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 31018
_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 0.02
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.1
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 1H-15N NOESY' . . . 31018 1
2 '3D 1H-13C NOESY aliphatic' . . . 31018 1
3 '3D 1H-13C NOESY aromatic' . . . 31018 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 1 1 MET HA H 1 3.980 0.000 . . . . . . A 1 MET HA . 31018 1
2 . 1 . 1 1 1 MET HB2 H 1 2.056 0.000 . . . . . . A 1 MET HB2 . 31018 1
3 . 1 . 1 1 1 MET HB3 H 1 2.056 0.000 . . . . . . A 1 MET HB3 . 31018 1
4 . 1 . 1 1 1 MET HG2 H 1 2.558 0.000 . . . . . . A 1 MET HG2 . 31018 1
5 . 1 . 1 1 1 MET HG3 H 1 2.558 0.000 . . . . . . A 1 MET HG3 . 31018 1
6 . 1 . 1 1 1 MET HE1 H 1 2.042 0.000 . . . . . . A 1 MET HE1 . 31018 1
7 . 1 . 1 1 1 MET HE2 H 1 2.042 0.000 . . . . . . A 1 MET HE2 . 31018 1
8 . 1 . 1 1 1 MET HE3 H 1 2.042 0.000 . . . . . . A 1 MET HE3 . 31018 1
9 . 1 . 1 1 1 MET CA C 13 55.786 0.000 . . . . . . A 1 MET CA . 31018 1
10 . 1 . 1 1 1 MET CB C 13 34.098 0.000 . . . . . . A 1 MET CB . 31018 1
11 . 1 . 1 1 1 MET CG C 13 31.509 0.000 . . . . . . A 1 MET CG . 31018 1
12 . 1 . 1 1 1 MET CE C 13 17.290 0.000 . . . . . . A 1 MET CE . 31018 1
13 . 1 . 1 2 2 ASP HA H 1 4.614 0.000 . . . . . . A 2 ASP HA . 31018 1
14 . 1 . 1 2 2 ASP HB2 H 1 2.686 0.000 . . . . . . A 2 ASP HB2 . 31018 1
15 . 1 . 1 2 2 ASP HB3 H 1 2.613 0.000 . . . . . . A 2 ASP HB3 . 31018 1
16 . 1 . 1 2 2 ASP C C 13 175.851 0.000 . . . . . . A 2 ASP C . 31018 1
17 . 1 . 1 2 2 ASP CA C 13 55.152 0.000 . . . . . . A 2 ASP CA . 31018 1
18 . 1 . 1 2 2 ASP CB C 13 41.990 0.000 . . . . . . A 2 ASP CB . 31018 1
19 . 1 . 1 3 3 GLY H H 1 8.243 0.000 . . . . . . A 3 GLY H . 31018 1
20 . 1 . 1 3 3 GLY HA2 H 1 3.789 0.000 . . . . . . A 3 GLY HA2 . 31018 1
21 . 1 . 1 3 3 GLY HA3 H 1 3.639 0.000 . . . . . . A 3 GLY HA3 . 31018 1
22 . 1 . 1 3 3 GLY C C 13 173.809 0.000 . . . . . . A 3 GLY C . 31018 1
23 . 1 . 1 3 3 GLY CA C 13 45.498 0.000 . . . . . . A 3 GLY CA . 31018 1
24 . 1 . 1 3 3 GLY N N 15 108.112 0.000 . . . . . . A 3 GLY N . 31018 1
25 . 1 . 1 4 4 PHE H H 1 7.592 0.000 . . . . . . A 4 PHE H . 31018 1
26 . 1 . 1 4 4 PHE HA H 1 4.501 0.000 . . . . . . A 4 PHE HA . 31018 1
27 . 1 . 1 4 4 PHE HB2 H 1 2.897 0.000 . . . . . . A 4 PHE HB2 . 31018 1
28 . 1 . 1 4 4 PHE HB3 H 1 2.586 0.000 . . . . . . A 4 PHE HB3 . 31018 1
29 . 1 . 1 4 4 PHE HD1 H 1 6.842 0.000 . . . . . . A 4 PHE HD1 . 31018 1
30 . 1 . 1 4 4 PHE HD2 H 1 6.842 0.000 . . . . . . A 4 PHE HD2 . 31018 1
31 . 1 . 1 4 4 PHE HE1 H 1 7.129 0.000 . . . . . . A 4 PHE HE1 . 31018 1
32 . 1 . 1 4 4 PHE HE2 H 1 7.129 0.000 . . . . . . A 4 PHE HE2 . 31018 1
33 . 1 . 1 4 4 PHE HZ H 1 7.235 0.000 . . . . . . A 4 PHE HZ . 31018 1
34 . 1 . 1 4 4 PHE C C 13 174.595 0.000 . . . . . . A 4 PHE C . 31018 1
35 . 1 . 1 4 4 PHE CA C 13 57.183 0.000 . . . . . . A 4 PHE CA . 31018 1
36 . 1 . 1 4 4 PHE CB C 13 39.546 0.000 . . . . . . A 4 PHE CB . 31018 1
37 . 1 . 1 4 4 PHE CD1 C 13 131.532 0.000 . . . . . . A 4 PHE CD1 . 31018 1
38 . 1 . 1 4 4 PHE CE1 C 13 131.532 0.000 . . . . . . A 4 PHE CE1 . 31018 1
39 . 1 . 1 4 4 PHE CZ C 13 129.978 0.000 . . . . . . A 4 PHE CZ . 31018 1
40 . 1 . 1 4 4 PHE N N 15 119.503 0.000 . . . . . . A 4 PHE N . 31018 1
41 . 1 . 1 5 5 ASP H H 1 7.828 0.001 . . . . . . A 5 ASP H . 31018 1
42 . 1 . 1 5 5 ASP HA H 1 4.673 0.000 . . . . . . A 5 ASP HA . 31018 1
43 . 1 . 1 5 5 ASP HB2 H 1 2.696 0.000 . . . . . . A 5 ASP HB2 . 31018 1
44 . 1 . 1 5 5 ASP HB3 H 1 2.503 0.000 . . . . . . A 5 ASP HB3 . 31018 1
45 . 1 . 1 5 5 ASP C C 13 175.904 0.000 . . . . . . A 5 ASP C . 31018 1
46 . 1 . 1 5 5 ASP CA C 13 53.951 0.000 . . . . . . A 5 ASP CA . 31018 1
47 . 1 . 1 5 5 ASP CB C 13 42.611 0.000 . . . . . . A 5 ASP CB . 31018 1
48 . 1 . 1 5 5 ASP N N 15 120.850 0.000 . . . . . . A 5 ASP N . 31018 1
49 . 1 . 1 6 6 ARG H H 1 8.447 0.001 . . . . . . A 6 ARG H . 31018 1
50 . 1 . 1 6 6 ARG HA H 1 3.880 0.000 . . . . . . A 6 ARG HA . 31018 1
51 . 1 . 1 6 6 ARG HB2 H 1 1.848 0.000 . . . . . . A 6 ARG HB2 . 31018 1
52 . 1 . 1 6 6 ARG HB3 H 1 1.848 0.000 . . . . . . A 6 ARG HB3 . 31018 1
53 . 1 . 1 6 6 ARG HG2 H 1 1.831 0.000 . . . . . . A 6 ARG HG2 . 31018 1
54 . 1 . 1 6 6 ARG HG3 H 1 1.634 0.000 . . . . . . A 6 ARG HG3 . 31018 1
55 . 1 . 1 6 6 ARG HD2 H 1 3.297 0.000 . . . . . . A 6 ARG HD2 . 31018 1
56 . 1 . 1 6 6 ARG HD3 H 1 3.297 0.000 . . . . . . A 6 ARG HD3 . 31018 1
57 . 1 . 1 6 6 ARG C C 13 177.618 0.000 . . . . . . A 6 ARG C . 31018 1
58 . 1 . 1 6 6 ARG CA C 13 58.343 0.000 . . . . . . A 6 ARG CA . 31018 1
59 . 1 . 1 6 6 ARG CB C 13 30.264 0.000 . . . . . . A 6 ARG CB . 31018 1
60 . 1 . 1 6 6 ARG CG C 13 27.737 0.000 . . . . . . A 6 ARG CG . 31018 1
61 . 1 . 1 6 6 ARG CD C 13 44.062 0.000 . . . . . . A 6 ARG CD . 31018 1
62 . 1 . 1 6 6 ARG N N 15 121.302 0.000 . . . . . . A 6 ARG N . 31018 1
63 . 1 . 1 7 7 GLY H H 1 9.032 0.001 . . . . . . A 7 GLY H . 31018 1
64 . 1 . 1 7 7 GLY HA2 H 1 4.325 0.000 . . . . . . A 7 GLY HA2 . 31018 1
65 . 1 . 1 7 7 GLY HA3 H 1 3.743 0.000 . . . . . . A 7 GLY HA3 . 31018 1
66 . 1 . 1 7 7 GLY C C 13 173.929 0.000 . . . . . . A 7 GLY C . 31018 1
67 . 1 . 1 7 7 GLY CA C 13 45.511 0.000 . . . . . . A 7 GLY CA . 31018 1
68 . 1 . 1 7 7 GLY N N 15 113.548 0.000 . . . . . . A 7 GLY N . 31018 1
69 . 1 . 1 8 8 ALA H H 1 8.067 0.000 . . . . . . A 8 ALA H . 31018 1
70 . 1 . 1 8 8 ALA HA H 1 4.386 0.000 . . . . . . A 8 ALA HA . 31018 1
71 . 1 . 1 8 8 ALA HB1 H 1 1.499 0.000 . . . . . . A 8 ALA HB1 . 31018 1
72 . 1 . 1 8 8 ALA HB2 H 1 1.499 0.000 . . . . . . A 8 ALA HB2 . 31018 1
73 . 1 . 1 8 8 ALA HB3 H 1 1.499 0.000 . . . . . . A 8 ALA HB3 . 31018 1
74 . 1 . 1 8 8 ALA C C 13 176.878 0.000 . . . . . . A 8 ALA C . 31018 1
75 . 1 . 1 8 8 ALA CA C 13 52.832 0.000 . . . . . . A 8 ALA CA . 31018 1
76 . 1 . 1 8 8 ALA CB C 13 20.072 0.000 . . . . . . A 8 ALA CB . 31018 1
77 . 1 . 1 8 8 ALA N N 15 123.367 0.000 . . . . . . A 8 ALA N . 31018 1
78 . 1 . 1 9 9 ASP H H 1 8.247 0.000 . . . . . . A 9 ASP H . 31018 1
79 . 1 . 1 9 9 ASP HA H 1 5.423 0.000 . . . . . . A 9 ASP HA . 31018 1
80 . 1 . 1 9 9 ASP HB2 H 1 2.632 0.000 . . . . . . A 9 ASP HB2 . 31018 1
81 . 1 . 1 9 9 ASP HB3 H 1 2.493 0.000 . . . . . . A 9 ASP HB3 . 31018 1
82 . 1 . 1 9 9 ASP C C 13 176.768 0.000 . . . . . . A 9 ASP C . 31018 1
83 . 1 . 1 9 9 ASP CA C 13 54.489 0.000 . . . . . . A 9 ASP CA . 31018 1
84 . 1 . 1 9 9 ASP CB C 13 42.694 0.000 . . . . . . A 9 ASP CB . 31018 1
85 . 1 . 1 9 9 ASP N N 15 119.751 0.000 . . . . . . A 9 ASP N . 31018 1
86 . 1 . 1 10 10 VAL H H 1 9.012 0.001 . . . . . . A 10 VAL H . 31018 1
87 . 1 . 1 10 10 VAL HA H 1 4.953 0.000 . . . . . . A 10 VAL HA . 31018 1
88 . 1 . 1 10 10 VAL HB H 1 2.042 0.000 . . . . . . A 10 VAL HB . 31018 1
89 . 1 . 1 10 10 VAL HG11 H 1 0.811 0.000 . . . . . . A 10 VAL HG11 . 31018 1
90 . 1 . 1 10 10 VAL HG12 H 1 0.811 0.000 . . . . . . A 10 VAL HG12 . 31018 1
91 . 1 . 1 10 10 VAL HG13 H 1 0.811 0.000 . . . . . . A 10 VAL HG13 . 31018 1
92 . 1 . 1 10 10 VAL HG21 H 1 0.839 0.000 . . . . . . A 10 VAL HG21 . 31018 1
93 . 1 . 1 10 10 VAL HG22 H 1 0.839 0.000 . . . . . . A 10 VAL HG22 . 31018 1
94 . 1 . 1 10 10 VAL HG23 H 1 0.839 0.000 . . . . . . A 10 VAL HG23 . 31018 1
95 . 1 . 1 10 10 VAL C C 13 174.828 0.000 . . . . . . A 10 VAL C . 31018 1
96 . 1 . 1 10 10 VAL CA C 13 59.793 0.000 . . . . . . A 10 VAL CA . 31018 1
97 . 1 . 1 10 10 VAL CB C 13 35.609 0.000 . . . . . . A 10 VAL CB . 31018 1
98 . 1 . 1 10 10 VAL CG1 C 13 22.682 0.000 . . . . . . A 10 VAL CG1 . 31018 1
99 . 1 . 1 10 10 VAL CG2 C 13 20.610 0.000 . . . . . . A 10 VAL CG2 . 31018 1
100 . 1 . 1 10 10 VAL N N 15 116.997 0.000 . . . . . . A 10 VAL N . 31018 1
101 . 1 . 1 11 11 THR H H 1 8.839 0.001 . . . . . . A 11 THR H . 31018 1
102 . 1 . 1 11 11 THR HA H 1 5.313 0.000 . . . . . . A 11 THR HA . 31018 1
103 . 1 . 1 11 11 THR HB H 1 3.952 0.000 . . . . . . A 11 THR HB . 31018 1
104 . 1 . 1 11 11 THR HG21 H 1 1.105 0.000 . . . . . . A 11 THR HG21 . 31018 1
105 . 1 . 1 11 11 THR HG22 H 1 1.105 0.000 . . . . . . A 11 THR HG22 . 31018 1
106 . 1 . 1 11 11 THR HG23 H 1 1.105 0.000 . . . . . . A 11 THR HG23 . 31018 1
107 . 1 . 1 11 11 THR C C 13 173.638 0.000 . . . . . . A 11 THR C . 31018 1
108 . 1 . 1 11 11 THR CA C 13 61.201 0.000 . . . . . . A 11 THR CA . 31018 1
109 . 1 . 1 11 11 THR CB C 13 71.698 0.000 . . . . . . A 11 THR CB . 31018 1
110 . 1 . 1 11 11 THR CG2 C 13 22.019 0.000 . . . . . . A 11 THR CG2 . 31018 1
111 . 1 . 1 11 11 THR N N 15 116.152 0.000 . . . . . . A 11 THR N . 31018 1
112 . 1 . 1 12 12 TYR H H 1 8.874 0.000 . . . . . . A 12 TYR H . 31018 1
113 . 1 . 1 12 12 TYR HA H 1 4.868 0.000 . . . . . . A 12 TYR HA . 31018 1
114 . 1 . 1 12 12 TYR HB2 H 1 2.736 0.000 . . . . . . A 12 TYR HB2 . 31018 1
115 . 1 . 1 12 12 TYR HB3 H 1 2.642 0.000 . . . . . . A 12 TYR HB3 . 31018 1
116 . 1 . 1 12 12 TYR HD1 H 1 6.829 0.000 . . . . . . A 12 TYR HD1 . 31018 1
117 . 1 . 1 12 12 TYR HD2 H 1 6.829 0.000 . . . . . . A 12 TYR HD2 . 31018 1
118 . 1 . 1 12 12 TYR HE1 H 1 6.670 0.000 . . . . . . A 12 TYR HE1 . 31018 1
119 . 1 . 1 12 12 TYR HE2 H 1 6.670 0.000 . . . . . . A 12 TYR HE2 . 31018 1
120 . 1 . 1 12 12 TYR C C 13 174.273 0.000 . . . . . . A 12 TYR C . 31018 1
121 . 1 . 1 12 12 TYR CA C 13 56.768 0.000 . . . . . . A 12 TYR CA . 31018 1
122 . 1 . 1 12 12 TYR CB C 13 42.900 0.000 . . . . . . A 12 TYR CB . 31018 1
123 . 1 . 1 12 12 TYR CD1 C 13 133.344 0.000 . . . . . . A 12 TYR CD1 . 31018 1
124 . 1 . 1 12 12 TYR CE1 C 13 118.584 0.000 . . . . . . A 12 TYR CE1 . 31018 1
125 . 1 . 1 12 12 TYR N N 15 125.409 0.000 . . . . . . A 12 TYR N . 31018 1
126 . 1 . 1 13 13 THR H H 1 7.900 0.000 . . . . . . A 13 THR H . 31018 1
127 . 1 . 1 13 13 THR HA H 1 4.699 0.000 . . . . . . A 13 THR HA . 31018 1
128 . 1 . 1 13 13 THR HB H 1 3.876 0.000 . . . . . . A 13 THR HB . 31018 1
129 . 1 . 1 13 13 THR HG21 H 1 1.118 0.000 . . . . . . A 13 THR HG21 . 31018 1
130 . 1 . 1 13 13 THR HG22 H 1 1.118 0.000 . . . . . . A 13 THR HG22 . 31018 1
131 . 1 . 1 13 13 THR HG23 H 1 1.118 0.000 . . . . . . A 13 THR HG23 . 31018 1
132 . 1 . 1 13 13 THR C C 13 173.359 0.000 . . . . . . A 13 THR C . 31018 1
133 . 1 . 1 13 13 THR CA C 13 61.933 0.000 . . . . . . A 13 THR CA . 31018 1
134 . 1 . 1 13 13 THR CB C 13 69.833 0.000 . . . . . . A 13 THR CB . 31018 1
135 . 1 . 1 13 13 THR CG2 C 13 21.356 0.000 . . . . . . A 13 THR CG2 . 31018 1
136 . 1 . 1 13 13 THR N N 15 123.085 0.000 . . . . . . A 13 THR N . 31018 1
137 . 1 . 1 14 14 ASP H H 1 8.560 0.000 . . . . . . A 14 ASP H . 31018 1
138 . 1 . 1 14 14 ASP HA H 1 4.651 0.000 . . . . . . A 14 ASP HA . 31018 1
139 . 1 . 1 14 14 ASP HB2 H 1 3.032 0.000 . . . . . . A 14 ASP HB2 . 31018 1
140 . 1 . 1 14 14 ASP HB3 H 1 2.779 0.000 . . . . . . A 14 ASP HB3 . 31018 1
141 . 1 . 1 14 14 ASP C C 13 178.495 0.000 . . . . . . A 14 ASP C . 31018 1
142 . 1 . 1 14 14 ASP CA C 13 53.081 0.000 . . . . . . A 14 ASP CA . 31018 1
143 . 1 . 1 14 14 ASP CB C 13 42.819 0.000 . . . . . . A 14 ASP CB . 31018 1
144 . 1 . 1 14 14 ASP N N 15 126.266 0.000 . . . . . . A 14 ASP N . 31018 1
145 . 1 . 1 15 15 SER H H 1 9.120 0.006 . . . . . . A 15 SER H . 31018 1
146 . 1 . 1 15 15 SER HA H 1 4.207 0.000 . . . . . . A 15 SER HA . 31018 1
147 . 1 . 1 15 15 SER HB2 H 1 4.014 0.000 . . . . . . A 15 SER HB2 . 31018 1
148 . 1 . 1 15 15 SER HB3 H 1 3.981 0.000 . . . . . . A 15 SER HB3 . 31018 1
149 . 1 . 1 15 15 SER C C 13 175.018 0.000 . . . . . . A 15 SER C . 31018 1
150 . 1 . 1 15 15 SER CA C 13 61.284 0.000 . . . . . . A 15 SER CA . 31018 1
151 . 1 . 1 15 15 SER CB C 13 63.576 0.000 . . . . . . A 15 SER CB . 31018 1
152 . 1 . 1 15 15 SER N N 15 116.785 0.000 . . . . . . A 15 SER N . 31018 1
153 . 1 . 1 16 16 ASP H H 1 8.121 0.000 . . . . . . A 16 ASP H . 31018 1
154 . 1 . 1 16 16 ASP HA H 1 4.663 0.000 . . . . . . A 16 ASP HA . 31018 1
155 . 1 . 1 16 16 ASP HB2 H 1 2.978 0.000 . . . . . . A 16 ASP HB2 . 31018 1
156 . 1 . 1 16 16 ASP HB3 H 1 2.733 0.000 . . . . . . A 16 ASP HB3 . 31018 1
157 . 1 . 1 16 16 ASP C C 13 177.233 0.000 . . . . . . A 16 ASP C . 31018 1
158 . 1 . 1 16 16 ASP CA C 13 54.034 0.000 . . . . . . A 16 ASP CA . 31018 1
159 . 1 . 1 16 16 ASP CB C 13 40.871 0.000 . . . . . . A 16 ASP CB . 31018 1
160 . 1 . 1 16 16 ASP N N 15 119.554 0.000 . . . . . . A 16 ASP N . 31018 1
161 . 1 . 1 17 17 GLY H H 1 8.209 0.001 . . . . . . A 17 GLY H . 31018 1
162 . 1 . 1 17 17 GLY HA2 H 1 4.262 0.000 . . . . . . A 17 GLY HA2 . 31018 1
163 . 1 . 1 17 17 GLY HA3 H 1 3.560 0.000 . . . . . . A 17 GLY HA3 . 31018 1
164 . 1 . 1 17 17 GLY C C 13 174.663 0.000 . . . . . . A 17 GLY C . 31018 1
165 . 1 . 1 17 17 GLY CA C 13 45.540 0.000 . . . . . . A 17 GLY CA . 31018 1
166 . 1 . 1 17 17 GLY N N 15 108.827 0.000 . . . . . . A 17 GLY N . 31018 1
167 . 1 . 1 18 18 SER H H 1 8.261 0.003 . . . . . . A 18 SER H . 31018 1
168 . 1 . 1 18 18 SER HA H 1 4.370 0.000 . . . . . . A 18 SER HA . 31018 1
169 . 1 . 1 18 18 SER HB2 H 1 3.970 0.000 . . . . . . A 18 SER HB2 . 31018 1
170 . 1 . 1 18 18 SER HB3 H 1 3.912 0.000 . . . . . . A 18 SER HB3 . 31018 1
171 . 1 . 1 18 18 SER C C 13 173.399 0.000 . . . . . . A 18 SER C . 31018 1
172 . 1 . 1 18 18 SER CA C 13 59.192 0.000 . . . . . . A 18 SER CA . 31018 1
173 . 1 . 1 18 18 SER CB C 13 64.115 0.000 . . . . . . A 18 SER CB . 31018 1
174 . 1 . 1 18 18 SER N N 15 118.114 0.000 . . . . . . A 18 SER N . 31018 1
175 . 1 . 1 19 19 LYS H H 1 8.388 0.000 . . . . . . A 19 LYS H . 31018 1
176 . 1 . 1 19 19 LYS HA H 1 4.944 0.000 . . . . . . A 19 LYS HA . 31018 1
177 . 1 . 1 19 19 LYS HB2 H 1 1.699 0.000 . . . . . . A 19 LYS HB2 . 31018 1
178 . 1 . 1 19 19 LYS HB3 H 1 1.645 0.000 . . . . . . A 19 LYS HB3 . 31018 1
179 . 1 . 1 19 19 LYS HG2 H 1 1.407 0.000 . . . . . . A 19 LYS HG2 . 31018 1
180 . 1 . 1 19 19 LYS HG3 H 1 1.350 0.000 . . . . . . A 19 LYS HG3 . 31018 1
181 . 1 . 1 19 19 LYS HD2 H 1 1.602 0.000 . . . . . . A 19 LYS HD2 . 31018 1
182 . 1 . 1 19 19 LYS HD3 H 1 1.602 0.000 . . . . . . A 19 LYS HD3 . 31018 1
183 . 1 . 1 19 19 LYS HE2 H 1 2.943 0.000 . . . . . . A 19 LYS HE2 . 31018 1
184 . 1 . 1 19 19 LYS HE3 H 1 2.943 0.000 . . . . . . A 19 LYS HE3 . 31018 1
185 . 1 . 1 19 19 LYS C C 13 176.581 0.000 . . . . . . A 19 LYS C . 31018 1
186 . 1 . 1 19 19 LYS CA C 13 56.050 0.000 . . . . . . A 19 LYS CA . 31018 1
187 . 1 . 1 19 19 LYS CB C 13 34.160 0.000 . . . . . . A 19 LYS CB . 31018 1
188 . 1 . 1 19 19 LYS CG C 13 25.251 0.000 . . . . . . A 19 LYS CG . 31018 1
189 . 1 . 1 19 19 LYS CD C 13 29.643 0.000 . . . . . . A 19 LYS CD . 31018 1
190 . 1 . 1 19 19 LYS CE C 13 42.514 0.000 . . . . . . A 19 LYS CE . 31018 1
191 . 1 . 1 19 19 LYS N N 15 122.532 0.000 . . . . . . A 19 LYS N . 31018 1
192 . 1 . 1 20 20 LYS H H 1 8.743 0.000 . . . . . . A 20 LYS H . 31018 1
193 . 1 . 1 20 20 LYS HA H 1 4.547 0.000 . . . . . . A 20 LYS HA . 31018 1
194 . 1 . 1 20 20 LYS HB2 H 1 1.602 0.000 . . . . . . A 20 LYS HB2 . 31018 1
195 . 1 . 1 20 20 LYS HB3 H 1 1.562 0.000 . . . . . . A 20 LYS HB3 . 31018 1
196 . 1 . 1 20 20 LYS HG2 H 1 1.462 0.000 . . . . . . A 20 LYS HG2 . 31018 1
197 . 1 . 1 20 20 LYS HG3 H 1 1.363 0.000 . . . . . . A 20 LYS HG3 . 31018 1
198 . 1 . 1 20 20 LYS HD2 H 1 1.757 0.000 . . . . . . A 20 LYS HD2 . 31018 1
199 . 1 . 1 20 20 LYS HD3 H 1 1.699 0.000 . . . . . . A 20 LYS HD3 . 31018 1
200 . 1 . 1 20 20 LYS HE2 H 1 3.032 0.000 . . . . . . A 20 LYS HE2 . 31018 1
201 . 1 . 1 20 20 LYS HE3 H 1 3.032 0.000 . . . . . . A 20 LYS HE3 . 31018 1
202 . 1 . 1 20 20 LYS C C 13 175.107 0.000 . . . . . . A 20 LYS C . 31018 1
203 . 1 . 1 20 20 LYS CA C 13 55.194 0.000 . . . . . . A 20 LYS CA . 31018 1
204 . 1 . 1 20 20 LYS CB C 13 36.065 0.000 . . . . . . A 20 LYS CB . 31018 1
205 . 1 . 1 20 20 LYS CG C 13 25.582 0.000 . . . . . . A 20 LYS CG . 31018 1
206 . 1 . 1 20 20 LYS CD C 13 29.229 0.000 . . . . . . A 20 LYS CD . 31018 1
207 . 1 . 1 20 20 LYS CE C 13 42.902 0.000 . . . . . . A 20 LYS CE . 31018 1
208 . 1 . 1 20 20 LYS N N 15 124.933 0.000 . . . . . . A 20 LYS N . 31018 1
209 . 1 . 1 21 21 THR H H 1 8.016 0.000 . . . . . . A 21 THR H . 31018 1
210 . 1 . 1 21 21 THR HA H 1 5.086 0.000 . . . . . . A 21 THR HA . 31018 1
211 . 1 . 1 21 21 THR HB H 1 3.919 0.000 . . . . . . A 21 THR HB . 31018 1
212 . 1 . 1 21 21 THR HG21 H 1 1.159 0.000 . . . . . . A 21 THR HG21 . 31018 1
213 . 1 . 1 21 21 THR HG22 H 1 1.159 0.000 . . . . . . A 21 THR HG22 . 31018 1
214 . 1 . 1 21 21 THR HG23 H 1 1.159 0.000 . . . . . . A 21 THR HG23 . 31018 1
215 . 1 . 1 21 21 THR C C 13 173.638 0.000 . . . . . . A 21 THR C . 31018 1
216 . 1 . 1 21 21 THR CA C 13 61.674 0.000 . . . . . . A 21 THR CA . 31018 1
217 . 1 . 1 21 21 THR CB C 13 70.870 0.000 . . . . . . A 21 THR CB . 31018 1
218 . 1 . 1 21 21 THR CG2 C 13 21.936 0.000 . . . . . . A 21 THR CG2 . 31018 1
219 . 1 . 1 21 21 THR N N 15 116.434 0.000 . . . . . . A 21 THR N . 31018 1
220 . 1 . 1 22 22 TYR H H 1 9.039 0.000 . . . . . . A 22 TYR H . 31018 1
221 . 1 . 1 22 22 TYR HA H 1 5.091 0.000 . . . . . . A 22 TYR HA . 31018 1
222 . 1 . 1 22 22 TYR HB2 H 1 2.372 0.000 . . . . . . A 22 TYR HB2 . 31018 1
223 . 1 . 1 22 22 TYR HB3 H 1 3.008 0.000 . . . . . . A 22 TYR HB3 . 31018 1
224 . 1 . 1 22 22 TYR HD1 H 1 6.760 0.000 . . . . . . A 22 TYR HD1 . 31018 1
225 . 1 . 1 22 22 TYR HD2 H 1 6.760 0.000 . . . . . . A 22 TYR HD2 . 31018 1
226 . 1 . 1 22 22 TYR HE1 H 1 6.624 0.000 . . . . . . A 22 TYR HE1 . 31018 1
227 . 1 . 1 22 22 TYR HE2 H 1 6.624 0.000 . . . . . . A 22 TYR HE2 . 31018 1
228 . 1 . 1 22 22 TYR C C 13 174.270 0.000 . . . . . . A 22 TYR C . 31018 1
229 . 1 . 1 22 22 TYR CA C 13 56.147 0.000 . . . . . . A 22 TYR CA . 31018 1
230 . 1 . 1 22 22 TYR CB C 13 43.523 0.000 . . . . . . A 22 TYR CB . 31018 1
231 . 1 . 1 22 22 TYR CD1 C 13 132.826 0.000 . . . . . . A 22 TYR CD1 . 31018 1
232 . 1 . 1 22 22 TYR CE1 C 13 118.325 0.000 . . . . . . A 22 TYR CE1 . 31018 1
233 . 1 . 1 22 22 TYR N N 15 123.613 0.000 . . . . . . A 22 TYR N . 31018 1
234 . 1 . 1 23 23 LYS H H 1 8.405 0.000 . . . . . . A 23 LYS H . 31018 1
235 . 1 . 1 23 23 LYS HA H 1 5.299 0.000 . . . . . . A 23 LYS HA . 31018 1
236 . 1 . 1 23 23 LYS HB2 H 1 1.830 0.000 . . . . . . A 23 LYS HB2 . 31018 1
237 . 1 . 1 23 23 LYS HB3 H 1 1.711 0.000 . . . . . . A 23 LYS HB3 . 31018 1
238 . 1 . 1 23 23 LYS HG2 H 1 1.452 0.000 . . . . . . A 23 LYS HG2 . 31018 1
239 . 1 . 1 23 23 LYS HG3 H 1 1.452 0.000 . . . . . . A 23 LYS HG3 . 31018 1
240 . 1 . 1 23 23 LYS HD2 H 1 1.717 0.000 . . . . . . A 23 LYS HD2 . 31018 1
241 . 1 . 1 23 23 LYS HD3 H 1 1.738 0.000 . . . . . . A 23 LYS HD3 . 31018 1
242 . 1 . 1 23 23 LYS HE2 H 1 3.027 0.000 . . . . . . A 23 LYS HE2 . 31018 1
243 . 1 . 1 23 23 LYS HE3 H 1 3.027 0.000 . . . . . . A 23 LYS HE3 . 31018 1
244 . 1 . 1 23 23 LYS C C 13 177.482 0.000 . . . . . . A 23 LYS C . 31018 1
245 . 1 . 1 23 23 LYS CA C 13 54.845 0.000 . . . . . . A 23 LYS CA . 31018 1
246 . 1 . 1 23 23 LYS CB C 13 35.568 0.000 . . . . . . A 23 LYS CB . 31018 1
247 . 1 . 1 23 23 LYS CG C 13 24.837 0.000 . . . . . . A 23 LYS CG . 31018 1
248 . 1 . 1 23 23 LYS CD C 13 29.311 0.000 . . . . . . A 23 LYS CD . 31018 1
249 . 1 . 1 23 23 LYS CE C 13 42.239 0.000 . . . . . . A 23 LYS CE . 31018 1
250 . 1 . 1 23 23 LYS N N 15 119.854 0.000 . . . . . . A 23 LYS N . 31018 1
251 . 1 . 1 24 24 VAL H H 1 9.083 0.000 . . . . . . A 24 VAL H . 31018 1
252 . 1 . 1 24 24 VAL HA H 1 3.768 0.000 . . . . . . A 24 VAL HA . 31018 1
253 . 1 . 1 24 24 VAL HB H 1 2.345 0.000 . . . . . . A 24 VAL HB . 31018 1
254 . 1 . 1 24 24 VAL HG11 H 1 0.727 0.000 . . . . . . A 24 VAL HG11 . 31018 1
255 . 1 . 1 24 24 VAL HG12 H 1 0.727 0.000 . . . . . . A 24 VAL HG12 . 31018 1
256 . 1 . 1 24 24 VAL HG13 H 1 0.727 0.000 . . . . . . A 24 VAL HG13 . 31018 1
257 . 1 . 1 24 24 VAL HG21 H 1 0.961 0.000 . . . . . . A 24 VAL HG21 . 31018 1
258 . 1 . 1 24 24 VAL HG22 H 1 0.961 0.000 . . . . . . A 24 VAL HG22 . 31018 1
259 . 1 . 1 24 24 VAL HG23 H 1 0.961 0.000 . . . . . . A 24 VAL HG23 . 31018 1
260 . 1 . 1 24 24 VAL C C 13 176.462 0.000 . . . . . . A 24 VAL C . 31018 1
261 . 1 . 1 24 24 VAL CA C 13 65.502 0.000 . . . . . . A 24 VAL CA . 31018 1
262 . 1 . 1 24 24 VAL CB C 13 32.668 0.000 . . . . . . A 24 VAL CB . 31018 1
263 . 1 . 1 24 24 VAL CG1 C 13 21.688 0.000 . . . . . . A 24 VAL CG1 . 31018 1
264 . 1 . 1 24 24 VAL CG2 C 13 23.759 0.000 . . . . . . A 24 VAL CG2 . 31018 1
265 . 1 . 1 24 24 VAL N N 15 124.164 0.000 . . . . . . A 24 VAL N . 31018 1
266 . 1 . 1 25 25 LEU H H 1 9.449 0.000 . . . . . . A 25 LEU H . 31018 1
267 . 1 . 1 25 25 LEU HA H 1 4.640 0.000 . . . . . . A 25 LEU HA . 31018 1
268 . 1 . 1 25 25 LEU HB2 H 1 1.511 0.000 . . . . . . A 25 LEU HB2 . 31018 1
269 . 1 . 1 25 25 LEU HB3 H 1 1.511 0.000 . . . . . . A 25 LEU HB3 . 31018 1
270 . 1 . 1 25 25 LEU HG H 1 1.574 0.000 . . . . . . A 25 LEU HG . 31018 1
271 . 1 . 1 25 25 LEU HD11 H 1 0.867 0.000 . . . . . . A 25 LEU HD11 . 31018 1
272 . 1 . 1 25 25 LEU HD12 H 1 0.867 0.000 . . . . . . A 25 LEU HD12 . 31018 1
273 . 1 . 1 25 25 LEU HD13 H 1 0.867 0.000 . . . . . . A 25 LEU HD13 . 31018 1
274 . 1 . 1 25 25 LEU HD21 H 1 0.826 0.000 . . . . . . A 25 LEU HD21 . 31018 1
275 . 1 . 1 25 25 LEU HD22 H 1 0.826 0.000 . . . . . . A 25 LEU HD22 . 31018 1
276 . 1 . 1 25 25 LEU HD23 H 1 0.826 0.000 . . . . . . A 25 LEU HD23 . 31018 1
277 . 1 . 1 25 25 LEU C C 13 176.927 0.000 . . . . . . A 25 LEU C . 31018 1
278 . 1 . 1 25 25 LEU CA C 13 56.478 0.000 . . . . . . A 25 LEU CA . 31018 1
279 . 1 . 1 25 25 LEU CB C 13 44.020 0.000 . . . . . . A 25 LEU CB . 31018 1
280 . 1 . 1 25 25 LEU CG C 13 27.074 0.000 . . . . . . A 25 LEU CG . 31018 1
281 . 1 . 1 25 25 LEU CD1 C 13 25.748 0.000 . . . . . . A 25 LEU CD1 . 31018 1
282 . 1 . 1 25 25 LEU CD2 C 13 23.179 0.000 . . . . . . A 25 LEU CD2 . 31018 1
283 . 1 . 1 25 25 LEU N N 15 129.104 0.000 . . . . . . A 25 LEU N . 31018 1
284 . 1 . 1 26 26 SER H H 1 7.962 0.000 . . . . . . A 26 SER H . 31018 1
285 . 1 . 1 26 26 SER HA H 1 4.601 0.000 . . . . . . A 26 SER HA . 31018 1
286 . 1 . 1 26 26 SER HB2 H 1 3.851 0.000 . . . . . . A 26 SER HB2 . 31018 1
287 . 1 . 1 26 26 SER HB3 H 1 3.851 0.000 . . . . . . A 26 SER HB3 . 31018 1
288 . 1 . 1 26 26 SER C C 13 171.745 0.000 . . . . . . A 26 SER C . 31018 1
289 . 1 . 1 26 26 SER CA C 13 58.136 0.000 . . . . . . A 26 SER CA . 31018 1
290 . 1 . 1 26 26 SER CB C 13 65.110 0.000 . . . . . . A 26 SER CB . 31018 1
291 . 1 . 1 26 26 SER N N 15 110.664 0.000 . . . . . . A 26 SER N . 31018 1
292 . 1 . 1 27 27 TYR H H 1 8.466 0.001 . . . . . . A 27 TYR H . 31018 1
293 . 1 . 1 27 27 TYR HA H 1 5.280 0.000 . . . . . . A 27 TYR HA . 31018 1
294 . 1 . 1 27 27 TYR HB2 H 1 3.051 0.000 . . . . . . A 27 TYR HB2 . 31018 1
295 . 1 . 1 27 27 TYR HB3 H 1 3.051 0.000 . . . . . . A 27 TYR HB3 . 31018 1
296 . 1 . 1 27 27 TYR HD1 H 1 7.063 0.000 . . . . . . A 27 TYR HD1 . 31018 1
297 . 1 . 1 27 27 TYR HD2 H 1 7.063 0.000 . . . . . . A 27 TYR HD2 . 31018 1
298 . 1 . 1 27 27 TYR HE1 H 1 6.768 0.000 . . . . . . A 27 TYR HE1 . 31018 1
299 . 1 . 1 27 27 TYR HE2 H 1 6.768 0.000 . . . . . . A 27 TYR HE2 . 31018 1
300 . 1 . 1 27 27 TYR C C 13 174.746 0.000 . . . . . . A 27 TYR C . 31018 1
301 . 1 . 1 27 27 TYR CA C 13 56.975 0.000 . . . . . . A 27 TYR CA . 31018 1
302 . 1 . 1 27 27 TYR CB C 13 41.659 0.000 . . . . . . A 27 TYR CB . 31018 1
303 . 1 . 1 27 27 TYR CD1 C 13 133.603 0.000 . . . . . . A 27 TYR CD1 . 31018 1
304 . 1 . 1 27 27 TYR CE1 C 13 118.584 0.000 . . . . . . A 27 TYR CE1 . 31018 1
305 . 1 . 1 27 27 TYR N N 15 120.580 0.000 . . . . . . A 27 TYR N . 31018 1
306 . 1 . 1 28 28 SER H H 1 8.367 0.000 . . . . . . A 28 SER H . 31018 1
307 . 1 . 1 28 28 SER HA H 1 4.612 0.000 . . . . . . A 28 SER HA . 31018 1
308 . 1 . 1 28 28 SER HB2 H 1 3.846 0.000 . . . . . . A 28 SER HB2 . 31018 1
309 . 1 . 1 28 28 SER HB3 H 1 3.846 0.000 . . . . . . A 28 SER HB3 . 31018 1
310 . 1 . 1 28 28 SER C C 13 175.092 0.000 . . . . . . A 28 SER C . 31018 1
311 . 1 . 1 28 28 SER CA C 13 57.431 0.000 . . . . . . A 28 SER CA . 31018 1
312 . 1 . 1 28 28 SER CB C 13 64.696 0.000 . . . . . . A 28 SER CB . 31018 1
313 . 1 . 1 28 28 SER N N 15 119.125 0.000 . . . . . . A 28 SER N . 31018 1
314 . 1 . 1 29 29 GLY H H 1 8.433 0.001 . . . . . . A 29 GLY H . 31018 1
315 . 1 . 1 29 29 GLY HA2 H 1 4.068 0.000 . . . . . . A 29 GLY HA2 . 31018 1
316 . 1 . 1 29 29 GLY HA3 H 1 3.662 0.000 . . . . . . A 29 GLY HA3 . 31018 1
317 . 1 . 1 29 29 GLY C C 13 174.234 0.000 . . . . . . A 29 GLY C . 31018 1
318 . 1 . 1 29 29 GLY CA C 13 47.736 0.000 . . . . . . A 29 GLY CA . 31018 1
319 . 1 . 1 29 29 GLY N N 15 116.100 0.000 . . . . . . A 29 GLY N . 31018 1
320 . 1 . 1 30 30 ASP H H 1 8.487 0.000 . . . . . . A 30 ASP H . 31018 1
321 . 1 . 1 30 30 ASP HA H 1 4.748 0.000 . . . . . . A 30 ASP HA . 31018 1
322 . 1 . 1 30 30 ASP HB2 H 1 2.881 0.000 . . . . . . A 30 ASP HB2 . 31018 1
323 . 1 . 1 30 30 ASP HB3 H 1 2.881 0.000 . . . . . . A 30 ASP HB3 . 31018 1
324 . 1 . 1 30 30 ASP C C 13 175.729 0.000 . . . . . . A 30 ASP C . 31018 1
325 . 1 . 1 30 30 ASP CA C 13 54.655 0.000 . . . . . . A 30 ASP CA . 31018 1
326 . 1 . 1 30 30 ASP CB C 13 41.451 0.000 . . . . . . A 30 ASP CB . 31018 1
327 . 1 . 1 30 30 ASP N N 15 122.553 0.000 . . . . . . A 30 ASP N . 31018 1
328 . 1 . 1 31 31 LYS H H 1 7.973 0.000 . . . . . . A 31 LYS H . 31018 1
329 . 1 . 1 31 31 LYS HA H 1 5.040 0.000 . . . . . . A 31 LYS HA . 31018 1
330 . 1 . 1 31 31 LYS HB2 H 1 1.924 0.000 . . . . . . A 31 LYS HB2 . 31018 1
331 . 1 . 1 31 31 LYS HB3 H 1 1.559 0.000 . . . . . . A 31 LYS HB3 . 31018 1
332 . 1 . 1 31 31 LYS HG2 H 1 1.459 0.000 . . . . . . A 31 LYS HG2 . 31018 1
333 . 1 . 1 31 31 LYS HG3 H 1 1.459 0.000 . . . . . . A 31 LYS HG3 . 31018 1
334 . 1 . 1 31 31 LYS HD2 H 1 1.631 0.000 . . . . . . A 31 LYS HD2 . 31018 1
335 . 1 . 1 31 31 LYS HD3 H 1 1.479 0.000 . . . . . . A 31 LYS HD3 . 31018 1
336 . 1 . 1 31 31 LYS HE2 H 1 2.978 0.000 . . . . . . A 31 LYS HE2 . 31018 1
337 . 1 . 1 31 31 LYS HE3 H 1 2.978 0.000 . . . . . . A 31 LYS HE3 . 31018 1
338 . 1 . 1 31 31 LYS C C 13 175.613 0.000 . . . . . . A 31 LYS C . 31018 1
339 . 1 . 1 31 31 LYS CA C 13 55.199 0.000 . . . . . . A 31 LYS CA . 31018 1
340 . 1 . 1 31 31 LYS CB C 13 35.402 0.000 . . . . . . A 31 LYS CB . 31018 1
341 . 1 . 1 31 31 LYS CG C 13 24.919 0.000 . . . . . . A 31 LYS CG . 31018 1
342 . 1 . 1 31 31 LYS CD C 13 29.063 0.000 . . . . . . A 31 LYS CD . 31018 1
343 . 1 . 1 31 31 LYS CE C 13 42.736 0.000 . . . . . . A 31 LYS CE . 31018 1
344 . 1 . 1 31 31 LYS N N 15 119.078 0.000 . . . . . . A 31 LYS N . 31018 1
345 . 1 . 1 32 32 VAL H H 1 9.128 0.000 . . . . . . A 32 VAL H . 31018 1
346 . 1 . 1 32 32 VAL HA H 1 4.673 0.000 . . . . . . A 32 VAL HA . 31018 1
347 . 1 . 1 32 32 VAL HB H 1 1.760 0.000 . . . . . . A 32 VAL HB . 31018 1
348 . 1 . 1 32 32 VAL HG11 H 1 0.735 0.000 . . . . . . A 32 VAL HG11 . 31018 1
349 . 1 . 1 32 32 VAL HG12 H 1 0.735 0.000 . . . . . . A 32 VAL HG12 . 31018 1
350 . 1 . 1 32 32 VAL HG13 H 1 0.735 0.000 . . . . . . A 32 VAL HG13 . 31018 1
351 . 1 . 1 32 32 VAL HG21 H 1 0.486 0.000 . . . . . . A 32 VAL HG21 . 31018 1
352 . 1 . 1 32 32 VAL HG22 H 1 0.486 0.000 . . . . . . A 32 VAL HG22 . 31018 1
353 . 1 . 1 32 32 VAL HG23 H 1 0.486 0.000 . . . . . . A 32 VAL HG23 . 31018 1
354 . 1 . 1 32 32 VAL C C 13 174.592 0.000 . . . . . . A 32 VAL C . 31018 1
355 . 1 . 1 32 32 VAL CA C 13 60.917 0.000 . . . . . . A 32 VAL CA . 31018 1
356 . 1 . 1 32 32 VAL CB C 13 34.781 0.000 . . . . . . A 32 VAL CB . 31018 1
357 . 1 . 1 32 32 VAL CG1 C 13 22.268 0.000 . . . . . . A 32 VAL CG1 . 31018 1
358 . 1 . 1 32 32 VAL CG2 C 13 21.688 0.000 . . . . . . A 32 VAL CG2 . 31018 1
359 . 1 . 1 32 32 VAL N N 15 123.531 0.000 . . . . . . A 32 VAL N . 31018 1
360 . 1 . 1 33 33 THR H H 1 9.024 0.000 . . . . . . A 33 THR H . 31018 1
361 . 1 . 1 33 33 THR HA H 1 5.191 0.000 . . . . . . A 33 THR HA . 31018 1
362 . 1 . 1 33 33 THR HB H 1 4.032 0.000 . . . . . . A 33 THR HB . 31018 1
363 . 1 . 1 33 33 THR HG21 H 1 1.164 0.000 . . . . . . A 33 THR HG21 . 31018 1
364 . 1 . 1 33 33 THR HG22 H 1 1.164 0.000 . . . . . . A 33 THR HG22 . 31018 1
365 . 1 . 1 33 33 THR HG23 H 1 1.164 0.000 . . . . . . A 33 THR HG23 . 31018 1
366 . 1 . 1 33 33 THR C C 13 174.534 0.000 . . . . . . A 33 THR C . 31018 1
367 . 1 . 1 33 33 THR CA C 13 62.610 0.000 . . . . . . A 33 THR CA . 31018 1
368 . 1 . 1 33 33 THR CB C 13 69.710 0.000 . . . . . . A 33 THR CB . 31018 1
369 . 1 . 1 33 33 THR CG2 C 13 22.102 0.000 . . . . . . A 33 THR CG2 . 31018 1
370 . 1 . 1 33 33 THR N N 15 124.619 0.000 . . . . . . A 33 THR N . 31018 1
371 . 1 . 1 34 34 VAL H H 1 9.484 0.000 . . . . . . A 34 VAL H . 31018 1
372 . 1 . 1 34 34 VAL HA H 1 5.378 0.001 . . . . . . A 34 VAL HA . 31018 1
373 . 1 . 1 34 34 VAL HB H 1 2.106 0.000 . . . . . . A 34 VAL HB . 31018 1
374 . 1 . 1 34 34 VAL HG11 H 1 0.716 0.000 . . . . . . A 34 VAL HG11 . 31018 1
375 . 1 . 1 34 34 VAL HG12 H 1 0.716 0.000 . . . . . . A 34 VAL HG12 . 31018 1
376 . 1 . 1 34 34 VAL HG13 H 1 0.716 0.000 . . . . . . A 34 VAL HG13 . 31018 1
377 . 1 . 1 34 34 VAL HG21 H 1 0.430 0.000 . . . . . . A 34 VAL HG21 . 31018 1
378 . 1 . 1 34 34 VAL HG22 H 1 0.430 0.000 . . . . . . A 34 VAL HG22 . 31018 1
379 . 1 . 1 34 34 VAL HG23 H 1 0.430 0.000 . . . . . . A 34 VAL HG23 . 31018 1
380 . 1 . 1 34 34 VAL C C 13 173.635 0.000 . . . . . . A 34 VAL C . 31018 1
381 . 1 . 1 34 34 VAL CA C 13 58.550 0.000 . . . . . . A 34 VAL CA . 31018 1
382 . 1 . 1 34 34 VAL CB C 13 35.941 0.000 . . . . . . A 34 VAL CB . 31018 1
383 . 1 . 1 34 34 VAL CG1 C 13 22.185 0.000 . . . . . . A 34 VAL CG1 . 31018 1
384 . 1 . 1 34 34 VAL CG2 C 13 20.196 0.000 . . . . . . A 34 VAL CG2 . 31018 1
385 . 1 . 1 34 34 VAL N N 15 120.931 0.000 . . . . . . A 34 VAL N . 31018 1
386 . 1 . 1 35 35 GLN H H 1 9.261 0.000 . . . . . . A 35 GLN H . 31018 1
387 . 1 . 1 35 35 GLN HA H 1 5.674 0.000 . . . . . . A 35 GLN HA . 31018 1
388 . 1 . 1 35 35 GLN HB2 H 1 2.083 0.000 . . . . . . A 35 GLN HB2 . 31018 1
389 . 1 . 1 35 35 GLN HB3 H 1 1.912 0.000 . . . . . . A 35 GLN HB3 . 31018 1
390 . 1 . 1 35 35 GLN HG2 H 1 2.611 0.000 . . . . . . A 35 GLN HG2 . 31018 1
391 . 1 . 1 35 35 GLN HG3 H 1 2.199 0.000 . . . . . . A 35 GLN HG3 . 31018 1
392 . 1 . 1 35 35 GLN HE21 H 1 7.329 0.000 . . . . . . A 35 GLN HE21 . 31018 1
393 . 1 . 1 35 35 GLN HE22 H 1 6.792 0.000 . . . . . . A 35 GLN HE22 . 31018 1
394 . 1 . 1 35 35 GLN C C 13 176.766 0.000 . . . . . . A 35 GLN C . 31018 1
395 . 1 . 1 35 35 GLN CA C 13 54.200 0.000 . . . . . . A 35 GLN CA . 31018 1
396 . 1 . 1 35 35 GLN CB C 13 34.076 0.000 . . . . . . A 35 GLN CB . 31018 1
397 . 1 . 1 35 35 GLN CG C 13 35.008 0.188 . . . . . . A 35 GLN CG . 31018 1
398 . 1 . 1 35 35 GLN N N 15 118.854 0.000 . . . . . . A 35 GLN N . 31018 1
399 . 1 . 1 35 35 GLN NE2 N 15 111.485 0.000 . . . . . . A 35 GLN NE2 . 31018 1
400 . 1 . 1 36 36 ASP H H 1 8.869 0.001 . . . . . . A 36 ASP H . 31018 1
401 . 1 . 1 36 36 ASP HA H 1 5.218 0.000 . . . . . . A 36 ASP HA . 31018 1
402 . 1 . 1 36 36 ASP HB2 H 1 3.344 0.000 . . . . . . A 36 ASP HB2 . 31018 1
403 . 1 . 1 36 36 ASP HB3 H 1 2.924 0.000 . . . . . . A 36 ASP HB3 . 31018 1
404 . 1 . 1 36 36 ASP C C 13 178.601 0.000 . . . . . . A 36 ASP C . 31018 1
405 . 1 . 1 36 36 ASP CA C 13 52.791 0.000 . . . . . . A 36 ASP CA . 31018 1
406 . 1 . 1 36 36 ASP CB C 13 43.026 0.000 . . . . . . A 36 ASP CB . 31018 1
407 . 1 . 1 36 36 ASP N N 15 125.774 0.000 . . . . . . A 36 ASP N . 31018 1
408 . 1 . 1 37 37 SER H H 1 8.790 0.000 . . . . . . A 37 SER H . 31018 1
409 . 1 . 1 37 37 SER HA H 1 4.255 0.000 . . . . . . A 37 SER HA . 31018 1
410 . 1 . 1 37 37 SER HB2 H 1 4.080 0.000 . . . . . . A 37 SER HB2 . 31018 1
411 . 1 . 1 37 37 SER HB3 H 1 3.997 0.000 . . . . . . A 37 SER HB3 . 31018 1
412 . 1 . 1 37 37 SER C C 13 175.230 0.000 . . . . . . A 37 SER C . 31018 1
413 . 1 . 1 37 37 SER CA C 13 61.450 0.000 . . . . . . A 37 SER CA . 31018 1
414 . 1 . 1 37 37 SER CB C 13 63.535 0.000 . . . . . . A 37 SER CB . 31018 1
415 . 1 . 1 37 37 SER N N 15 114.988 0.000 . . . . . . A 37 SER N . 31018 1
416 . 1 . 1 38 38 ASP H H 1 8.164 0.000 . . . . . . A 38 ASP H . 31018 1
417 . 1 . 1 38 38 ASP HA H 1 4.847 0.000 . . . . . . A 38 ASP HA . 31018 1
418 . 1 . 1 38 38 ASP HB2 H 1 2.823 0.000 . . . . . . A 38 ASP HB2 . 31018 1
419 . 1 . 1 38 38 ASP HB3 H 1 2.823 0.000 . . . . . . A 38 ASP HB3 . 31018 1
420 . 1 . 1 38 38 ASP C C 13 176.781 0.000 . . . . . . A 38 ASP C . 31018 1
421 . 1 . 1 38 38 ASP CA C 13 54.655 0.000 . . . . . . A 38 ASP CA . 31018 1
422 . 1 . 1 38 38 ASP CB C 13 41.866 0.000 . . . . . . A 38 ASP CB . 31018 1
423 . 1 . 1 38 38 ASP N N 15 120.675 0.000 . . . . . . A 38 ASP N . 31018 1
424 . 1 . 1 39 39 GLY H H 1 8.164 0.000 . . . . . . A 39 GLY H . 31018 1
425 . 1 . 1 39 39 GLY HA2 H 1 3.596 0.000 . . . . . . A 39 GLY HA2 . 31018 1
426 . 1 . 1 39 39 GLY HA3 H 1 4.353 0.000 . . . . . . A 39 GLY HA3 . 31018 1
427 . 1 . 1 39 39 GLY C C 13 174.910 0.000 . . . . . . A 39 GLY C . 31018 1
428 . 1 . 1 39 39 GLY CA C 13 45.581 0.000 . . . . . . A 39 GLY CA . 31018 1
429 . 1 . 1 39 39 GLY N N 15 108.253 0.000 . . . . . . A 39 GLY N . 31018 1
430 . 1 . 1 40 40 ARG H H 1 8.500 0.001 . . . . . . A 40 ARG H . 31018 1
431 . 1 . 1 40 40 ARG HA H 1 4.363 0.000 . . . . . . A 40 ARG HA . 31018 1
432 . 1 . 1 40 40 ARG HB2 H 1 2.009 0.000 . . . . . . A 40 ARG HB2 . 31018 1
433 . 1 . 1 40 40 ARG HB3 H 1 1.851 0.000 . . . . . . A 40 ARG HB3 . 31018 1
434 . 1 . 1 40 40 ARG HG2 H 1 1.734 0.000 . . . . . . A 40 ARG HG2 . 31018 1
435 . 1 . 1 40 40 ARG HG3 H 1 1.624 0.000 . . . . . . A 40 ARG HG3 . 31018 1
436 . 1 . 1 40 40 ARG HD2 H 1 3.282 0.000 . . . . . . A 40 ARG HD2 . 31018 1
437 . 1 . 1 40 40 ARG HD3 H 1 3.282 0.000 . . . . . . A 40 ARG HD3 . 31018 1
438 . 1 . 1 40 40 ARG C C 13 176.210 0.000 . . . . . . A 40 ARG C . 31018 1
439 . 1 . 1 40 40 ARG CA C 13 57.141 0.000 . . . . . . A 40 ARG CA . 31018 1
440 . 1 . 1 40 40 ARG CB C 13 30.844 0.000 . . . . . . A 40 ARG CB . 31018 1
441 . 1 . 1 40 40 ARG CG C 13 28.400 0.000 . . . . . . A 40 ARG CG . 31018 1
442 . 1 . 1 40 40 ARG CD C 13 43.896 0.000 . . . . . . A 40 ARG CD . 31018 1
443 . 1 . 1 40 40 ARG N N 15 123.519 0.000 . . . . . . A 40 ARG N . 31018 1
444 . 1 . 1 41 41 THR H H 1 8.242 0.000 . . . . . . A 41 THR H . 31018 1
445 . 1 . 1 41 41 THR HA H 1 5.311 0.000 . . . . . . A 41 THR HA . 31018 1
446 . 1 . 1 41 41 THR HB H 1 4.002 0.000 . . . . . . A 41 THR HB . 31018 1
447 . 1 . 1 41 41 THR HG21 H 1 1.110 0.000 . . . . . . A 41 THR HG21 . 31018 1
448 . 1 . 1 41 41 THR HG22 H 1 1.110 0.000 . . . . . . A 41 THR HG22 . 31018 1
449 . 1 . 1 41 41 THR HG23 H 1 1.110 0.000 . . . . . . A 41 THR HG23 . 31018 1
450 . 1 . 1 41 41 THR C C 13 174.539 0.000 . . . . . . A 41 THR C . 31018 1
451 . 1 . 1 41 41 THR CA C 13 61.508 0.000 . . . . . . A 41 THR CA . 31018 1
452 . 1 . 1 41 41 THR CB C 13 70.786 0.000 . . . . . . A 41 THR CB . 31018 1
453 . 1 . 1 41 41 THR CG2 C 13 22.268 0.000 . . . . . . A 41 THR CG2 . 31018 1
454 . 1 . 1 41 41 THR N N 15 115.951 0.000 . . . . . . A 41 THR N . 31018 1
455 . 1 . 1 42 42 LEU H H 1 8.838 0.000 . . . . . . A 42 LEU H . 31018 1
456 . 1 . 1 42 42 LEU HA H 1 4.617 0.000 . . . . . . A 42 LEU HA . 31018 1
457 . 1 . 1 42 42 LEU HB2 H 1 1.133 0.000 . . . . . . A 42 LEU HB2 . 31018 1
458 . 1 . 1 42 42 LEU HB3 H 1 1.133 0.000 . . . . . . A 42 LEU HB3 . 31018 1
459 . 1 . 1 42 42 LEU HG H 1 1.375 0.000 . . . . . . A 42 LEU HG . 31018 1
460 . 1 . 1 42 42 LEU HD11 H 1 0.737 0.000 . . . . . . A 42 LEU HD11 . 31018 1
461 . 1 . 1 42 42 LEU HD12 H 1 0.737 0.000 . . . . . . A 42 LEU HD12 . 31018 1
462 . 1 . 1 42 42 LEU HD13 H 1 0.737 0.000 . . . . . . A 42 LEU HD13 . 31018 1
463 . 1 . 1 42 42 LEU HD21 H 1 0.790 0.000 . . . . . . A 42 LEU HD21 . 31018 1
464 . 1 . 1 42 42 LEU HD22 H 1 0.790 0.000 . . . . . . A 42 LEU HD22 . 31018 1
465 . 1 . 1 42 42 LEU HD23 H 1 0.790 0.000 . . . . . . A 42 LEU HD23 . 31018 1
466 . 1 . 1 42 42 LEU C C 13 175.041 0.000 . . . . . . A 42 LEU C . 31018 1
467 . 1 . 1 42 42 LEU CA C 13 54.655 0.000 . . . . . . A 42 LEU CA . 31018 1
468 . 1 . 1 42 42 LEU CB C 13 46.258 0.000 . . . . . . A 42 LEU CB . 31018 1
469 . 1 . 1 42 42 LEU CG C 13 27.737 0.000 . . . . . . A 42 LEU CG . 31018 1
470 . 1 . 1 42 42 LEU CD1 C 13 26.315 0.000 . . . . . . A 42 LEU CD1 . 31018 1
471 . 1 . 1 42 42 LEU CD2 C 13 25.000 0.000 . . . . . . A 42 LEU CD2 . 31018 1
472 . 1 . 1 42 42 LEU N N 15 125.879 0.000 . . . . . . A 42 LEU N . 31018 1
473 . 1 . 1 43 43 THR H H 1 8.031 0.000 . . . . . . A 43 THR H . 31018 1
474 . 1 . 1 43 43 THR HA H 1 5.244 0.000 . . . . . . A 43 THR HA . 31018 1
475 . 1 . 1 43 43 THR HB H 1 3.718 0.000 . . . . . . A 43 THR HB . 31018 1
476 . 1 . 1 43 43 THR HG21 H 1 1.067 0.000 . . . . . . A 43 THR HG21 . 31018 1
477 . 1 . 1 43 43 THR HG22 H 1 1.067 0.000 . . . . . . A 43 THR HG22 . 31018 1
478 . 1 . 1 43 43 THR HG23 H 1 1.067 0.000 . . . . . . A 43 THR HG23 . 31018 1
479 . 1 . 1 43 43 THR C C 13 173.678 0.000 . . . . . . A 43 THR C . 31018 1
480 . 1 . 1 43 43 THR CA C 13 61.697 0.000 . . . . . . A 43 THR CA . 31018 1
481 . 1 . 1 43 43 THR CB C 13 71.325 0.000 . . . . . . A 43 THR CB . 31018 1
482 . 1 . 1 43 43 THR CG2 C 13 22.102 0.000 . . . . . . A 43 THR CG2 . 31018 1
483 . 1 . 1 43 43 THR N N 15 115.575 0.000 . . . . . . A 43 THR N . 31018 1
484 . 1 . 1 44 44 PHE H H 1 8.927 0.000 . . . . . . A 44 PHE H . 31018 1
485 . 1 . 1 44 44 PHE HA H 1 4.883 0.000 . . . . . . A 44 PHE HA . 31018 1
486 . 1 . 1 44 44 PHE HB2 H 1 2.483 0.000 . . . . . . A 44 PHE HB2 . 31018 1
487 . 1 . 1 44 44 PHE HB3 H 1 3.078 0.000 . . . . . . A 44 PHE HB3 . 31018 1
488 . 1 . 1 44 44 PHE HD1 H 1 6.810 0.000 . . . . . . A 44 PHE HD1 . 31018 1
489 . 1 . 1 44 44 PHE HD2 H 1 6.810 0.000 . . . . . . A 44 PHE HD2 . 31018 1
490 . 1 . 1 44 44 PHE HE1 H 1 6.405 0.000 . . . . . . A 44 PHE HE1 . 31018 1
491 . 1 . 1 44 44 PHE HE2 H 1 6.405 0.000 . . . . . . A 44 PHE HE2 . 31018 1
492 . 1 . 1 44 44 PHE HZ H 1 6.640 0.000 . . . . . . A 44 PHE HZ . 31018 1
493 . 1 . 1 44 44 PHE C C 13 175.200 0.000 . . . . . . A 44 PHE C . 31018 1
494 . 1 . 1 44 44 PHE CA C 13 56.354 0.000 . . . . . . A 44 PHE CA . 31018 1
495 . 1 . 1 44 44 PHE CB C 13 44.227 0.000 . . . . . . A 44 PHE CB . 31018 1
496 . 1 . 1 44 44 PHE CD1 C 13 131.273 0.000 . . . . . . A 44 PHE CD1 . 31018 1
497 . 1 . 1 44 44 PHE CE1 C 13 131.014 0.000 . . . . . . A 44 PHE CE1 . 31018 1
498 . 1 . 1 44 44 PHE CZ C 13 129.460 0.000 . . . . . . A 44 PHE CZ . 31018 1
499 . 1 . 1 44 44 PHE N N 15 123.358 0.000 . . . . . . A 44 PHE N . 31018 1
500 . 1 . 1 45 45 ASP H H 1 8.427 0.000 . . . . . . A 45 ASP H . 31018 1
501 . 1 . 1 45 45 ASP HA H 1 4.805 0.000 . . . . . . A 45 ASP HA . 31018 1
502 . 1 . 1 45 45 ASP HB2 H 1 2.650 0.000 . . . . . . A 45 ASP HB2 . 31018 1
503 . 1 . 1 45 45 ASP HB3 H 1 2.878 0.000 . . . . . . A 45 ASP HB3 . 31018 1
504 . 1 . 1 45 45 ASP C C 13 177.297 0.000 . . . . . . A 45 ASP C . 31018 1
505 . 1 . 1 45 45 ASP CA C 13 55.341 0.000 . . . . . . A 45 ASP CA . 31018 1
506 . 1 . 1 45 45 ASP CB C 13 42.114 0.000 . . . . . . A 45 ASP CB . 31018 1
507 . 1 . 1 45 45 ASP N N 15 121.209 0.000 . . . . . . A 45 ASP N . 31018 1
508 . 1 . 1 46 46 ALA H H 1 8.749 0.000 . . . . . . A 46 ALA H . 31018 1
509 . 1 . 1 46 46 ALA HA H 1 3.795 0.000 . . . . . . A 46 ALA HA . 31018 1
510 . 1 . 1 46 46 ALA HB1 H 1 1.360 0.000 . . . . . . A 46 ALA HB1 . 31018 1
511 . 1 . 1 46 46 ALA HB2 H 1 1.360 0.000 . . . . . . A 46 ALA HB2 . 31018 1
512 . 1 . 1 46 46 ALA HB3 H 1 1.360 0.000 . . . . . . A 46 ALA HB3 . 31018 1
513 . 1 . 1 46 46 ALA C C 13 179.305 0.000 . . . . . . A 46 ALA C . 31018 1
514 . 1 . 1 46 46 ALA CA C 13 55.567 0.000 . . . . . . A 46 ALA CA . 31018 1
515 . 1 . 1 46 46 ALA CB C 13 19.284 0.000 . . . . . . A 46 ALA CB . 31018 1
516 . 1 . 1 46 46 ALA N N 15 128.447 0.000 . . . . . . A 46 ALA N . 31018 1
517 . 1 . 1 47 47 ARG H H 1 8.668 0.000 . . . . . . A 47 ARG H . 31018 1
518 . 1 . 1 47 47 ARG HA H 1 4.228 0.000 . . . . . . A 47 ARG HA . 31018 1
519 . 1 . 1 47 47 ARG HB2 H 1 1.969 0.000 . . . . . . A 47 ARG HB2 . 31018 1
520 . 1 . 1 47 47 ARG HB3 H 1 1.916 0.000 . . . . . . A 47 ARG HB3 . 31018 1
521 . 1 . 1 47 47 ARG HG2 H 1 1.723 0.000 . . . . . . A 47 ARG HG2 . 31018 1
522 . 1 . 1 47 47 ARG HG3 H 1 1.723 0.000 . . . . . . A 47 ARG HG3 . 31018 1
523 . 1 . 1 47 47 ARG HD2 H 1 3.286 0.000 . . . . . . A 47 ARG HD2 . 31018 1
524 . 1 . 1 47 47 ARG HD3 H 1 3.286 0.000 . . . . . . A 47 ARG HD3 . 31018 1
525 . 1 . 1 47 47 ARG C C 13 178.020 0.000 . . . . . . A 47 ARG C . 31018 1
526 . 1 . 1 47 47 ARG CA C 13 58.426 0.000 . . . . . . A 47 ARG CA . 31018 1
527 . 1 . 1 47 47 ARG CB C 13 29.974 0.000 . . . . . . A 47 ARG CB . 31018 1
528 . 1 . 1 47 47 ARG CG C 13 27.654 0.000 . . . . . . A 47 ARG CG . 31018 1
529 . 1 . 1 47 47 ARG CD C 13 43.813 0.000 . . . . . . A 47 ARG CD . 31018 1
530 . 1 . 1 47 47 ARG N N 15 114.359 0.000 . . . . . . A 47 ARG N . 31018 1
531 . 1 . 1 48 48 LEU H H 1 7.835 0.000 . . . . . . A 48 LEU H . 31018 1
532 . 1 . 1 48 48 LEU HA H 1 4.386 0.000 . . . . . . A 48 LEU HA . 31018 1
533 . 1 . 1 48 48 LEU HB2 H 1 1.944 0.000 . . . . . . A 48 LEU HB2 . 31018 1
534 . 1 . 1 48 48 LEU HB3 H 1 1.799 0.000 . . . . . . A 48 LEU HB3 . 31018 1
535 . 1 . 1 48 48 LEU HG H 1 1.729 0.000 . . . . . . A 48 LEU HG . 31018 1
536 . 1 . 1 48 48 LEU HD11 H 1 1.189 0.000 . . . . . . A 48 LEU HD11 . 31018 1
537 . 1 . 1 48 48 LEU HD12 H 1 1.189 0.000 . . . . . . A 48 LEU HD12 . 31018 1
538 . 1 . 1 48 48 LEU HD13 H 1 1.189 0.000 . . . . . . A 48 LEU HD13 . 31018 1
539 . 1 . 1 48 48 LEU HD21 H 1 0.963 0.000 . . . . . . A 48 LEU HD21 . 31018 1
540 . 1 . 1 48 48 LEU HD22 H 1 0.963 0.000 . . . . . . A 48 LEU HD22 . 31018 1
541 . 1 . 1 48 48 LEU HD23 H 1 0.963 0.000 . . . . . . A 48 LEU HD23 . 31018 1
542 . 1 . 1 48 48 LEU C C 13 177.181 0.000 . . . . . . A 48 LEU C . 31018 1
543 . 1 . 1 48 48 LEU CA C 13 55.774 0.000 . . . . . . A 48 LEU CA . 31018 1
544 . 1 . 1 48 48 LEU CB C 13 42.778 0.000 . . . . . . A 48 LEU CB . 31018 1
545 . 1 . 1 48 48 LEU CG C 13 27.737 0.000 . . . . . . A 48 LEU CG . 31018 1
546 . 1 . 1 48 48 LEU CD1 C 13 26.080 0.000 . . . . . . A 48 LEU CD1 . 31018 1
547 . 1 . 1 48 48 LEU CD2 C 13 22.800 0.000 . . . . . . A 48 LEU CD2 . 31018 1
548 . 1 . 1 48 48 LEU N N 15 118.436 0.000 . . . . . . A 48 LEU N . 31018 1
549 . 1 . 1 49 49 LEU H H 1 7.520 0.000 . . . . . . A 49 LEU H . 31018 1
550 . 1 . 1 49 49 LEU HA H 1 4.806 0.000 . . . . . . A 49 LEU HA . 31018 1
551 . 1 . 1 49 49 LEU HB2 H 1 1.337 0.000 . . . . . . A 49 LEU HB2 . 31018 1
552 . 1 . 1 49 49 LEU HB3 H 1 1.834 0.000 . . . . . . A 49 LEU HB3 . 31018 1
553 . 1 . 1 49 49 LEU HG H 1 1.517 0.000 . . . . . . A 49 LEU HG . 31018 1
554 . 1 . 1 49 49 LEU HD11 H 1 0.468 0.000 . . . . . . A 49 LEU HD11 . 31018 1
555 . 1 . 1 49 49 LEU HD12 H 1 0.468 0.000 . . . . . . A 49 LEU HD12 . 31018 1
556 . 1 . 1 49 49 LEU HD13 H 1 0.468 0.000 . . . . . . A 49 LEU HD13 . 31018 1
557 . 1 . 1 49 49 LEU HD21 H 1 0.644 0.000 . . . . . . A 49 LEU HD21 . 31018 1
558 . 1 . 1 49 49 LEU HD22 H 1 0.644 0.000 . . . . . . A 49 LEU HD22 . 31018 1
559 . 1 . 1 49 49 LEU HD23 H 1 0.644 0.000 . . . . . . A 49 LEU HD23 . 31018 1
560 . 1 . 1 49 49 LEU C C 13 176.969 0.000 . . . . . . A 49 LEU C . 31018 1
561 . 1 . 1 49 49 LEU CA C 13 54.738 0.000 . . . . . . A 49 LEU CA . 31018 1
562 . 1 . 1 49 49 LEU CB C 13 44.725 0.000 . . . . . . A 49 LEU CB . 31018 1
563 . 1 . 1 49 49 LEU CG C 13 26.743 0.000 . . . . . . A 49 LEU CG . 31018 1
564 . 1 . 1 49 49 LEU CD1 C 13 23.100 0.000 . . . . . . A 49 LEU CD1 . 31018 1
565 . 1 . 1 49 49 LEU CD2 C 13 26.000 0.000 . . . . . . A 49 LEU CD2 . 31018 1
566 . 1 . 1 49 49 LEU N N 15 118.229 0.000 . . . . . . A 49 LEU N . 31018 1
567 . 1 . 1 50 50 ARG H H 1 8.105 0.000 . . . . . . A 50 ARG H . 31018 1
568 . 1 . 1 50 50 ARG HA H 1 4.636 0.000 . . . . . . A 50 ARG HA . 31018 1
569 . 1 . 1 50 50 ARG HB2 H 1 1.834 0.000 . . . . . . A 50 ARG HB2 . 31018 1
570 . 1 . 1 50 50 ARG HB3 H 1 1.795 0.000 . . . . . . A 50 ARG HB3 . 31018 1
571 . 1 . 1 50 50 ARG HG2 H 1 1.664 0.000 . . . . . . A 50 ARG HG2 . 31018 1
572 . 1 . 1 50 50 ARG HG3 H 1 1.616 0.000 . . . . . . A 50 ARG HG3 . 31018 1
573 . 1 . 1 50 50 ARG HD2 H 1 3.241 0.000 . . . . . . A 50 ARG HD2 . 31018 1
574 . 1 . 1 50 50 ARG HD3 H 1 3.166 0.000 . . . . . . A 50 ARG HD3 . 31018 1
575 . 1 . 1 50 50 ARG C C 13 176.591 0.000 . . . . . . A 50 ARG C . 31018 1
576 . 1 . 1 50 50 ARG CA C 13 55.484 0.000 . . . . . . A 50 ARG CA . 31018 1
577 . 1 . 1 50 50 ARG CB C 13 32.046 0.000 . . . . . . A 50 ARG CB . 31018 1
578 . 1 . 1 50 50 ARG CG C 13 27.488 0.000 . . . . . . A 50 ARG CG . 31018 1
579 . 1 . 1 50 50 ARG CD C 13 43.896 0.000 . . . . . . A 50 ARG CD . 31018 1
580 . 1 . 1 50 50 ARG N N 15 117.988 0.000 . . . . . . A 50 ARG N . 31018 1
581 . 1 . 1 51 51 VAL H H 1 8.161 0.001 . . . . . . A 51 VAL H . 31018 1
582 . 1 . 1 51 51 VAL HA H 1 4.124 0.000 . . . . . . A 51 VAL HA . 31018 1
583 . 1 . 1 51 51 VAL HB H 1 2.003 0.000 . . . . . . A 51 VAL HB . 31018 1
584 . 1 . 1 51 51 VAL HG11 H 1 0.828 0.000 . . . . . . A 51 VAL HG11 . 31018 1
585 . 1 . 1 51 51 VAL HG12 H 1 0.828 0.000 . . . . . . A 51 VAL HG12 . 31018 1
586 . 1 . 1 51 51 VAL HG13 H 1 0.828 0.000 . . . . . . A 51 VAL HG13 . 31018 1
587 . 1 . 1 51 51 VAL HG21 H 1 0.790 0.000 . . . . . . A 51 VAL HG21 . 31018 1
588 . 1 . 1 51 51 VAL HG22 H 1 0.790 0.000 . . . . . . A 51 VAL HG22 . 31018 1
589 . 1 . 1 51 51 VAL HG23 H 1 0.790 0.000 . . . . . . A 51 VAL HG23 . 31018 1
590 . 1 . 1 51 51 VAL C C 13 176.408 0.000 . . . . . . A 51 VAL C . 31018 1
591 . 1 . 1 51 51 VAL CA C 13 63.375 0.000 . . . . . . A 51 VAL CA . 31018 1
592 . 1 . 1 51 51 VAL CB C 13 32.709 0.000 . . . . . . A 51 VAL CB . 31018 1
593 . 1 . 1 51 51 VAL CG1 C 13 21.770 0.000 . . . . . . A 51 VAL CG1 . 31018 1
594 . 1 . 1 51 51 VAL CG2 C 13 21.439 0.000 . . . . . . A 51 VAL CG2 . 31018 1
595 . 1 . 1 51 51 VAL N N 15 121.334 0.000 . . . . . . A 51 VAL N . 31018 1
596 . 1 . 1 52 52 LYS H H 1 8.276 0.001 . . . . . . A 52 LYS H . 31018 1
597 . 1 . 1 52 52 LYS HA H 1 4.165 0.000 . . . . . . A 52 LYS HA . 31018 1
598 . 1 . 1 52 52 LYS HB2 H 1 1.708 0.000 . . . . . . A 52 LYS HB2 . 31018 1
599 . 1 . 1 52 52 LYS HB3 H 1 1.620 0.000 . . . . . . A 52 LYS HB3 . 31018 1
600 . 1 . 1 52 52 LYS HG2 H 1 1.282 0.000 . . . . . . A 52 LYS HG2 . 31018 1
601 . 1 . 1 52 52 LYS HG3 H 1 1.282 0.000 . . . . . . A 52 LYS HG3 . 31018 1
602 . 1 . 1 52 52 LYS HD2 H 1 1.578 0.000 . . . . . . A 52 LYS HD2 . 31018 1
603 . 1 . 1 52 52 LYS HD3 H 1 1.578 0.000 . . . . . . A 52 LYS HD3 . 31018 1
604 . 1 . 1 52 52 LYS HE2 H 1 2.832 0.000 . . . . . . A 52 LYS HE2 . 31018 1
605 . 1 . 1 52 52 LYS HE3 H 1 2.832 0.000 . . . . . . A 52 LYS HE3 . 31018 1
606 . 1 . 1 52 52 LYS C C 13 176.674 0.000 . . . . . . A 52 LYS C . 31018 1
607 . 1 . 1 52 52 LYS CA C 13 57.721 0.000 . . . . . . A 52 LYS CA . 31018 1
608 . 1 . 1 52 52 LYS CB C 13 33.127 0.000 . . . . . . A 52 LYS CB . 31018 1
609 . 1 . 1 52 52 LYS CG C 13 25.500 0.000 . . . . . . A 52 LYS CG . 31018 1
610 . 1 . 1 52 52 LYS CD C 13 29.525 0.000 . . . . . . A 52 LYS CD . 31018 1
611 . 1 . 1 52 52 LYS CE C 13 42.191 0.000 . . . . . . A 52 LYS CE . 31018 1
612 . 1 . 1 52 52 LYS N N 15 125.967 0.000 . . . . . . A 52 LYS N . 31018 1
613 . 1 . 1 53 53 LYS H H 1 8.170 0.001 . . . . . . A 53 LYS H . 31018 1
614 . 1 . 1 53 53 LYS HA H 1 4.304 0.000 . . . . . . A 53 LYS HA . 31018 1
615 . 1 . 1 53 53 LYS HB2 H 1 1.758 0.000 . . . . . . A 53 LYS HB2 . 31018 1
616 . 1 . 1 53 53 LYS HB3 H 1 1.758 0.000 . . . . . . A 53 LYS HB3 . 31018 1
617 . 1 . 1 53 53 LYS HG2 H 1 1.389 0.000 . . . . . . A 53 LYS HG2 . 31018 1
618 . 1 . 1 53 53 LYS HG3 H 1 1.336 0.000 . . . . . . A 53 LYS HG3 . 31018 1
619 . 1 . 1 53 53 LYS HD2 H 1 1.658 0.000 . . . . . . A 53 LYS HD2 . 31018 1
620 . 1 . 1 53 53 LYS HD3 H 1 1.658 0.000 . . . . . . A 53 LYS HD3 . 31018 1
621 . 1 . 1 53 53 LYS HE2 H 1 2.952 0.000 . . . . . . A 53 LYS HE2 . 31018 1
622 . 1 . 1 53 53 LYS HE3 H 1 2.952 0.000 . . . . . . A 53 LYS HE3 . 31018 1
623 . 1 . 1 53 53 LYS C C 13 176.523 0.000 . . . . . . A 53 LYS C . 31018 1
624 . 1 . 1 53 53 LYS CA C 13 57.042 0.000 . . . . . . A 53 LYS CA . 31018 1
625 . 1 . 1 53 53 LYS CB C 13 33.248 0.000 . . . . . . A 53 LYS CB . 31018 1
626 . 1 . 1 53 53 LYS CG C 13 25.002 0.000 . . . . . . A 53 LYS CG . 31018 1
627 . 1 . 1 53 53 LYS CD C 13 29.560 0.000 . . . . . . A 53 LYS CD . 31018 1
628 . 1 . 1 53 53 LYS CE C 13 42.514 0.000 . . . . . . A 53 LYS CE . 31018 1
629 . 1 . 1 53 53 LYS N N 15 121.912 0.000 . . . . . . A 53 LYS N . 31018 1
630 . 1 . 1 54 54 TRP H H 1 8.034 0.004 . . . . . . A 54 TRP H . 31018 1
631 . 1 . 1 54 54 TRP HA H 1 4.651 0.000 . . . . . . A 54 TRP HA . 31018 1
632 . 1 . 1 54 54 TRP HB2 H 1 3.315 0.000 . . . . . . A 54 TRP HB2 . 31018 1
633 . 1 . 1 54 54 TRP HB3 H 1 3.230 0.000 . . . . . . A 54 TRP HB3 . 31018 1
634 . 1 . 1 54 54 TRP HD1 H 1 7.200 0.000 . . . . . . A 54 TRP HD1 . 31018 1
635 . 1 . 1 54 54 TRP HE1 H 1 10.105 0.000 . . . . . . A 54 TRP HE1 . 31018 1
636 . 1 . 1 54 54 TRP HE3 H 1 7.520 0.002 . . . . . . A 54 TRP HE3 . 31018 1
637 . 1 . 1 54 54 TRP HZ2 H 1 7.360 0.000 . . . . . . A 54 TRP HZ2 . 31018 1
638 . 1 . 1 54 54 TRP HZ3 H 1 6.982 0.000 . . . . . . A 54 TRP HZ3 . 31018 1
639 . 1 . 1 54 54 TRP HH2 H 1 7.076 0.000 . . . . . . A 54 TRP HH2 . 31018 1
640 . 1 . 1 54 54 TRP C C 13 176.581 0.000 . . . . . . A 54 TRP C . 31018 1
641 . 1 . 1 54 54 TRP CA C 13 58.105 0.000 . . . . . . A 54 TRP CA . 31018 1
642 . 1 . 1 54 54 TRP CB C 13 29.809 0.000 . . . . . . A 54 TRP CB . 31018 1
643 . 1 . 1 54 54 TRP CD1 C 13 127.388 0.000 . . . . . . A 54 TRP CD1 . 31018 1
644 . 1 . 1 54 54 TRP CE3 C 13 120.900 0.000 . . . . . . A 54 TRP CE3 . 31018 1
645 . 1 . 1 54 54 TRP CZ2 C 13 114.700 0.000 . . . . . . A 54 TRP CZ2 . 31018 1
646 . 1 . 1 54 54 TRP CZ3 C 13 122.468 0.000 . . . . . . A 54 TRP CZ3 . 31018 1
647 . 1 . 1 54 54 TRP CH2 C 13 124.799 0.000 . . . . . . A 54 TRP CH2 . 31018 1
648 . 1 . 1 54 54 TRP N N 15 122.287 0.000 . . . . . . A 54 TRP N . 31018 1
649 . 1 . 1 54 54 TRP NE1 N 15 129.337 0.000 . . . . . . A 54 TRP NE1 . 31018 1
650 . 1 . 1 55 55 LEU H H 1 8.057 0.001 . . . . . . A 55 LEU H . 31018 1
651 . 1 . 1 55 55 LEU HA H 1 4.230 0.000 . . . . . . A 55 LEU HA . 31018 1
652 . 1 . 1 55 55 LEU HB2 H 1 1.550 0.000 . . . . . . A 55 LEU HB2 . 31018 1
653 . 1 . 1 55 55 LEU HB3 H 1 1.471 0.000 . . . . . . A 55 LEU HB3 . 31018 1
654 . 1 . 1 55 55 LEU HG H 1 1.502 0.000 . . . . . . A 55 LEU HG . 31018 1
655 . 1 . 1 55 55 LEU HD11 H 1 0.838 0.000 . . . . . . A 55 LEU HD11 . 31018 1
656 . 1 . 1 55 55 LEU HD12 H 1 0.838 0.000 . . . . . . A 55 LEU HD12 . 31018 1
657 . 1 . 1 55 55 LEU HD13 H 1 0.838 0.000 . . . . . . A 55 LEU HD13 . 31018 1
658 . 1 . 1 55 55 LEU HD21 H 1 0.794 0.000 . . . . . . A 55 LEU HD21 . 31018 1
659 . 1 . 1 55 55 LEU HD22 H 1 0.794 0.000 . . . . . . A 55 LEU HD22 . 31018 1
660 . 1 . 1 55 55 LEU HD23 H 1 0.794 0.000 . . . . . . A 55 LEU HD23 . 31018 1
661 . 1 . 1 55 55 LEU C C 13 177.355 0.000 . . . . . . A 55 LEU C . 31018 1
662 . 1 . 1 55 55 LEU CA C 13 55.774 0.000 . . . . . . A 55 LEU CA . 31018 1
663 . 1 . 1 55 55 LEU CB C 13 42.694 0.000 . . . . . . A 55 LEU CB . 31018 1
664 . 1 . 1 55 55 LEU CG C 13 27.157 0.000 . . . . . . A 55 LEU CG . 31018 1
665 . 1 . 1 55 55 LEU CD1 C 13 25.085 0.000 . . . . . . A 55 LEU CD1 . 31018 1
666 . 1 . 1 55 55 LEU CD2 C 13 23.800 0.000 . . . . . . A 55 LEU CD2 . 31018 1
667 . 1 . 1 55 55 LEU N N 15 122.691 0.000 . . . . . . A 55 LEU N . 31018 1
668 . 1 . 1 56 56 GLU H H 1 8.094 0.000 . . . . . . A 56 GLU H . 31018 1
669 . 1 . 1 56 56 GLU HA H 1 4.138 0.000 . . . . . . A 56 GLU HA . 31018 1
670 . 1 . 1 56 56 GLU HB2 H 1 1.924 0.000 . . . . . . A 56 GLU HB2 . 31018 1
671 . 1 . 1 56 56 GLU HB3 H 1 1.924 0.000 . . . . . . A 56 GLU HB3 . 31018 1
672 . 1 . 1 56 56 GLU HG2 H 1 2.244 0.000 . . . . . . A 56 GLU HG2 . 31018 1
673 . 1 . 1 56 56 GLU HG3 H 1 2.168 0.000 . . . . . . A 56 GLU HG3 . 31018 1
674 . 1 . 1 56 56 GLU C C 13 177.644 0.000 . . . . . . A 56 GLU C . 31018 1
675 . 1 . 1 56 56 GLU CA C 13 57.405 0.000 . . . . . . A 56 GLU CA . 31018 1
676 . 1 . 1 56 56 GLU CB C 13 30.537 0.000 . . . . . . A 56 GLU CB . 31018 1
677 . 1 . 1 56 56 GLU CG C 13 36.688 0.000 . . . . . . A 56 GLU CG . 31018 1
678 . 1 . 1 56 56 GLU N N 15 120.561 0.000 . . . . . . A 56 GLU N . 31018 1
679 . 1 . 1 57 57 HIS H H 1 7.908 0.000 . . . . . . A 57 HIS H . 31018 1
680 . 1 . 1 57 57 HIS C C 13 177.113 0.000 . . . . . . A 57 HIS C . 31018 1
681 . 1 . 1 57 57 HIS N N 15 115.796 0.000 . . . . . . A 57 HIS N . 31018 1
682 . 1 . 1 58 58 HIS H H 1 7.933 0.000 . . . . . . A 58 HIS H . 31018 1
683 . 1 . 1 58 58 HIS N N 15 121.680 0.000 . . . . . . A 58 HIS N . 31018 1
684 . 1 . 1 59 59 HIS C C 13 178.282 0.000 . . . . . . A 59 HIS C . 31018 1
685 . 1 . 1 60 60 HIS H H 1 8.340 0.000 . . . . . . A 60 HIS H . 31018 1
686 . 1 . 1 60 60 HIS N N 15 114.439 0.000 . . . . . . A 60 HIS N . 31018 1
687 . 1 . 1 61 61 HIS HA H 1 4.587 0.000 . . . . . . A 61 HIS HA . 31018 1
688 . 1 . 1 61 61 HIS HB2 H 1 3.045 0.000 . . . . . . A 61 HIS HB2 . 31018 1
689 . 1 . 1 61 61 HIS HB3 H 1 3.045 0.000 . . . . . . A 61 HIS HB3 . 31018 1
690 . 1 . 1 61 61 HIS C C 13 174.195 0.000 . . . . . . A 61 HIS C . 31018 1
691 . 1 . 1 61 61 HIS CA C 13 56.404 0.000 . . . . . . A 61 HIS CA . 31018 1
692 . 1 . 1 61 61 HIS CB C 13 30.803 0.000 . . . . . . A 61 HIS CB . 31018 1
693 . 1 . 1 62 62 HIS H H 1 7.994 0.001 . . . . . . A 62 HIS H . 31018 1
694 . 1 . 1 62 62 HIS N N 15 125.389 0.000 . . . . . . A 62 HIS N . 31018 1
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