Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30904
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D HSQC' . . . 30904 1
2 '3D HNCACB' . . . 30904 1
3 '3D CBCA(CO)NH' . . . 30904 1
4 '3D HNCO' . . . 30904 1
5 '3D H(CCO)NH' . . . 30904 1
6 '3D 15NNOESY' . . . 30904 1
7 '3D 13CNOESY' . . . 30904 1
8 '3D HNHA' . . . 30904 1
9 '3D C(CO)NH' . . . 30904 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 4 4 LYS C C 13 173.651 0 . 1 . . . . A 4 LYS C . 30904 1
2 . 1 . 1 4 4 LYS CA C 13 54.932 0 . 1 . . . . A 4 LYS CA . 30904 1
3 . 1 . 1 4 4 LYS CB C 13 35.153 0 . 1 . . . . A 4 LYS CB . 30904 1
4 . 1 . 1 4 4 LYS CG C 13 25.099 0 . 1 . . . . A 4 LYS CG . 30904 1
5 . 1 . 1 4 4 LYS CD C 13 29.646 0 . 1 . . . . A 4 LYS CD . 30904 1
6 . 1 . 1 5 5 TYR H H 1 8.591 0.008 . 1 . . . . A 5 TYR H . 30904 1
7 . 1 . 1 5 5 TYR HA H 1 5.192 0.02 . 1 . . . . A 5 TYR HA . 30904 1
8 . 1 . 1 5 5 TYR HB2 H 1 2.643 0 . 1 . . . . A 5 TYR HB2 . 30904 1
9 . 1 . 1 5 5 TYR HB3 H 1 2.643 0 . 1 . . . . A 5 TYR HB3 . 30904 1
10 . 1 . 1 5 5 TYR C C 13 174.192 0.007 . 1 . . . . A 5 TYR C . 30904 1
11 . 1 . 1 5 5 TYR CA C 13 57.096 0.09 . 1 . . . . A 5 TYR CA . 30904 1
12 . 1 . 1 5 5 TYR CB C 13 42.23 0.091 . 1 . . . . A 5 TYR CB . 30904 1
13 . 1 . 1 5 5 TYR N N 15 119.607 0 . 1 . . . . A 5 TYR N . 30904 1
14 . 1 . 1 6 6 ILE H H 1 8.979 0.011 . 1 . . . . A 6 ILE H . 30904 1
15 . 1 . 1 6 6 ILE HA H 1 4.71 0.013 . 1 . . . . A 6 ILE HA . 30904 1
16 . 1 . 1 6 6 ILE HB H 1 1.643 0 . 1 . . . . A 6 ILE HB . 30904 1
17 . 1 . 1 6 6 ILE HD11 H 1 0.684 0 . 1 . . . . A 6 ILE HD11 . 30904 1
18 . 1 . 1 6 6 ILE HD12 H 1 0.684 0 . 1 . . . . A 6 ILE HD12 . 30904 1
19 . 1 . 1 6 6 ILE HD13 H 1 0.684 0 . 1 . . . . A 6 ILE HD13 . 30904 1
20 . 1 . 1 6 6 ILE C C 13 175.459 0 . 1 . . . . A 6 ILE C . 30904 1
21 . 1 . 1 6 6 ILE CA C 13 60.018 0.05 . 1 . . . . A 6 ILE CA . 30904 1
22 . 1 . 1 6 6 ILE CB C 13 40.001 0.039 . 1 . . . . A 6 ILE CB . 30904 1
23 . 1 . 1 6 6 ILE CG2 C 13 18.469 0 . 1 . . . . A 6 ILE CG1 . 30904 1
24 . 1 . 1 6 6 ILE N N 15 122.568 0 . 1 . . . . A 6 ILE N . 30904 1
25 . 1 . 1 7 7 LEU H H 1 9.064 0.002 . 1 . . . . A 7 LEU H . 30904 1
26 . 1 . 1 7 7 LEU HA H 1 5.244 0.013 . 1 . . . . A 7 LEU HA . 30904 1
27 . 1 . 1 7 7 LEU HB2 H 1 1.341 0 . 1 . . . . A 7 LEU HB2 . 30904 1
28 . 1 . 1 7 7 LEU HB3 H 1 1.341 0 . 1 . . . . A 7 LEU HB3 . 30904 1
29 . 1 . 1 7 7 LEU HD11 H 1 0.629 0 . 1 . . . . A 7 LEU HD11 . 30904 1
30 . 1 . 1 7 7 LEU HD12 H 1 0.629 0 . 1 . . . . A 7 LEU HD12 . 30904 1
31 . 1 . 1 7 7 LEU HD13 H 1 0.629 0 . 1 . . . . A 7 LEU HD13 . 30904 1
32 . 1 . 1 7 7 LEU C C 13 174.562 0.02 . 1 . . . . A 7 LEU C . 30904 1
33 . 1 . 1 7 7 LEU CA C 13 53.79 0.228 . 1 . . . . A 7 LEU CA . 30904 1
34 . 1 . 1 7 7 LEU CB C 13 43.563 0.116 . 1 . . . . A 7 LEU CB . 30904 1
35 . 1 . 1 7 7 LEU CG C 13 25.921 0 . 1 . . . . A 7 LEU CG . 30904 1
36 . 1 . 1 7 7 LEU CD1 C 13 28.331 0 . 1 . . . . A 7 LEU CD1 . 30904 1
37 . 1 . 1 7 7 LEU N N 15 129.404 0 . 1 . . . . A 7 LEU N . 30904 1
38 . 1 . 1 8 8 ASN H H 1 8.865 0.004 . 1 . . . . A 8 ASN H . 30904 1
39 . 1 . 1 8 8 ASN HA H 1 5.641 0 . 1 . . . . A 8 ASN HA . 30904 1
40 . 1 . 1 8 8 ASN HB2 H 1 2.519 0 . 1 . . . . A 8 ASN HB2 . 30904 1
41 . 1 . 1 8 8 ASN HB3 H 1 2.519 0 . 1 . . . . A 8 ASN HB3 . 30904 1
42 . 1 . 1 8 8 ASN C C 13 173.713 0.034 . 1 . . . . A 8 ASN C . 30904 1
43 . 1 . 1 8 8 ASN CA C 13 51.982 0.19 . 1 . . . . A 8 ASN CA . 30904 1
44 . 1 . 1 8 8 ASN CB C 13 42.723 0.168 . 1 . . . . A 8 ASN CB . 30904 1
45 . 1 . 1 8 8 ASN N N 15 121.846 0 . 1 . . . . A 8 ASN N . 30904 1
46 . 1 . 1 9 9 LEU H H 1 9.752 0.001 . 1 . . . . A 9 LEU H . 30904 1
47 . 1 . 1 9 9 LEU HA H 1 5.223 0.012 . 1 . . . . A 9 LEU HA . 30904 1
48 . 1 . 1 9 9 LEU HB2 H 1 1.698 0 . 1 . . . . A 9 LEU HB2 . 30904 1
49 . 1 . 1 9 9 LEU HB3 H 1 1.698 0 . 1 . . . . A 9 LEU HB3 . 30904 1
50 . 1 . 1 9 9 LEU HG H 1 1.122 0 . 1 . . . . A 9 LEU HG . 30904 1
51 . 1 . 1 9 9 LEU HD11 H 1 0.492 0 . 2 . . . . A 9 LEU HD11 . 30904 1
52 . 1 . 1 9 9 LEU HD12 H 1 0.492 0 . 2 . . . . A 9 LEU HD12 . 30904 1
53 . 1 . 1 9 9 LEU HD13 H 1 0.492 0 . 2 . . . . A 9 LEU HD13 . 30904 1
54 . 1 . 1 9 9 LEU C C 13 173.871 0 . 1 . . . . A 9 LEU C . 30904 1
55 . 1 . 1 9 9 LEU CA C 13 54.247 0.082 . 1 . . . . A 9 LEU CA . 30904 1
56 . 1 . 1 9 9 LEU CB C 13 45.773 0.013 . 1 . . . . A 9 LEU CB . 30904 1
57 . 1 . 1 9 9 LEU CG C 13 21.592 0 . 1 . . . . A 9 LEU CG . 30904 1
58 . 1 . 1 9 9 LEU CD1 C 13 27.838 0 . 1 . . . . A 9 LEU CD1 . 30904 1
59 . 1 . 1 9 9 LEU N N 15 127.29 0 . 1 . . . . A 9 LEU N . 30904 1
60 . 1 . 1 10 10 LYS H H 1 8.784 0.002 . 1 . . . . A 10 LYS H . 30904 1
61 . 1 . 1 10 10 LYS HA H 1 5.115 0.027 . 1 . . . . A 10 LYS HA . 30904 1
62 . 1 . 1 10 10 LYS HB2 H 1 1.862 0 . 1 . . . . A 10 LYS HB2 . 30904 1
63 . 1 . 1 10 10 LYS HB3 H 1 1.862 0 . 1 . . . . A 10 LYS HB3 . 30904 1
64 . 1 . 1 10 10 LYS HG2 H 1 1.52 0 . 1 . . . . A 10 LYS HG2 . 30904 1
65 . 1 . 1 10 10 LYS HG3 H 1 1.52 0 . 1 . . . . A 10 LYS HG3 . 30904 1
66 . 1 . 1 10 10 LYS C C 13 174.474 0.027 . 1 . . . . A 10 LYS C . 30904 1
67 . 1 . 1 10 10 LYS CA C 13 55.306 0.009 . 1 . . . . A 10 LYS CA . 30904 1
68 . 1 . 1 10 10 LYS CB C 13 35.107 0.091 . 1 . . . . A 10 LYS CB . 30904 1
69 . 1 . 1 10 10 LYS CG C 13 24.989 0 . 1 . . . . A 10 LYS CG . 30904 1
70 . 1 . 1 10 10 LYS N N 15 127.451 0.014 . 1 . . . . A 10 LYS N . 30904 1
71 . 1 . 1 11 11 PHE H H 1 9.176 0.002 . 1 . . . . A 11 PHE H . 30904 1
72 . 1 . 1 11 11 PHE HA H 1 5.212 0.019 . 1 . . . . A 11 PHE HA . 30904 1
73 . 1 . 1 11 11 PHE HB2 H 1 2.999 0 . 1 . . . . A 11 PHE HB2 . 30904 1
74 . 1 . 1 11 11 PHE HB3 H 1 2.999 0 . 1 . . . . A 11 PHE HB3 . 30904 1
75 . 1 . 1 11 11 PHE C C 13 173.987 0.007 . 1 . . . . A 11 PHE C . 30904 1
76 . 1 . 1 11 11 PHE CA C 13 56.694 0.11 . 1 . . . . A 11 PHE CA . 30904 1
77 . 1 . 1 11 11 PHE CB C 13 43.398 0.116 . 1 . . . . A 11 PHE CB . 30904 1
78 . 1 . 1 11 11 PHE N N 15 130.281 0 . 1 . . . . A 11 PHE N . 30904 1
79 . 1 . 1 12 12 ALA H H 1 8.633 0.001 . 1 . . . . A 12 ALA H . 30904 1
80 . 1 . 1 12 12 ALA HA H 1 4.491 0 . 1 . . . . A 12 ALA HA . 30904 1
81 . 1 . 1 12 12 ALA HB1 H 1 1.246 0 . 1 . . . . A 12 ALA HB1 . 30904 1
82 . 1 . 1 12 12 ALA HB2 H 1 1.246 0 . 1 . . . . A 12 ALA HB2 . 30904 1
83 . 1 . 1 12 12 ALA HB3 H 1 1.246 0 . 1 . . . . A 12 ALA HB3 . 30904 1
84 . 1 . 1 12 12 ALA C C 13 176.165 0.048 . 1 . . . . A 12 ALA C . 30904 1
85 . 1 . 1 12 12 ALA CA C 13 51.179 0.09 . 1 . . . . A 12 ALA CA . 30904 1
86 . 1 . 1 12 12 ALA CB C 13 18.579 0.039 . 1 . . . . A 12 ALA CB . 30904 1
87 . 1 . 1 12 12 ALA N N 15 128.178 0 . 1 . . . . A 12 ALA N . 30904 1
88 . 1 . 1 13 13 PHE H H 1 8.349 0.002 . 1 . . . . A 13 PHE H . 30904 1
89 . 1 . 1 13 13 PHE HA H 1 4.268 0 . 1 . . . . A 13 PHE HA . 30904 1
90 . 1 . 1 13 13 PHE HB2 H 1 3.259 0 . 2 . . . . A 13 PHE HB2 . 30904 1
91 . 1 . 1 13 13 PHE HB3 H 1 2.971 0 . 2 . . . . A 13 PHE HB3 . 30904 1
92 . 1 . 1 13 13 PHE C C 13 176.411 0.035 . 1 . . . . A 13 PHE C . 30904 1
93 . 1 . 1 13 13 PHE CA C 13 59.415 0.11 . 1 . . . . A 13 PHE CA . 30904 1
94 . 1 . 1 13 13 PHE CB C 13 40.075 0.091 . 1 . . . . A 13 PHE CB . 30904 1
95 . 1 . 1 13 13 PHE N N 15 122.127 0 . 1 . . . . A 13 PHE N . 30904 1
96 . 1 . 1 14 14 GLY H H 1 8.547 0.002 . 1 . . . . A 14 GLY H . 30904 1
97 . 1 . 1 14 14 GLY HA2 H 1 3.94 0 . 1 . . . . A 14 GLY HA2 . 30904 1
98 . 1 . 1 14 14 GLY HA3 H 1 3.94 0 . 1 . . . . A 14 GLY HA3 . 30904 1
99 . 1 . 1 14 14 GLY C C 13 173.74 0.007 . 1 . . . . A 14 GLY C . 30904 1
100 . 1 . 1 14 14 GLY CA C 13 44.987 0.15 . 1 . . . . A 14 GLY CA . 30904 1
101 . 1 . 1 14 14 GLY N N 15 109.089 0 . 1 . . . . A 14 GLY N . 30904 1
102 . 1 . 1 15 15 ASP H H 1 8.35 0.002 . 1 . . . . A 15 ASP H . 30904 1
103 . 1 . 1 15 15 ASP HA H 1 4.339 0 . 1 . . . . A 15 ASP HA . 30904 1
104 . 1 . 1 15 15 ASP C C 13 176.651 0.069 . 1 . . . . A 15 ASP C . 30904 1
105 . 1 . 1 15 15 ASP CA C 13 54.046 0.17 . 1 . . . . A 15 ASP CA . 30904 1
106 . 1 . 1 15 15 ASP CB C 13 41.024 0.013 . 1 . . . . A 15 ASP CB . 30904 1
107 . 1 . 1 15 15 ASP N N 15 121.083 0 . 1 . . . . A 15 ASP N . 30904 1
108 . 1 . 1 16 16 THR H H 1 8.17 0.001 . 1 . . . . A 16 THR H . 30904 1
109 . 1 . 1 16 16 THR HA H 1 4.304 0 . 1 . . . . A 16 THR HA . 30904 1
110 . 1 . 1 16 16 THR HG21 H 1 1.191 0 . 1 . . . . A 16 THR HG21 . 30904 1
111 . 1 . 1 16 16 THR HG22 H 1 1.191 0 . 1 . . . . A 16 THR HG22 . 30904 1
112 . 1 . 1 16 16 THR HG23 H 1 1.191 0 . 1 . . . . A 16 THR HG23 . 30904 1
113 . 1 . 1 16 16 THR C C 13 174.603 0.034 . 1 . . . . A 16 THR C . 30904 1
114 . 1 . 1 16 16 THR CA C 13 62.1 0.05 . 1 . . . . A 16 THR CA . 30904 1
115 . 1 . 1 16 16 THR CB C 13 69.405 0.142 . 1 . . . . A 16 THR CB . 30904 1
116 . 1 . 1 16 16 THR CG2 C 13 21.674 0 . 1 . . . . A 16 THR CG2 . 30904 1
117 . 1 . 1 16 16 THR N N 15 114.699 0 . 1 . . . . A 16 THR N . 30904 1
118 . 1 . 1 17 17 ASN H H 1 8.514 0.002 . 1 . . . . A 17 ASN H . 30904 1
119 . 1 . 1 17 17 ASN HA H 1 4.726 0 . 1 . . . . A 17 ASN HA . 30904 1
120 . 1 . 1 17 17 ASN C C 13 173.61 0 . 1 . . . . A 17 ASN C . 30904 1
121 . 1 . 1 17 17 ASN CA C 13 54.466 0 . 1 . . . . A 17 ASN CA . 30904 1
122 . 1 . 1 17 17 ASN CB C 13 35.345 0 . 1 . . . . A 17 ASN CB . 30904 1
123 . 1 . 1 17 17 ASN N N 15 121.006 0 . 1 . . . . A 17 ASN N . 30904 1
124 . 1 . 1 18 18 SER C C 13 174.61 0 . 1 . . . . A 18 SER C . 30904 1
125 . 1 . 1 18 18 SER CA C 13 57.89 0 . 1 . . . . A 18 SER CA . 30904 1
126 . 1 . 1 18 18 SER CB C 13 63.369 0 . 1 . . . . A 18 SER CB . 30904 1
127 . 1 . 1 19 19 GLU H H 1 8.295 0.001 . 1 . . . . A 19 GLU H . 30904 1
128 . 1 . 1 19 19 GLU HA H 1 4.081 0 . 1 . . . . A 19 GLU HA . 30904 1
129 . 1 . 1 19 19 GLU HB2 H 1 2.054 0 . 1 . . . . A 19 GLU HB2 . 30904 1
130 . 1 . 1 19 19 GLU HB3 H 1 2.054 0 . 1 . . . . A 19 GLU HB3 . 30904 1
131 . 1 . 1 19 19 GLU C C 13 176.206 0.021 . 1 . . . . A 19 GLU C . 30904 1
132 . 1 . 1 19 19 GLU CA C 13 57.735 0.31 . 1 . . . . A 19 GLU CA . 30904 1
133 . 1 . 1 19 19 GLU CB C 13 29.756 0.194 . 1 . . . . A 19 GLU CB . 30904 1
134 . 1 . 1 19 19 GLU CG C 13 36.331 0 . 1 . . . . A 19 GLU CG . 30904 1
135 . 1 . 1 19 19 GLU N N 15 123.533 0 . 1 . . . . A 19 GLU N . 30904 1
136 . 1 . 1 20 20 ALA H H 1 8.134 0.002 . 1 . . . . A 20 ALA H . 30904 1
137 . 1 . 1 20 20 ALA HA H 1 4.081 0 . 1 . . . . A 20 ALA HA . 30904 1
138 . 1 . 1 20 20 ALA HB1 H 1 1.437 0 . 1 . . . . A 20 ALA HB1 . 30904 1
139 . 1 . 1 20 20 ALA HB2 H 1 1.437 0 . 1 . . . . A 20 ALA HB2 . 30904 1
140 . 1 . 1 20 20 ALA HB3 H 1 1.437 0 . 1 . . . . A 20 ALA HB3 . 30904 1
141 . 1 . 1 20 20 ALA C C 13 179.062 0 . 1 . . . . A 20 ALA C . 30904 1
142 . 1 . 1 20 20 ALA CA C 13 53.967 0.243 . 1 . . . . A 20 ALA CA . 30904 1
143 . 1 . 1 20 20 ALA CB C 13 18.622 0.124 . 1 . . . . A 20 ALA CB . 30904 1
144 . 1 . 1 20 20 ALA N N 15 123.05 0 . 1 . . . . A 20 ALA N . 30904 1
145 . 1 . 1 21 21 VAL H H 1 8.212 0.006 . 1 . . . . A 21 VAL H . 30904 1
146 . 1 . 1 21 21 VAL HA H 1 4.092 0 . 1 . . . . A 21 VAL HA . 30904 1
147 . 1 . 1 21 21 VAL CA C 13 61.863 0 . 1 . . . . A 21 VAL CA . 30904 1
148 . 1 . 1 21 21 VAL CB C 13 32.824 0 . 1 . . . . A 21 VAL CB . 30904 1
149 . 1 . 1 21 21 VAL N N 15 121.694 0.033 . 1 . . . . A 21 VAL N . 30904 1
150 . 1 . 1 22 22 ASP CA C 13 55.315 0 . 1 . . . . A 22 ASP CA . 30904 1
151 . 1 . 1 22 22 ASP CB C 13 40.686 0 . 1 . . . . A 22 ASP CB . 30904 1
152 . 1 . 1 23 23 ALA H H 1 8.827 0.001 . 1 . . . . A 23 ALA H . 30904 1
153 . 1 . 1 23 23 ALA HA H 1 4.351 0 . 1 . . . . A 23 ALA HA . 30904 1
154 . 1 . 1 23 23 ALA C C 13 177.541 0 . 1 . . . . A 23 ALA C . 30904 1
155 . 1 . 1 23 23 ALA CA C 13 55.379 0.07 . 1 . . . . A 23 ALA CA . 30904 1
156 . 1 . 1 23 23 ALA CB C 13 17.593 0.194 . 1 . . . . A 23 ALA CB . 30904 1
157 . 1 . 1 23 23 ALA N N 15 124.879 0 . 1 . . . . A 23 ALA N . 30904 1
158 . 1 . 1 24 24 ALA H H 1 7.822 0.002 . 1 . . . . A 24 ALA H . 30904 1
159 . 1 . 1 24 24 ALA HA H 1 4.034 0 . 1 . . . . A 24 ALA HA . 30904 1
160 . 1 . 1 24 24 ALA C C 13 180.966 0 . 1 . . . . A 24 ALA C . 30904 1
161 . 1 . 1 24 24 ALA CA C 13 54.759 0.05 . 1 . . . . A 24 ALA CA . 30904 1
162 . 1 . 1 24 24 ALA CB C 13 17.94 0.091 . 1 . . . . A 24 ALA CB . 30904 1
163 . 1 . 1 24 24 ALA N N 15 120.433 0 . 1 . . . . A 24 ALA N . 30904 1
164 . 1 . 1 25 25 GLU H H 1 7.938 0 . 1 . . . . A 25 GLU H . 30904 1
165 . 1 . 1 25 25 GLU HA H 1 3.975 0 . 1 . . . . A 25 GLU HA . 30904 1
166 . 1 . 1 25 25 GLU HB2 H 1 2.026 0 . 1 . . . . A 25 GLU HB2 . 30904 1
167 . 1 . 1 25 25 GLU HB3 H 1 2.026 0 . 1 . . . . A 25 GLU HB3 . 30904 1
168 . 1 . 1 25 25 GLU C C 13 178.74 0.007 . 1 . . . . A 25 GLU C . 30904 1
169 . 1 . 1 25 25 GLU CA C 13 58.63 0.03 . 1 . . . . A 25 GLU CA . 30904 1
170 . 1 . 1 25 25 GLU CB C 13 29.373 0.116 . 1 . . . . A 25 GLU CB . 30904 1
171 . 1 . 1 25 25 GLU CG C 13 36.276 0 . 1 . . . . A 25 GLU CG . 30904 1
172 . 1 . 1 25 25 GLU N N 15 119.13 0 . 1 . . . . A 25 GLU N . 30904 1
173 . 1 . 1 26 26 ALA H H 1 7.997 0.003 . 1 . . . . A 26 ALA H . 30904 1
174 . 1 . 1 26 26 ALA HA H 1 3.963 0 . 1 . . . . A 26 ALA HA . 30904 1
175 . 1 . 1 26 26 ALA HB1 H 1 1.314 0 . 1 . . . . A 26 ALA HB1 . 30904 1
176 . 1 . 1 26 26 ALA HB2 H 1 1.314 0 . 1 . . . . A 26 ALA HB2 . 30904 1
177 . 1 . 1 26 26 ALA HB3 H 1 1.314 0 . 1 . . . . A 26 ALA HB3 . 30904 1
178 . 1 . 1 26 26 ALA C C 13 178.172 0 . 1 . . . . A 26 ALA C . 30904 1
179 . 1 . 1 26 26 ALA CA C 13 54.667 0.07 . 1 . . . . A 26 ALA CA . 30904 1
180 . 1 . 1 26 26 ALA CB C 13 18.031 0.194 . 1 . . . . A 26 ALA CB . 30904 1
181 . 1 . 1 26 26 ALA N N 15 122.298 0 . 1 . . . . A 26 ALA N . 30904 1
182 . 1 . 1 27 27 GLU H H 1 7.935 0.003 . 1 . . . . A 27 GLU H . 30904 1
183 . 1 . 1 27 27 GLU HA H 1 3.905 0 . 1 . . . . A 27 GLU HA . 30904 1
184 . 1 . 1 27 27 GLU C C 13 178.706 0 . 1 . . . . A 27 GLU C . 30904 1
185 . 1 . 1 27 27 GLU CA C 13 58.356 0 . 1 . . . . A 27 GLU CA . 30904 1
186 . 1 . 1 27 27 GLU CB C 13 29.427 0 . 1 . . . . A 27 GLU CB . 30904 1
187 . 1 . 1 27 27 GLU N N 15 119.746 0.002 . 1 . . . . A 27 GLU N . 30904 1
188 . 1 . 1 28 28 LYS H H 1 7.936 0 . 1 . . . . A 28 LYS H . 30904 1
189 . 1 . 1 28 28 LYS N N 15 119.746 0 . 1 . . . . A 28 LYS N . 30904 1
190 . 1 . 1 29 29 LYS H H 1 7.936 0 . 1 . . . . A 29 LYS H . 30904 1
191 . 1 . 1 29 29 LYS C C 13 179.048 0 . 1 . . . . A 29 LYS C . 30904 1
192 . 1 . 1 29 29 LYS N N 15 119.746 0 . 1 . . . . A 29 LYS N . 30904 1
193 . 1 . 1 30 30 PHE H H 1 8.254 0.001 . 1 . . . . A 30 PHE H . 30904 1
194 . 1 . 1 30 30 PHE HA H 1 4.081 0 . 1 . . . . A 30 PHE HA . 30904 1
195 . 1 . 1 30 30 PHE C C 13 177.562 0.021 . 1 . . . . A 30 PHE C . 30904 1
196 . 1 . 1 30 30 PHE CA C 13 59.014 0.15 . 1 . . . . A 30 PHE CA . 30904 1
197 . 1 . 1 30 30 PHE CB C 13 36.294 0.013 . 1 . . . . A 30 PHE CB . 30904 1
198 . 1 . 1 30 30 PHE N N 15 119.803 0.042 . 1 . . . . A 30 PHE N . 30904 1
199 . 1 . 1 31 31 LYS H H 1 7.877 0.003 . 1 . . . . A 31 LYS H . 30904 1
200 . 1 . 1 31 31 LYS HA H 1 3.74 0 . 1 . . . . A 31 LYS HA . 30904 1
201 . 1 . 1 31 31 LYS HB2 H 1 1.643 0 . 1 . . . . A 31 LYS HB2 . 30904 1
202 . 1 . 1 31 31 LYS HB3 H 1 1.643 0 . 1 . . . . A 31 LYS HB3 . 30904 1
203 . 1 . 1 31 31 LYS HG2 H 1 1.04 0 . 1 . . . . A 31 LYS HG2 . 30904 1
204 . 1 . 1 31 31 LYS HG3 H 1 1.04 0 . 1 . . . . A 31 LYS HG3 . 30904 1
205 . 1 . 1 31 31 LYS C C 13 178.884 0 . 1 . . . . A 31 LYS C . 30904 1
206 . 1 . 1 31 31 LYS CA C 13 59.598 0.07 . 1 . . . . A 31 LYS CA . 30904 1
207 . 1 . 1 31 31 LYS CB C 13 32.076 0.065 . 1 . . . . A 31 LYS CB . 30904 1
208 . 1 . 1 31 31 LYS CG C 13 25.318 0 . 1 . . . . A 31 LYS CG . 30904 1
209 . 1 . 1 31 31 LYS CD C 13 29.372 0 . 1 . . . . A 31 LYS CD . 30904 1
210 . 1 . 1 31 31 LYS CE C 13 42.412 0 . 1 . . . . A 31 LYS CE . 30904 1
211 . 1 . 1 31 31 LYS N N 15 119.615 0 . 1 . . . . A 31 LYS N . 30904 1
212 . 1 . 1 32 32 GLN H H 1 7.483 0.001 . 1 . . . . A 32 GLN H . 30904 1
213 . 1 . 1 32 32 GLN HA H 1 3.975 0 . 1 . . . . A 32 GLN HA . 30904 1
214 . 1 . 1 32 32 GLN HB2 H 1 2.108 0 . 1 . . . . A 32 GLN HB2 . 30904 1
215 . 1 . 1 32 32 GLN HB3 H 1 2.108 0 . 1 . . . . A 32 GLN HB3 . 30904 1
216 . 1 . 1 32 32 GLN HG2 H 1 2.424 0 . 1 . . . . A 32 GLN HG2 . 30904 1
217 . 1 . 1 32 32 GLN HG3 H 1 2.424 0 . 1 . . . . A 32 GLN HG3 . 30904 1
218 . 1 . 1 32 32 GLN C C 13 179.706 0 . 1 . . . . A 32 GLN C . 30904 1
219 . 1 . 1 32 32 GLN CA C 13 58.758 0.07 . 1 . . . . A 32 GLN CA . 30904 1
220 . 1 . 1 32 32 GLN CB C 13 27.93 0.013 . 1 . . . . A 32 GLN CB . 30904 1
221 . 1 . 1 32 32 GLN CG C 13 33.81 0 . 1 . . . . A 32 GLN CG . 30904 1
222 . 1 . 1 32 32 GLN N N 15 119.376 0 . 1 . . . . A 32 GLN N . 30904 1
223 . 1 . 1 33 33 TYR H H 1 8.102 0.001 . 1 . . . . A 33 TYR H . 30904 1
224 . 1 . 1 33 33 TYR HA H 1 4.057 0 . 1 . . . . A 33 TYR HA . 30904 1
225 . 1 . 1 33 33 TYR C C 13 178.939 0.027 . 1 . . . . A 33 TYR C . 30904 1
226 . 1 . 1 33 33 TYR CA C 13 60.438 0.21 . 1 . . . . A 33 TYR CA . 30904 1
227 . 1 . 1 33 33 TYR CB C 13 38.084 0.039 . 1 . . . . A 33 TYR CB . 30904 1
228 . 1 . 1 33 33 TYR N N 15 119.341 0 . 1 . . . . A 33 TYR N . 30904 1
229 . 1 . 1 34 34 ALA H H 1 8.879 0.002 . 1 . . . . A 34 ALA H . 30904 1
230 . 1 . 1 34 34 ALA HA H 1 4.151 0 . 1 . . . . A 34 ALA HA . 30904 1
231 . 1 . 1 34 34 ALA HB1 H 1 1.903 0 . 1 . . . . A 34 ALA HB1 . 30904 1
232 . 1 . 1 34 34 ALA HB2 H 1 1.903 0 . 1 . . . . A 34 ALA HB2 . 30904 1
233 . 1 . 1 34 34 ALA HB3 H 1 1.903 0 . 1 . . . . A 34 ALA HB3 . 30904 1
234 . 1 . 1 34 34 ALA C C 13 179.733 0.055 . 1 . . . . A 34 ALA C . 30904 1
235 . 1 . 1 34 34 ALA CA C 13 55.854 0.11 . 1 . . . . A 34 ALA CA . 30904 1
236 . 1 . 1 34 34 ALA CB C 13 18.177 0.065 . 1 . . . . A 34 ALA CB . 30904 1
237 . 1 . 1 34 34 ALA N N 15 121.814 0 . 1 . . . . A 34 ALA N . 30904 1
238 . 1 . 1 35 35 ASN H H 1 8.526 0.001 . 1 . . . . A 35 ASN H . 30904 1
239 . 1 . 1 35 35 ASN HA H 1 4.397 0 . 1 . . . . A 35 ASN HA . 30904 1
240 . 1 . 1 35 35 ASN HB2 H 1 2.944 0 . 2 . . . . A 35 ASN HB2 . 30904 1
241 . 1 . 1 35 35 ASN HB3 H 1 2.944 0 . 2 . . . . A 35 ASN HB3 . 30904 1
242 . 1 . 1 35 35 ASN C C 13 178.966 0.027 . 1 . . . . A 35 ASN C . 30904 1
243 . 1 . 1 35 35 ASN CA C 13 56.639 0.01 . 1 . . . . A 35 ASN CA . 30904 1
244 . 1 . 1 35 35 ASN CB C 13 38.796 0.039 . 1 . . . . A 35 ASN CB . 30904 1
245 . 1 . 1 35 35 ASN N N 15 118.963 0 . 1 . . . . A 35 ASN N . 30904 1
246 . 1 . 1 36 36 ASP H H 1 8.54 0.001 . 1 . . . . A 36 ASP H . 30904 1
247 . 1 . 1 36 36 ASP HA H 1 4.327 0 . 1 . . . . A 36 ASP HA . 30904 1
248 . 1 . 1 36 36 ASP HB2 H 1 2.848 0 . 1 . . . . A 36 ASP HB2 . 30904 1
249 . 1 . 1 36 36 ASP HB3 H 1 2.424 0 . 1 . . . . A 36 ASP HB3 . 30904 1
250 . 1 . 1 36 36 ASP C C 13 177.226 0.014 . 1 . . . . A 36 ASP C . 30904 1
251 . 1 . 1 36 36 ASP CA C 13 56.713 0.03 . 1 . . . . A 36 ASP CA . 30904 1
252 . 1 . 1 36 36 ASP CB C 13 40.02 0.091 . 1 . . . . A 36 ASP CB . 30904 1
253 . 1 . 1 36 36 ASP N N 15 121.342 0 . 1 . . . . A 36 ASP N . 30904 1
254 . 1 . 1 37 37 HIS H H 1 7.665 0.001 . 1 . . . . A 37 HIS H . 30904 1
255 . 1 . 1 37 37 HIS HA H 1 4.176 0.246 . 1 . . . . A 37 HIS HA . 30904 1
256 . 1 . 1 37 37 HIS HB2 H 1 3.492 0 . 2 . . . . A 37 HIS HB2 . 30904 1
257 . 1 . 1 37 37 HIS HB3 H 1 2.711 0 . 2 . . . . A 37 HIS HB3 . 30904 1
258 . 1 . 1 37 37 HIS C C 13 174.637 0.028 . 1 . . . . A 37 HIS C . 30904 1
259 . 1 . 1 37 37 HIS CA C 13 57.077 0.05 . 1 . . . . A 37 HIS CA . 30904 1
260 . 1 . 1 37 37 HIS CB C 13 29.774 0.142 . 1 . . . . A 37 HIS CB . 30904 1
261 . 1 . 1 37 37 HIS N N 15 116.237 0 . 1 . . . . A 37 HIS N . 30904 1
262 . 1 . 1 38 38 GLY H H 1 7.839 0.001 . 1 . . . . A 38 GLY H . 30904 1
263 . 1 . 1 38 38 GLY HA2 H 1 3.952 0 . 1 . . . . A 38 GLY HA2 . 30904 1
264 . 1 . 1 38 38 GLY HA3 H 1 3.952 0 . 1 . . . . A 38 GLY HA3 . 30904 1
265 . 1 . 1 38 38 GLY C C 13 174.487 0.069 . 1 . . . . A 38 GLY C . 30904 1
266 . 1 . 1 38 38 GLY CA C 13 46.503 0.07 . 1 . . . . A 38 GLY CA . 30904 1
267 . 1 . 1 38 38 GLY N N 15 107.634 0 . 1 . . . . A 38 GLY N . 30904 1
268 . 1 . 1 39 39 VAL H H 1 8.238 0 . 1 . . . . A 39 VAL H . 30904 1
269 . 1 . 1 39 39 VAL HA H 1 4.104 0 . 1 . . . . A 39 VAL HA . 30904 1
270 . 1 . 1 39 39 VAL HB H 1 1.903 0 . 1 . . . . A 39 VAL HB . 30904 1
271 . 1 . 1 39 39 VAL HG11 H 1 0.752 0 . 2 . . . . A 39 VAL HG11 . 30904 1
272 . 1 . 1 39 39 VAL HG12 H 1 0.752 0 . 2 . . . . A 39 VAL HG12 . 30904 1
273 . 1 . 1 39 39 VAL HG13 H 1 0.752 0 . 2 . . . . A 39 VAL HG13 . 30904 1
274 . 1 . 1 39 39 VAL C C 13 174.048 0.014 . 1 . . . . A 39 VAL C . 30904 1
275 . 1 . 1 39 39 VAL CA C 13 61.79 0.13 . 1 . . . . A 39 VAL CA . 30904 1
276 . 1 . 1 39 39 VAL CB C 13 32.66 0.039 . 1 . . . . A 39 VAL CB . 30904 1
277 . 1 . 1 39 39 VAL CG1 C 13 21.264 0 . 1 . . . . A 39 VAL CG1 . 30904 1
278 . 1 . 1 39 39 VAL N N 15 121.728 0 . 1 . . . . A 39 VAL N . 30904 1
279 . 1 . 1 40 40 ASP H H 1 8.372 0.001 . 1 . . . . A 40 ASP H . 30904 1
280 . 1 . 1 40 40 ASP HA H 1 4.82 0 . 1 . . . . A 40 ASP HA . 30904 1
281 . 1 . 1 40 40 ASP HB2 H 1 2.697 0 . 1 . . . . A 40 ASP HB2 . 30904 1
282 . 1 . 1 40 40 ASP HB3 H 1 2.697 0 . 1 . . . . A 40 ASP HB3 . 30904 1
283 . 1 . 1 40 40 ASP C C 13 175.418 0.014 . 1 . . . . A 40 ASP C . 30904 1
284 . 1 . 1 40 40 ASP CA C 13 53.133 0.07 . 1 . . . . A 40 ASP CA . 30904 1
285 . 1 . 1 40 40 ASP CB C 13 41.901 0.168 . 1 . . . . A 40 ASP CB . 30904 1
286 . 1 . 1 40 40 ASP N N 15 127.548 0 . 1 . . . . A 40 ASP N . 30904 1
287 . 1 . 1 41 41 GLY H H 1 8.073 0.001 . 1 . . . . A 41 GLY H . 30904 1
288 . 1 . 1 41 41 GLY HA2 H 1 3.86 0.015 . 1 . . . . A 41 GLY HA2 . 30904 1
289 . 1 . 1 41 41 GLY HA3 H 1 3.86 0.015 . 1 . . . . A 41 GLY HA3 . 30904 1
290 . 1 . 1 41 41 GLY C C 13 172.008 0 . 1 . . . . A 41 GLY C . 30904 1
291 . 1 . 1 41 41 GLY CA C 13 44.604 0.137 . 1 . . . . A 41 GLY CA . 30904 1
292 . 1 . 1 41 41 GLY N N 15 108.196 0 . 1 . . . . A 41 GLY N . 30904 1
293 . 1 . 1 42 42 GLU H H 1 8.213 0.003 . 1 . . . . A 42 GLU H . 30904 1
294 . 1 . 1 42 42 GLU HA H 1 4.653 0.018 . 1 . . . . A 42 GLU HA . 30904 1
295 . 1 . 1 42 42 GLU HB2 H 1 1.972 0 . 1 . . . . A 42 GLU HB2 . 30904 1
296 . 1 . 1 42 42 GLU HB3 H 1 1.972 0 . 1 . . . . A 42 GLU HB3 . 30904 1
297 . 1 . 1 42 42 GLU HG2 H 1 2.287 0 . 1 . . . . A 42 GLU HG2 . 30904 1
298 . 1 . 1 42 42 GLU HG3 H 1 2.287 0 . 1 . . . . A 42 GLU HG3 . 30904 1
299 . 1 . 1 42 42 GLU C C 13 176.233 0.021 . 1 . . . . A 42 GLU C . 30904 1
300 . 1 . 1 42 42 GLU CA C 13 55.398 0.09 . 1 . . . . A 42 GLU CA . 30904 1
301 . 1 . 1 42 42 GLU CB C 13 31.181 0.116 . 1 . . . . A 42 GLU CB . 30904 1
302 . 1 . 1 42 42 GLU CG C 13 36.44 0 . 1 . . . . A 42 GLU CG . 30904 1
303 . 1 . 1 42 42 GLU N N 15 119.926 0.001 . 1 . . . . A 42 GLU N . 30904 1
304 . 1 . 1 43 43 TRP H H 1 9.196 0.002 . 1 . . . . A 43 TRP H . 30904 1
305 . 1 . 1 43 43 TRP HA H 1 5.271 0.007 . 1 . . . . A 43 TRP HA . 30904 1
306 . 1 . 1 43 43 TRP HB2 H 1 3.218 0 . 1 . . . . A 43 TRP HB2 . 30904 1
307 . 1 . 1 43 43 TRP HB3 H 1 3.218 0 . 1 . . . . A 43 TRP HB3 . 30904 1
308 . 1 . 1 43 43 TRP C C 13 176.87 0.041 . 1 . . . . A 43 TRP C . 30904 1
309 . 1 . 1 43 43 TRP CA C 13 57.224 0.23 . 1 . . . . A 43 TRP CA . 30904 1
310 . 1 . 1 43 43 TRP CB C 13 30.341 0.168 . 1 . . . . A 43 TRP CB . 30904 1
311 . 1 . 1 43 43 TRP N N 15 127.023 0 . 1 . . . . A 43 TRP N . 30904 1
312 . 1 . 1 44 44 THR H H 1 9.385 0.001 . 1 . . . . A 44 THR H . 30904 1
313 . 1 . 1 44 44 THR HA H 1 4.867 0 . 1 . . . . A 44 THR HA . 30904 1
314 . 1 . 1 44 44 THR HB H 1 4.177 0 . 1 . . . . A 44 THR HB . 30904 1
315 . 1 . 1 44 44 THR HG21 H 1 1.218 0 . 1 . . . . A 44 THR HG21 . 30904 1
316 . 1 . 1 44 44 THR HG22 H 1 1.218 0 . 1 . . . . A 44 THR HG22 . 30904 1
317 . 1 . 1 44 44 THR HG23 H 1 1.218 0 . 1 . . . . A 44 THR HG23 . 30904 1
318 . 1 . 1 44 44 THR C C 13 172.837 0.021 . 1 . . . . A 44 THR C . 30904 1
319 . 1 . 1 44 44 THR CA C 13 60.894 0.11 . 1 . . . . A 44 THR CA . 30904 1
320 . 1 . 1 44 44 THR CB C 13 71.853 0.013 . 1 . . . . A 44 THR CB . 30904 1
321 . 1 . 1 44 44 THR CG2 C 13 21.921 0 . 1 . . . . A 44 THR CG2 . 30904 1
322 . 1 . 1 44 44 THR N N 15 115.17 0 . 1 . . . . A 44 THR N . 30904 1
323 . 1 . 1 45 45 TYR H H 1 8.86 0.002 . 1 . . . . A 45 TYR H . 30904 1
324 . 1 . 1 45 45 TYR HA H 1 4.891 0.002 . 1 . . . . A 45 TYR HA . 30904 1
325 . 1 . 1 45 45 TYR HB2 H 1 2.766 0 . 1 . . . . A 45 TYR HB2 . 30904 1
326 . 1 . 1 45 45 TYR HB3 H 1 2.766 0 . 1 . . . . A 45 TYR HB3 . 30904 1
327 . 1 . 1 45 45 TYR C C 13 173.7 0.02 . 1 . . . . A 45 TYR C . 30904 1
328 . 1 . 1 45 45 TYR CA C 13 56.603 0.028 . 1 . . . . A 45 TYR CA . 30904 1
329 . 1 . 1 45 45 TYR CB C 13 41.134 0.065 . 1 . . . . A 45 TYR CB . 30904 1
330 . 1 . 1 45 45 TYR N N 15 123.778 0 . 1 . . . . A 45 TYR N . 30904 1
331 . 1 . 1 46 46 ASP H H 1 7.718 0.003 . 1 . . . . A 46 ASP H . 30904 1
332 . 1 . 1 46 46 ASP HA H 1 4.609 0 . 1 . . . . A 46 ASP HA . 30904 1
333 . 1 . 1 46 46 ASP HB2 H 1 2.643 0 . 1 . . . . A 46 ASP HB2 . 30904 1
334 . 1 . 1 46 46 ASP HB3 H 1 2.643 0 . 1 . . . . A 46 ASP HB3 . 30904 1
335 . 1 . 1 46 46 ASP C C 13 174.651 0.014 . 1 . . . . A 46 ASP C . 30904 1
336 . 1 . 1 46 46 ASP CA C 13 51.726 0.09 . 1 . . . . A 46 ASP CA . 30904 1
337 . 1 . 1 46 46 ASP CB C 13 42.832 0.091 . 1 . . . . A 46 ASP CB . 30904 1
338 . 1 . 1 46 46 ASP N N 15 128.202 0 . 1 . . . . A 46 ASP N . 30904 1
339 . 1 . 1 47 47 ASP H H 1 8.498 0.001 . 1 . . . . A 47 ASP H . 30904 1
340 . 1 . 1 47 47 ASP HA H 1 4.104 0 . 1 . . . . A 47 ASP HA . 30904 1
341 . 1 . 1 47 47 ASP HB2 H 1 2.766 0 . 2 . . . . A 47 ASP HB2 . 30904 1
342 . 1 . 1 47 47 ASP HB3 H 1 2.506 0 . 2 . . . . A 47 ASP HB3 . 30904 1
343 . 1 . 1 47 47 ASP C C 13 177.233 0.007 . 1 . . . . A 47 ASP C . 30904 1
344 . 1 . 1 47 47 ASP CA C 13 55.891 0.21 . 1 . . . . A 47 ASP CA . 30904 1
345 . 1 . 1 47 47 ASP CB C 13 41.737 0.168 . 1 . . . . A 47 ASP CB . 30904 1
346 . 1 . 1 47 47 ASP N N 15 124.941 0 . 1 . . . . A 47 ASP N . 30904 1
347 . 1 . 1 48 48 ALA H H 1 8.222 0.001 . 1 . . . . A 48 ALA H . 30904 1
348 . 1 . 1 48 48 ALA HA H 1 4.151 0 . 1 . . . . A 48 ALA HA . 30904 1
349 . 1 . 1 48 48 ALA HB1 H 1 1.506 0 . 1 . . . . A 48 ALA HB1 . 30904 1
350 . 1 . 1 48 48 ALA HB2 H 1 1.506 0 . 1 . . . . A 48 ALA HB2 . 30904 1
351 . 1 . 1 48 48 ALA HB3 H 1 1.506 0 . 1 . . . . A 48 ALA HB3 . 30904 1
352 . 1 . 1 48 48 ALA C C 13 179.911 0.068 . 1 . . . . A 48 ALA C . 30904 1
353 . 1 . 1 48 48 ALA CA C 13 55.068 0.09 . 1 . . . . A 48 ALA CA . 30904 1
354 . 1 . 1 48 48 ALA CB C 13 18.451 0.142 . 1 . . . . A 48 ALA CB . 30904 1
355 . 1 . 1 48 48 ALA N N 15 119.925 0 . 1 . . . . A 48 ALA N . 30904 1
356 . 1 . 1 49 49 THR H H 1 7.092 0.001 . 1 . . . . A 49 THR H . 30904 1
357 . 1 . 1 49 49 THR HA H 1 4.304 0 . 1 . . . . A 49 THR HA . 30904 1
358 . 1 . 1 49 49 THR HB H 1 4.067 0 . 1 . . . . A 49 THR HB . 30904 1
359 . 1 . 1 49 49 THR C C 13 175.507 0.007 . 1 . . . . A 49 THR C . 30904 1
360 . 1 . 1 49 49 THR CA C 13 60.931 0.03 . 1 . . . . A 49 THR CA . 30904 1
361 . 1 . 1 49 49 THR CB C 13 70.191 0.193 . 1 . . . . A 49 THR CB . 30904 1
362 . 1 . 1 49 49 THR CG2 C 13 21.538 0 . 1 . . . . A 49 THR CG2 . 30904 1
363 . 1 . 1 49 49 THR N N 15 103.937 0 . 1 . . . . A 49 THR N . 30904 1
364 . 1 . 1 50 50 LYS H H 1 7.968 0.002 . 1 . . . . A 50 LYS H . 30904 1
365 . 1 . 1 50 50 LYS HA H 1 4.233 0 . 1 . . . . A 50 LYS HA . 30904 1
366 . 1 . 1 50 50 LYS HB2 H 1 1.643 0 . 1 . . . . A 50 LYS HB2 . 30904 1
367 . 1 . 1 50 50 LYS HB3 H 1 1.643 0 . 1 . . . . A 50 LYS HB3 . 30904 1
368 . 1 . 1 50 50 LYS HG2 H 1 1.273 0 . 1 . . . . A 50 LYS HG2 . 30904 1
369 . 1 . 1 50 50 LYS HG3 H 1 1.273 0 . 1 . . . . A 50 LYS HG3 . 30904 1
370 . 1 . 1 50 50 LYS HE2 H 1 2.396 0 . 1 . . . . A 50 LYS HE2 . 30904 1
371 . 1 . 1 50 50 LYS HE3 H 1 2.396 0 . 1 . . . . A 50 LYS HE3 . 30904 1
372 . 1 . 1 50 50 LYS C C 13 174.946 0.048 . 1 . . . . A 50 LYS C . 30904 1
373 . 1 . 1 50 50 LYS CA C 13 56.091 0.01 . 1 . . . . A 50 LYS CA . 30904 1
374 . 1 . 1 50 50 LYS CB C 13 28.902 0.016 . 1 . . . . A 50 LYS CB . 30904 1
375 . 1 . 1 50 50 LYS CG C 13 25.154 0 . 1 . . . . A 50 LYS CG . 30904 1
376 . 1 . 1 50 50 LYS N N 15 121.552 0 . 1 . . . . A 50 LYS N . 30904 1
377 . 1 . 1 51 51 THR H H 1 7.143 0.002 . 1 . . . . A 51 THR H . 30904 1
378 . 1 . 1 51 51 THR HA H 1 5.473 0.008 . 1 . . . . A 51 THR HA . 30904 1
379 . 1 . 1 51 51 THR HB H 1 3.862 0 . 1 . . . . A 51 THR HB . 30904 1
380 . 1 . 1 51 51 THR HG21 H 1 1.095 0 . 1 . . . . A 51 THR HG21 . 30904 1
381 . 1 . 1 51 51 THR HG22 H 1 1.095 0 . 1 . . . . A 51 THR HG22 . 30904 1
382 . 1 . 1 51 51 THR HG23 H 1 1.095 0 . 1 . . . . A 51 THR HG23 . 30904 1
383 . 1 . 1 51 51 THR C C 13 174.357 0.007 . 1 . . . . A 51 THR C . 30904 1
384 . 1 . 1 51 51 THR CA C 13 61.095 0.082 . 1 . . . . A 51 THR CA . 30904 1
385 . 1 . 1 51 51 THR CB C 13 72.218 0.116 . 1 . . . . A 51 THR CB . 30904 1
386 . 1 . 1 51 51 THR CG2 C 13 20.99 0 . 1 . . . . A 51 THR CG2 . 30904 1
387 . 1 . 1 51 51 THR N N 15 109.432 0.002 . 1 . . . . A 51 THR N . 30904 1
388 . 1 . 1 52 52 PHE H H 1 9.764 0.003 . 1 . . . . A 52 PHE H . 30904 1
389 . 1 . 1 52 52 PHE HA H 1 5.714 0.016 . 1 . . . . A 52 PHE HA . 30904 1
390 . 1 . 1 52 52 PHE HB2 H 1 3.314 0 . 1 . . . . A 52 PHE HB2 . 30904 1
391 . 1 . 1 52 52 PHE HB3 H 1 3.314 0 . 1 . . . . A 52 PHE HB3 . 30904 1
392 . 1 . 1 52 52 PHE C C 13 175.425 0.075 . 1 . . . . A 52 PHE C . 30904 1
393 . 1 . 1 52 52 PHE CA C 13 57.424 0.082 . 1 . . . . A 52 PHE CA . 30904 1
394 . 1 . 1 52 52 PHE CB C 13 42.686 0.039 . 1 . . . . A 52 PHE CB . 30904 1
395 . 1 . 1 52 52 PHE N N 15 125.799 0 . 1 . . . . A 52 PHE N . 30904 1
396 . 1 . 1 53 53 THR H H 1 9.283 0.015 . 1 . . . . A 53 THR H . 30904 1
397 . 1 . 1 53 53 THR HA H 1 5.578 0.035 . 1 . . . . A 53 THR HA . 30904 1
398 . 1 . 1 53 53 THR C C 13 172.556 0 . 1 . . . . A 53 THR C . 30904 1
399 . 1 . 1 53 53 THR CA C 13 61.369 0 . 1 . . . . A 53 THR CA . 30904 1
400 . 1 . 1 53 53 THR CB C 13 71.944 0 . 1 . . . . A 53 THR CB . 30904 1
401 . 1 . 1 53 53 THR N N 15 118.397 0 . 1 . . . . A 53 THR N . 30904 1
402 . 1 . 1 54 54 VAL HA H 1 4.259 0 . 1 . . . . A 54 VAL HA . 30904 1
403 . 1 . 1 54 54 VAL HB H 1 1.903 0 . 1 . . . . A 54 VAL HB . 30904 1
404 . 1 . 1 54 54 VAL HG11 H 1 0.903 0 . 2 . . . . A 54 VAL HG11 . 30904 1
405 . 1 . 1 54 54 VAL HG12 H 1 0.903 0 . 2 . . . . A 54 VAL HG12 . 30904 1
406 . 1 . 1 54 54 VAL HG13 H 1 0.903 0 . 2 . . . . A 54 VAL HG13 . 30904 1
407 . 1 . 1 54 54 VAL C C 13 176.226 0 . 1 . . . . A 54 VAL C . 30904 1
408 . 1 . 1 54 54 VAL CA C 13 60.794 0 . 1 . . . . A 54 VAL CA . 30904 1
409 . 1 . 1 54 54 VAL CB C 13 38.44 0 . 1 . . . . A 54 VAL CB . 30904 1
410 . 1 . 1 54 54 VAL CG1 C 13 17.702 0 . 1 . . . . A 54 VAL CG1 . 30904 1
411 . 1 . 1 55 55 THR H H 1 8.221 0.002 . 1 . . . . A 55 THR H . 30904 1
412 . 1 . 1 55 55 THR HA H 1 4.33 0.009 . 1 . . . . A 55 THR HA . 30904 1
413 . 1 . 1 55 55 THR HB H 1 3.944 0 . 1 . . . . A 55 THR HB . 30904 1
414 . 1 . 1 55 55 THR HG21 H 1 0.999 0 . 1 . . . . A 55 THR HG21 . 30904 1
415 . 1 . 1 55 55 THR HG22 H 1 0.999 0 . 1 . . . . A 55 THR HG22 . 30904 1
416 . 1 . 1 55 55 THR HG23 H 1 0.999 0 . 1 . . . . A 55 THR HG23 . 30904 1
417 . 1 . 1 55 55 THR C C 13 174.186 0 . 1 . . . . A 55 THR C . 30904 1
418 . 1 . 1 55 55 THR CA C 13 61.114 0.21 . 1 . . . . A 55 THR CA . 30904 1
419 . 1 . 1 55 55 THR CB C 13 69.405 0.245 . 1 . . . . A 55 THR CB . 30904 1
420 . 1 . 1 55 55 THR CG2 C 13 21.209 0 . 1 . . . . A 55 THR CG2 . 30904 1
421 . 1 . 1 55 55 THR N N 15 118.722 0 . 1 . . . . A 55 THR N . 30904 1
422 . 1 . 1 56 56 ALA H H 1 9.207 0.023 . 1 . . . . A 56 ALA H . 30904 1
423 . 1 . 1 56 56 ALA HA H 1 4.815 0.035 . 1 . . . . A 56 ALA HA . 30904 1
424 . 1 . 1 56 56 ALA HB1 H 1 1.341 0 . 1 . . . . A 56 ALA HB1 . 30904 1
425 . 1 . 1 56 56 ALA HB2 H 1 1.341 0 . 1 . . . . A 56 ALA HB2 . 30904 1
426 . 1 . 1 56 56 ALA HB3 H 1 1.341 0 . 1 . . . . A 56 ALA HB3 . 30904 1
427 . 1 . 1 56 56 ALA C C 13 176.13 0.014 . 1 . . . . A 56 ALA C . 30904 1
428 . 1 . 1 56 56 ALA CA C 13 50.777 0.01 . 1 . . . . A 56 ALA CA . 30904 1
429 . 1 . 1 56 56 ALA CB C 13 21.063 0.013 . 1 . . . . A 56 ALA CB . 30904 1
430 . 1 . 1 56 56 ALA N N 15 130.309 0 . 1 . . . . A 56 ALA N . 30904 1
431 . 1 . 1 57 57 LYS H H 1 8.843 0.011 . 1 . . . . A 57 LYS H . 30904 1
432 . 1 . 1 57 57 LYS HA H 1 4.813 0.007 . 1 . . . . A 57 LYS HA . 30904 1
433 . 1 . 1 57 57 LYS HB2 H 1 1.78 0 . 1 . . . . A 57 LYS HB2 . 30904 1
434 . 1 . 1 57 57 LYS HB3 H 1 1.78 0 . 1 . . . . A 57 LYS HB3 . 30904 1
435 . 1 . 1 57 57 LYS HG2 H 1 1.341 0 . 1 . . . . A 57 LYS HG2 . 30904 1
436 . 1 . 1 57 57 LYS HG3 H 1 1.341 0 . 1 . . . . A 57 LYS HG3 . 30904 1
437 . 1 . 1 57 57 LYS C C 13 176.076 0.014 . 1 . . . . A 57 LYS C . 30904 1
438 . 1 . 1 57 57 LYS CA C 13 55.836 0.27 . 1 . . . . A 57 LYS CA . 30904 1
439 . 1 . 1 57 57 LYS CB C 13 34.157 0.22 . 1 . . . . A 57 LYS CB . 30904 1
440 . 1 . 1 57 57 LYS CG C 13 25.044 0 . 1 . . . . A 57 LYS CG . 30904 1
441 . 1 . 1 57 57 LYS CD C 13 29.537 0 . 1 . . . . A 57 LYS CD . 30904 1
442 . 1 . 1 57 57 LYS N N 15 121.858 0.02 . 1 . . . . A 57 LYS N . 30904 1
443 . 1 . 1 58 58 ASP H H 1 8.934 0.001 . 1 . . . . A 58 ASP H . 30904 1
444 . 1 . 1 58 58 ASP HA H 1 4.75 0 . 1 . . . . A 58 ASP HA . 30904 1
445 . 1 . 1 58 58 ASP HB2 H 1 2.971 0 . 2 . . . . A 58 ASP HB2 . 30904 1
446 . 1 . 1 58 58 ASP HB3 H 1 2.656 0 . 2 . . . . A 58 ASP HB3 . 30904 1
447 . 1 . 1 58 58 ASP C C 13 175.925 0.027 . 1 . . . . A 58 ASP C . 30904 1
448 . 1 . 1 58 58 ASP CA C 13 54.375 0.01 . 1 . . . . A 58 ASP CA . 30904 1
449 . 1 . 1 58 58 ASP CB C 13 41.755 0.039 . 1 . . . . A 58 ASP CB . 30904 1
450 . 1 . 1 58 58 ASP N N 15 121.282 0 . 1 . . . . A 58 ASP N . 30904 1
451 . 1 . 1 59 59 SER H H 1 8.62 0.021 . 1 . . . . A 59 SER H . 30904 1
452 . 1 . 1 59 59 SER C C 13 173.843 0 . 1 . . . . A 59 SER C . 30904 1
453 . 1 . 1 59 59 SER CA C 13 58.027 0.348 . 1 . . . . A 59 SER CA . 30904 1
454 . 1 . 1 59 59 SER CB C 13 64.767 0.039 . 1 . . . . A 59 SER CB . 30904 1
455 . 1 . 1 59 59 SER N N 15 114.93 0 . 1 . . . . A 59 SER N . 30904 1
456 . 1 . 1 60 60 HIS H H 1 8.42 0.002 . 1 . . . . A 60 HIS H . 30904 1
457 . 1 . 1 60 60 HIS HA H 1 4.714 0 . 1 . . . . A 60 HIS HA . 30904 1
458 . 1 . 1 60 60 HIS HB2 H 1 3.163 0 . 1 . . . . A 60 HIS HB2 . 30904 1
459 . 1 . 1 60 60 HIS HB3 H 1 3.163 0 . 1 . . . . A 60 HIS HB3 . 30904 1
460 . 1 . 1 60 60 HIS C C 13 175.672 0.007 . 1 . . . . A 60 HIS C . 30904 1
461 . 1 . 1 60 60 HIS CA C 13 55.598 0.01 . 1 . . . . A 60 HIS CA . 30904 1
462 . 1 . 1 60 60 HIS CB C 13 32.076 0.065 . 1 . . . . A 60 HIS CB . 30904 1
463 . 1 . 1 60 60 HIS N N 15 120.829 0.002 . 1 . . . . A 60 HIS N . 30904 1
464 . 1 . 1 61 61 ALA H H 1 8.391 0.002 . 1 . . . . A 61 ALA H . 30904 1
465 . 1 . 1 61 61 ALA HA H 1 3.3 0 . 1 . . . . A 61 ALA HA . 30904 1
466 . 1 . 1 61 61 ALA HB1 H 1 1.177 0 . 1 . . . . A 61 ALA HB1 . 30904 1
467 . 1 . 1 61 61 ALA HB2 H 1 1.177 0 . 1 . . . . A 61 ALA HB2 . 30904 1
468 . 1 . 1 61 61 ALA HB3 H 1 1.177 0 . 1 . . . . A 61 ALA HB3 . 30904 1
469 . 1 . 1 61 61 ALA C C 13 179.076 0.027 . 1 . . . . A 61 ALA C . 30904 1
470 . 1 . 1 61 61 ALA CA C 13 55.379 0.013 . 1 . . . . A 61 ALA CA . 30904 1
471 . 1 . 1 61 61 ALA CB C 13 18.853 0.039 . 1 . . . . A 61 ALA CB . 30904 1
472 . 1 . 1 61 61 ALA N N 15 126.551 0 . 1 . . . . A 61 ALA N . 30904 1
473 . 1 . 1 62 62 ASP H H 1 9.383 0.002 . 1 . . . . A 62 ASP H . 30904 1
474 . 1 . 1 62 62 ASP HA H 1 4.259 0 . 1 . . . . A 62 ASP HA . 30904 1
475 . 1 . 1 62 62 ASP HB2 H 1 2.684 0 . 1 . . . . A 62 ASP HB2 . 30904 1
476 . 1 . 1 62 62 ASP HB3 H 1 2.684 0 . 1 . . . . A 62 ASP HB3 . 30904 1
477 . 1 . 1 62 62 ASP C C 13 178.993 0.028 . 1 . . . . A 62 ASP C . 30904 1
478 . 1 . 1 62 62 ASP CA C 13 57.443 0.065 . 1 . . . . A 62 ASP CA . 30904 1
479 . 1 . 1 62 62 ASP CB C 13 39.801 0.065 . 1 . . . . A 62 ASP CB . 30904 1
480 . 1 . 1 62 62 ASP N N 15 116.73 0 . 1 . . . . A 62 ASP N . 30904 1
481 . 1 . 1 63 63 ARG H H 1 7.648 0.002 . 1 . . . . A 63 ARG H . 30904 1
482 . 1 . 1 63 63 ARG HA H 1 4.21 0 . 1 . . . . A 63 ARG HA . 30904 1
483 . 1 . 1 63 63 ARG HB2 H 1 1.944 0 . 1 . . . . A 63 ARG HB2 . 30904 1
484 . 1 . 1 63 63 ARG HB3 H 1 1.944 0 . 1 . . . . A 63 ARG HB3 . 30904 1
485 . 1 . 1 63 63 ARG C C 13 178.939 0 . 1 . . . . A 63 ARG C . 30904 1
486 . 1 . 1 63 63 ARG CA C 13 58.484 0.07 . 1 . . . . A 63 ARG CA . 30904 1
487 . 1 . 1 63 63 ARG CB C 13 30.15 0.131 . 1 . . . . A 63 ARG CB . 30904 1
488 . 1 . 1 63 63 ARG CG C 13 27.126 0 . 1 . . . . A 63 ARG CG . 30904 1
489 . 1 . 1 63 63 ARG CD C 13 43.453 0 . 1 . . . . A 63 ARG CD . 30904 1
490 . 1 . 1 63 63 ARG N N 15 119.245 0.009 . 1 . . . . A 63 ARG N . 30904 1
491 . 1 . 1 64 64 VAL H H 1 7.724 0.001 . 1 . . . . A 64 VAL H . 30904 1
492 . 1 . 1 64 64 VAL HA H 1 3.459 0 . 1 . . . . A 64 VAL HA . 30904 1
493 . 1 . 1 64 64 VAL C C 13 180.569 0 . 1 . . . . A 64 VAL C . 30904 1
494 . 1 . 1 64 64 VAL CA C 13 66.41 0 . 1 . . . . A 64 VAL CA . 30904 1
495 . 1 . 1 64 64 VAL CB C 13 30.797 0 . 1 . . . . A 64 VAL CB . 30904 1
496 . 1 . 1 64 64 VAL N N 15 119.176 0 . 1 . . . . A 64 VAL N . 30904 1
497 . 1 . 1 65 65 ARG C C 13 179.24 0 . 1 . . . . A 65 ARG C . 30904 1
498 . 1 . 1 65 65 ARG CA C 13 60.137 0 . 1 . . . . A 65 ARG CA . 30904 1
499 . 1 . 1 65 65 ARG CB C 13 29.619 0 . 1 . . . . A 65 ARG CB . 30904 1
500 . 1 . 1 65 65 ARG CG C 13 28.77 0 . 1 . . . . A 65 ARG CG . 30904 1
501 . 1 . 1 65 65 ARG CD C 13 43.399 0 . 1 . . . . A 65 ARG CD . 30904 1
502 . 1 . 1 66 66 GLU H H 1 7.821 0.001 . 1 . . . . A 66 GLU H . 30904 1
503 . 1 . 1 66 66 GLU HA H 1 4.045 0 . 1 . . . . A 66 GLU HA . 30904 1
504 . 1 . 1 66 66 GLU HB2 H 1 2.287 0 . 1 . . . . A 66 GLU HB2 . 30904 1
505 . 1 . 1 66 66 GLU HB3 H 1 2.287 0 . 1 . . . . A 66 GLU HB3 . 30904 1
506 . 1 . 1 66 66 GLU HG2 H 1 2.629 0 . 1 . . . . A 66 GLU HG2 . 30904 1
507 . 1 . 1 66 66 GLU HG3 H 1 2.629 0 . 1 . . . . A 66 GLU HG3 . 30904 1
508 . 1 . 1 66 66 GLU C C 13 178.815 0.014 . 1 . . . . A 66 GLU C . 30904 1
509 . 1 . 1 66 66 GLU CA C 13 59.397 0.09 . 1 . . . . A 66 GLU CA . 30904 1
510 . 1 . 1 66 66 GLU CB C 13 29.354 0.091 . 1 . . . . A 66 GLU CB . 30904 1
511 . 1 . 1 66 66 GLU CG C 13 36.221 0 . 1 . . . . A 66 GLU CG . 30904 1
512 . 1 . 1 66 66 GLU N N 15 120.772 0 . 1 . . . . A 66 GLU N . 30904 1
513 . 1 . 1 67 67 LEU H H 1 7.982 0.001 . 1 . . . . A 67 LEU H . 30904 1
514 . 1 . 1 67 67 LEU HA H 1 4.163 0 . 1 . . . . A 67 LEU HA . 30904 1
515 . 1 . 1 67 67 LEU C C 13 178.021 0.014 . 1 . . . . A 67 LEU C . 30904 1
516 . 1 . 1 67 67 LEU CA C 13 57.589 0.03 . 1 . . . . A 67 LEU CA . 30904 1
517 . 1 . 1 67 67 LEU CB C 13 41.006 0.22 . 1 . . . . A 67 LEU CB . 30904 1
518 . 1 . 1 67 67 LEU CG C 13 26.633 0 . 1 . . . . A 67 LEU CG . 30904 1
519 . 1 . 1 67 67 LEU N N 15 120.758 0 . 1 . . . . A 67 LEU N . 30904 1
520 . 1 . 1 68 68 ALA H H 1 8.394 0.001 . 1 . . . . A 68 ALA H . 30904 1
521 . 1 . 1 68 68 ALA HA H 1 3.776 0 . 1 . . . . A 68 ALA HA . 30904 1
522 . 1 . 1 68 68 ALA C C 13 178.418 0 . 1 . . . . A 68 ALA C . 30904 1
523 . 1 . 1 68 68 ALA CA C 13 55.763 0.01 . 1 . . . . A 68 ALA CA . 30904 1
524 . 1 . 1 68 68 ALA CB C 13 18.341 0.013 . 1 . . . . A 68 ALA CB . 30904 1
525 . 1 . 1 68 68 ALA N N 15 119.976 0 . 1 . . . . A 68 ALA N . 30904 1
526 . 1 . 1 69 69 GLN H H 1 7.656 0 . 1 . . . . A 69 GLN H . 30904 1
527 . 1 . 1 69 69 GLN HA H 1 3.987 0 . 1 . . . . A 69 GLN HA . 30904 1
528 . 1 . 1 69 69 GLN HB2 H 1 2.136 0 . 1 . . . . A 69 GLN HB2 . 30904 1
529 . 1 . 1 69 69 GLN HB3 H 1 2.136 0 . 1 . . . . A 69 GLN HB3 . 30904 1
530 . 1 . 1 69 69 GLN HG2 H 1 2.465 0 . 1 . . . . A 69 GLN HG2 . 30904 1
531 . 1 . 1 69 69 GLN HG3 H 1 2.465 0 . 1 . . . . A 69 GLN HG3 . 30904 1
532 . 1 . 1 69 69 GLN C C 13 178.466 0.007 . 1 . . . . A 69 GLN C . 30904 1
533 . 1 . 1 69 69 GLN CA C 13 58.666 0.05 . 1 . . . . A 69 GLN CA . 30904 1
534 . 1 . 1 69 69 GLN CB C 13 28.185 0.142 . 1 . . . . A 69 GLN CB . 30904 1
535 . 1 . 1 69 69 GLN CG C 13 33.701 0 . 1 . . . . A 69 GLN CG . 30904 1
536 . 1 . 1 70 70 ARG H H 1 7.786 0.001 . 1 . . . . A 70 ARG H . 30904 1
537 . 1 . 1 70 70 ARG HA H 1 4.034 0 . 1 . . . . A 70 ARG HA . 30904 1
538 . 1 . 1 70 70 ARG HB2 H 1 1.917 0 . 1 . . . . A 70 ARG HB2 . 30904 1
539 . 1 . 1 70 70 ARG HB3 H 1 1.917 0 . 1 . . . . A 70 ARG HB3 . 30904 1
540 . 1 . 1 70 70 ARG HG2 H 1 1.602 0 . 1 . . . . A 70 ARG HD2 . 30904 1
541 . 1 . 1 70 70 ARG HG3 H 1 1.602 0 . 1 . . . . A 70 ARG HD3 . 30904 1
542 . 1 . 1 70 70 ARG C C 13 180.617 0.035 . 1 . . . . A 70 ARG C . 30904 1
543 . 1 . 1 70 70 ARG CA C 13 58.74 0.03 . 1 . . . . A 70 ARG CA . 30904 1
544 . 1 . 1 70 70 ARG CB C 13 29.884 0.013 . 1 . . . . A 70 ARG CB . 30904 1
545 . 1 . 1 70 70 ARG CG C 13 27.29 0 . 1 . . . . A 70 ARG CG . 30904 1
546 . 1 . 1 70 70 ARG CD C 13 43.015 0 . 1 . . . . A 70 ARG CD . 30904 1
547 . 1 . 1 70 70 ARG N N 15 118.616 0 . 1 . . . . A 70 ARG N . 30904 1
548 . 1 . 1 71 71 LEU H H 1 8.645 0.001 . 1 . . . . A 71 LEU H . 30904 1
549 . 1 . 1 71 71 LEU HA H 1 3.858 0 . 1 . . . . A 71 LEU HA . 30904 1
550 . 1 . 1 71 71 LEU HB2 H 1 1.944 0 . 1 . . . . A 71 LEU HB2 . 30904 1
551 . 1 . 1 71 71 LEU HB3 H 1 1.944 0 . 1 . . . . A 71 LEU HB3 . 30904 1
552 . 1 . 1 71 71 LEU HG H 1 1.191 0 . 1 . . . . A 71 LEU HG . 30904 1
553 . 1 . 1 71 71 LEU HD11 H 1 0.78 0 . 2 . . . . A 71 LEU HD11 . 30904 1
554 . 1 . 1 71 71 LEU HD12 H 1 0.78 0 . 2 . . . . A 71 LEU HD12 . 30904 1
555 . 1 . 1 71 71 LEU HD13 H 1 0.78 0 . 2 . . . . A 71 LEU HD13 . 30904 1
556 . 1 . 1 71 71 LEU C C 13 178.226 0 . 1 . . . . A 71 LEU C . 30904 1
557 . 1 . 1 71 71 LEU CA C 13 57.79 0.13 . 1 . . . . A 71 LEU CA . 30904 1
558 . 1 . 1 71 71 LEU CB C 13 42.12 0.091 . 1 . . . . A 71 LEU CB . 30904 1
559 . 1 . 1 71 71 LEU CG C 13 26.304 0 . 1 . . . . A 71 LEU CG . 30904 1
560 . 1 . 1 71 71 LEU N N 15 119.642 0 . 1 . . . . A 71 LEU N . 30904 1
561 . 1 . 1 72 72 ARG H H 1 7.811 0.002 . 1 . . . . A 72 ARG H . 30904 1
562 . 1 . 1 72 72 ARG HA H 1 3.822 0 . 1 . . . . A 72 ARG HA . 30904 1
563 . 1 . 1 72 72 ARG HB2 H 1 1.889 0 . 1 . . . . A 72 ARG HB2 . 30904 1
564 . 1 . 1 72 72 ARG HB3 H 1 1.889 0 . 1 . . . . A 72 ARG HB3 . 30904 1
565 . 1 . 1 72 72 ARG HG2 H 1 1.588 0 . 1 . . . . A 72 ARG HG2 . 30904 1
566 . 1 . 1 72 72 ARG HG3 H 1 1.588 0 . 1 . . . . A 72 ARG HG3 . 30904 1
567 . 1 . 1 72 72 ARG HD2 H 1 3.149 0 . 1 . . . . A 72 ARG HD2 . 30904 1
568 . 1 . 1 72 72 ARG HD3 H 1 3.149 0 . 1 . . . . A 72 ARG HD3 . 30904 1
569 . 1 . 1 72 72 ARG C C 13 176.925 0.041 . 1 . . . . A 72 ARG C . 30904 1
570 . 1 . 1 72 72 ARG CA C 13 58.521 0.09 . 1 . . . . A 72 ARG CA . 30904 1
571 . 1 . 1 72 72 ARG CB C 13 30.377 0.142 . 1 . . . . A 72 ARG CB . 30904 1
572 . 1 . 1 72 72 ARG CD C 13 44.111 0 . 1 . . . . A 72 ARG CD . 30904 1
573 . 1 . 1 72 72 ARG N N 15 114.775 0 . 1 . . . . A 72 ARG N . 30904 1
574 . 1 . 1 73 73 GLN H H 1 7.077 0.001 . 1 . . . . A 73 GLN H . 30904 1
575 . 1 . 1 73 73 GLN HA H 1 4.351 0 . 1 . . . . A 73 GLN HA . 30904 1
576 . 1 . 1 73 73 GLN HB2 H 1 2.026 0 . 1 . . . . A 73 GLN HB2 . 30904 1
577 . 1 . 1 73 73 GLN HB3 H 1 2.026 0 . 1 . . . . A 73 GLN HB3 . 30904 1
578 . 1 . 1 73 73 GLN HG2 H 1 2.437 0 . 1 . . . . A 73 GLN HG2 . 30904 1
579 . 1 . 1 73 73 GLN HG3 H 1 2.437 0 . 1 . . . . A 73 GLN HG3 . 30904 1
580 . 1 . 1 73 73 GLN C C 13 176.281 0.028 . 1 . . . . A 73 GLN C . 30904 1
581 . 1 . 1 73 73 GLN CA C 13 55.269 0.05 . 1 . . . . A 73 GLN CA . 30904 1
582 . 1 . 1 73 73 GLN CB C 13 29.299 0.013 . 1 . . . . A 73 GLN CB . 30904 1
583 . 1 . 1 73 73 GLN CG C 13 34.084 0 . 1 . . . . A 73 GLN CG . 30904 1
584 . 1 . 1 73 73 GLN N N 15 113.33 0 . 1 . . . . A 73 GLN N . 30904 1
585 . 1 . 1 74 74 ARG H H 1 7.583 0.001 . 1 . . . . A 74 ARG H . 30904 1
586 . 1 . 1 74 74 ARG HA H 1 4.538 0 . 1 . . . . A 74 ARG HA . 30904 1
587 . 1 . 1 74 74 ARG C C 13 174.323 0 . 1 . . . . A 74 ARG C . 30904 1
588 . 1 . 1 74 74 ARG N N 15 120.785 0 . 1 . . . . A 74 ARG N . 30904 1
589 . 1 . 1 75 75 PRO HB2 H 1 2.341 0 . 1 . . . . A 75 PRO HB2 . 30904 1
590 . 1 . 1 75 75 PRO HB3 H 1 2.341 0 . 1 . . . . A 75 PRO HB3 . 30904 1
591 . 1 . 1 75 75 PRO HG2 H 1 1.862 0 . 1 . . . . A 75 PRO HG2 . 30904 1
592 . 1 . 1 75 75 PRO HG3 H 1 1.862 0 . 1 . . . . A 75 PRO HG3 . 30904 1
593 . 1 . 1 75 75 PRO C C 13 176.61 0 . 1 . . . . A 75 PRO C . 30904 1
594 . 1 . 1 75 75 PRO CA C 13 64.082 0 . 1 . . . . A 75 PRO CA . 30904 1
595 . 1 . 1 75 75 PRO CB C 13 31.756 0 . 1 . . . . A 75 PRO CB . 30904 1
596 . 1 . 1 75 75 PRO CG C 13 27.893 0 . 1 . . . . A 75 PRO CG . 30904 1
597 . 1 . 1 75 75 PRO CD C 13 50.959 0 . 1 . . . . A 75 PRO CD . 30904 1
598 . 1 . 1 76 76 ARG H H 1 8.48 0.001 . 1 . . . . A 76 ARG H . 30904 1
599 . 1 . 1 76 76 ARG HA H 1 3.611 0 . 1 . . . . A 76 ARG HA . 30904 1
600 . 1 . 1 76 76 ARG HB2 H 1 1.862 0 . 1 . . . . A 76 ARG HB2 . 30904 1
601 . 1 . 1 76 76 ARG HB3 H 1 1.862 0 . 1 . . . . A 76 ARG HB3 . 30904 1
602 . 1 . 1 76 76 ARG HG2 H 1 1.465 0 . 1 . . . . A 76 ARG HG2 . 30904 1
603 . 1 . 1 76 76 ARG HG3 H 1 1.465 0 . 1 . . . . A 76 ARG HG3 . 30904 1
604 . 1 . 1 76 76 ARG C C 13 174.029 0.021 . 1 . . . . A 76 ARG C . 30904 1
605 . 1 . 1 76 76 ARG CA C 13 57.936 0.05 . 1 . . . . A 76 ARG CA . 30904 1
606 . 1 . 1 76 76 ARG CB C 13 27.51 0.116 . 1 . . . . A 76 ARG CB . 30904 1
607 . 1 . 1 76 76 ARG CD C 13 43.289 0 . 1 . . . . A 76 ARG CD . 30904 1
608 . 1 . 1 76 76 ARG N N 15 112.726 0 . 1 . . . . A 76 ARG N . 30904 1
609 . 1 . 1 77 77 VAL H H 1 7.342 0.001 . 1 . . . . A 77 VAL H . 30904 1
610 . 1 . 1 77 77 VAL HA H 1 4.022 0 . 1 . . . . A 77 VAL HA . 30904 1
611 . 1 . 1 77 77 VAL HB H 1 2.218 0 . 1 . . . . A 77 VAL HB . 30904 1
612 . 1 . 1 77 77 VAL HG11 H 1 1.013 0 . 2 . . . . A 77 VAL HG11 . 30904 1
613 . 1 . 1 77 77 VAL HG12 H 1 1.013 0 . 2 . . . . A 77 VAL HG12 . 30904 1
614 . 1 . 1 77 77 VAL HG13 H 1 1.013 0 . 2 . . . . A 77 VAL HG13 . 30904 1
615 . 1 . 1 77 77 VAL HG21 H 1 0.643 0 . 2 . . . . A 77 VAL HG21 . 30904 1
616 . 1 . 1 77 77 VAL HG22 H 1 0.643 0 . 2 . . . . A 77 VAL HG22 . 30904 1
617 . 1 . 1 77 77 VAL HG23 H 1 0.643 0 . 2 . . . . A 77 VAL HG23 . 30904 1
618 . 1 . 1 77 77 VAL C C 13 176.055 0.048 . 1 . . . . A 77 VAL C . 30904 1
619 . 1 . 1 77 77 VAL CA C 13 63.525 0.05 . 1 . . . . A 77 VAL CA . 30904 1
620 . 1 . 1 77 77 VAL CB C 13 31.235 0.039 . 1 . . . . A 77 VAL CB . 30904 1
621 . 1 . 1 77 77 VAL CG1 C 13 22.633 0 . 1 . . . . A 77 VAL CG1 . 30904 1
622 . 1 . 1 77 77 VAL N N 15 119.288 0 . 1 . . . . A 77 VAL N . 30904 1
623 . 1 . 1 78 78 GLU H H 1 8.974 0.001 . 1 . . . . A 78 GLU H . 30904 1
624 . 1 . 1 78 78 GLU HA H 1 4.233 0 . 1 . . . . A 78 GLU HA . 30904 1
625 . 1 . 1 78 78 GLU C C 13 176.062 0 . 1 . . . . A 78 GLU C . 30904 1
626 . 1 . 1 78 78 GLU CA C 13 58.393 0.11 . 1 . . . . A 78 GLU CA . 30904 1
627 . 1 . 1 78 78 GLU CB C 13 31.582 0.091 . 1 . . . . A 78 GLU CB . 30904 1
628 . 1 . 1 78 78 GLU N N 15 129.898 0 . 1 . . . . A 78 GLU N . 30904 1
629 . 1 . 1 79 79 ARG H H 1 8.251 0.006 . 1 . . . . A 79 ARG H . 30904 1
630 . 1 . 1 79 79 ARG HA H 1 4.128 0 . 1 . . . . A 79 ARG HA . 30904 1
631 . 1 . 1 79 79 ARG C C 13 175.268 0 . 1 . . . . A 79 ARG C . 30904 1
632 . 1 . 1 79 79 ARG CA C 13 55.361 0.01 . 1 . . . . A 79 ARG CA . 30904 1
633 . 1 . 1 79 79 ARG CB C 13 31.674 0.116 . 1 . . . . A 79 ARG CB . 30904 1
634 . 1 . 1 79 79 ARG N N 15 119.782 0.035 . 1 . . . . A 79 ARG N . 30904 1
635 . 1 . 1 80 80 VAL H H 1 8.759 0.002 . 1 . . . . A 80 VAL H . 30904 1
636 . 1 . 1 80 80 VAL HA H 1 4.365 0.015 . 1 . . . . A 80 VAL HA . 30904 1
637 . 1 . 1 80 80 VAL C C 13 175.185 0 . 1 . . . . A 80 VAL C . 30904 1
638 . 1 . 1 80 80 VAL CA C 13 61.169 0.05 . 1 . . . . A 80 VAL CA . 30904 1
639 . 1 . 1 80 80 VAL CB C 13 34.03 0 . 1 . . . . A 80 VAL CB . 30904 1
640 . 1 . 1 80 80 VAL CG1 C 13 21.866 0 . 1 . . . . A 80 VAL CG1 . 30904 1
641 . 1 . 1 80 80 VAL N N 15 126.372 0.063 . 1 . . . . A 80 VAL N . 30904 1
642 . 1 . 1 81 81 GLU H H 1 8.979 0.002 . 1 . . . . A 81 GLU H . 30904 1
643 . 1 . 1 81 81 GLU HA H 1 4.82 0 . 1 . . . . A 81 GLU HA . 30904 1
644 . 1 . 1 81 81 GLU HB2 H 1 1.93 0 . 1 . . . . A 81 GLU HB2 . 30904 1
645 . 1 . 1 81 81 GLU HB3 H 1 1.93 0 . 1 . . . . A 81 GLU HB3 . 30904 1
646 . 1 . 1 81 81 GLU HG2 H 1 2.245 0 . 1 . . . . A 81 GLU HG2 . 30904 1
647 . 1 . 1 81 81 GLU HG3 H 1 2.245 0 . 1 . . . . A 81 GLU HG3 . 30904 1
648 . 1 . 1 81 81 GLU C C 13 174.863 0.035 . 1 . . . . A 81 GLU C . 30904 1
649 . 1 . 1 81 81 GLU CA C 13 54.356 0.03 . 1 . . . . A 81 GLU CA . 30904 1
650 . 1 . 1 81 81 GLU CB C 13 33.719 0.065 . 1 . . . . A 81 GLU CB . 30904 1
651 . 1 . 1 81 81 GLU CG C 13 36.44 0 . 1 . . . . A 81 GLU CG . 30904 1
652 . 1 . 1 81 81 GLU N N 15 127.204 0 . 1 . . . . A 81 GLU N . 30904 1
653 . 1 . 1 82 82 ILE H H 1 8.806 0.002 . 1 . . . . A 82 ILE H . 30904 1
654 . 1 . 1 82 82 ILE HA H 1 5.006 0.004 . 1 . . . . A 82 ILE HA . 30904 1
655 . 1 . 1 82 82 ILE HB H 1 1.656 0 . 1 . . . . A 82 ILE HB . 30904 1
656 . 1 . 1 82 82 ILE HG12 H 1 1.341 0 . 1 . . . . A 82 ILE HG12 . 30904 1
657 . 1 . 1 82 82 ILE HG13 H 1 1.341 0 . 1 . . . . A 82 ILE HG13 . 30904 1
658 . 1 . 1 82 82 ILE HD11 H 1 0.835 0 . 1 . . . . A 82 ILE HD11 . 30904 1
659 . 1 . 1 82 82 ILE HD12 H 1 0.835 0 . 1 . . . . A 82 ILE HD12 . 30904 1
660 . 1 . 1 82 82 ILE HD13 H 1 0.835 0 . 1 . . . . A 82 ILE HD13 . 30904 1
661 . 1 . 1 82 82 ILE C C 13 175.726 0.048 . 1 . . . . A 82 ILE C . 30904 1
662 . 1 . 1 82 82 ILE CA C 13 59.89 0.027 . 1 . . . . A 82 ILE CA . 30904 1
663 . 1 . 1 82 82 ILE CB C 13 40.805 0.168 . 1 . . . . A 82 ILE CB . 30904 1
664 . 1 . 1 82 82 ILE CG1 C 13 27.729 0 . 1 . . . . A 82 ILE CG1 . 30904 1
665 . 1 . 1 82 82 ILE CD1 C 13 17.812 0 . 1 . . . . A 82 ILE CD1 . 30904 1
666 . 1 . 1 82 82 ILE N N 15 123.21 0 . 1 . . . . A 82 ILE N . 30904 1
667 . 1 . 1 83 83 THR H H 1 9.298 0.004 . 1 . . . . A 83 THR H . 30904 1
668 . 1 . 1 83 83 THR HA H 1 4.55 0 . 1 . . . . A 83 THR HA . 30904 1
669 . 1 . 1 83 83 THR HB H 1 3.958 0 . 1 . . . . A 83 THR HB . 30904 1
670 . 1 . 1 83 83 THR C C 13 172.412 0.007 . 1 . . . . A 83 THR C . 30904 1
671 . 1 . 1 83 83 THR CA C 13 61.698 0.03 . 1 . . . . A 83 THR CA . 30904 1
672 . 1 . 1 83 83 THR CB C 13 71.012 0.116 . 1 . . . . A 83 THR CB . 30904 1
673 . 1 . 1 83 83 THR CG2 C 13 21.65 0 . 1 . . . . A 83 THR CG2 . 30904 1
674 . 1 . 1 83 83 THR N N 15 124.579 0 . 1 . . . . A 83 THR N . 30904 1
675 . 1 . 1 84 84 GLU H H 1 8.796 0.002 . 1 . . . . A 84 GLU H . 30904 1
676 . 1 . 1 84 84 GLU HA H 1 4.543 0.004 . 1 . . . . A 84 GLU HA . 30904 1
677 . 1 . 1 84 84 GLU C C 13 172.583 0 . 1 . . . . A 84 GLU C . 30904 1
678 . 1 . 1 84 84 GLU CA C 13 55.233 0 . 1 . . . . A 84 GLU CA . 30904 1
679 . 1 . 1 84 84 GLU CB C 13 31.783 0 . 1 . . . . A 84 GLU CB . 30904 1
680 . 1 . 1 84 84 GLU N N 15 127.447 0.006 . 1 . . . . A 84 GLU N . 30904 1
681 . 1 . 1 85 85 VAL C C 13 176.226 0 . 1 . . . . A 85 VAL C . 30904 1
682 . 1 . 1 85 85 VAL CA C 13 62.328 0 . 1 . . . . A 85 VAL CA . 30904 1
683 . 1 . 1 85 85 VAL CB C 13 32.797 0 . 1 . . . . A 85 VAL CB . 30904 1
684 . 1 . 1 85 85 VAL CG1 C 13 21.099 0 . 1 . . . . A 85 VAL CG1 . 30904 1
685 . 1 . 1 86 86 THR H H 1 8.334 0.002 . 1 . . . . A 86 THR H . 30904 1
686 . 1 . 1 86 86 THR HA H 1 4.386 0 . 1 . . . . A 86 THR HA . 30904 1
687 . 1 . 1 86 86 THR C C 13 173.659 0.02 . 1 . . . . A 86 THR C . 30904 1
688 . 1 . 1 86 86 THR CA C 13 61.205 0.33 . 1 . . . . A 86 THR CA . 30904 1
689 . 1 . 1 86 86 THR CB C 13 70.008 0.013 . 1 . . . . A 86 THR CB . 30904 1
690 . 1 . 1 86 86 THR CG2 C 13 21.921 0 . 1 . . . . A 86 THR CG2 . 30904 1
691 . 1 . 1 86 86 THR N N 15 118.871 0.04 . 1 . . . . A 86 THR N . 30904 1
692 . 1 . 1 87 87 GLU H H 1 8.082 0.002 . 1 . . . . A 87 GLU H . 30904 1
693 . 1 . 1 87 87 GLU HA H 1 4.151 0 . 1 . . . . A 87 GLU HA . 30904 1
694 . 1 . 1 87 87 GLU CA C 13 57.753 0 . 1 . . . . A 87 GLU CA . 30904 1
695 . 1 . 1 87 87 GLU CB C 13 31.728 0 . 1 . . . . A 87 GLU CB . 30904 1
696 . 1 . 1 87 87 GLU N N 15 128.438 0.012 . 1 . . . . A 87 GLU N . 30904 1
stop_
save_