Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 15341
_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 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.2
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 15341 1
2 '2D 1H-13C HSQC' . . . 15341 1
3 '2D 1H-15N HSQC' . . . 15341 1
4 '2D 1H-13C HSQC (aliph)' . . . 15341 1
5 '3D CBCA(CO)NH' . . . 15341 1
6 '3D HNCACB' . . . 15341 1
7 '3D HBHA(CO)NH' . . . 15341 1
8 '3D HNHA' . . . 15341 1
9 '3D HCCH-TOCSY' . . . 15341 1
10 '3D 1H-15N NOESY' . . . 15341 1
13 '2D 1H-13C HSQC (arom)' . . . 15341 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
9 $AutoAssign . . 15341 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.Ambiguity_set_ID
_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 THR HA H 1 3.902 0.02 . 1 . . . . . 2 THR HA . 15341 1
2 . 1 1 2 2 THR HB H 1 4.138 0.02 . 1 . . . . . 2 THR HB . 15341 1
3 . 1 1 2 2 THR HG21 H 1 1.273 0.02 . 1 . . . . . 2 THR HG2 . 15341 1
4 . 1 1 2 2 THR HG22 H 1 1.273 0.02 . 1 . . . . . 2 THR HG2 . 15341 1
5 . 1 1 2 2 THR HG23 H 1 1.273 0.02 . 1 . . . . . 2 THR HG2 . 15341 1
6 . 1 1 2 2 THR CA C 13 61.460 0.2 . 1 . . . . . 2 THR CA . 15341 1
7 . 1 1 2 2 THR CB C 13 69.379 0.2 . 1 . . . . . 2 THR CB . 15341 1
8 . 1 1 2 2 THR CG2 C 13 21.614 0.2 . 1 . . . . . 2 THR CG2 . 15341 1
9 . 1 1 3 3 ILE H H 1 8.671 0.02 . 1 . . . . . 3 ILE H . 15341 1
10 . 1 1 3 3 ILE HA H 1 4.166 0.02 . 1 . . . . . 3 ILE HA . 15341 1
11 . 1 1 3 3 ILE HB H 1 1.820 0.02 . 1 . . . . . 3 ILE HB . 15341 1
12 . 1 1 3 3 ILE HD11 H 1 0.835 0.02 . 1 . . . . . 3 ILE HD1 . 15341 1
13 . 1 1 3 3 ILE HD12 H 1 0.835 0.02 . 1 . . . . . 3 ILE HD1 . 15341 1
14 . 1 1 3 3 ILE HD13 H 1 0.835 0.02 . 1 . . . . . 3 ILE HD1 . 15341 1
15 . 1 1 3 3 ILE HG12 H 1 1.171 0.02 . 2 . . . . . 3 ILE HG12 . 15341 1
16 . 1 1 3 3 ILE HG13 H 1 1.460 0.02 . 2 . . . . . 3 ILE HG13 . 15341 1
17 . 1 1 3 3 ILE HG21 H 1 0.878 0.02 . 1 . . . . . 3 ILE HG2 . 15341 1
18 . 1 1 3 3 ILE HG22 H 1 0.878 0.02 . 1 . . . . . 3 ILE HG2 . 15341 1
19 . 1 1 3 3 ILE HG23 H 1 0.878 0.02 . 1 . . . . . 3 ILE HG2 . 15341 1
20 . 1 1 3 3 ILE CA C 13 61.569 0.2 . 1 . . . . . 3 ILE CA . 15341 1
21 . 1 1 3 3 ILE CB C 13 38.770 0.2 . 1 . . . . . 3 ILE CB . 15341 1
22 . 1 1 3 3 ILE CD1 C 13 12.761 0.2 . 1 . . . . . 3 ILE CD1 . 15341 1
23 . 1 1 3 3 ILE CG1 C 13 27.380 0.2 . 1 . . . . . 3 ILE CG1 . 15341 1
24 . 1 1 3 3 ILE CG2 C 13 17.350 0.2 . 1 . . . . . 3 ILE CG2 . 15341 1
25 . 1 1 3 3 ILE N N 15 124.520 0.2 . 1 . . . . . 3 ILE N . 15341 1
26 . 1 1 4 4 GLN H H 1 8.477 0.02 . 1 . . . . . 4 GLN H . 15341 1
27 . 1 1 4 4 GLN HA H 1 4.291 0.02 . 1 . . . . . 4 GLN HA . 15341 1
28 . 1 1 4 4 GLN HB2 H 1 1.964 0.02 . 2 . . . . . 4 GLN HB2 . 15341 1
29 . 1 1 4 4 GLN HB3 H 1 2.022 0.02 . 2 . . . . . 4 GLN HB3 . 15341 1
30 . 1 1 4 4 GLN HE21 H 1 6.850 0.02 . 2 . . . . . 4 GLN HE21 . 15341 1
31 . 1 1 4 4 GLN HE22 H 1 7.567 0.02 . 2 . . . . . 4 GLN HE22 . 15341 1
32 . 1 1 4 4 GLN HG2 H 1 2.334 0.02 . 2 . . . . . 4 GLN HG2 . 15341 1
33 . 1 1 4 4 GLN HG3 H 1 2.022 0.02 . 2 . . . . . 4 GLN HG3 . 15341 1
34 . 1 1 4 4 GLN CA C 13 55.615 0.2 . 1 . . . . . 4 GLN CA . 15341 1
35 . 1 1 4 4 GLN CB C 13 29.590 0.2 . 1 . . . . . 4 GLN CB . 15341 1
36 . 1 1 4 4 GLN CG C 13 33.728 0.2 . 1 . . . . . 4 GLN CG . 15341 1
37 . 1 1 4 4 GLN N N 15 124.855 0.2 . 1 . . . . . 4 GLN N . 15341 1
38 . 1 1 4 4 GLN NE2 N 15 112.742 0.2 . 1 . . . . . 4 GLN NE2 . 15341 1
39 . 1 1 5 5 ALA H H 1 8.334 0.02 . 1 . . . . . 5 ALA H . 15341 1
40 . 1 1 5 5 ALA HA H 1 4.568 0.02 . 1 . . . . . 5 ALA HA . 15341 1
41 . 1 1 5 5 ALA HB1 H 1 1.299 0.02 . 1 . . . . . 5 ALA HB . 15341 1
42 . 1 1 5 5 ALA HB2 H 1 1.299 0.02 . 1 . . . . . 5 ALA HB . 15341 1
43 . 1 1 5 5 ALA HB3 H 1 1.299 0.02 . 1 . . . . . 5 ALA HB . 15341 1
44 . 1 1 5 5 ALA CA C 13 50.464 0.2 . 1 . . . . . 5 ALA CA . 15341 1
45 . 1 1 5 5 ALA CB C 13 18.235 0.2 . 1 . . . . . 5 ALA CB . 15341 1
46 . 1 1 5 5 ALA N N 15 127.159 0.2 . 1 . . . . . 5 ALA N . 15341 1
47 . 1 1 6 6 PRO HA H 1 4.429 0.02 . 1 . . . . . 6 PRO HA . 15341 1
48 . 1 1 6 6 PRO HB2 H 1 2.273 0.02 . 2 . . . . . 6 PRO HB2 . 15341 1
49 . 1 1 6 6 PRO HB3 H 1 1.842 0.02 . 2 . . . . . 6 PRO HB3 . 15341 1
50 . 1 1 6 6 PRO HD2 H 1 3.740 0.02 . 2 . . . . . 6 PRO HD2 . 15341 1
51 . 1 1 6 6 PRO HD3 H 1 3.543 0.02 . 2 . . . . . 6 PRO HD3 . 15341 1
52 . 1 1 6 6 PRO HG2 H 1 1.976 0.02 . 2 . . . . . 6 PRO HG2 . 15341 1
53 . 1 1 6 6 PRO CA C 13 63.072 0.2 . 1 . . . . . 6 PRO CA . 15341 1
54 . 1 1 6 6 PRO CB C 13 32.220 0.2 . 1 . . . . . 6 PRO CB . 15341 1
55 . 1 1 6 6 PRO CD C 13 50.534 0.2 . 1 . . . . . 6 PRO CD . 15341 1
56 . 1 1 6 6 PRO CG C 13 27.503 0.2 . 1 . . . . . 6 PRO CG . 15341 1
57 . 1 1 7 7 GLU H H 1 8.363 0.02 . 1 . . . . . 7 GLU H . 15341 1
58 . 1 1 7 7 GLU HA H 1 4.280 0.02 . 1 . . . . . 7 GLU HA . 15341 1
59 . 1 1 7 7 GLU HB2 H 1 1.926 0.02 . 2 . . . . . 7 GLU HB2 . 15341 1
60 . 1 1 7 7 GLU HG2 H 1 2.268 0.02 . 2 . . . . . 7 GLU HG2 . 15341 1
61 . 1 1 7 7 GLU HG3 H 1 2.209 0.02 . 2 . . . . . 7 GLU HG3 . 15341 1
62 . 1 1 7 7 GLU CA C 13 56.298 0.2 . 1 . . . . . 7 GLU CA . 15341 1
63 . 1 1 7 7 GLU CB C 13 31.415 0.2 . 1 . . . . . 7 GLU CB . 15341 1
64 . 1 1 7 7 GLU CG C 13 36.304 0.2 . 1 . . . . . 7 GLU CG . 15341 1
65 . 1 1 7 7 GLU N N 15 122.629 0.2 . 1 . . . . . 7 GLU N . 15341 1
66 . 1 1 8 8 THR H H 1 8.219 0.02 . 1 . . . . . 8 THR H . 15341 1
67 . 1 1 8 8 THR HA H 1 4.948 0.02 . 1 . . . . . 8 THR HA . 15341 1
68 . 1 1 8 8 THR HB H 1 3.796 0.02 . 1 . . . . . 8 THR HB . 15341 1
69 . 1 1 8 8 THR HG21 H 1 0.939 0.02 . 1 . . . . . 8 THR HG2 . 15341 1
70 . 1 1 8 8 THR HG22 H 1 0.939 0.02 . 1 . . . . . 8 THR HG2 . 15341 1
71 . 1 1 8 8 THR HG23 H 1 0.939 0.02 . 1 . . . . . 8 THR HG2 . 15341 1
72 . 1 1 8 8 THR CA C 13 62.157 0.2 . 1 . . . . . 8 THR CA . 15341 1
73 . 1 1 8 8 THR CB C 13 70.658 0.2 . 1 . . . . . 8 THR CB . 15341 1
74 . 1 1 8 8 THR CG2 C 13 21.764 0.2 . 1 . . . . . 8 THR CG2 . 15341 1
75 . 1 1 8 8 THR N N 15 119.082 0.2 . 1 . . . . . 8 THR N . 15341 1
76 . 1 1 9 9 LYS H H 1 8.885 0.02 . 1 . . . . . 9 LYS H . 15341 1
77 . 1 1 9 9 LYS HA H 1 4.513 0.02 . 1 . . . . . 9 LYS HA . 15341 1
78 . 1 1 9 9 LYS HB2 H 1 1.648 0.02 . 2 . . . . . 9 LYS HB2 . 15341 1
79 . 1 1 9 9 LYS HB3 H 1 1.363 0.02 . 2 . . . . . 9 LYS HB3 . 15341 1
80 . 1 1 9 9 LYS HD2 H 1 1.521 0.02 . 2 . . . . . 9 LYS HD2 . 15341 1
81 . 1 1 9 9 LYS HD3 H 1 1.64 0.02 . 2 . . . . . 9 LYS HD3 . 15341 1
82 . 1 1 9 9 LYS HE2 H 1 2.918 0.02 . 2 . . . . . 9 LYS HE2 . 15341 1
83 . 1 1 9 9 LYS HE3 H 1 2.909 0.02 . 2 . . . . . 9 LYS HE3 . 15341 1
84 . 1 1 9 9 LYS HG2 H 1 1.196 0.02 . 2 . . . . . 9 LYS HG2 . 15341 1
85 . 1 1 9 9 LYS HG3 H 1 1.089 0.02 . 2 . . . . . 9 LYS HG3 . 15341 1
86 . 1 1 9 9 LYS CA C 13 55.062 0.2 . 1 . . . . . 9 LYS CA . 15341 1
87 . 1 1 9 9 LYS CB C 13 35.316 0.2 . 1 . . . . . 9 LYS CB . 15341 1
88 . 1 1 9 9 LYS CD C 13 29.580 0.2 . 1 . . . . . 9 LYS CD . 15341 1
89 . 1 1 9 9 LYS CE C 13 42.443 0.2 . 1 . . . . . 9 LYS CE . 15341 1
90 . 1 1 9 9 LYS CG C 13 25.544 0.2 . 1 . . . . . 9 LYS CG . 15341 1
91 . 1 1 9 9 LYS N N 15 128.038 0.2 . 1 . . . . . 9 LYS N . 15341 1
92 . 1 1 10 10 ILE H H 1 8.550 0.02 . 1 . . . . . 10 ILE H . 15341 1
93 . 1 1 10 10 ILE HA H 1 5.029 0.02 . 1 . . . . . 10 ILE HA . 15341 1
94 . 1 1 10 10 ILE HB H 1 1.829 0.02 . 1 . . . . . 10 ILE HB . 15341 1
95 . 1 1 10 10 ILE HD11 H 1 0.764 0.02 . 1 . . . . . 10 ILE HD1 . 15341 1
96 . 1 1 10 10 ILE HD12 H 1 0.764 0.02 . 1 . . . . . 10 ILE HD1 . 15341 1
97 . 1 1 10 10 ILE HD13 H 1 0.764 0.02 . 1 . . . . . 10 ILE HD1 . 15341 1
98 . 1 1 10 10 ILE HG12 H 1 1.146 0.02 . 2 . . . . . 10 ILE HG12 . 15341 1
99 . 1 1 10 10 ILE HG13 H 1 1.446 0.02 . 2 . . . . . 10 ILE HG13 . 15341 1
100 . 1 1 10 10 ILE HG21 H 1 0.857 0.02 . 1 . . . . . 10 ILE HG2 . 15341 1
101 . 1 1 10 10 ILE HG22 H 1 0.857 0.02 . 1 . . . . . 10 ILE HG2 . 15341 1
102 . 1 1 10 10 ILE HG23 H 1 0.857 0.02 . 1 . . . . . 10 ILE HG2 . 15341 1
103 . 1 1 10 10 ILE CA C 13 59.908 0.2 . 1 . . . . . 10 ILE CA . 15341 1
104 . 1 1 10 10 ILE CB C 13 37.184 0.2 . 1 . . . . . 10 ILE CB . 15341 1
105 . 1 1 10 10 ILE CD1 C 13 12.503 0.2 . 1 . . . . . 10 ILE CD1 . 15341 1
106 . 1 1 10 10 ILE CG1 C 13 27.680 0.2 . 1 . . . . . 10 ILE CG1 . 15341 1
107 . 1 1 10 10 ILE CG2 C 13 17.596 0.2 . 1 . . . . . 10 ILE CG2 . 15341 1
108 . 1 1 10 10 ILE N N 15 124.813 0.2 . 1 . . . . . 10 ILE N . 15341 1
109 . 1 1 11 11 VAL H H 1 9.253 0.02 . 1 . . . . . 11 VAL H . 15341 1
110 . 1 1 11 11 VAL HA H 1 4.97 0.02 . 1 . . . . . 11 VAL HA . 15341 1
111 . 1 1 11 11 VAL HB H 1 2.474 0.02 . 1 . . . . . 11 VAL HB . 15341 1
112 . 1 1 11 11 VAL HG11 H 1 1.108 0.02 . 1 . . . . . 11 VAL HG1 . 15341 1
113 . 1 1 11 11 VAL HG12 H 1 1.108 0.02 . 1 . . . . . 11 VAL HG1 . 15341 1
114 . 1 1 11 11 VAL HG13 H 1 1.108 0.02 . 1 . . . . . 11 VAL HG1 . 15341 1
115 . 1 1 11 11 VAL HG21 H 1 0.912 0.02 . 1 . . . . . 11 VAL HG2 . 15341 1
116 . 1 1 11 11 VAL HG22 H 1 0.912 0.02 . 1 . . . . . 11 VAL HG2 . 15341 1
117 . 1 1 11 11 VAL HG23 H 1 0.912 0.02 . 1 . . . . . 11 VAL HG2 . 15341 1
118 . 1 1 11 11 VAL CA C 13 59.3 0.2 . 1 . . . . . 11 VAL CA . 15341 1
119 . 1 1 11 11 VAL CB C 13 35.7 0.2 . 1 . . . . . 11 VAL CB . 15341 1
120 . 1 1 11 11 VAL CG1 C 13 22.98 0.2 . 1 . . . . . 11 VAL CG1 . 15341 1
121 . 1 1 11 11 VAL CG2 C 13 18.8 0.2 . 1 . . . . . 11 VAL CG2 . 15341 1
122 . 1 1 11 11 VAL N N 15 121.581 0.2 . 1 . . . . . 11 VAL N . 15341 1
123 . 1 1 12 12 ASP H H 1 8.471 0.02 . 1 . . . . . 12 ASP H . 15341 1
124 . 1 1 12 12 ASP HA H 1 4.825 0.02 . 1 . . . . . 12 ASP HA . 15341 1
125 . 1 1 12 12 ASP HB2 H 1 2.860 0.02 . 2 . . . . . 12 ASP HB2 . 15341 1
126 . 1 1 12 12 ASP HB3 H 1 2.608 0.02 . 2 . . . . . 12 ASP HB3 . 15341 1
127 . 1 1 12 12 ASP CA C 13 53.836 0.2 . 1 . . . . . 12 ASP CA . 15341 1
128 . 1 1 12 12 ASP CB C 13 41.671 0.2 . 1 . . . . . 12 ASP CB . 15341 1
129 . 1 1 12 12 ASP N N 15 118.084 0.2 . 1 . . . . . 12 ASP N . 15341 1
130 . 1 1 13 13 LYS H H 1 7.17 0.02 . 1 . . . . . 13 LYS H . 15341 1
131 . 1 1 13 13 LYS HA H 1 4.679 0.02 . 1 . . . . . 13 LYS HA . 15341 1
132 . 1 1 13 13 LYS HB2 H 1 2.012 0.02 . 2 . . . . . 13 LYS HB2 . 15341 1
133 . 1 1 13 13 LYS HB3 H 1 1.788 0.02 . 2 . . . . . 13 LYS HB3 . 15341 1
134 . 1 1 13 13 LYS HD2 H 1 1.784 0.02 . 2 . . . . . 13 LYS HD2 . 15341 1
135 . 1 1 13 13 LYS HD3 H 1 1.794 0.02 . 2 . . . . . 13 LYS HD3 . 15341 1
136 . 1 1 13 13 LYS HE2 H 1 3.085 0.02 . 2 . . . . . 13 LYS HE2 . 15341 1
137 . 1 1 13 13 LYS HE3 H 1 3.071 0.02 . 2 . . . . . 13 LYS HE3 . 15341 1
138 . 1 1 13 13 LYS HG2 H 1 1.475 0.02 . 2 . . . . . 13 LYS HG2 . 15341 1
139 . 1 1 13 13 LYS HG3 H 1 1.522 0.02 . 2 . . . . . 13 LYS HG3 . 15341 1
140 . 1 1 13 13 LYS CA C 13 54.180 0.2 . 1 . . . . . 13 LYS CA . 15341 1
141 . 1 1 13 13 LYS CB C 13 35.890 0.2 . 1 . . . . . 13 LYS CB . 15341 1
142 . 1 1 13 13 LYS CD C 13 29.145 0.2 . 1 . . . . . 13 LYS CD . 15341 1
143 . 1 1 13 13 LYS CE C 13 42.340 0.2 . 1 . . . . . 13 LYS CE . 15341 1
144 . 1 1 13 13 LYS CG C 13 24.479 0.2 . 1 . . . . . 13 LYS CG . 15341 1
145 . 1 1 13 13 LYS N N 15 117.3 0.2 . 1 . . . . . 13 LYS N . 15341 1
146 . 1 1 14 14 SER H H 1 8.254 0.02 . 1 . . . . . 14 SER H . 15341 1
147 . 1 1 14 14 SER HA H 1 4.170 0.02 . 1 . . . . . 14 SER HA . 15341 1
148 . 1 1 14 14 SER HB2 H 1 4.067 0.02 . 2 . . . . . 14 SER HB2 . 15341 1
149 . 1 1 14 14 SER HB3 H 1 3.886 0.02 . 2 . . . . . 14 SER HB3 . 15341 1
150 . 1 1 14 14 SER CA C 13 60.024 0.2 . 1 . . . . . 14 SER CA . 15341 1
151 . 1 1 14 14 SER CB C 13 63.593 0.2 . 1 . . . . . 14 SER CB . 15341 1
152 . 1 1 14 14 SER N N 15 111.308 0.2 . 1 . . . . . 14 SER N . 15341 1
153 . 1 1 15 15 ARG H H 1 7.110 0.02 . 1 . . . . . 15 ARG H . 15341 1
154 . 1 1 15 15 ARG HA H 1 5.297 0.02 . 1 . . . . . 15 ARG HA . 15341 1
155 . 1 1 15 15 ARG HB2 H 1 1.647 0.02 . 2 . . . . . 15 ARG HB2 . 15341 1
156 . 1 1 15 15 ARG HB3 H 1 1.724 0.02 . 2 . . . . . 15 ARG HB3 . 15341 1
157 . 1 1 15 15 ARG HD2 H 1 3.023 0.02 . 2 . . . . . 15 ARG HD2 . 15341 1
158 . 1 1 15 15 ARG HD3 H 1 2.945 0.02 . 2 . . . . . 15 ARG HD3 . 15341 1
159 . 1 1 15 15 ARG HG2 H 1 1.52 0.02 . 2 . . . . . 15 ARG HG2 . 15341 1
160 . 1 1 15 15 ARG HG3 H 1 1.59 0.02 . 2 . . . . . 15 ARG HG3 . 15341 1
161 . 1 1 15 15 ARG CA C 13 55.163 0.2 . 1 . . . . . 15 ARG CA . 15341 1
162 . 1 1 15 15 ARG CB C 13 31.260 0.2 . 1 . . . . . 15 ARG CB . 15341 1
163 . 1 1 15 15 ARG CD C 13 43.288 0.2 . 1 . . . . . 15 ARG CD . 15341 1
164 . 1 1 15 15 ARG CG C 13 28.233 0.2 . 1 . . . . . 15 ARG CG . 15341 1
165 . 1 1 15 15 ARG N N 15 121.362 0.2 . 1 . . . . . 15 ARG N . 15341 1
166 . 1 1 16 16 VAL H H 1 8.809 0.02 . 1 . . . . . 16 VAL H . 15341 1
167 . 1 1 16 16 VAL HA H 1 4.45 0.02 . 1 . . . . . 16 VAL HA . 15341 1
168 . 1 1 16 16 VAL HB H 1 1.66 0.02 . 1 . . . . . 16 VAL HB . 15341 1
169 . 1 1 16 16 VAL HG11 H 1 0.35 0.02 . 1 . . . . . 16 VAL HG1 . 15341 1
170 . 1 1 16 16 VAL HG12 H 1 0.35 0.02 . 1 . . . . . 16 VAL HG1 . 15341 1
171 . 1 1 16 16 VAL HG13 H 1 0.35 0.02 . 1 . . . . . 16 VAL HG1 . 15341 1
172 . 1 1 16 16 VAL HG21 H 1 0.454 0.02 . 1 . . . . . 16 VAL HG2 . 15341 1
173 . 1 1 16 16 VAL HG22 H 1 0.454 0.02 . 1 . . . . . 16 VAL HG2 . 15341 1
174 . 1 1 16 16 VAL HG23 H 1 0.454 0.02 . 1 . . . . . 16 VAL HG2 . 15341 1
175 . 1 1 16 16 VAL CA C 13 59.6 0.2 . 1 . . . . . 16 VAL CA . 15341 1
176 . 1 1 16 16 VAL CB C 13 35.8 0.2 . 1 . . . . . 16 VAL CB . 15341 1
177 . 1 1 16 16 VAL CG1 C 13 20.0 0.2 . 1 . . . . . 16 VAL CG1 . 15341 1
178 . 1 1 16 16 VAL CG2 C 13 20.15 0.2 . 1 . . . . . 16 VAL CG2 . 15341 1
179 . 1 1 16 16 VAL N N 15 124.300 0.2 . 1 . . . . . 16 VAL N . 15341 1
180 . 1 1 17 17 ALA H H 1 8.009 0.02 . 1 . . . . . 17 ALA H . 15341 1
181 . 1 1 17 17 ALA HA H 1 4.322 0.02 . 1 . . . . . 17 ALA HA . 15341 1
182 . 1 1 17 17 ALA HB1 H 1 -0.186 0.02 . 1 . . . . . 17 ALA HB . 15341 1
183 . 1 1 17 17 ALA HB2 H 1 -0.186 0.02 . 1 . . . . . 17 ALA HB . 15341 1
184 . 1 1 17 17 ALA HB3 H 1 -0.186 0.02 . 1 . . . . . 17 ALA HB . 15341 1
185 . 1 1 17 17 ALA CA C 13 49.691 0.2 . 1 . . . . . 17 ALA CA . 15341 1
186 . 1 1 17 17 ALA CB C 13 17.652 0.2 . 1 . . . . . 17 ALA CB . 15341 1
187 . 1 1 17 17 ALA N N 15 127.911 0.2 . 1 . . . . . 17 ALA N . 15341 1
188 . 1 1 18 18 CYS H H 1 8.814 0.02 . 1 . . . . . 18 CYS H . 15341 1
189 . 1 1 18 18 CYS HA H 1 4.492 0.02 . 1 . . . . . 18 CYS HA . 15341 1
190 . 1 1 18 18 CYS HB2 H 1 3.210 0.02 . 2 . . . . . 18 CYS HB2 . 15341 1
191 . 1 1 18 18 CYS HB3 H 1 2.473 0.02 . 2 . . . . . 18 CYS HB3 . 15341 1
192 . 1 1 18 18 CYS CA C 13 59.650 0.2 . 1 . . . . . 18 CYS CA . 15341 1
193 . 1 1 18 18 CYS CB C 13 31.882 0.2 . 1 . . . . . 18 CYS CB . 15341 1
194 . 1 1 18 18 CYS N N 15 123.363 0.2 . 1 . . . . . 18 CYS N . 15341 1
195 . 1 1 19 19 ASP H H 1 8.528 0.02 . 1 . . . . . 19 ASP H . 15341 1
196 . 1 1 19 19 ASP HA H 1 4.489 0.02 . 1 . . . . . 19 ASP HA . 15341 1
197 . 1 1 19 19 ASP HB2 H 1 2.73 0.02 . 2 . . . . . 19 ASP HB2 . 15341 1
198 . 1 1 19 19 ASP HB3 H 1 2.35 0.02 . 2 . . . . . 19 ASP HB3 . 15341 1
199 . 1 1 19 19 ASP CA C 13 53.107 0.2 . 1 . . . . . 19 ASP CA . 15341 1
200 . 1 1 19 19 ASP CB C 13 42.346 0.2 . 1 . . . . . 19 ASP CB . 15341 1
201 . 1 1 19 19 ASP N N 15 128.758 0.2 . 1 . . . . . 19 ASP N . 15341 1
202 . 1 1 20 20 GLY H H 1 9.037 0.02 . 1 . . . . . 20 GLY H . 15341 1
203 . 1 1 20 20 GLY HA2 H 1 4.079 0.02 . 2 . . . . . 20 GLY HA2 . 15341 1
204 . 1 1 20 20 GLY HA3 H 1 3.906 0.02 . 2 . . . . . 20 GLY HA3 . 15341 1
205 . 1 1 20 20 GLY CA C 13 45.894 0.2 . 1 . . . . . 20 GLY CA . 15341 1
206 . 1 1 20 20 GLY N N 15 115.047 0.2 . 1 . . . . . 20 GLY N . 15341 1
207 . 1 1 21 21 GLY H H 1 7.336 0.02 . 1 . . . . . 21 GLY H . 15341 1
208 . 1 1 21 21 GLY HA2 H 1 4.246 0.02 . 2 . . . . . 21 GLY HA2 . 15341 1
209 . 1 1 21 21 GLY HA3 H 1 3.612 0.02 . 2 . . . . . 21 GLY HA3 . 15341 1
210 . 1 1 21 21 GLY CA C 13 44.222 0.2 . 1 . . . . . 21 GLY CA . 15341 1
211 . 1 1 21 21 GLY N N 15 109.000 0.2 . 1 . . . . . 21 GLY N . 15341 1
212 . 1 1 22 22 GLU H H 1 8.359 0.02 . 1 . . . . . 22 GLU H . 15341 1
213 . 1 1 22 22 GLU HA H 1 4.192 0.02 . 1 . . . . . 22 GLU HA . 15341 1
214 . 1 1 22 22 GLU HB2 H 1 1.87 0.02 . 2 . . . . . 22 GLU HB2 . 15341 1
215 . 1 1 22 22 GLU HB3 H 1 1.98 0.02 . 2 . . . . . 22 GLU HB3 . 15341 1
216 . 1 1 22 22 GLU HG2 H 1 2.25 0.02 . 2 . . . . . 22 GLU HG2 . 15341 1
217 . 1 1 22 22 GLU HG3 H 1 2.25 0.02 . 2 . . . . . 22 GLU HG3 . 15341 1
218 . 1 1 22 22 GLU CA C 13 56.20 0.2 . 1 . . . . . 22 GLU CA . 15341 1
219 . 1 1 22 22 GLU CB C 13 30.746 0.2 . 1 . . . . . 22 GLU CB . 15341 1
220 . 1 1 22 22 GLU CG C 13 36.2 0.2 . 1 . . . . . 22 GLU CG . 15341 1
221 . 1 1 22 22 GLU N N 15 118.322 0.2 . 1 . . . . . 22 GLU N . 15341 1
222 . 1 1 23 23 GLY H H 1 8.809 0.02 . 1 . . . . . 23 GLY H . 15341 1
223 . 1 1 23 23 GLY HA2 H 1 3.780 0.02 . 2 . . . . . 23 GLY HA2 . 15341 1
224 . 1 1 23 23 GLY HA3 H 1 3.835 0.02 . 2 . . . . . 23 GLY HA3 . 15341 1
225 . 1 1 23 23 GLY CA C 13 46.688 0.2 . 1 . . . . . 23 GLY CA . 15341 1
226 . 1 1 23 23 GLY N N 15 111.934 0.2 . 1 . . . . . 23 GLY N . 15341 1
227 . 1 1 24 24 ALA H H 1 8.995 0.02 . 1 . . . . . 24 ALA H . 15341 1
228 . 1 1 24 24 ALA HA H 1 4.246 0.02 . 1 . . . . . 24 ALA HA . 15341 1
229 . 1 1 24 24 ALA HB1 H 1 1.455 0.02 . 1 . . . . . 24 ALA HB . 15341 1
230 . 1 1 24 24 ALA HB2 H 1 1.455 0.02 . 1 . . . . . 24 ALA HB . 15341 1
231 . 1 1 24 24 ALA HB3 H 1 1.455 0.02 . 1 . . . . . 24 ALA HB . 15341 1
232 . 1 1 24 24 ALA CA C 13 53.645 0.2 . 1 . . . . . 24 ALA CA . 15341 1
233 . 1 1 24 24 ALA CB C 13 18.641 0.2 . 1 . . . . . 24 ALA CB . 15341 1
234 . 1 1 24 24 ALA N N 15 129.183 0.2 . 1 . . . . . 24 ALA N . 15341 1
235 . 1 1 25 25 LEU H H 1 7.780 0.02 . 1 . . . . . 25 LEU H . 15341 1
236 . 1 1 25 25 LEU HA H 1 4.407 0.02 . 1 . . . . . 25 LEU HA . 15341 1
237 . 1 1 25 25 LEU HB2 H 1 1.711 0.02 . 2 . . . . . 25 LEU HB2 . 15341 1
238 . 1 1 25 25 LEU HB3 H 1 1.711 0.02 . 2 . . . . . 25 LEU HB3 . 15341 1
239 . 1 1 25 25 LEU HD11 H 1 0.975 0.02 . 1 . . . . . 25 LEU HD1 . 15341 1
240 . 1 1 25 25 LEU HD12 H 1 0.975 0.02 . 1 . . . . . 25 LEU HD1 . 15341 1
241 . 1 1 25 25 LEU HD13 H 1 0.975 0.02 . 1 . . . . . 25 LEU HD1 . 15341 1
242 . 1 1 25 25 LEU HD21 H 1 0.888 0.02 . 1 . . . . . 25 LEU HD2 . 15341 1
243 . 1 1 25 25 LEU HD22 H 1 0.888 0.02 . 1 . . . . . 25 LEU HD2 . 15341 1
244 . 1 1 25 25 LEU HD23 H 1 0.888 0.02 . 1 . . . . . 25 LEU HD2 . 15341 1
245 . 1 1 25 25 LEU HG H 1 1.685 0.02 . 1 . . . . . 25 LEU HG . 15341 1
246 . 1 1 25 25 LEU CA C 13 54.551 0.2 . 1 . . . . . 25 LEU CA . 15341 1
247 . 1 1 25 25 LEU CB C 13 41.305 0.2 . 1 . . . . . 25 LEU CB . 15341 1
248 . 1 1 25 25 LEU CD1 C 13 25.345 0.2 . 1 . . . . . 25 LEU CD1 . 15341 1
249 . 1 1 25 25 LEU CD2 C 13 22.645 0.2 . 1 . . . . . 25 LEU CD2 . 15341 1
250 . 1 1 25 25 LEU CG C 13 27.314 0.2 . 1 . . . . . 25 LEU CG . 15341 1
251 . 1 1 25 25 LEU N N 15 116.850 0.2 . 1 . . . . . 25 LEU N . 15341 1
252 . 1 1 26 26 GLY H H 1 7.808 0.02 . 1 . . . . . 26 GLY H . 15341 1
253 . 1 1 26 26 GLY HA2 H 1 4.313 0.02 . 2 . . . . . 26 GLY HA2 . 15341 1
254 . 1 1 26 26 GLY HA3 H 1 3.685 0.02 . 2 . . . . . 26 GLY HA3 . 15341 1
255 . 1 1 26 26 GLY CA C 13 45.895 0.2 . 1 . . . . . 26 GLY CA . 15341 1
256 . 1 1 26 26 GLY N N 15 110.392 0.2 . 1 . . . . . 26 GLY N . 15341 1
257 . 1 1 27 27 HIS H H 1 7.626 0.02 . 1 . . . . . 27 HIS H . 15341 1
258 . 1 1 27 27 HIS HA H 1 4.999 0.02 . 1 . . . . . 27 HIS HA . 15341 1
259 . 1 1 27 27 HIS HB2 H 1 2.794 0.02 . 2 . . . . . 27 HIS HB2 . 15341 1
260 . 1 1 27 27 HIS HB3 H 1 3.018 0.02 . 2 . . . . . 27 HIS HB3 . 15341 1
261 . 1 1 27 27 HIS HD2 H 1 7.11 0.02 . 1 . . . . . 27 HIS HD2 . 15341 1
262 . 1 1 27 27 HIS HE1 H 1 6.94 0.02 . 1 . . . . . 27 HIS HE1 . 15341 1
263 . 1 1 27 27 HIS CA C 13 53.604 0.2 . 1 . . . . . 27 HIS CA . 15341 1
264 . 1 1 27 27 HIS CB C 13 28.333 0.2 . 1 . . . . . 27 HIS CB . 15341 1
265 . 1 1 27 27 HIS CD2 C 13 119.3 0.2 . 1 . . . . . 27 HIS CD2 . 15341 1
266 . 1 1 27 27 HIS CE1 C 13 129.2 0.2 . 1 . . . . . 27 HIS CE1 . 15341 1
267 . 1 1 27 27 HIS N N 15 118.046 0.2 . 1 . . . . . 27 HIS N . 15341 1
268 . 1 1 28 28 PRO HA H 1 4.270 0.02 . 1 . . . . . 28 PRO HA . 15341 1
269 . 1 1 28 28 PRO HB2 H 1 2.315 0.02 . 2 . . . . . 28 PRO HB2 . 15341 1
270 . 1 1 28 28 PRO HB3 H 1 1.710 0.02 . 2 . . . . . 28 PRO HB3 . 15341 1
271 . 1 1 28 28 PRO HD2 H 1 3.745 0.02 . 2 . . . . . 28 PRO HD2 . 15341 1
272 . 1 1 28 28 PRO HD3 H 1 3.270 0.02 . 2 . . . . . 28 PRO HD3 . 15341 1
273 . 1 1 28 28 PRO HG2 H 1 1.994 0.02 . 2 . . . . . 28 PRO HG2 . 15341 1
274 . 1 1 28 28 PRO HG3 H 1 1.879 0.02 . 2 . . . . . 28 PRO HG3 . 15341 1
275 . 1 1 28 28 PRO CA C 13 63.293 0.2 . 1 . . . . . 28 PRO CA . 15341 1
276 . 1 1 28 28 PRO CB C 13 31.916 0.2 . 1 . . . . . 28 PRO CB . 15341 1
277 . 1 1 28 28 PRO CD C 13 50.895 0.2 . 1 . . . . . 28 PRO CD . 15341 1
278 . 1 1 28 28 PRO CG C 13 28.1 0.2 . 1 . . . . . 28 PRO CG . 15341 1
279 . 1 1 29 29 ARG H H 1 8.464 0.02 . 1 . . . . . 29 ARG H . 15341 1
280 . 1 1 29 29 ARG HA H 1 4.35 0.02 . 1 . . . . . 29 ARG HA . 15341 1
281 . 1 1 29 29 ARG HB2 H 1 1.56 0.02 . 2 . . . . . 29 ARG HB2 . 15341 1
282 . 1 1 29 29 ARG HB3 H 1 1.86 0.02 . 2 . . . . . 29 ARG HB3 . 15341 1
283 . 1 1 29 29 ARG HD2 H 1 2.48 0.02 . 2 . . . . . 29 ARG HD2 . 15341 1
284 . 1 1 29 29 ARG HD3 H 1 2.85 0.02 . 2 . . . . . 29 ARG HD3 . 15341 1
285 . 1 1 29 29 ARG HE H 1 8.638 0.02 . 1 . . . . . 29 ARG HE . 15341 1
286 . 1 1 29 29 ARG HG2 H 1 0.74 0.02 . 2 . . . . . 29 ARG HG2 . 15341 1
287 . 1 1 29 29 ARG HG3 H 1 0.87 0.02 . 2 . . . . . 29 ARG HG3 . 15341 1
288 . 1 1 29 29 ARG CA C 13 58.043 0.2 . 1 . . . . . 29 ARG CA . 15341 1
289 . 1 1 29 29 ARG CB C 13 30.269 0.2 . 1 . . . . . 29 ARG CB . 15341 1
290 . 1 1 29 29 ARG CD C 13 43.08 0.2 . 1 . . . . . 29 ARG CD . 15341 1
291 . 1 1 29 29 ARG CG C 13 26.5 0.2 . 1 . . . . . 29 ARG CG . 15341 1
292 . 1 1 29 29 ARG N N 15 125.844 0.2 . 1 . . . . . 29 ARG N . 15341 1
293 . 1 1 29 29 ARG NE N 15 85.26 0.2 . 1 . . . . . 29 ARG NE . 15341 1
294 . 1 1 30 30 VAL H H 1 8.472 0.02 . 1 . . . . . 30 VAL H . 15341 1
295 . 1 1 30 30 VAL HA H 1 4.54 0.02 . 1 . . . . . 30 VAL HA . 15341 1
296 . 1 1 30 30 VAL HB H 1 2.15 0.02 . 1 . . . . . 30 VAL HB . 15341 1
297 . 1 1 30 30 VAL HG11 H 1 1.08 0.02 . 2 . . . . . 30 VAL HG1 . 15341 1
298 . 1 1 30 30 VAL HG12 H 1 1.08 0.02 . 2 . . . . . 30 VAL HG1 . 15341 1
299 . 1 1 30 30 VAL HG13 H 1 1.08 0.02 . 2 . . . . . 30 VAL HG1 . 15341 1
300 . 1 1 30 30 VAL HG21 H 1 1.12 0.02 . 2 . . . . . 30 VAL HG2 . 15341 1
301 . 1 1 30 30 VAL HG22 H 1 1.12 0.02 . 2 . . . . . 30 VAL HG2 . 15341 1
302 . 1 1 30 30 VAL HG23 H 1 1.12 0.02 . 2 . . . . . 30 VAL HG2 . 15341 1
303 . 1 1 30 30 VAL CA C 13 59.5 0.2 . 1 . . . . . 30 VAL CA . 15341 1
304 . 1 1 30 30 VAL CB C 13 35.7 0.2 . 1 . . . . . 30 VAL CB . 15341 1
305 . 1 1 30 30 VAL CG1 C 13 21.3 0.2 . 2 . . . . . 30 VAL CG1 . 15341 1
306 . 1 1 30 30 VAL CG2 C 13 21.8 0.2 . 2 . . . . . 30 VAL CG2 . 15341 1
307 . 1 1 30 30 VAL N N 15 125.322 0.2 . 1 . . . . . 30 VAL N . 15341 1
308 . 1 1 31 31 TRP H H 1 8.648 0.02 . 1 . . . . . 31 TRP H . 15341 1
309 . 1 1 31 31 TRP HA H 1 4.864 0.02 . 1 . . . . . 31 TRP HA . 15341 1
310 . 1 1 31 31 TRP HB2 H 1 2.89 0.02 . 2 . . . . . 31 TRP HB2 . 15341 1
311 . 1 1 31 31 TRP HB3 H 1 2.99 0.02 . 2 . . . . . 31 TRP HB3 . 15341 1
312 . 1 1 31 31 TRP HD1 H 1 7.17 0.02 . 1 . . . . . 31 TRP HD1 . 15341 1
313 . 1 1 31 31 TRP HE1 H 1 9.996 0.02 . 1 . . . . . 31 TRP HE1 . 15341 1
314 . 1 1 31 31 TRP HE3 H 1 7.18 0.02 . 1 . . . . . 31 TRP HE3 . 15341 1
315 . 1 1 31 31 TRP HH2 H 1 7.14 0.02 . 1 . . . . . 31 TRP HH2 . 15341 1
316 . 1 1 31 31 TRP HZ2 H 1 7.43 0.02 . 1 . . . . . 31 TRP HZ2 . 15341 1
317 . 1 1 31 31 TRP HZ3 H 1 6.85 0.02 . 1 . . . . . 31 TRP HZ3 . 15341 1
318 . 1 1 31 31 TRP CA C 13 56.885 0.2 . 1 . . . . . 31 TRP CA . 15341 1
319 . 1 1 31 31 TRP CB C 13 29.922 0.2 . 1 . . . . . 31 TRP CB . 15341 1
320 . 1 1 31 31 TRP CD1 C 13 126.6 0.2 . 1 . . . . . 31 TRP CD1 . 15341 1
321 . 1 1 31 31 TRP CE3 C 13 120.2 0.2 . 1 . . . . . 31 TRP CE3 . 15341 1
322 . 1 1 31 31 TRP CH2 C 13 124.5 0.2 . 1 . . . . . 31 TRP CH2 . 15341 1
323 . 1 1 31 31 TRP CZ2 C 13 114.3 0.2 . 1 . . . . . 31 TRP CZ2 . 15341 1
324 . 1 1 31 31 TRP CZ3 C 13 122.1 0.2 . 1 . . . . . 31 TRP CZ3 . 15341 1
325 . 1 1 31 31 TRP N N 15 125.162 0.2 . 1 . . . . . 31 TRP N . 15341 1
326 . 1 1 31 31 TRP NE1 N 15 127.7 0.2 . 1 . . . . . 31 TRP NE1 . 15341 1
327 . 1 1 32 32 LEU H H 1 9.634 0.02 . 1 . . . . . 32 LEU H . 15341 1
328 . 1 1 32 32 LEU HA H 1 4.701 0.02 . 1 . . . . . 32 LEU HA . 15341 1
329 . 1 1 32 32 LEU HB2 H 1 1.563 0.02 . 2 . . . . . 32 LEU HB2 . 15341 1
330 . 1 1 32 32 LEU HB3 H 1 1.237 0.02 . 2 . . . . . 32 LEU HB3 . 15341 1
331 . 1 1 32 32 LEU HD11 H 1 0.969 0.02 . 1 . . . . . 32 LEU HD1 . 15341 1
332 . 1 1 32 32 LEU HD12 H 1 0.969 0.02 . 1 . . . . . 32 LEU HD1 . 15341 1
333 . 1 1 32 32 LEU HD13 H 1 0.969 0.02 . 1 . . . . . 32 LEU HD1 . 15341 1
334 . 1 1 32 32 LEU HD21 H 1 0.712 0.02 . 1 . . . . . 32 LEU HD2 . 15341 1
335 . 1 1 32 32 LEU HD22 H 1 0.712 0.02 . 1 . . . . . 32 LEU HD2 . 15341 1
336 . 1 1 32 32 LEU HD23 H 1 0.712 0.02 . 1 . . . . . 32 LEU HD2 . 15341 1
337 . 1 1 32 32 LEU HG H 1 1.577 0.02 . 1 . . . . . 32 LEU HG . 15341 1
338 . 1 1 32 32 LEU CA C 13 53.078 0.2 . 1 . . . . . 32 LEU CA . 15341 1
339 . 1 1 32 32 LEU CB C 13 44.467 0.2 . 1 . . . . . 32 LEU CB . 15341 1
340 . 1 1 32 32 LEU CD1 C 13 23.748 0.2 . 1 . . . . . 32 LEU CD1 . 15341 1
341 . 1 1 32 32 LEU CD2 C 13 26.643 0.2 . 1 . . . . . 32 LEU CD2 . 15341 1
342 . 1 1 32 32 LEU CG C 13 26.610 0.2 . 1 . . . . . 32 LEU CG . 15341 1
343 . 1 1 32 32 LEU N N 15 125.975 0.2 . 1 . . . . . 32 LEU N . 15341 1
344 . 1 1 33 33 GLN H H 1 8.446 0.02 . 1 . . . . . 33 GLN H . 15341 1
345 . 1 1 33 33 GLN HA H 1 5.027 0.02 . 1 . . . . . 33 GLN HA . 15341 1
346 . 1 1 33 33 GLN HB2 H 1 1.876 0.02 . 2 . . . . . 33 GLN HB2 . 15341 1
347 . 1 1 33 33 GLN HB3 H 1 1.985 0.02 . 2 . . . . . 33 GLN HB3 . 15341 1
348 . 1 1 33 33 GLN HE21 H 1 6.795 0.02 . 2 . . . . . 33 GLN HE21 . 15341 1
349 . 1 1 33 33 GLN HE22 H 1 7.534 0.02 . 2 . . . . . 33 GLN HE22 . 15341 1
350 . 1 1 33 33 GLN HG2 H 1 2.050 0.02 . 2 . . . . . 33 GLN HG2 . 15341 1
351 . 1 1 33 33 GLN HG3 H 1 2.225 0.02 . 2 . . . . . 33 GLN HG3 . 15341 1
352 . 1 1 33 33 GLN CA C 13 53.279 0.2 . 1 . . . . . 33 GLN CA . 15341 1
353 . 1 1 33 33 GLN CB C 13 30.512 0.2 . 1 . . . . . 33 GLN CB . 15341 1
354 . 1 1 33 33 GLN CG C 13 33.662 0.2 . 1 . . . . . 33 GLN CG . 15341 1
355 . 1 1 33 33 GLN N N 15 121.000 0.2 . 1 . . . . . 33 GLN N . 15341 1
356 . 1 1 33 33 GLN NE2 N 15 112.237 0.2 . 1 . . . . . 33 GLN NE2 . 15341 1
357 . 1 1 34 34 ILE H H 1 9.377 0.02 . 1 . . . . . 34 ILE H . 15341 1
358 . 1 1 34 34 ILE HA H 1 3.900 0.02 . 1 . . . . . 34 ILE HA . 15341 1
359 . 1 1 34 34 ILE HB H 1 1.666 0.02 . 1 . . . . . 34 ILE HB . 15341 1
360 . 1 1 34 34 ILE HD11 H 1 0.719 0.02 . 1 . . . . . 34 ILE HD1 . 15341 1
361 . 1 1 34 34 ILE HD12 H 1 0.719 0.02 . 1 . . . . . 34 ILE HD1 . 15341 1
362 . 1 1 34 34 ILE HD13 H 1 0.719 0.02 . 1 . . . . . 34 ILE HD1 . 15341 1
363 . 1 1 34 34 ILE HG12 H 1 0.731 0.02 . 2 . . . . . 34 ILE HG12 . 15341 1
364 . 1 1 34 34 ILE HG13 H 1 1.595 0.02 . 2 . . . . . 34 ILE HG13 . 15341 1
365 . 1 1 34 34 ILE HG21 H 1 0.629 0.02 . 1 . . . . . 34 ILE HG2 . 15341 1
366 . 1 1 34 34 ILE HG22 H 1 0.629 0.02 . 1 . . . . . 34 ILE HG2 . 15341 1
367 . 1 1 34 34 ILE HG23 H 1 0.629 0.02 . 1 . . . . . 34 ILE HG2 . 15341 1
368 . 1 1 34 34 ILE CA C 13 60.335 0.2 . 1 . . . . . 34 ILE CA . 15341 1
369 . 1 1 34 34 ILE CB C 13 38.613 0.2 . 1 . . . . . 34 ILE CB . 15341 1
370 . 1 1 34 34 ILE CD1 C 13 14.132 0.2 . 1 . . . . . 34 ILE CD1 . 15341 1
371 . 1 1 34 34 ILE CG1 C 13 28.795 0.2 . 1 . . . . . 34 ILE CG1 . 15341 1
372 . 1 1 34 34 ILE CG2 C 13 16.848 0.2 . 1 . . . . . 34 ILE CG2 . 15341 1
373 . 1 1 34 34 ILE N N 15 128.325 0.2 . 1 . . . . . 34 ILE N . 15341 1
374 . 1 1 35 35 PRO HA H 1 4.471 0.02 . 1 . . . . . 35 PRO HA . 15341 1
375 . 1 1 35 35 PRO HB2 H 1 2.348 0.02 . 2 . . . . . 35 PRO HB2 . 15341 1
376 . 1 1 35 35 PRO HB3 H 1 2.174 0.02 . 2 . . . . . 35 PRO HB3 . 15341 1
377 . 1 1 35 35 PRO HD2 H 1 4.060 0.02 . 2 . . . . . 35 PRO HD2 . 15341 1
378 . 1 1 35 35 PRO HD3 H 1 3.478 0.02 . 2 . . . . . 35 PRO HD3 . 15341 1
379 . 1 1 35 35 PRO HG2 H 1 2.114 0.02 . 2 . . . . . 35 PRO HG2 . 15341 1
380 . 1 1 35 35 PRO HG3 H 1 1.865 0.02 . 2 . . . . . 35 PRO HG3 . 15341 1
381 . 1 1 35 35 PRO CA C 13 62.744 0.2 . 1 . . . . . 35 PRO CA . 15341 1
382 . 1 1 35 35 PRO CB C 13 32.282 0.2 . 1 . . . . . 35 PRO CB . 15341 1
383 . 1 1 35 35 PRO CD C 13 51.517 0.2 . 1 . . . . . 35 PRO CD . 15341 1
384 . 1 1 35 35 PRO CG C 13 27.641 0.2 . 1 . . . . . 35 PRO CG . 15341 1
385 . 1 1 36 36 GLU H H 1 8.971 0.02 . 1 . . . . . 36 GLU H . 15341 1
386 . 1 1 36 36 GLU HA H 1 3.918 0.02 . 1 . . . . . 36 GLU HA . 15341 1
387 . 1 1 36 36 GLU HB2 H 1 2.016 0.02 . 2 . . . . . 36 GLU HB2 . 15341 1
388 . 1 1 36 36 GLU HB3 H 1 2.016 0.02 . 2 . . . . . 36 GLU HB3 . 15341 1
389 . 1 1 36 36 GLU HG2 H 1 2.29 0.02 . 2 . . . . . 36 GLU HG2 . 15341 1
390 . 1 1 36 36 GLU HG3 H 1 2.35 0.02 . 2 . . . . . 36 GLU HG3 . 15341 1
391 . 1 1 36 36 GLU CA C 13 59.030 0.2 . 1 . . . . . 36 GLU CA . 15341 1
392 . 1 1 36 36 GLU CB C 13 29.791 0.2 . 1 . . . . . 36 GLU CB . 15341 1
393 . 1 1 36 36 GLU CG C 13 36.28 0.2 . 1 . . . . . 36 GLU CG . 15341 1
394 . 1 1 36 36 GLU N N 15 124.755 0.2 . 1 . . . . . 36 GLU N . 15341 1
395 . 1 1 37 37 ASP H H 1 8.657 0.02 . 1 . . . . . 37 ASP H . 15341 1
396 . 1 1 37 37 ASP HA H 1 4.421 0.02 . 1 . . . . . 37 ASP HA . 15341 1
397 . 1 1 37 37 ASP HB2 H 1 2.717 0.02 . 2 . . . . . 37 ASP HB2 . 15341 1
398 . 1 1 37 37 ASP HB3 H 1 2.717 0.02 . 2 . . . . . 37 ASP HB3 . 15341 1
399 . 1 1 37 37 ASP CA C 13 55.552 0.2 . 1 . . . . . 37 ASP CA . 15341 1
400 . 1 1 37 37 ASP CB C 13 39.824 0.2 . 1 . . . . . 37 ASP CB . 15341 1
401 . 1 1 37 37 ASP N N 15 114.541 0.2 . 1 . . . . . 37 ASP N . 15341 1
402 . 1 1 38 38 THR H H 1 7.498 0.02 . 1 . . . . . 38 THR H . 15341 1
403 . 1 1 38 38 THR HA H 1 4.415 0.02 . 1 . . . . . 38 THR HA . 15341 1
404 . 1 1 38 38 THR HB H 1 3.945 0.02 . 1 . . . . . 38 THR HB . 15341 1
405 . 1 1 38 38 THR HG21 H 1 0.978 0.02 . 1 . . . . . 38 THR HG2 . 15341 1
406 . 1 1 38 38 THR HG22 H 1 0.978 0.02 . 1 . . . . . 38 THR HG2 . 15341 1
407 . 1 1 38 38 THR HG23 H 1 0.978 0.02 . 1 . . . . . 38 THR HG2 . 15341 1
408 . 1 1 38 38 THR CA C 13 62.748 0.2 . 1 . . . . . 38 THR CA . 15341 1
409 . 1 1 38 38 THR CB C 13 69.280 0.2 . 1 . . . . . 38 THR CB . 15341 1
410 . 1 1 38 38 THR CG2 C 13 21.869 0.2 . 1 . . . . . 38 THR CG2 . 15341 1
411 . 1 1 38 38 THR N N 15 109.405 0.2 . 1 . . . . . 38 THR N . 15341 1
412 . 1 1 39 39 GLY H H 1 7.967 0.02 . 1 . . . . . 39 GLY H . 15341 1
413 . 1 1 39 39 GLY HA2 H 1 4.446 0.02 . 2 . . . . . 39 GLY HA2 . 15341 1
414 . 1 1 39 39 GLY HA3 H 1 3.619 0.02 . 2 . . . . . 39 GLY HA3 . 15341 1
415 . 1 1 39 39 GLY CA C 13 46.428 0.2 . 1 . . . . . 39 GLY CA . 15341 1
416 . 1 1 39 39 GLY N N 15 108.005 0.2 . 1 . . . . . 39 GLY N . 15341 1
417 . 1 1 40 40 TRP H H 1 7.442 0.02 . 1 . . . . . 40 TRP H . 15341 1
418 . 1 1 40 40 TRP HA H 1 5.960 0.02 . 1 . . . . . 40 TRP HA . 15341 1
419 . 1 1 40 40 TRP HB2 H 1 3.028 0.02 . 2 . . . . . 40 TRP HB2 . 15341 1
420 . 1 1 40 40 TRP HB3 H 1 3.148 0.02 . 2 . . . . . 40 TRP HB3 . 15341 1
421 . 1 1 40 40 TRP HD1 H 1 7.07 0.02 . 1 . . . . . 40 TRP HD1 . 15341 1
422 . 1 1 40 40 TRP HE1 H 1 10.39 0.02 . 1 . . . . . 40 TRP HE1 . 15341 1
423 . 1 1 40 40 TRP HE3 H 1 7.125 0.02 . 1 . . . . . 40 TRP HE3 . 15341 1
424 . 1 1 40 40 TRP HH2 H 1 7.21 0.02 . 1 . . . . . 40 TRP HH2 . 15341 1
425 . 1 1 40 40 TRP HZ2 H 1 7.49 0.02 . 1 . . . . . 40 TRP HZ2 . 15341 1
426 . 1 1 40 40 TRP HZ3 H 1 7.03 0.02 . 1 . . . . . 40 TRP HZ3 . 15341 1
427 . 1 1 40 40 TRP CA C 13 54.581 0.2 . 1 . . . . . 40 TRP CA . 15341 1
428 . 1 1 40 40 TRP CB C 13 33.231 0.2 . 1 . . . . . 40 TRP CB . 15341 1
429 . 1 1 40 40 TRP CD1 C 13 128 0.2 . 1 . . . . . 40 TRP CD1 . 15341 1
430 . 1 1 40 40 TRP CE3 C 13 119.6 0.2 . 1 . . . . . 40 TRP CE3 . 15341 1
431 . 1 1 40 40 TRP CH2 C 13 124.5 0.2 . 1 . . . . . 40 TRP CH2 . 15341 1
432 . 1 1 40 40 TRP CZ2 C 13 114.9 0.2 . 1 . . . . . 40 TRP CZ2 . 15341 1
433 . 1 1 40 40 TRP CZ3 C 13 122.1 0.2 . 1 . . . . . 40 TRP CZ3 . 15341 1
434 . 1 1 40 40 TRP N N 15 114.404 0.2 . 1 . . . . . 40 TRP N . 15341 1
435 . 1 1 40 40 TRP NE1 N 15 130.2 0.2 . 1 . . . . . 40 TRP NE1 . 15341 1
436 . 1 1 41 41 VAL H H 1 9.317 0.02 . 1 . . . . . 41 VAL H . 15341 1
437 . 1 1 41 41 VAL HA H 1 4.26 0.02 . 1 . . . . . 41 VAL HA . 15341 1
438 . 1 1 41 41 VAL HB H 1 1.99 0.02 . 1 . . . . . 41 VAL HB . 15341 1
439 . 1 1 41 41 VAL HG11 H 1 1.15 0.02 . 2 . . . . . 41 VAL HG1 . 15341 1
440 . 1 1 41 41 VAL HG12 H 1 1.15 0.02 . 2 . . . . . 41 VAL HG1 . 15341 1
441 . 1 1 41 41 VAL HG13 H 1 1.15 0.02 . 2 . . . . . 41 VAL HG1 . 15341 1
442 . 1 1 41 41 VAL HG21 H 1 0.82 0.02 . 2 . . . . . 41 VAL HG2 . 15341 1
443 . 1 1 41 41 VAL HG22 H 1 0.82 0.02 . 2 . . . . . 41 VAL HG2 . 15341 1
444 . 1 1 41 41 VAL HG23 H 1 0.82 0.02 . 2 . . . . . 41 VAL HG2 . 15341 1
445 . 1 1 41 41 VAL CA C 13 60.9 0.2 . 1 . . . . . 41 VAL CA . 15341 1
446 . 1 1 41 41 VAL CB C 13 36.4 0.2 . 1 . . . . . 41 VAL CB . 15341 1
447 . 1 1 41 41 VAL CG1 C 13 22.1 0.2 . 2 . . . . . 41 VAL CG1 . 15341 1
448 . 1 1 41 41 VAL CG2 C 13 21.75 0.2 . 2 . . . . . 41 VAL CG2 . 15341 1
449 . 1 1 41 41 VAL N N 15 119.203 0.2 . 1 . . . . . 41 VAL N . 15341 1
450 . 1 1 42 42 GLU H H 1 8.635 0.02 . 1 . . . . . 42 GLU H . 15341 1
451 . 1 1 42 42 GLU HA H 1 5.559 0.02 . 1 . . . . . 42 GLU HA . 15341 1
452 . 1 1 42 42 GLU HB2 H 1 2.009 0.02 . 2 . . . . . 42 GLU HB2 . 15341 1
453 . 1 1 42 42 GLU HB3 H 1 1.970 0.02 . 2 . . . . . 42 GLU HB3 . 15341 1
454 . 1 1 42 42 GLU HG2 H 1 2.240 0.02 . 2 . . . . . 42 GLU HG2 . 15341 1
455 . 1 1 42 42 GLU HG3 H 1 2.256 0.02 . 2 . . . . . 42 GLU HG3 . 15341 1
456 . 1 1 42 42 GLU CA C 13 53.676 0.2 . 1 . . . . . 42 GLU CA . 15341 1
457 . 1 1 42 42 GLU CB C 13 32.534 0.2 . 1 . . . . . 42 GLU CB . 15341 1
458 . 1 1 42 42 GLU CG C 13 36.259 0.2 . 1 . . . . . 42 GLU CG . 15341 1
459 . 1 1 42 42 GLU N N 15 125.457 0.2 . 1 . . . . . 42 GLU N . 15341 1
460 . 1 1 43 43 CYS H H 1 9.018 0.02 . 1 . . . . . 43 CYS H . 15341 1
461 . 1 1 43 43 CYS HA H 1 4.71 0.02 . 1 . . . . . 43 CYS HA . 15341 1
462 . 1 1 43 43 CYS HB2 H 1 2.96 0.02 . 2 . . . . . 43 CYS HB2 . 15341 1
463 . 1 1 43 43 CYS HB3 H 1 3.36 0.02 . 2 . . . . . 43 CYS HB3 . 15341 1
464 . 1 1 43 43 CYS CA C 13 56.955 0.2 . 1 . . . . . 43 CYS CA . 15341 1
465 . 1 1 43 43 CYS CB C 13 31.65 0.2 . 1 . . . . . 43 CYS CB . 15341 1
466 . 1 1 43 43 CYS N N 15 127.165 0.2 . 1 . . . . . 43 CYS N . 15341 1
467 . 1 1 44 44 PRO HA H 1 4.455 0.02 . 1 . . . . . 44 PRO HA . 15341 1
468 . 1 1 44 44 PRO HB2 H 1 1.427 0.02 . 2 . . . . . 44 PRO HB2 . 15341 1
469 . 1 1 44 44 PRO HB3 H 1 2.151 0.02 . 2 . . . . . 44 PRO HB3 . 15341 1
470 . 1 1 44 44 PRO HD2 H 1 4.163 0.02 . 2 . . . . . 44 PRO HD2 . 15341 1
471 . 1 1 44 44 PRO HD3 H 1 3.958 0.02 . 2 . . . . . 44 PRO HD3 . 15341 1
472 . 1 1 44 44 PRO HG2 H 1 1.479 0.02 . 2 . . . . . 44 PRO HG2 . 15341 1
473 . 1 1 44 44 PRO HG3 H 1 1.948 0.02 . 2 . . . . . 44 PRO HG3 . 15341 1
474 . 1 1 44 44 PRO CA C 13 64.002 0.2 . 1 . . . . . 44 PRO CA . 15341 1
475 . 1 1 44 44 PRO CB C 13 31.979 0.2 . 1 . . . . . 44 PRO CB . 15341 1
476 . 1 1 44 44 PRO CD C 13 51.526 0.2 . 1 . . . . . 44 PRO CD . 15341 1
477 . 1 1 44 44 PRO CG C 13 26.360 0.2 . 1 . . . . . 44 PRO CG . 15341 1
478 . 1 1 45 45 TYR H H 1 9.205 0.02 . 1 . . . . . 45 TYR H . 15341 1
479 . 1 1 45 45 TYR HA H 1 4.477 0.02 . 1 . . . . . 45 TYR HA . 15341 1
480 . 1 1 45 45 TYR HB2 H 1 2.517 0.02 . 2 . . . . . 45 TYR HB2 . 15341 1
481 . 1 1 45 45 TYR HB3 H 1 1.602 0.02 . 2 . . . . . 45 TYR HB3 . 15341 1
482 . 1 1 45 45 TYR HD1 H 1 6.78 0.02 . 1 . . . . . 45 TYR HD1 . 15341 1
483 . 1 1 45 45 TYR HD2 H 1 6.78 0.02 . 1 . . . . . 45 TYR HD2 . 15341 1
484 . 1 1 45 45 TYR HE1 H 1 6.79 0.02 . 1 . . . . . 45 TYR HE1 . 15341 1
485 . 1 1 45 45 TYR HE2 H 1 6.79 0.02 . 1 . . . . . 45 TYR HE2 . 15341 1
486 . 1 1 45 45 TYR CA C 13 59.357 0.2 . 1 . . . . . 45 TYR CA . 15341 1
487 . 1 1 45 45 TYR CB C 13 38.009 0.2 . 1 . . . . . 45 TYR CB . 15341 1
488 . 1 1 45 45 TYR CD1 C 13 132.4 0.2 . 1 . . . . . 45 TYR CD1 . 15341 1
489 . 1 1 45 45 TYR CD2 C 13 132.4 0.2 . 1 . . . . . 45 TYR CD2 . 15341 1
490 . 1 1 45 45 TYR CE1 C 13 118.2 0.2 . 1 . . . . . 45 TYR CE1 . 15341 1
491 . 1 1 45 45 TYR CE2 C 13 118.2 0.2 . 1 . . . . . 45 TYR CE2 . 15341 1
492 . 1 1 45 45 TYR N N 15 120.751 0.2 . 1 . . . . . 45 TYR N . 15341 1
493 . 1 1 46 46 CYS H H 1 8.097 0.02 . 1 . . . . . 46 CYS H . 15341 1
494 . 1 1 46 46 CYS HA H 1 5.092 0.02 . 1 . . . . . 46 CYS HA . 15341 1
495 . 1 1 46 46 CYS HB2 H 1 3.409 0.02 . 2 . . . . . 46 CYS HB2 . 15341 1
496 . 1 1 46 46 CYS HB3 H 1 3.135 0.02 . 2 . . . . . 46 CYS HB3 . 15341 1
497 . 1 1 46 46 CYS CA C 13 58.497 0.2 . 1 . . . . . 46 CYS CA . 15341 1
498 . 1 1 46 46 CYS CB C 13 32.055 0.2 . 1 . . . . . 46 CYS CB . 15341 1
499 . 1 1 46 46 CYS N N 15 117.233 0.2 . 1 . . . . . 46 CYS N . 15341 1
500 . 1 1 47 47 ASP H H 1 7.967 0.02 . 1 . . . . . 47 ASP H . 15341 1
501 . 1 1 47 47 ASP HA H 1 4.629 0.02 . 1 . . . . . 47 ASP HA . 15341 1
502 . 1 1 47 47 ASP HB2 H 1 2.964 0.02 . 2 . . . . . 47 ASP HB2 . 15341 1
503 . 1 1 47 47 ASP HB3 H 1 2.991 0.02 . 2 . . . . . 47 ASP HB3 . 15341 1
504 . 1 1 47 47 ASP CA C 13 56.076 0.2 . 1 . . . . . 47 ASP CA . 15341 1
505 . 1 1 47 47 ASP CB C 13 39.369 0.2 . 1 . . . . . 47 ASP CB . 15341 1
506 . 1 1 47 47 ASP N N 15 118.439 0.2 . 1 . . . . . 47 ASP N . 15341 1
507 . 1 1 48 48 CYS H H 1 8.364 0.02 . 1 . . . . . 48 CYS H . 15341 1
508 . 1 1 48 48 CYS HA H 1 4.175 0.02 . 1 . . . . . 48 CYS HA . 15341 1
509 . 1 1 48 48 CYS HB2 H 1 2.985 0.02 . 2 . . . . . 48 CYS HB2 . 15341 1
510 . 1 1 48 48 CYS HB3 H 1 2.608 0.02 . 2 . . . . . 48 CYS HB3 . 15341 1
511 . 1 1 48 48 CYS CA C 13 61.629 0.2 . 1 . . . . . 48 CYS CA . 15341 1
512 . 1 1 48 48 CYS CB C 13 28.528 0.2 . 1 . . . . . 48 CYS CB . 15341 1
513 . 1 1 48 48 CYS N N 15 121.540 0.2 . 1 . . . . . 48 CYS N . 15341 1
514 . 1 1 49 49 LYS H H 1 8.542 0.02 . 1 . . . . . 49 LYS H . 15341 1
515 . 1 1 49 49 LYS HA H 1 4.956 0.02 . 1 . . . . . 49 LYS HA . 15341 1
516 . 1 1 49 49 LYS HB2 H 1 1.865 0.02 . 2 . . . . . 49 LYS HB2 . 15341 1
517 . 1 1 49 49 LYS HB3 H 1 1.780 0.02 . 2 . . . . . 49 LYS HB3 . 15341 1
518 . 1 1 49 49 LYS HD2 H 1 1.280 0.02 . 2 . . . . . 49 LYS HD2 . 15341 1
519 . 1 1 49 49 LYS HD3 H 1 1.280 0.02 . 2 . . . . . 49 LYS HD3 . 15341 1
520 . 1 1 49 49 LYS HE2 H 1 2.30 0.02 . 2 . . . . . 49 LYS HE2 . 15341 1
521 . 1 1 49 49 LYS HE3 H 1 2.30 0.02 . 2 . . . . . 49 LYS HE3 . 15341 1
522 . 1 1 49 49 LYS HG2 H 1 1.229 0.02 . 2 . . . . . 49 LYS HG2 . 15341 1
523 . 1 1 49 49 LYS HG3 H 1 1.393 0.02 . 2 . . . . . 49 LYS HG3 . 15341 1
524 . 1 1 49 49 LYS CA C 13 55.388 0.2 . 1 . . . . . 49 LYS CA . 15341 1
525 . 1 1 49 49 LYS CB C 13 34.179 0.2 . 1 . . . . . 49 LYS CB . 15341 1
526 . 1 1 49 49 LYS CD C 13 29.369 0.2 . 1 . . . . . 49 LYS CD . 15341 1
527 . 1 1 49 49 LYS CE C 13 41.488 0.2 . 1 . . . . . 49 LYS CE . 15341 1
528 . 1 1 49 49 LYS CG C 13 25.986 0.2 . 1 . . . . . 49 LYS CG . 15341 1
529 . 1 1 49 49 LYS N N 15 129.258 0.2 . 1 . . . . . 49 LYS N . 15341 1
530 . 1 1 50 50 TYR H H 1 9.32 0.02 . 1 . . . . . 50 TYR H . 15341 1
531 . 1 1 50 50 TYR HA H 1 5.264 0.02 . 1 . . . . . 50 TYR HA . 15341 1
532 . 1 1 50 50 TYR HB2 H 1 2.67 0.02 . 2 . . . . . 50 TYR HB2 . 15341 1
533 . 1 1 50 50 TYR HB3 H 1 2.782 0.02 . 2 . . . . . 50 TYR HB3 . 15341 1
534 . 1 1 50 50 TYR HD1 H 1 6.897 0.02 . 1 . . . . . 50 TYR HD1 . 15341 1
535 . 1 1 50 50 TYR HD2 H 1 6.897 0.02 . 1 . . . . . 50 TYR HD2 . 15341 1
536 . 1 1 50 50 TYR HE1 H 1 6.67 0.02 . 1 . . . . . 50 TYR HE1 . 15341 1
537 . 1 1 50 50 TYR HE2 H 1 6.67 0.02 . 1 . . . . . 50 TYR HE2 . 15341 1
538 . 1 1 50 50 TYR CA C 13 57.636 0.2 . 1 . . . . . 50 TYR CA . 15341 1
539 . 1 1 50 50 TYR CB C 13 40.412 0.2 . 1 . . . . . 50 TYR CB . 15341 1
540 . 1 1 50 50 TYR CD1 C 13 133.4 0.2 . 1 . . . . . 50 TYR CD1 . 15341 1
541 . 1 1 50 50 TYR CD2 C 13 133.4 0.2 . 1 . . . . . 50 TYR CD2 . 15341 1
542 . 1 1 50 50 TYR CE1 C 13 117.1 0.2 . 1 . . . . . 50 TYR CE1 . 15341 1
543 . 1 1 50 50 TYR CE2 C 13 117.1 0.2 . 1 . . . . . 50 TYR CE2 . 15341 1
544 . 1 1 50 50 TYR N N 15 125.926 0.2 . 1 . . . . . 50 TYR N . 15341 1
545 . 1 1 51 51 VAL H H 1 8.925 0.02 . 1 . . . . . 51 VAL H . 15341 1
546 . 1 1 51 51 VAL HA H 1 4.824 0.02 . 1 . . . . . 51 VAL HA . 15341 1
547 . 1 1 51 51 VAL HB H 1 1.799 0.02 . 1 . . . . . 51 VAL HB . 15341 1
548 . 1 1 51 51 VAL HG11 H 1 0.771 0.02 . 1 . . . . . 51 VAL HG1 . 15341 1
549 . 1 1 51 51 VAL HG12 H 1 0.771 0.02 . 1 . . . . . 51 VAL HG1 . 15341 1
550 . 1 1 51 51 VAL HG13 H 1 0.771 0.02 . 1 . . . . . 51 VAL HG1 . 15341 1
551 . 1 1 51 51 VAL HG21 H 1 0.813 0.02 . 1 . . . . . 51 VAL HG2 . 15341 1
552 . 1 1 51 51 VAL HG22 H 1 0.813 0.02 . 1 . . . . . 51 VAL HG2 . 15341 1
553 . 1 1 51 51 VAL HG23 H 1 0.813 0.02 . 1 . . . . . 51 VAL HG2 . 15341 1
554 . 1 1 51 51 VAL CA C 13 59.968 0.2 . 1 . . . . . 51 VAL CA . 15341 1
555 . 1 1 51 51 VAL CB C 13 35.624 0.2 . 1 . . . . . 51 VAL CB . 15341 1
556 . 1 1 51 51 VAL CG1 C 13 21.0 0.2 . 1 . . . . . 51 VAL CG1 . 15341 1
557 . 1 1 51 51 VAL CG2 C 13 21.9 0.2 . 1 . . . . . 51 VAL CG2 . 15341 1
558 . 1 1 51 51 VAL N N 15 122.631 0.2 . 1 . . . . . 51 VAL N . 15341 1
559 . 1 1 52 52 LEU H H 1 8.771 0.02 . 1 . . . . . 52 LEU H . 15341 1
560 . 1 1 52 52 LEU HA H 1 4.496 0.02 . 1 . . . . . 52 LEU HA . 15341 1
561 . 1 1 52 52 LEU HB2 H 1 1.212 0.02 . 2 . . . . . 52 LEU HB2 . 15341 1
562 . 1 1 52 52 LEU HB3 H 1 1.774 0.02 . 2 . . . . . 52 LEU HB3 . 15341 1
563 . 1 1 52 52 LEU HD11 H 1 0.682 0.02 . 1 . . . . . 52 LEU HD1 . 15341 1
564 . 1 1 52 52 LEU HD12 H 1 0.682 0.02 . 1 . . . . . 52 LEU HD1 . 15341 1
565 . 1 1 52 52 LEU HD13 H 1 0.682 0.02 . 1 . . . . . 52 LEU HD1 . 15341 1
566 . 1 1 52 52 LEU HD21 H 1 0.820 0.02 . 1 . . . . . 52 LEU HD2 . 15341 1
567 . 1 1 52 52 LEU HD22 H 1 0.820 0.02 . 1 . . . . . 52 LEU HD2 . 15341 1
568 . 1 1 52 52 LEU HD23 H 1 0.820 0.02 . 1 . . . . . 52 LEU HD2 . 15341 1
569 . 1 1 52 52 LEU HG H 1 1.567 0.02 . 1 . . . . . 52 LEU HG . 15341 1
570 . 1 1 52 52 LEU CA C 13 54.163 0.2 . 1 . . . . . 52 LEU CA . 15341 1
571 . 1 1 52 52 LEU CB C 13 43.220 0.2 . 1 . . . . . 52 LEU CB . 15341 1
572 . 1 1 52 52 LEU CD1 C 13 23.057 0.2 . 1 . . . . . 52 LEU CD1 . 15341 1
573 . 1 1 52 52 LEU CD2 C 13 26.17 0.2 . 1 . . . . . 52 LEU CD2 . 15341 1
574 . 1 1 52 52 LEU CG C 13 26.212 0.2 . 1 . . . . . 52 LEU CG . 15341 1
575 . 1 1 52 52 LEU N N 15 127.249 0.2 . 1 . . . . . 52 LEU N . 15341 1
576 . 1 1 53 53 LYS H H 1 9.317 0.02 . 1 . . . . . 53 LYS H . 15341 1
577 . 1 1 53 53 LYS HA H 1 4.028 0.02 . 1 . . . . . 53 LYS HA . 15341 1
578 . 1 1 53 53 LYS HB2 H 1 1.628 0.02 . 2 . . . . . 53 LYS HB2 . 15341 1
579 . 1 1 53 53 LYS HB3 H 1 1.739 0.02 . 2 . . . . . 53 LYS HB3 . 15341 1
580 . 1 1 53 53 LYS HD2 H 1 1.267 0.02 . 2 . . . . . 53 LYS HD2 . 15341 1
581 . 1 1 53 53 LYS HD3 H 1 1.267 0.02 . 2 . . . . . 53 LYS HD3 . 15341 1
582 . 1 1 53 53 LYS HE2 H 1 2.92 0.02 . 2 . . . . . 53 LYS HE2 . 15341 1
583 . 1 1 53 53 LYS HE3 H 1 2.92 0.02 . 2 . . . . . 53 LYS HE3 . 15341 1
584 . 1 1 53 53 LYS HG2 H 1 1.32 0.02 . 2 . . . . . 53 LYS HG2 . 15341 1
585 . 1 1 53 53 LYS HG3 H 1 1.39 0.02 . 2 . . . . . 53 LYS HG3 . 15341 1
586 . 1 1 53 53 LYS CA C 13 57.885 0.2 . 1 . . . . . 53 LYS CA . 15341 1
587 . 1 1 53 53 LYS CB C 13 32.819 0.2 . 1 . . . . . 53 LYS CB . 15341 1
588 . 1 1 53 53 LYS CD C 13 29.391 0.2 . 1 . . . . . 53 LYS CD . 15341 1
589 . 1 1 53 53 LYS CE C 13 41.944 0.2 . 1 . . . . . 53 LYS CE . 15341 1
590 . 1 1 53 53 LYS CG C 13 24.359 0.2 . 1 . . . . . 53 LYS CG . 15341 1
591 . 1 1 53 53 LYS N N 15 132.446 0.2 . 1 . . . . . 53 LYS N . 15341 1
592 . 1 1 54 54 GLY H H 1 10.642 0.02 . 1 . . . . . 54 GLY H . 15341 1
593 . 1 1 54 54 GLY HA2 H 1 4.195 0.02 . 2 . . . . . 54 GLY HA2 . 15341 1
594 . 1 1 54 54 GLY HA3 H 1 3.817 0.02 . 2 . . . . . 54 GLY HA3 . 15341 1
595 . 1 1 54 54 GLY CA C 13 45.390 0.2 . 1 . . . . . 54 GLY CA . 15341 1
596 . 1 1 54 54 GLY N N 15 117.440 0.2 . 1 . . . . . 54 GLY N . 15341 1
597 . 1 1 55 55 SER H H 1 7.996 0.02 . 1 . . . . . 55 SER H . 15341 1
598 . 1 1 55 55 SER HA H 1 4.623 0.02 . 1 . . . . . 55 SER HA . 15341 1
599 . 1 1 55 55 SER HB2 H 1 4.405 0.02 . 2 . . . . . 55 SER HB2 . 15341 1
600 . 1 1 55 55 SER HB3 H 1 3.883 0.02 . 2 . . . . . 55 SER HB3 . 15341 1
601 . 1 1 55 55 SER CA C 13 58.553 0.2 . 1 . . . . . 55 SER CA . 15341 1
602 . 1 1 55 55 SER CB C 13 66.037 0.2 . 1 . . . . . 55 SER CB . 15341 1
603 . 1 1 55 55 SER N N 15 115.895 0.2 . 1 . . . . . 55 SER N . 15341 1
604 . 1 1 56 56 LYS H H 1 9.018 0.02 . 1 . . . . . 56 LYS H . 15341 1
605 . 1 1 56 56 LYS HA H 1 4.115 0.02 . 1 . . . . . 56 LYS HA . 15341 1
606 . 1 1 56 56 LYS HB2 H 1 1.869 0.02 . 2 . . . . . 56 LYS HB2 . 15341 1
607 . 1 1 56 56 LYS HB3 H 1 1.869 0.02 . 2 . . . . . 56 LYS HB3 . 15341 1
608 . 1 1 56 56 LYS HD2 H 1 1.869 0.02 . 2 . . . . . 56 LYS HD2 . 15341 1
609 . 1 1 56 56 LYS HD3 H 1 1.869 0.02 . 2 . . . . . 56 LYS HD3 . 15341 1
610 . 1 1 56 56 LYS HE2 H 1 3.04 0.02 . 2 . . . . . 56 LYS HE2 . 15341 1
611 . 1 1 56 56 LYS HE3 H 1 3.04 0.02 . 2 . . . . . 56 LYS HE3 . 15341 1
612 . 1 1 56 56 LYS HG2 H 1 1.495 0.02 . 2 . . . . . 56 LYS HG2 . 15341 1
613 . 1 1 56 56 LYS HG3 H 1 1.535 0.02 . 2 . . . . . 56 LYS HG3 . 15341 1
614 . 1 1 56 56 LYS CA C 13 58.716 0.2 . 1 . . . . . 56 LYS CA . 15341 1
615 . 1 1 56 56 LYS CB C 13 32.311 0.2 . 1 . . . . . 56 LYS CB . 15341 1
616 . 1 1 56 56 LYS CD C 13 29.14 0.2 . 1 . . . . . 56 LYS CD . 15341 1
617 . 1 1 56 56 LYS CE C 13 41.96 0.2 . 1 . . . . . 56 LYS CE . 15341 1
618 . 1 1 56 56 LYS CG C 13 24.77 0.2 . 1 . . . . . 56 LYS CG . 15341 1
619 . 1 1 56 56 LYS N N 15 120.334 0.2 . 1 . . . . . 56 LYS N . 15341 1
620 . 1 1 57 57 ALA H H 1 7.590 0.02 . 1 . . . . . 57 ALA H . 15341 1
621 . 1 1 57 57 ALA HA H 1 4.318 0.02 . 1 . . . . . 57 ALA HA . 15341 1
622 . 1 1 57 57 ALA HB1 H 1 1.626 0.02 . 1 . . . . . 57 ALA HB . 15341 1
623 . 1 1 57 57 ALA HB2 H 1 1.626 0.02 . 1 . . . . . 57 ALA HB . 15341 1
624 . 1 1 57 57 ALA HB3 H 1 1.626 0.02 . 1 . . . . . 57 ALA HB . 15341 1
625 . 1 1 57 57 ALA CA C 13 53.124 0.2 . 1 . . . . . 57 ALA CA . 15341 1
626 . 1 1 57 57 ALA CB C 13 20.015 0.2 . 1 . . . . . 57 ALA CB . 15341 1
627 . 1 1 57 57 ALA N N 15 119.501 0.2 . 1 . . . . . 57 ALA N . 15341 1
628 . 1 1 58 58 ASP H H 1 7.588 0.02 . 1 . . . . . 58 ASP H . 15341 1
629 . 1 1 58 58 ASP HA H 1 4.441 0.02 . 1 . . . . . 58 ASP HA . 15341 1
630 . 1 1 58 58 ASP HB2 H 1 3.007 0.02 . 2 . . . . . 58 ASP HB2 . 15341 1
631 . 1 1 58 58 ASP HB3 H 1 2.652 0.02 . 2 . . . . . 58 ASP HB3 . 15341 1
632 . 1 1 58 58 ASP CA C 13 54.193 0.2 . 1 . . . . . 58 ASP CA . 15341 1
633 . 1 1 58 58 ASP CB C 13 41.066 0.2 . 1 . . . . . 58 ASP CB . 15341 1
634 . 1 1 58 58 ASP N N 15 120.195 0.2 . 1 . . . . . 58 ASP N . 15341 1
635 . 1 1 59 59 ALA H H 1 7.840 0.02 . 1 . . . . . 59 ALA H . 15341 1
636 . 1 1 59 59 ALA HA H 1 4.188 0.02 . 1 . . . . . 59 ALA HA . 15341 1
637 . 1 1 59 59 ALA HB1 H 1 1.369 0.02 . 1 . . . . . 59 ALA HB . 15341 1
638 . 1 1 59 59 ALA HB2 H 1 1.369 0.02 . 1 . . . . . 59 ALA HB . 15341 1
639 . 1 1 59 59 ALA HB3 H 1 1.369 0.02 . 1 . . . . . 59 ALA HB . 15341 1
640 . 1 1 59 59 ALA CA C 13 53.326 0.2 . 1 . . . . . 59 ALA CA . 15341 1
641 . 1 1 59 59 ALA CB C 13 19.094 0.2 . 1 . . . . . 59 ALA CB . 15341 1
642 . 1 1 59 59 ALA N N 15 124.358 0.2 . 1 . . . . . 59 ALA N . 15341 1
643 . 1 1 60 60 LEU H H 1 8.078 0.02 . 1 . . . . . 60 LEU H . 15341 1
644 . 1 1 60 60 LEU HA H 1 4.10 0.02 . 1 . . . . . 60 LEU HA . 15341 1
645 . 1 1 60 60 LEU HB2 H 1 1.670 0.02 . 2 . . . . . 60 LEU HB2 . 15341 1
646 . 1 1 60 60 LEU HB3 H 1 1.488 0.02 . 2 . . . . . 60 LEU HB3 . 15341 1
647 . 1 1 60 60 LEU HD11 H 1 0.82 0.02 . 1 . . . . . 60 LEU HD1 . 15341 1
648 . 1 1 60 60 LEU HD12 H 1 0.82 0.02 . 1 . . . . . 60 LEU HD1 . 15341 1
649 . 1 1 60 60 LEU HD13 H 1 0.82 0.02 . 1 . . . . . 60 LEU HD1 . 15341 1
650 . 1 1 60 60 LEU HD21 H 1 0.86 0.02 . 1 . . . . . 60 LEU HD2 . 15341 1
651 . 1 1 60 60 LEU HD22 H 1 0.86 0.02 . 1 . . . . . 60 LEU HD2 . 15341 1
652 . 1 1 60 60 LEU HD23 H 1 0.86 0.02 . 1 . . . . . 60 LEU HD2 . 15341 1
653 . 1 1 60 60 LEU HG H 1 1.613 0.02 . 1 . . . . . 60 LEU HG . 15341 1
654 . 1 1 60 60 LEU CA C 13 56.210 0.2 . 1 . . . . . 60 LEU CA . 15341 1
655 . 1 1 60 60 LEU CB C 13 41.973 0.2 . 1 . . . . . 60 LEU CB . 15341 1
656 . 1 1 60 60 LEU CD1 C 13 23.386 0.2 . 1 . . . . . 60 LEU CD1 . 15341 1
657 . 1 1 60 60 LEU CD2 C 13 24.760 0.2 . 1 . . . . . 60 LEU CD2 . 15341 1
658 . 1 1 60 60 LEU CG C 13 26.962 0.2 . 1 . . . . . 60 LEU CG . 15341 1
659 . 1 1 60 60 LEU N N 15 119.688 0.2 . 1 . . . . . 60 LEU N . 15341 1
660 . 1 1 61 61 GLU H H 1 8.042 0.02 . 1 . . . . . 61 GLU H . 15341 1
661 . 1 1 61 61 GLU HA H 1 4.072 0.02 . 1 . . . . . 61 GLU HA . 15341 1
662 . 1 1 61 61 GLU HB2 H 1 1.900 0.02 . 2 . . . . . 61 GLU HB2 . 15341 1
663 . 1 1 61 61 GLU HB3 H 1 1.900 0.02 . 2 . . . . . 61 GLU HB3 . 15341 1
664 . 1 1 61 61 GLU HG2 H 1 2.13 0.02 . 2 . . . . . 61 GLU HG2 . 15341 1
665 . 1 1 61 61 GLU HG3 H 1 2.13 0.02 . 2 . . . . . 61 GLU HG3 . 15341 1
666 . 1 1 61 61 GLU CA C 13 56.896 0.2 . 1 . . . . . 61 GLU CA . 15341 1
667 . 1 1 61 61 GLU CB C 13 29.776 0.2 . 1 . . . . . 61 GLU CB . 15341 1
668 . 1 1 61 61 GLU CG C 13 35.83 0.2 . 1 . . . . . 61 GLU CG . 15341 1
669 . 1 1 61 61 GLU N N 15 119.804 0.2 . 1 . . . . . 61 GLU N . 15341 1
670 . 1 1 62 62 HIS H H 1 8.153 0.02 . 1 . . . . . 62 HIS H . 15341 1
671 . 1 1 62 62 HIS HA H 1 4.61 0.02 . 1 . . . . . 62 HIS HA . 15341 1
672 . 1 1 62 62 HIS HB2 H 1 3.16 0.02 . 2 . . . . . 62 HIS HB2 . 15341 1
673 . 1 1 62 62 HIS HB3 H 1 3.06 0.02 . 2 . . . . . 62 HIS HB3 . 15341 1
674 . 1 1 62 62 HIS CA C 13 56.131 0.2 . 1 . . . . . 62 HIS CA . 15341 1
675 . 1 1 62 62 HIS CB C 13 29.25 0.2 . 1 . . . . . 62 HIS CB . 15341 1
676 . 1 1 62 62 HIS N N 15 117.955 0.2 . 1 . . . . . 62 HIS N . 15341 1
677 . 1 1 63 63 HIS H H 1 8.324 0.02 . 1 . . . . . 63 HIS H . 15341 1
678 . 1 1 63 63 HIS HA H 1 4.52 0.02 . 1 . . . . . 63 HIS HA . 15341 1
679 . 1 1 63 63 HIS HB2 H 1 3.216 0.02 . 2 . . . . . 63 HIS HB2 . 15341 1
680 . 1 1 63 63 HIS HB3 H 1 3.103 0.02 . 2 . . . . . 63 HIS HB3 . 15341 1
681 . 1 1 63 63 HIS CA C 13 57.194 0.2 . 1 . . . . . 63 HIS CA . 15341 1
682 . 1 1 63 63 HIS CB C 13 29.761 0.2 . 1 . . . . . 63 HIS CB . 15341 1
683 . 1 1 63 63 HIS N N 15 125.429 0.2 . 1 . . . . . 63 HIS N . 15341 1
stop_
save_