734 1
560 . 1 1 55 55 VAL HG23 H 1 0.770 0.01 . 2 . 516 . . 55 VAL HG23 . 25734 1
561 . 1 1 55 55 VAL C C 13 179.640 0.10 . 1 . 510 . . 55 VAL C . 25734 1
562 . 1 1 55 55 VAL CA C 13 67.250 0.10 . 1 . 508 . . 55 VAL CA . 25734 1
563 . 1 1 55 55 VAL CB C 13 31.860 0.10 . 1 . 511 . . 55 VAL CB . 25734 1
564 . 1 1 55 55 VAL CG1 C 13 19.590 0.10 . 1 . 513 . . 55 VAL CG1 . 25734 1
565 . 1 1 55 55 VAL CG2 C 13 21.600 0.10 . 1 . 515 . . 55 VAL CG2 . 25734 1
566 . 1 1 55 55 VAL N N 15 119.000 0.10 . 1 . 506 . . 55 VAL N . 25734 1
567 . 1 1 56 56 PHE H H 1 7.979 0.01 . 1 . 518 . . 56 PHE H . 25734 1
568 . 1 1 56 56 PHE HA H 1 4.197 0.01 . 1 . 520 . . 56 PHE HA . 25734 1
569 . 1 1 56 56 PHE HB2 H 1 3.193 0.01 . 1 . 524 . . 56 PHE HB2 . 25734 1
570 . 1 1 56 56 PHE HB3 H 1 3.193 0.01 . 1 . 525 . . 56 PHE HB3 . 25734 1
571 . 1 1 56 56 PHE HD1 H 1 7.225 0.01 . 1 . 526 . . 56 PHE HD1 . 25734 1
572 . 1 1 56 56 PHE HD2 H 1 7.225 0.01 . 1 . 527 . . 56 PHE HD2 . 25734 1
573 . 1 1 56 56 PHE HE1 H 1 7.250 0.01 . 1 . 528 . . 56 PHE HE1 . 25734 1
574 . 1 1 56 56 PHE HE2 H 1 7.250 0.01 . 1 . 529 . . 56 PHE HE2 . 25734 1
575 . 1 1 56 56 PHE HZ H 1 7.198 0.01 . 1 . 523 . . 56 PHE HZ . 25734 1
576 . 1 1 56 56 PHE C C 13 178.400 0.10 . 1 . 521 . . 56 PHE C . 25734 1
577 . 1 1 56 56 PHE CA C 13 60.890 0.10 . 1 . 519 . . 56 PHE CA . 25734 1
578 . 1 1 56 56 PHE CB C 13 38.800 0.10 . 1 . 522 . . 56 PHE CB . 25734 1
579 . 1 1 56 56 PHE N N 15 120.700 0.10 . 1 . 517 . . 56 PHE N . 25734 1
580 . 1 1 57 57 CYS H H 1 8.050 0.01 . 1 . 531 . . 57 CYS H . 25734 1
581 . 1 1 57 57 CYS HA H 1 3.948 0.01 . 1 . 533 . . 57 CYS HA . 25734 1
582 . 1 1 57 57 CYS HB2 H 1 2.739 0.01 . 1 . 536 . . 57 CYS HB2 . 25734 1
583 . 1 1 57 57 CYS HB3 H 1 2.835 0.01 . 1 . 537 . . 57 CYS HB3 . 25734 1
584 . 1 1 57 57 CYS C C 13 176.270 0.10 . 1 . 534 . . 57 CYS C . 25734 1
585 . 1 1 57 57 CYS CA C 13 62.600 0.10 . 1 . 532 . . 57 CYS CA . 25734 1
586 . 1 1 57 57 CYS CB C 13 26.500 0.10 . 1 . 535 . . 57 CYS CB . 25734 1
587 . 1 1 57 57 CYS N N 15 116.780 0.10 . 1 . 530 . . 57 CYS N . 25734 1
588 . 1 1 58 58 HIS H H 1 7.263 0.01 . 1 . 539 . . 58 HIS H . 25734 1
589 . 1 1 58 58 HIS HA H 1 4.397 0.01 . 1 . 541 . . 58 HIS HA . 25734 1
590 . 1 1 58 58 HIS HB2 H 1 3.112 0.01 . 1 . 544 . . 58 HIS HB2 . 25734 1
591 . 1 1 58 58 HIS HB3 H 1 3.226 0.01 . 1 . 545 . . 58 HIS HB3 . 25734 1
592 . 1 1 58 58 HIS HD2 H 1 6.650 0.01 . 1 . 546 . . 58 HIS HD2 . 25734 1
593 . 1 1 58 58 HIS HE1 H 1 7.996 0.01 . 1 . 547 . . 58 HIS HE1 . 25734 1
594 . 1 1 58 58 HIS C C 13 175.540 0.10 . 1 . 542 . . 58 HIS C . 25734 1
595 . 1 1 58 58 HIS CA C 13 58.270 0.10 . 1 . 540 . . 58 HIS CA . 25734 1
596 . 1 1 58 58 HIS CB C 13 28.760 0.10 . 1 . 543 . . 58 HIS CB . 25734 1
597 . 1 1 58 58 HIS N N 15 116.780 0.10 . 1 . 538 . . 58 HIS N . 25734 1
598 . 1 1 59 59 SER H H 1 7.934 0.01 . 1 . 549 . . 59 SER H . 25734 1
599 . 1 1 59 59 SER HA H 1 4.361 0.01 . 1 . 551 . . 59 SER HA . 25734 1
600 . 1 1 59 59 SER HB2 H 1 3.801 0.01 . 1 . 554 . . 59 SER HB2 . 25734 1
601 . 1 1 59 59 SER HB3 H 1 3.801 0.01 . 1 . 555 . . 59 SER HB3 . 25734 1
602 . 1 1 59 59 SER C C 13 173.170 0.10 . 1 . 552 . . 59 SER C . 25734 1
603 . 1 1 59 59 SER CA C 13 58.680 0.10 . 1 . 550 . . 59 SER CA . 25734 1
604 . 1 1 59 59 SER CB C 13 63.880 0.10 . 1 . 553 . . 59 SER CB . 25734 1
605 . 1 1 59 59 SER N N 15 114.380 0.10 . 1 . 548 . . 59 SER N . 25734 1
606 . 1 1 60 60 LEU H H 1 7.146 0.01 . 1 . 557 . . 60 LEU H . 25734 1
607 . 1 1 60 60 LEU HA H 1 4.028 0.01 . 1 . 559 . . 60 LEU HA . 25734 1
608 . 1 1 60 60 LEU HB2 H 1 1.450 0.01 . 2 . 562 . . 60 LEU HB2 . 25734 1
609 . 1 1 60 60 LEU HB3 H 1 1.559 0.01 . 2 . 563 . . 60 LEU HB3 . 25734 1
610 . 1 1 60 60 LEU HG H 1 1.381 0.01 . 1 . 564 . . 60 LEU HG . 25734 1
611 . 1 1 60 60 LEU HD11 H 1 0.844 0.01 . 2 . 566 . . 60 LEU HD11 . 25734 1
612 . 1 1 60 60 LEU HD12 H 1 0.844 0.01 . 2 . 566 . . 60 LEU HD12 . 25734 1
613 . 1 1 60 60 LEU HD13 H 1 0.844 0.01 . 2 . 566 . . 60 LEU HD13 . 25734 1
614 . 1 1 60 60 LEU HD21 H 1 0.702 0.01 . 2 . 568 . . 60 LEU HD21 . 25734 1
615 . 1 1 60 60 LEU HD22 H 1 0.702 0.01 . 2 . 568 . . 60 LEU HD22 . 25734 1
616 . 1 1 60 60 LEU HD23 H 1 0.702 0.01 . 2 . 568 . . 60 LEU HD23 . 25734 1
617 . 1 1 60 60 LEU C C 13 169.440 0.10 . 1 . 560 . . 60 LEU C . 25734 1
618 . 1 1 60 60 LEU CA C 13 56.490 0.10 . 1 . 558 . . 60 LEU CA . 25734 1
619 . 1 1 60 60 LEU CB C 13 42.860 0.10 . 1 . 561 . . 60 LEU CB . 25734 1
620 . 1 1 60 60 LEU CD1 C 13 23.770 0.10 . 1 . 565 . . 60 LEU CD1 . 25734 1
621 . 1 1 60 60 LEU CD2 C 13 20.950 0.10 . 1 . 567 . . 60 LEU CD2 . 25734 1
622 . 1 1 60 60 LEU N N 15 128.350 0.10 . 1 . 556 . . 60 LEU N . 25734 1
stop_
save_