Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 19033
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.003
_Assigned_chem_shift_list.Chem_shift_13C_err 0.164
_Assigned_chem_shift_list.Chem_shift_15N_err 0.121
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 19033 1
2 4D-HACANH-APSY . . . 19033 1
3 5D-CBCACONH-APSY . . . 19033 1
4 5D-HACACONH-APSY . . . 19033 1
5 '3D 1H-13C NOESY aliphatic' . . . 19033 1
7 '3D 1H-13C NOESY aromatic' . . . 19033 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 3 3 ARG H H 1 8.600 0.003 . 1 . . . A 3 ARG H . 19033 1
2 . 1 1 3 3 ARG HA H 1 4.298 0.003 . 1 . . . A 3 ARG HA . 19033 1
3 . 1 1 3 3 ARG HB2 H 1 1.718 0.003 . 2 . . . A 3 ARG QB . 19033 1
4 . 1 1 3 3 ARG HB3 H 1 1.718 0.003 . 2 . . . A 3 ARG QB . 19033 1
5 . 1 1 3 3 ARG HG2 H 1 1.379 0.003 . 2 . . . A 3 ARG QG . 19033 1
6 . 1 1 3 3 ARG HG3 H 1 1.379 0.003 . 2 . . . A 3 ARG QG . 19033 1
7 . 1 1 3 3 ARG HD2 H 1 3.089 0.003 . 2 . . . A 3 ARG HD2 . 19033 1
8 . 1 1 3 3 ARG HD3 H 1 2.899 0.003 . 2 . . . A 3 ARG HD3 . 19033 1
9 . 1 1 3 3 ARG HE H 1 7.871 0.003 . 1 . . . A 3 ARG HE . 19033 1
10 . 1 1 3 3 ARG CA C 13 54.177 0.164 . 1 . . . A 3 ARG CA . 19033 1
11 . 1 1 3 3 ARG CB C 13 29.313 0.164 . 1 . . . A 3 ARG CB . 19033 1
12 . 1 1 3 3 ARG CG C 13 24.453 0.164 . 1 . . . A 3 ARG CG . 19033 1
13 . 1 1 3 3 ARG CD C 13 41.474 0.164 . 1 . . . A 3 ARG CD . 19033 1
14 . 1 1 3 3 ARG N N 15 123.172 0.121 . 1 . . . A 3 ARG N . 19033 1
15 . 1 1 3 3 ARG NE N 15 84.620 0.121 . 1 . . . A 3 ARG NE . 19033 1
16 . 1 1 4 4 ARG H H 1 8.458 0.003 . 1 . . . A 4 ARG H . 19033 1
17 . 1 1 4 4 ARG HA H 1 5.445 0.003 . 1 . . . A 4 ARG HA . 19033 1
18 . 1 1 4 4 ARG HB2 H 1 1.630 0.003 . 2 . . . A 4 ARG QB . 19033 1
19 . 1 1 4 4 ARG HB3 H 1 1.630 0.003 . 2 . . . A 4 ARG QB . 19033 1
20 . 1 1 4 4 ARG HG2 H 1 1.627 0.003 . 2 . . . A 4 ARG HG2 . 19033 1
21 . 1 1 4 4 ARG HG3 H 1 1.491 0.003 . 2 . . . A 4 ARG HG3 . 19033 1
22 . 1 1 4 4 ARG HD2 H 1 2.950 0.003 . 2 . . . A 4 ARG HD2 . 19033 1
23 . 1 1 4 4 ARG HD3 H 1 3.067 0.003 . 2 . . . A 4 ARG HD3 . 19033 1
24 . 1 1 4 4 ARG HE H 1 7.293 0.003 . 1 . . . A 4 ARG HE . 19033 1
25 . 1 1 4 4 ARG CA C 13 51.948 0.164 . 1 . . . A 4 ARG CA . 19033 1
26 . 1 1 4 4 ARG CB C 13 30.814 0.164 . 1 . . . A 4 ARG CB . 19033 1
27 . 1 1 4 4 ARG CG C 13 25.237 0.164 . 1 . . . A 4 ARG CG . 19033 1
28 . 1 1 4 4 ARG CD C 13 41.137 0.164 . 1 . . . A 4 ARG CD . 19033 1
29 . 1 1 4 4 ARG N N 15 122.811 0.121 . 1 . . . A 4 ARG N . 19033 1
30 . 1 1 4 4 ARG NE N 15 84.552 0.121 . 1 . . . A 4 ARG NE . 19033 1
31 . 1 1 5 5 VAL H H 1 8.173 0.003 . 1 . . . A 5 VAL H . 19033 1
32 . 1 1 5 5 VAL HA H 1 5.084 0.003 . 1 . . . A 5 VAL HA . 19033 1
33 . 1 1 5 5 VAL HB H 1 1.831 0.003 . 1 . . . A 5 VAL HB . 19033 1
34 . 1 1 5 5 VAL HG11 H 1 0.401 0.003 . 2 . . . A 5 VAL QG1 . 19033 1
35 . 1 1 5 5 VAL HG12 H 1 0.401 0.003 . 2 . . . A 5 VAL QG1 . 19033 1
36 . 1 1 5 5 VAL HG13 H 1 0.401 0.003 . 2 . . . A 5 VAL QG1 . 19033 1
37 . 1 1 5 5 VAL HG21 H 1 0.557 0.003 . 2 . . . A 5 VAL QG2 . 19033 1
38 . 1 1 5 5 VAL HG22 H 1 0.557 0.003 . 2 . . . A 5 VAL QG2 . 19033 1
39 . 1 1 5 5 VAL HG23 H 1 0.557 0.003 . 2 . . . A 5 VAL QG2 . 19033 1
40 . 1 1 5 5 VAL CA C 13 55.894 0.164 . 1 . . . A 5 VAL CA . 19033 1
41 . 1 1 5 5 VAL CB C 13 33.614 0.164 . 1 . . . A 5 VAL CB . 19033 1
42 . 1 1 5 5 VAL CG1 C 13 15.825 0.164 . 2 . . . A 5 VAL CG1 . 19033 1
43 . 1 1 5 5 VAL CG2 C 13 19.612 0.164 . 2 . . . A 5 VAL CG2 . 19033 1
44 . 1 1 5 5 VAL N N 15 112.133 0.121 . 1 . . . A 5 VAL N . 19033 1
45 . 1 1 6 6 ARG H H 1 9.102 0.003 . 1 . . . A 6 ARG H . 19033 1
46 . 1 1 6 6 ARG HA H 1 5.615 0.003 . 1 . . . A 6 ARG HA . 19033 1
47 . 1 1 6 6 ARG HB2 H 1 1.623 0.003 . 2 . . . A 6 ARG HB2 . 19033 1
48 . 1 1 6 6 ARG HB3 H 1 1.459 0.003 . 2 . . . A 6 ARG HB3 . 19033 1
49 . 1 1 6 6 ARG HG2 H 1 1.358 0.003 . 2 . . . A 6 ARG QG . 19033 1
50 . 1 1 6 6 ARG HG3 H 1 1.358 0.003 . 2 . . . A 6 ARG QG . 19033 1
51 . 1 1 6 6 ARG HD2 H 1 3.168 0.003 . 2 . . . A 6 ARG QD . 19033 1
52 . 1 1 6 6 ARG HD3 H 1 3.168 0.003 . 2 . . . A 6 ARG QD . 19033 1
53 . 1 1 6 6 ARG HE H 1 7.258 0.003 . 1 . . . A 6 ARG HE . 19033 1
54 . 1 1 6 6 ARG CA C 13 50.883 0.164 . 1 . . . A 6 ARG CA . 19033 1
55 . 1 1 6 6 ARG CB C 13 32.664 0.164 . 1 . . . A 6 ARG CB . 19033 1
56 . 1 1 6 6 ARG CG C 13 24.089 0.164 . 1 . . . A 6 ARG CG . 19033 1
57 . 1 1 6 6 ARG CD C 13 41.324 0.164 . 1 . . . A 6 ARG CD . 19033 1
58 . 1 1 6 6 ARG N N 15 120.981 0.121 . 1 . . . A 6 ARG N . 19033 1
59 . 1 1 6 6 ARG NE N 15 83.947 0.121 . 1 . . . A 6 ARG NE . 19033 1
60 . 1 1 7 7 ALA H H 1 9.300 0.003 . 1 . . . A 7 ALA H . 19033 1
61 . 1 1 7 7 ALA HA H 1 4.825 0.003 . 1 . . . A 7 ALA HA . 19033 1
62 . 1 1 7 7 ALA HB1 H 1 1.830 0.003 . 1 . . . A 7 ALA QB . 19033 1
63 . 1 1 7 7 ALA HB2 H 1 1.830 0.003 . 1 . . . A 7 ALA QB . 19033 1
64 . 1 1 7 7 ALA HB3 H 1 1.830 0.003 . 1 . . . A 7 ALA QB . 19033 1
65 . 1 1 7 7 ALA CA C 13 50.010 0.164 . 1 . . . A 7 ALA CA . 19033 1
66 . 1 1 7 7 ALA CB C 13 18.560 0.164 . 1 . . . A 7 ALA CB . 19033 1
67 . 1 1 7 7 ALA N N 15 127.309 0.121 . 1 . . . A 7 ALA N . 19033 1
68 . 1 1 8 8 ILE H H 1 9.095 0.003 . 1 . . . A 8 ILE H . 19033 1
69 . 1 1 8 8 ILE HA H 1 4.293 0.003 . 1 . . . A 8 ILE HA . 19033 1
70 . 1 1 8 8 ILE HB H 1 2.023 0.003 . 1 . . . A 8 ILE HB . 19033 1
71 . 1 1 8 8 ILE HG12 H 1 1.168 0.003 . 2 . . . A 8 ILE QG1 . 19033 1
72 . 1 1 8 8 ILE HG13 H 1 1.168 0.003 . 2 . . . A 8 ILE QG1 . 19033 1
73 . 1 1 8 8 ILE HG21 H 1 0.793 0.003 . 1 . . . A 8 ILE QG2 . 19033 1
74 . 1 1 8 8 ILE HG22 H 1 0.793 0.003 . 1 . . . A 8 ILE QG2 . 19033 1
75 . 1 1 8 8 ILE HG23 H 1 0.793 0.003 . 1 . . . A 8 ILE QG2 . 19033 1
76 . 1 1 8 8 ILE HD11 H 1 0.779 0.003 . 1 . . . A 8 ILE QD1 . 19033 1
77 . 1 1 8 8 ILE HD12 H 1 0.779 0.003 . 1 . . . A 8 ILE QD1 . 19033 1
78 . 1 1 8 8 ILE HD13 H 1 0.779 0.003 . 1 . . . A 8 ILE QD1 . 19033 1
79 . 1 1 8 8 ILE CA C 13 59.073 0.164 . 1 . . . A 8 ILE CA . 19033 1
80 . 1 1 8 8 ILE CB C 13 36.125 0.164 . 1 . . . A 8 ILE CB . 19033 1
81 . 1 1 8 8 ILE CG1 C 13 23.796 0.164 . 1 . . . A 8 ILE CG1 . 19033 1
82 . 1 1 8 8 ILE CG2 C 13 16.457 0.164 . 1 . . . A 8 ILE CG2 . 19033 1
83 . 1 1 8 8 ILE CD1 C 13 11.821 0.164 . 1 . . . A 8 ILE CD1 . 19033 1
84 . 1 1 8 8 ILE N N 15 119.944 0.121 . 1 . . . A 8 ILE N . 19033 1
85 . 1 1 9 9 LEU H H 1 7.738 0.003 . 1 . . . A 9 LEU H . 19033 1
86 . 1 1 9 9 LEU HA H 1 4.549 0.003 . 1 . . . A 9 LEU HA . 19033 1
87 . 1 1 9 9 LEU HB2 H 1 1.765 0.003 . 2 . . . A 9 LEU HB2 . 19033 1
88 . 1 1 9 9 LEU HB3 H 1 1.486 0.003 . 2 . . . A 9 LEU HB3 . 19033 1
89 . 1 1 9 9 LEU HG H 1 1.672 0.003 . 1 . . . A 9 LEU HG . 19033 1
90 . 1 1 9 9 LEU HD11 H 1 0.859 0.003 . 2 . . . A 9 LEU QD1 . 19033 1
91 . 1 1 9 9 LEU HD12 H 1 0.859 0.003 . 2 . . . A 9 LEU QD1 . 19033 1
92 . 1 1 9 9 LEU HD13 H 1 0.859 0.003 . 2 . . . A 9 LEU QD1 . 19033 1
93 . 1 1 9 9 LEU HD21 H 1 1.052 0.003 . 2 . . . A 9 LEU QD2 . 19033 1
94 . 1 1 9 9 LEU HD22 H 1 1.052 0.003 . 2 . . . A 9 LEU QD2 . 19033 1
95 . 1 1 9 9 LEU HD23 H 1 1.052 0.003 . 2 . . . A 9 LEU QD2 . 19033 1
96 . 1 1 9 9 LEU CA C 13 49.936 0.164 . 1 . . . A 9 LEU CA . 19033 1
97 . 1 1 9 9 LEU CB C 13 44.882 0.164 . 1 . . . A 9 LEU CB . 19033 1
98 . 1 1 9 9 LEU CG C 13 25.264 0.164 . 1 . . . A 9 LEU CG . 19033 1
99 . 1 1 9 9 LEU CD1 C 13 23.035 0.164 . 2 . . . A 9 LEU CD1 . 19033 1
100 . 1 1 9 9 LEU CD2 C 13 20.864 0.164 . 2 . . . A 9 LEU CD2 . 19033 1
101 . 1 1 9 9 LEU N N 15 123.267 0.121 . 1 . . . A 9 LEU N . 19033 1
102 . 1 1 10 10 PRO HA H 1 4.534 0.003 . 1 . . . A 10 PRO HA . 19033 1
103 . 1 1 10 10 PRO HB2 H 1 1.978 0.003 . 2 . . . A 10 PRO HB2 . 19033 1
104 . 1 1 10 10 PRO HB3 H 1 2.320 0.003 . 2 . . . A 10 PRO HB3 . 19033 1
105 . 1 1 10 10 PRO HG2 H 1 2.022 0.003 . 2 . . . A 10 PRO HG2 . 19033 1
106 . 1 1 10 10 PRO HG3 H 1 1.933 0.003 . 2 . . . A 10 PRO HG3 . 19033 1
107 . 1 1 10 10 PRO HD2 H 1 3.701 0.003 . 2 . . . A 10 PRO HD2 . 19033 1
108 . 1 1 10 10 PRO HD3 H 1 3.482 0.003 . 2 . . . A 10 PRO HD3 . 19033 1
109 . 1 1 10 10 PRO CA C 13 59.146 0.164 . 1 . . . A 10 PRO CA . 19033 1
110 . 1 1 10 10 PRO CB C 13 30.365 0.164 . 1 . . . A 10 PRO CB . 19033 1
111 . 1 1 10 10 PRO CG C 13 23.664 0.164 . 1 . . . A 10 PRO CG . 19033 1
112 . 1 1 10 10 PRO CD C 13 46.719 0.164 . 1 . . . A 10 PRO CD . 19033 1
113 . 1 1 11 11 TYR H H 1 7.754 0.003 . 1 . . . A 11 TYR H . 19033 1
114 . 1 1 11 11 TYR HA H 1 4.070 0.003 . 1 . . . A 11 TYR HA . 19033 1
115 . 1 1 11 11 TYR HB2 H 1 2.214 0.003 . 2 . . . A 11 TYR HB2 . 19033 1
116 . 1 1 11 11 TYR HB3 H 1 0.665 0.003 . 2 . . . A 11 TYR HB3 . 19033 1
117 . 1 1 11 11 TYR HD1 H 1 6.791 0.003 . 3 . . . A 11 TYR QD . 19033 1
118 . 1 1 11 11 TYR HD2 H 1 6.791 0.003 . 3 . . . A 11 TYR QD . 19033 1
119 . 1 1 11 11 TYR HE1 H 1 6.782 0.003 . 3 . . . A 11 TYR QE . 19033 1
120 . 1 1 11 11 TYR HE2 H 1 6.782 0.003 . 3 . . . A 11 TYR QE . 19033 1
121 . 1 1 11 11 TYR CA C 13 56.303 0.164 . 1 . . . A 11 TYR CA . 19033 1
122 . 1 1 11 11 TYR CB C 13 39.864 0.164 . 1 . . . A 11 TYR CB . 19033 1
123 . 1 1 11 11 TYR CD2 C 13 129.928 0.164 . 3 . . . A 11 TYR CD2 . 19033 1
124 . 1 1 11 11 TYR CE2 C 13 115.419 0.164 . 3 . . . A 11 TYR CE2 . 19033 1
125 . 1 1 11 11 TYR N N 15 117.178 0.121 . 1 . . . A 11 TYR N . 19033 1
126 . 1 1 12 12 THR H H 1 7.149 0.003 . 1 . . . A 12 THR H . 19033 1
127 . 1 1 12 12 THR HA H 1 4.224 0.003 . 1 . . . A 12 THR HA . 19033 1
128 . 1 1 12 12 THR HB H 1 3.485 0.003 . 1 . . . A 12 THR HB . 19033 1
129 . 1 1 12 12 THR HG21 H 1 0.998 0.003 . 1 . . . A 12 THR QG2 . 19033 1
130 . 1 1 12 12 THR HG22 H 1 0.998 0.003 . 1 . . . A 12 THR QG2 . 19033 1
131 . 1 1 12 12 THR HG23 H 1 0.998 0.003 . 1 . . . A 12 THR QG2 . 19033 1
132 . 1 1 12 12 THR CA C 13 57.833 0.164 . 1 . . . A 12 THR CA . 19033 1
133 . 1 1 12 12 THR CB C 13 66.962 0.164 . 1 . . . A 12 THR CB . 19033 1
134 . 1 1 12 12 THR CG2 C 13 18.634 0.164 . 1 . . . A 12 THR CG2 . 19033 1
135 . 1 1 12 12 THR N N 15 125.004 0.121 . 1 . . . A 12 THR N . 19033 1
136 . 1 1 13 13 LYS H H 1 8.121 0.003 . 1 . . . A 13 LYS H . 19033 1
137 . 1 1 13 13 LYS HA H 1 4.148 0.003 . 1 . . . A 13 LYS HA . 19033 1
138 . 1 1 13 13 LYS HB2 H 1 1.162 0.003 . 2 . . . A 13 LYS HB2 . 19033 1
139 . 1 1 13 13 LYS HB3 H 1 1.674 0.003 . 2 . . . A 13 LYS HB3 . 19033 1
140 . 1 1 13 13 LYS HG2 H 1 1.294 0.003 . 2 . . . A 13 LYS HG2 . 19033 1
141 . 1 1 13 13 LYS HG3 H 1 0.560 0.003 . 2 . . . A 13 LYS HG3 . 19033 1
142 . 1 1 13 13 LYS HD2 H 1 1.781 0.003 . 2 . . . A 13 LYS HD2 . 19033 1
143 . 1 1 13 13 LYS HD3 H 1 1.506 0.003 . 2 . . . A 13 LYS HD3 . 19033 1
144 . 1 1 13 13 LYS HE2 H 1 2.881 0.003 . 2 . . . A 13 LYS HE2 . 19033 1
145 . 1 1 13 13 LYS HE3 H 1 2.846 0.003 . 2 . . . A 13 LYS HE3 . 19033 1
146 . 1 1 13 13 LYS CA C 13 52.749 0.164 . 1 . . . A 13 LYS CA . 19033 1
147 . 1 1 13 13 LYS CB C 13 30.350 0.164 . 1 . . . A 13 LYS CB . 19033 1
148 . 1 1 13 13 LYS CG C 13 20.524 0.164 . 1 . . . A 13 LYS CG . 19033 1
149 . 1 1 13 13 LYS CD C 13 26.480 0.164 . 1 . . . A 13 LYS CD . 19033 1
150 . 1 1 13 13 LYS CE C 13 39.783 0.164 . 1 . . . A 13 LYS CE . 19033 1
151 . 1 1 13 13 LYS N N 15 123.175 0.121 . 1 . . . A 13 LYS N . 19033 1
152 . 1 1 14 14 VAL H H 1 8.061 0.003 . 1 . . . A 14 VAL H . 19033 1
153 . 1 1 14 14 VAL HA H 1 4.048 0.003 . 1 . . . A 14 VAL HA . 19033 1
154 . 1 1 14 14 VAL HB H 1 1.801 0.003 . 1 . . . A 14 VAL HB . 19033 1
155 . 1 1 14 14 VAL HG11 H 1 0.923 0.003 . 2 . . . A 14 VAL QG1 . 19033 1
156 . 1 1 14 14 VAL HG12 H 1 0.923 0.003 . 2 . . . A 14 VAL QG1 . 19033 1
157 . 1 1 14 14 VAL HG13 H 1 0.923 0.003 . 2 . . . A 14 VAL QG1 . 19033 1
158 . 1 1 14 14 VAL HG21 H 1 1.053 0.003 . 2 . . . A 14 VAL QG2 . 19033 1
159 . 1 1 14 14 VAL HG22 H 1 1.053 0.003 . 2 . . . A 14 VAL QG2 . 19033 1
160 . 1 1 14 14 VAL HG23 H 1 1.053 0.003 . 2 . . . A 14 VAL QG2 . 19033 1
161 . 1 1 14 14 VAL CA C 13 58.059 0.164 . 1 . . . A 14 VAL CA . 19033 1
162 . 1 1 14 14 VAL CB C 13 29.394 0.164 . 1 . . . A 14 VAL CB . 19033 1
163 . 1 1 14 14 VAL CG1 C 13 17.990 0.164 . 2 . . . A 14 VAL CG1 . 19033 1
164 . 1 1 14 14 VAL CG2 C 13 20.225 0.164 . 2 . . . A 14 VAL CG2 . 19033 1
165 . 1 1 14 14 VAL N N 15 126.091 0.121 . 1 . . . A 14 VAL N . 19033 1
166 . 1 1 15 15 PRO HA H 1 4.120 0.003 . 1 . . . A 15 PRO HA . 19033 1
167 . 1 1 15 15 PRO HB2 H 1 2.194 0.003 . 2 . . . A 15 PRO HB2 . 19033 1
168 . 1 1 15 15 PRO HB3 H 1 1.756 0.003 . 2 . . . A 15 PRO HB3 . 19033 1
169 . 1 1 15 15 PRO HG2 H 1 1.859 0.003 . 2 . . . A 15 PRO HG2 . 19033 1
170 . 1 1 15 15 PRO HG3 H 1 1.969 0.003 . 2 . . . A 15 PRO HG3 . 19033 1
171 . 1 1 15 15 PRO HD2 H 1 3.572 0.003 . 2 . . . A 15 PRO HD2 . 19033 1
172 . 1 1 15 15 PRO HD3 H 1 3.853 0.003 . 2 . . . A 15 PRO HD3 . 19033 1
173 . 1 1 15 15 PRO CA C 13 61.050 0.164 . 1 . . . A 15 PRO CA . 19033 1
174 . 1 1 15 15 PRO CB C 13 29.695 0.164 . 1 . . . A 15 PRO CB . 19033 1
175 . 1 1 15 15 PRO CG C 13 24.935 0.164 . 1 . . . A 15 PRO CG . 19033 1
176 . 1 1 15 15 PRO CD C 13 48.767 0.164 . 1 . . . A 15 PRO CD . 19033 1
177 . 1 1 16 16 ASP H H 1 8.808 0.003 . 1 . . . A 16 ASP H . 19033 1
178 . 1 1 16 16 ASP HA H 1 4.287 0.003 . 1 . . . A 16 ASP HA . 19033 1
179 . 1 1 16 16 ASP HB2 H 1 2.839 0.003 . 2 . . . A 16 ASP HB2 . 19033 1
180 . 1 1 16 16 ASP HB3 H 1 2.774 0.003 . 2 . . . A 16 ASP HB3 . 19033 1
181 . 1 1 16 16 ASP CA C 13 53.189 0.164 . 1 . . . A 16 ASP CA . 19033 1
182 . 1 1 16 16 ASP CB C 13 36.311 0.164 . 1 . . . A 16 ASP CB . 19033 1
183 . 1 1 16 16 ASP N N 15 115.188 0.121 . 1 . . . A 16 ASP N . 19033 1
184 . 1 1 17 17 THR H H 1 7.264 0.003 . 1 . . . A 17 THR H . 19033 1
185 . 1 1 17 17 THR HA H 1 4.704 0.003 . 1 . . . A 17 THR HA . 19033 1
186 . 1 1 17 17 THR HB H 1 4.273 0.003 . 1 . . . A 17 THR HB . 19033 1
187 . 1 1 17 17 THR HG21 H 1 1.021 0.003 . 1 . . . A 17 THR QG2 . 19033 1
188 . 1 1 17 17 THR HG22 H 1 1.021 0.003 . 1 . . . A 17 THR QG2 . 19033 1
189 . 1 1 17 17 THR HG23 H 1 1.021 0.003 . 1 . . . A 17 THR QG2 . 19033 1
190 . 1 1 17 17 THR CA C 13 58.069 0.164 . 1 . . . A 17 THR CA . 19033 1
191 . 1 1 17 17 THR CB C 13 70.764 0.164 . 1 . . . A 17 THR CB . 19033 1
192 . 1 1 17 17 THR CG2 C 13 18.419 0.164 . 1 . . . A 17 THR CG2 . 19033 1
193 . 1 1 17 17 THR N N 15 106.185 0.121 . 1 . . . A 17 THR N . 19033 1
194 . 1 1 18 18 ASP H H 1 8.855 0.003 . 1 . . . A 18 ASP H . 19033 1
195 . 1 1 18 18 ASP HA H 1 4.963 0.003 . 1 . . . A 18 ASP HA . 19033 1
196 . 1 1 18 18 ASP HB2 H 1 3.257 0.003 . 2 . . . A 18 ASP HB2 . 19033 1
197 . 1 1 18 18 ASP HB3 H 1 2.582 0.003 . 2 . . . A 18 ASP HB3 . 19033 1
198 . 1 1 18 18 ASP CA C 13 51.920 0.164 . 1 . . . A 18 ASP CA . 19033 1
199 . 1 1 18 18 ASP CB C 13 38.059 0.164 . 1 . . . A 18 ASP CB . 19033 1
200 . 1 1 18 18 ASP N N 15 117.426 0.121 . 1 . . . A 18 ASP N . 19033 1
201 . 1 1 19 19 GLU H H 1 7.603 0.003 . 1 . . . A 19 GLU H . 19033 1
202 . 1 1 19 19 GLU HA H 1 4.694 0.003 . 1 . . . A 19 GLU HA . 19033 1
203 . 1 1 19 19 GLU HB2 H 1 2.535 0.003 . 2 . . . A 19 GLU HB2 . 19033 1
204 . 1 1 19 19 GLU HB3 H 1 1.939 0.003 . 2 . . . A 19 GLU HB3 . 19033 1
205 . 1 1 19 19 GLU HG2 H 1 2.311 0.003 . 2 . . . A 19 GLU QG . 19033 1
206 . 1 1 19 19 GLU HG3 H 1 2.311 0.003 . 2 . . . A 19 GLU QG . 19033 1
207 . 1 1 19 19 GLU CA C 13 54.515 0.164 . 1 . . . A 19 GLU CA . 19033 1
208 . 1 1 19 19 GLU CB C 13 29.535 0.164 . 1 . . . A 19 GLU CB . 19033 1
209 . 1 1 19 19 GLU CG C 13 33.581 0.164 . 1 . . . A 19 GLU CG . 19033 1
210 . 1 1 19 19 GLU N N 15 119.666 0.121 . 1 . . . A 19 GLU N . 19033 1
211 . 1 1 20 20 ILE H H 1 6.909 0.003 . 1 . . . A 20 ILE H . 19033 1
212 . 1 1 20 20 ILE HA H 1 4.853 0.003 . 1 . . . A 20 ILE HA . 19033 1
213 . 1 1 20 20 ILE HB H 1 2.071 0.003 . 1 . . . A 20 ILE HB . 19033 1
214 . 1 1 20 20 ILE HG12 H 1 0.585 0.003 . 2 . . . A 20 ILE HG12 . 19033 1
215 . 1 1 20 20 ILE HG13 H 1 1.458 0.003 . 2 . . . A 20 ILE HG13 . 19033 1
216 . 1 1 20 20 ILE HG21 H 1 0.653 0.003 . 1 . . . A 20 ILE QG2 . 19033 1
217 . 1 1 20 20 ILE HG22 H 1 0.653 0.003 . 1 . . . A 20 ILE QG2 . 19033 1
218 . 1 1 20 20 ILE HG23 H 1 0.653 0.003 . 1 . . . A 20 ILE QG2 . 19033 1
219 . 1 1 20 20 ILE HD11 H 1 0.722 0.003 . 1 . . . A 20 ILE QD1 . 19033 1
220 . 1 1 20 20 ILE HD12 H 1 0.722 0.003 . 1 . . . A 20 ILE QD1 . 19033 1
221 . 1 1 20 20 ILE HD13 H 1 0.722 0.003 . 1 . . . A 20 ILE QD1 . 19033 1
222 . 1 1 20 20 ILE CA C 13 56.257 0.164 . 1 . . . A 20 ILE CA . 19033 1
223 . 1 1 20 20 ILE CB C 13 38.401 0.164 . 1 . . . A 20 ILE CB . 19033 1
224 . 1 1 20 20 ILE CG1 C 13 22.702 0.164 . 1 . . . A 20 ILE CG1 . 19033 1
225 . 1 1 20 20 ILE CG2 C 13 16.145 0.164 . 1 . . . A 20 ILE CG2 . 19033 1
226 . 1 1 20 20 ILE CD1 C 13 12.517 0.164 . 1 . . . A 20 ILE CD1 . 19033 1
227 . 1 1 20 20 ILE N N 15 109.127 0.121 . 1 . . . A 20 ILE N . 19033 1
228 . 1 1 21 21 SER H H 1 8.738 0.003 . 1 . . . A 21 SER H . 19033 1
229 . 1 1 21 21 SER HA H 1 4.796 0.003 . 1 . . . A 21 SER HA . 19033 1
230 . 1 1 21 21 SER HB2 H 1 3.764 0.003 . 2 . . . A 21 SER HB2 . 19033 1
231 . 1 1 21 21 SER HB3 H 1 4.121 0.003 . 2 . . . A 21 SER HB3 . 19033 1
232 . 1 1 21 21 SER CA C 13 54.907 0.164 . 1 . . . A 21 SER CA . 19033 1
233 . 1 1 21 21 SER CB C 13 61.426 0.164 . 1 . . . A 21 SER CB . 19033 1
234 . 1 1 21 21 SER N N 15 117.834 0.121 . 1 . . . A 21 SER N . 19033 1
235 . 1 1 22 22 PHE H H 1 8.860 0.003 . 1 . . . A 22 PHE H . 19033 1
236 . 1 1 22 22 PHE HA H 1 4.665 0.003 . 1 . . . A 22 PHE HA . 19033 1
237 . 1 1 22 22 PHE HB2 H 1 3.279 0.003 . 2 . . . A 22 PHE HB2 . 19033 1
238 . 1 1 22 22 PHE HB3 H 1 3.585 0.003 . 2 . . . A 22 PHE HB3 . 19033 1
239 . 1 1 22 22 PHE HD1 H 1 5.972 0.003 . 3 . . . A 22 PHE QD . 19033 1
240 . 1 1 22 22 PHE HD2 H 1 5.972 0.003 . 3 . . . A 22 PHE QD . 19033 1
241 . 1 1 22 22 PHE CA C 13 53.807 0.164 . 1 . . . A 22 PHE CA . 19033 1
242 . 1 1 22 22 PHE CB C 13 38.324 0.164 . 1 . . . A 22 PHE CB . 19033 1
243 . 1 1 22 22 PHE CD1 C 13 125.472 0.164 . 3 . . . A 22 PHE CD1 . 19033 1
244 . 1 1 22 22 PHE N N 15 116.177 0.121 . 1 . . . A 22 PHE N . 19033 1
245 . 1 1 23 23 LEU H H 1 8.681 0.003 . 1 . . . A 23 LEU H . 19033 1
246 . 1 1 23 23 LEU HA H 1 4.611 0.003 . 1 . . . A 23 LEU HA . 19033 1
247 . 1 1 23 23 LEU HB2 H 1 1.536 0.003 . 2 . . . A 23 LEU HB2 . 19033 1
248 . 1 1 23 23 LEU HB3 H 1 1.423 0.003 . 2 . . . A 23 LEU HB3 . 19033 1
249 . 1 1 23 23 LEU HG H 1 1.528 0.003 . 1 . . . A 23 LEU HG . 19033 1
250 . 1 1 23 23 LEU HD11 H 1 0.800 0.003 . 2 . . . A 23 LEU QD1 . 19033 1
251 . 1 1 23 23 LEU HD12 H 1 0.800 0.003 . 2 . . . A 23 LEU QD1 . 19033 1
252 . 1 1 23 23 LEU HD13 H 1 0.800 0.003 . 2 . . . A 23 LEU QD1 . 19033 1
253 . 1 1 23 23 LEU HD21 H 1 0.754 0.003 . 2 . . . A 23 LEU QD2 . 19033 1
254 . 1 1 23 23 LEU HD22 H 1 0.754 0.003 . 2 . . . A 23 LEU QD2 . 19033 1
255 . 1 1 23 23 LEU HD23 H 1 0.754 0.003 . 2 . . . A 23 LEU QD2 . 19033 1
256 . 1 1 23 23 LEU CA C 13 49.953 0.164 . 1 . . . A 23 LEU CA . 19033 1
257 . 1 1 23 23 LEU CB C 13 41.634 0.164 . 1 . . . A 23 LEU CB . 19033 1
258 . 1 1 23 23 LEU CG C 13 24.496 0.164 . 1 . . . A 23 LEU CG . 19033 1
259 . 1 1 23 23 LEU CD1 C 13 20.000 0.164 . 2 . . . A 23 LEU CD1 . 19033 1
260 . 1 1 23 23 LEU CD2 C 13 22.343 0.164 . 2 . . . A 23 LEU CD2 . 19033 1
261 . 1 1 23 23 LEU N N 15 121.283 0.121 . 1 . . . A 23 LEU N . 19033 1
262 . 1 1 24 24 LYS H H 1 8.076 0.003 . 1 . . . A 24 LYS H . 19033 1
263 . 1 1 24 24 LYS HA H 1 3.322 0.003 . 1 . . . A 24 LYS HA . 19033 1
264 . 1 1 24 24 LYS HB2 H 1 1.269 0.003 . 2 . . . A 24 LYS HB2 . 19033 1
265 . 1 1 24 24 LYS HB3 H 1 1.649 0.003 . 2 . . . A 24 LYS HB3 . 19033 1
266 . 1 1 24 24 LYS HG2 H 1 1.151 0.003 . 2 . . . A 24 LYS HG2 . 19033 1
267 . 1 1 24 24 LYS HG3 H 1 1.026 0.003 . 2 . . . A 24 LYS HG3 . 19033 1
268 . 1 1 24 24 LYS HD2 H 1 1.660 0.003 . 2 . . . A 24 LYS HD2 . 19033 1
269 . 1 1 24 24 LYS HD3 H 1 1.594 0.003 . 2 . . . A 24 LYS HD3 . 19033 1
270 . 1 1 24 24 LYS HE2 H 1 2.946 0.003 . 2 . . . A 24 LYS QE . 19033 1
271 . 1 1 24 24 LYS HE3 H 1 2.946 0.003 . 2 . . . A 24 LYS QE . 19033 1
272 . 1 1 24 24 LYS CA C 13 56.428 0.164 . 1 . . . A 24 LYS CA . 19033 1
273 . 1 1 24 24 LYS CB C 13 29.987 0.164 . 1 . . . A 24 LYS CB . 19033 1
274 . 1 1 24 24 LYS CG C 13 22.669 0.164 . 1 . . . A 24 LYS CG . 19033 1
275 . 1 1 24 24 LYS CD C 13 27.244 0.164 . 1 . . . A 24 LYS CD . 19033 1
276 . 1 1 24 24 LYS CE C 13 39.474 0.164 . 1 . . . A 24 LYS CE . 19033 1
277 . 1 1 24 24 LYS N N 15 119.660 0.121 . 1 . . . A 24 LYS N . 19033 1
278 . 1 1 25 25 GLY H H 1 8.569 0.003 . 1 . . . A 25 GLY H . 19033 1
279 . 1 1 25 25 GLY HA2 H 1 3.349 0.003 . 2 . . . A 25 GLY HA2 . 19033 1
280 . 1 1 25 25 GLY HA3 H 1 4.391 0.003 . 2 . . . A 25 GLY HA3 . 19033 1
281 . 1 1 25 25 GLY CA C 13 42.313 0.164 . 1 . . . A 25 GLY CA . 19033 1
282 . 1 1 25 25 GLY N N 15 115.402 0.121 . 1 . . . A 25 GLY N . 19033 1
283 . 1 1 26 26 ASP H H 1 7.847 0.003 . 1 . . . A 26 ASP H . 19033 1
284 . 1 1 26 26 ASP HA H 1 4.307 0.003 . 1 . . . A 26 ASP HA . 19033 1
285 . 1 1 26 26 ASP HB2 H 1 2.564 0.003 . 2 . . . A 26 ASP HB2 . 19033 1
286 . 1 1 26 26 ASP HB3 H 1 1.939 0.003 . 2 . . . A 26 ASP HB3 . 19033 1
287 . 1 1 26 26 ASP CA C 13 53.273 0.164 . 1 . . . A 26 ASP CA . 19033 1
288 . 1 1 26 26 ASP CB C 13 37.932 0.164 . 1 . . . A 26 ASP CB . 19033 1
289 . 1 1 26 26 ASP N N 15 122.287 0.121 . 1 . . . A 26 ASP N . 19033 1
290 . 1 1 27 27 MET H H 1 8.117 0.003 . 1 . . . A 27 MET H . 19033 1
291 . 1 1 27 27 MET HA H 1 5.070 0.003 . 1 . . . A 27 MET HA . 19033 1
292 . 1 1 27 27 MET HB2 H 1 1.890 0.003 . 2 . . . A 27 MET HB2 . 19033 1
293 . 1 1 27 27 MET HB3 H 1 1.760 0.003 . 2 . . . A 27 MET HB3 . 19033 1
294 . 1 1 27 27 MET HG2 H 1 2.513 0.003 . 2 . . . A 27 MET HG2 . 19033 1
295 . 1 1 27 27 MET HG3 H 1 2.391 0.003 . 2 . . . A 27 MET HG3 . 19033 1
296 . 1 1 27 27 MET HE1 H 1 1.958 0.003 . 1 . . . A 27 MET QE . 19033 1
297 . 1 1 27 27 MET HE2 H 1 1.958 0.003 . 1 . . . A 27 MET QE . 19033 1
298 . 1 1 27 27 MET HE3 H 1 1.958 0.003 . 1 . . . A 27 MET QE . 19033 1
299 . 1 1 27 27 MET CA C 13 50.485 0.164 . 1 . . . A 27 MET CA . 19033 1
300 . 1 1 27 27 MET CB C 13 32.786 0.164 . 1 . . . A 27 MET CB . 19033 1
301 . 1 1 27 27 MET CG C 13 29.639 0.164 . 1 . . . A 27 MET CG . 19033 1
302 . 1 1 27 27 MET CE C 13 14.323 0.164 . 1 . . . A 27 MET CE . 19033 1
303 . 1 1 27 27 MET N N 15 119.570 0.121 . 1 . . . A 27 MET N . 19033 1
304 . 1 1 28 28 PHE H H 1 8.909 0.003 . 1 . . . A 28 PHE H . 19033 1
305 . 1 1 28 28 PHE HA H 1 5.659 0.003 . 1 . . . A 28 PHE HA . 19033 1
306 . 1 1 28 28 PHE HB2 H 1 2.332 0.003 . 2 . . . A 28 PHE HB2 . 19033 1
307 . 1 1 28 28 PHE HB3 H 1 2.545 0.003 . 2 . . . A 28 PHE HB3 . 19033 1
308 . 1 1 28 28 PHE HD1 H 1 6.639 0.003 . 3 . . . A 28 PHE QD . 19033 1
309 . 1 1 28 28 PHE HD2 H 1 6.639 0.003 . 3 . . . A 28 PHE QD . 19033 1
310 . 1 1 28 28 PHE HE1 H 1 6.586 0.003 . 3 . . . A 28 PHE QE . 19033 1
311 . 1 1 28 28 PHE HE2 H 1 6.586 0.003 . 3 . . . A 28 PHE QE . 19033 1
312 . 1 1 28 28 PHE HZ H 1 6.956 0.003 . 1 . . . A 28 PHE HZ . 19033 1
313 . 1 1 28 28 PHE CA C 13 52.237 0.164 . 1 . . . A 28 PHE CA . 19033 1
314 . 1 1 28 28 PHE CB C 13 39.127 0.164 . 1 . . . A 28 PHE CB . 19033 1
315 . 1 1 28 28 PHE CD1 C 13 129.253 0.164 . 3 . . . A 28 PHE CD1 . 19033 1
316 . 1 1 28 28 PHE CE1 C 13 127.054 0.164 . 3 . . . A 28 PHE CE1 . 19033 1
317 . 1 1 28 28 PHE CZ C 13 127.716 0.164 . 1 . . . A 28 PHE CZ . 19033 1
318 . 1 1 28 28 PHE N N 15 116.911 0.121 . 1 . . . A 28 PHE N . 19033 1
319 . 1 1 29 29 ILE H H 1 8.060 0.003 . 1 . . . A 29 ILE H . 19033 1
320 . 1 1 29 29 ILE HA H 1 4.554 0.003 . 1 . . . A 29 ILE HA . 19033 1
321 . 1 1 29 29 ILE HB H 1 1.475 0.003 . 1 . . . A 29 ILE HB . 19033 1
322 . 1 1 29 29 ILE HG12 H 1 1.487 0.003 . 2 . . . A 29 ILE HG12 . 19033 1
323 . 1 1 29 29 ILE HG13 H 1 1.018 0.003 . 2 . . . A 29 ILE HG13 . 19033 1
324 . 1 1 29 29 ILE HG21 H 1 0.660 0.003 . 1 . . . A 29 ILE QG2 . 19033 1
325 . 1 1 29 29 ILE HG22 H 1 0.660 0.003 . 1 . . . A 29 ILE QG2 . 19033 1
326 . 1 1 29 29 ILE HG23 H 1 0.660 0.003 . 1 . . . A 29 ILE QG2 . 19033 1
327 . 1 1 29 29 ILE HD11 H 1 0.776 0.003 . 1 . . . A 29 ILE QD1 . 19033 1
328 . 1 1 29 29 ILE HD12 H 1 0.776 0.003 . 1 . . . A 29 ILE QD1 . 19033 1
329 . 1 1 29 29 ILE HD13 H 1 0.776 0.003 . 1 . . . A 29 ILE QD1 . 19033 1
330 . 1 1 29 29 ILE CA C 13 56.548 0.164 . 1 . . . A 29 ILE CA . 19033 1
331 . 1 1 29 29 ILE CB C 13 37.618 0.164 . 1 . . . A 29 ILE CB . 19033 1
332 . 1 1 29 29 ILE CG1 C 13 24.982 0.164 . 1 . . . A 29 ILE CG1 . 19033 1
333 . 1 1 29 29 ILE CG2 C 13 15.015 0.164 . 1 . . . A 29 ILE CG2 . 19033 1
334 . 1 1 29 29 ILE CD1 C 13 10.556 0.164 . 1 . . . A 29 ILE CD1 . 19033 1
335 . 1 1 29 29 ILE N N 15 118.126 0.121 . 1 . . . A 29 ILE N . 19033 1
336 . 1 1 30 30 VAL H H 1 8.331 0.003 . 1 . . . A 30 VAL H . 19033 1
337 . 1 1 30 30 VAL HA H 1 3.864 0.003 . 1 . . . A 30 VAL HA . 19033 1
338 . 1 1 30 30 VAL HB H 1 1.962 0.003 . 1 . . . A 30 VAL HB . 19033 1
339 . 1 1 30 30 VAL HG11 H 1 0.726 0.003 . 2 . . . A 30 VAL QG1 . 19033 1
340 . 1 1 30 30 VAL HG12 H 1 0.726 0.003 . 2 . . . A 30 VAL QG1 . 19033 1
341 . 1 1 30 30 VAL HG13 H 1 0.726 0.003 . 2 . . . A 30 VAL QG1 . 19033 1
342 . 1 1 30 30 VAL HG21 H 1 0.640 0.003 . 2 . . . A 30 VAL QG2 . 19033 1
343 . 1 1 30 30 VAL HG22 H 1 0.640 0.003 . 2 . . . A 30 VAL QG2 . 19033 1
344 . 1 1 30 30 VAL HG23 H 1 0.640 0.003 . 2 . . . A 30 VAL QG2 . 19033 1
345 . 1 1 30 30 VAL CA C 13 59.874 0.164 . 1 . . . A 30 VAL CA . 19033 1
346 . 1 1 30 30 VAL CB C 13 29.863 0.164 . 1 . . . A 30 VAL CB . 19033 1
347 . 1 1 30 30 VAL CG1 C 13 18.775 0.164 . 2 . . . A 30 VAL CG1 . 19033 1
348 . 1 1 30 30 VAL CG2 C 13 19.468 0.164 . 2 . . . A 30 VAL CG2 . 19033 1
349 . 1 1 30 30 VAL N N 15 125.411 0.121 . 1 . . . A 30 VAL N . 19033 1
350 . 1 1 31 31 HIS H H 1 9.289 0.003 . 1 . . . A 31 HIS H . 19033 1
351 . 1 1 31 31 HIS HA H 1 4.698 0.003 . 1 . . . A 31 HIS HA . 19033 1
352 . 1 1 31 31 HIS HB2 H 1 3.167 0.003 . 1 . . . A 31 HIS HB2 . 19033 1
353 . 1 1 31 31 HIS HB3 H 1 3.253 0.003 . 1 . . . A 31 HIS HB3 . 19033 1
354 . 1 1 31 31 HIS HD1 H 1 7.872 0.003 . 1 . . . A 31 HIS HD1 . 19033 1
355 . 1 1 31 31 HIS HD2 H 1 6.664 0.003 . 1 . . . A 31 HIS HD2 . 19033 1
356 . 1 1 31 31 HIS HE1 H 1 7.824 0.003 . 1 . . . A 31 HIS HE1 . 19033 1
357 . 1 1 31 31 HIS CA C 13 54.672 0.164 . 1 . . . A 31 HIS CA . 19033 1
358 . 1 1 31 31 HIS CB C 13 28.040 0.164 . 1 . . . A 31 HIS CB . 19033 1
359 . 1 1 31 31 HIS CD2 C 13 119.431 0.164 . 1 . . . A 31 HIS CD2 . 19033 1
360 . 1 1 31 31 HIS CE1 C 13 135.581 0.164 . 1 . . . A 31 HIS CE1 . 19033 1
361 . 1 1 31 31 HIS N N 15 127.208 0.121 . 1 . . . A 31 HIS N . 19033 1
362 . 1 1 31 31 HIS ND1 N 15 177.279 0.121 . 1 . . . A 31 HIS ND1 . 19033 1
363 . 1 1 32 32 ASN H H 1 7.866 0.003 . 1 . . . A 32 ASN H . 19033 1
364 . 1 1 32 32 ASN HA H 1 4.950 0.003 . 1 . . . A 32 ASN HA . 19033 1
365 . 1 1 32 32 ASN HB2 H 1 2.597 0.003 . 2 . . . A 32 ASN HB2 . 19033 1
366 . 1 1 32 32 ASN HB3 H 1 2.729 0.003 . 2 . . . A 32 ASN HB3 . 19033 1
367 . 1 1 32 32 ASN HD21 H 1 6.669 0.003 . 1 . . . A 32 ASN HD21 . 19033 1
368 . 1 1 32 32 ASN HD22 H 1 7.366 0.003 . 1 . . . A 32 ASN HD22 . 19033 1
369 . 1 1 32 32 ASN CA C 13 50.672 0.164 . 1 . . . A 32 ASN CA . 19033 1
370 . 1 1 32 32 ASN CB C 13 39.290 0.164 . 1 . . . A 32 ASN CB . 19033 1
371 . 1 1 32 32 ASN N N 15 112.446 0.121 . 1 . . . A 32 ASN N . 19033 1
372 . 1 1 32 32 ASN ND2 N 15 111.930 0.121 . 1 . . . A 32 ASN ND2 . 19033 1
373 . 1 1 33 33 GLU H H 1 8.723 0.003 . 1 . . . A 33 GLU H . 19033 1
374 . 1 1 33 33 GLU HA H 1 4.405 0.003 . 1 . . . A 33 GLU HA . 19033 1
375 . 1 1 33 33 GLU HB2 H 1 2.097 0.003 . 2 . . . A 33 GLU HB2 . 19033 1
376 . 1 1 33 33 GLU HB3 H 1 1.892 0.003 . 2 . . . A 33 GLU HB3 . 19033 1
377 . 1 1 33 33 GLU HG2 H 1 2.104 0.003 . 2 . . . A 33 GLU QG . 19033 1
378 . 1 1 33 33 GLU HG3 H 1 2.104 0.003 . 2 . . . A 33 GLU QG . 19033 1
379 . 1 1 33 33 GLU CA C 13 54.104 0.164 . 1 . . . A 33 GLU CA . 19033 1
380 . 1 1 33 33 GLU CB C 13 27.678 0.164 . 1 . . . A 33 GLU CB . 19033 1
381 . 1 1 33 33 GLU CG C 13 33.776 0.164 . 1 . . . A 33 GLU CG . 19033 1
382 . 1 1 33 33 GLU N N 15 123.553 0.121 . 1 . . . A 33 GLU N . 19033 1
383 . 1 1 34 34 LEU H H 1 8.488 0.003 . 1 . . . A 34 LEU H . 19033 1
384 . 1 1 34 34 LEU HA H 1 4.650 0.003 . 1 . . . A 34 LEU HA . 19033 1
385 . 1 1 34 34 LEU HB2 H 1 1.682 0.003 . 2 . . . A 34 LEU HB2 . 19033 1
386 . 1 1 34 34 LEU HB3 H 1 1.780 0.003 . 2 . . . A 34 LEU HB3 . 19033 1
387 . 1 1 34 34 LEU HG H 1 1.520 0.003 . 1 . . . A 34 LEU HG . 19033 1
388 . 1 1 34 34 LEU HD11 H 1 0.812 0.003 . 2 . . . A 34 LEU QD1 . 19033 1
389 . 1 1 34 34 LEU HD12 H 1 0.812 0.003 . 2 . . . A 34 LEU QD1 . 19033 1
390 . 1 1 34 34 LEU HD13 H 1 0.812 0.003 . 2 . . . A 34 LEU QD1 . 19033 1
391 . 1 1 34 34 LEU HD21 H 1 0.894 0.003 . 2 . . . A 34 LEU QD2 . 19033 1
392 . 1 1 34 34 LEU HD22 H 1 0.894 0.003 . 2 . . . A 34 LEU QD2 . 19033 1
393 . 1 1 34 34 LEU HD23 H 1 0.894 0.003 . 2 . . . A 34 LEU QD2 . 19033 1
394 . 1 1 34 34 LEU CA C 13 51.344 0.164 . 1 . . . A 34 LEU CA . 19033 1
395 . 1 1 34 34 LEU CB C 13 39.813 0.164 . 1 . . . A 34 LEU CB . 19033 1
396 . 1 1 34 34 LEU CG C 13 25.661 0.164 . 1 . . . A 34 LEU CG . 19033 1
397 . 1 1 34 34 LEU CD1 C 13 21.358 0.164 . 2 . . . A 34 LEU CD1 . 19033 1
398 . 1 1 34 34 LEU CD2 C 13 23.632 0.164 . 2 . . . A 34 LEU CD2 . 19033 1
399 . 1 1 34 34 LEU N N 15 125.739 0.121 . 1 . . . A 34 LEU N . 19033 1
400 . 1 1 35 35 GLU H H 1 8.174 0.003 . 1 . . . A 35 GLU H . 19033 1
401 . 1 1 35 35 GLU HA H 1 4.289 0.003 . 1 . . . A 35 GLU HA . 19033 1
402 . 1 1 35 35 GLU HB2 H 1 1.952 0.003 . 2 . . . A 35 GLU HB2 . 19033 1
403 . 1 1 35 35 GLU HB3 H 1 2.036 0.003 . 2 . . . A 35 GLU HB3 . 19033 1
404 . 1 1 35 35 GLU HG2 H 1 2.284 0.003 . 2 . . . A 35 GLU HG2 . 19033 1
405 . 1 1 35 35 GLU CA C 13 54.432 0.164 . 1 . . . A 35 GLU CA . 19033 1
406 . 1 1 35 35 GLU CB C 13 27.756 0.164 . 1 . . . A 35 GLU CB . 19033 1
407 . 1 1 35 35 GLU CG C 13 33.812 0.164 . 1 . . . A 35 GLU CG . 19033 1
408 . 1 1 35 35 GLU N N 15 117.915 0.121 . 1 . . . A 35 GLU N . 19033 1
409 . 1 1 36 36 ASP H H 1 8.755 0.003 . 1 . . . A 36 ASP H . 19033 1
410 . 1 1 36 36 ASP HA H 1 4.363 0.003 . 1 . . . A 36 ASP HA . 19033 1
411 . 1 1 36 36 ASP HB2 H 1 2.972 0.003 . 2 . . . A 36 ASP HB2 . 19033 1
412 . 1 1 36 36 ASP HB3 H 1 2.906 0.003 . 2 . . . A 36 ASP HB3 . 19033 1
413 . 1 1 36 36 ASP CA C 13 52.392 0.164 . 1 . . . A 36 ASP CA . 19033 1
414 . 1 1 36 36 ASP CB C 13 37.268 0.164 . 1 . . . A 36 ASP CB . 19033 1
415 . 1 1 36 36 ASP N N 15 116.640 0.121 . 1 . . . A 36 ASP N . 19033 1
416 . 1 1 37 37 GLY H H 1 8.235 0.003 . 1 . . . A 37 GLY H . 19033 1
417 . 1 1 37 37 GLY HA2 H 1 3.955 0.003 . 2 . . . A 37 GLY HA2 . 19033 1
418 . 1 1 37 37 GLY HA3 H 1 3.524 0.003 . 2 . . . A 37 GLY HA3 . 19033 1
419 . 1 1 37 37 GLY CA C 13 43.066 0.164 . 1 . . . A 37 GLY CA . 19033 1
420 . 1 1 37 37 GLY N N 15 104.775 0.121 . 1 . . . A 37 GLY N . 19033 1
421 . 1 1 38 38 TRP H H 1 7.331 0.003 . 1 . . . A 38 TRP H . 19033 1
422 . 1 1 38 38 TRP HA H 1 4.952 0.003 . 1 . . . A 38 TRP HA . 19033 1
423 . 1 1 38 38 TRP HB2 H 1 3.169 0.003 . 2 . . . A 38 TRP HB2 . 19033 1
424 . 1 1 38 38 TRP HB3 H 1 3.067 0.003 . 2 . . . A 38 TRP HB3 . 19033 1
425 . 1 1 38 38 TRP HD1 H 1 7.245 0.003 . 1 . . . A 38 TRP HD1 . 19033 1
426 . 1 1 38 38 TRP HE1 H 1 10.108 0.003 . 1 . . . A 38 TRP HE1 . 19033 1
427 . 1 1 38 38 TRP HE3 H 1 7.281 0.003 . 1 . . . A 38 TRP HE3 . 19033 1
428 . 1 1 38 38 TRP HZ2 H 1 7.343 0.003 . 1 . . . A 38 TRP HZ2 . 19033 1
429 . 1 1 38 38 TRP HZ3 H 1 6.662 0.003 . 1 . . . A 38 TRP HZ3 . 19033 1
430 . 1 1 38 38 TRP HH2 H 1 7.083 0.003 . 1 . . . A 38 TRP HH2 . 19033 1
431 . 1 1 38 38 TRP CA C 13 54.689 0.164 . 1 . . . A 38 TRP CA . 19033 1
432 . 1 1 38 38 TRP CB C 13 28.348 0.164 . 1 . . . A 38 TRP CB . 19033 1
433 . 1 1 38 38 TRP CD1 C 13 125.394 0.164 . 1 . . . A 38 TRP CD1 . 19033 1
434 . 1 1 38 38 TRP CE3 C 13 117.837 0.164 . 1 . . . A 38 TRP CE3 . 19033 1
435 . 1 1 38 38 TRP CZ2 C 13 111.548 0.164 . 1 . . . A 38 TRP CZ2 . 19033 1
436 . 1 1 38 38 TRP CZ3 C 13 118.542 0.164 . 1 . . . A 38 TRP CZ3 . 19033 1
437 . 1 1 38 38 TRP CH2 C 13 122.284 0.164 . 1 . . . A 38 TRP CH2 . 19033 1
438 . 1 1 38 38 TRP N N 15 119.789 0.121 . 1 . . . A 38 TRP N . 19033 1
439 . 1 1 38 38 TRP NE1 N 15 129.306 0.121 . 1 . . . A 38 TRP NE1 . 19033 1
440 . 1 1 39 39 MET H H 1 9.330 0.003 . 1 . . . A 39 MET H . 19033 1
441 . 1 1 39 39 MET HA H 1 4.941 0.003 . 1 . . . A 39 MET HA . 19033 1
442 . 1 1 39 39 MET HB2 H 1 1.590 0.003 . 2 . . . A 39 MET HB2 . 19033 1
443 . 1 1 39 39 MET HB3 H 1 1.859 0.003 . 2 . . . A 39 MET HB3 . 19033 1
444 . 1 1 39 39 MET HG2 H 1 2.233 0.003 . 2 . . . A 39 MET HG2 . 19033 1
445 . 1 1 39 39 MET HG3 H 1 2.198 0.003 . 2 . . . A 39 MET HG3 . 19033 1
446 . 1 1 39 39 MET HE1 H 1 1.563 0.003 . 1 . . . A 39 MET QE . 19033 1
447 . 1 1 39 39 MET HE2 H 1 1.563 0.003 . 1 . . . A 39 MET QE . 19033 1
448 . 1 1 39 39 MET HE3 H 1 1.563 0.003 . 1 . . . A 39 MET QE . 19033 1
449 . 1 1 39 39 MET CA C 13 52.194 0.164 . 1 . . . A 39 MET CA . 19033 1
450 . 1 1 39 39 MET CB C 13 35.101 0.164 . 1 . . . A 39 MET CB . 19033 1
451 . 1 1 39 39 MET CG C 13 29.529 0.164 . 1 . . . A 39 MET CG . 19033 1
452 . 1 1 39 39 MET CE C 13 14.882 0.164 . 1 . . . A 39 MET CE . 19033 1
453 . 1 1 39 39 MET N N 15 118.460 0.121 . 1 . . . A 39 MET N . 19033 1
454 . 1 1 40 40 TRP H H 1 8.777 0.003 . 1 . . . A 40 TRP H . 19033 1
455 . 1 1 40 40 TRP HA H 1 5.068 0.003 . 1 . . . A 40 TRP HA . 19033 1
456 . 1 1 40 40 TRP HB2 H 1 3.351 0.003 . 1 . . . A 40 TRP HB2 . 19033 1
457 . 1 1 40 40 TRP HB3 H 1 3.008 0.003 . 1 . . . A 40 TRP HB3 . 19033 1
458 . 1 1 40 40 TRP HD1 H 1 6.765 0.003 . 1 . . . A 40 TRP HD1 . 19033 1
459 . 1 1 40 40 TRP HE1 H 1 10.215 0.003 . 1 . . . A 40 TRP HE1 . 19033 1
460 . 1 1 40 40 TRP HE3 H 1 7.413 0.003 . 1 . . . A 40 TRP HE3 . 19033 1
461 . 1 1 40 40 TRP HZ2 H 1 7.296 0.003 . 1 . . . A 40 TRP HZ2 . 19033 1
462 . 1 1 40 40 TRP HZ3 H 1 6.985 0.003 . 1 . . . A 40 TRP HZ3 . 19033 1
463 . 1 1 40 40 TRP HH2 H 1 7.152 0.003 . 1 . . . A 40 TRP HH2 . 19033 1
464 . 1 1 40 40 TRP CA C 13 54.321 0.164 . 1 . . . A 40 TRP CA . 19033 1
465 . 1 1 40 40 TRP CB C 13 27.857 0.164 . 1 . . . A 40 TRP CB . 19033 1
466 . 1 1 40 40 TRP CD1 C 13 123.567 0.164 . 1 . . . A 40 TRP CD1 . 19033 1
467 . 1 1 40 40 TRP CE3 C 13 117.348 0.164 . 1 . . . A 40 TRP CE3 . 19033 1
468 . 1 1 40 40 TRP CZ2 C 13 111.688 0.164 . 1 . . . A 40 TRP CZ2 . 19033 1
469 . 1 1 40 40 TRP CZ3 C 13 118.879 0.164 . 1 . . . A 40 TRP CZ3 . 19033 1
470 . 1 1 40 40 TRP CH2 C 13 121.867 0.164 . 1 . . . A 40 TRP CH2 . 19033 1
471 . 1 1 40 40 TRP N N 15 123.201 0.121 . 1 . . . A 40 TRP N . 19033 1
472 . 1 1 40 40 TRP NE1 N 15 129.207 0.121 . 1 . . . A 40 TRP NE1 . 19033 1
473 . 1 1 41 41 VAL H H 1 8.755 0.003 . 1 . . . A 41 VAL H . 19033 1
474 . 1 1 41 41 VAL HA H 1 5.447 0.003 . 1 . . . A 41 VAL HA . 19033 1
475 . 1 1 41 41 VAL HB H 1 2.054 0.003 . 1 . . . A 41 VAL HB . 19033 1
476 . 1 1 41 41 VAL HG11 H 1 0.482 0.003 . 2 . . . A 41 VAL QG1 . 19033 1
477 . 1 1 41 41 VAL HG12 H 1 0.482 0.003 . 2 . . . A 41 VAL QG1 . 19033 1
478 . 1 1 41 41 VAL HG13 H 1 0.482 0.003 . 2 . . . A 41 VAL QG1 . 19033 1
479 . 1 1 41 41 VAL HG21 H 1 0.531 0.003 . 2 . . . A 41 VAL QG2 . 19033 1
480 . 1 1 41 41 VAL HG22 H 1 0.531 0.003 . 2 . . . A 41 VAL QG2 . 19033 1
481 . 1 1 41 41 VAL HG23 H 1 0.531 0.003 . 2 . . . A 41 VAL QG2 . 19033 1
482 . 1 1 41 41 VAL CA C 13 56.711 0.164 . 1 . . . A 41 VAL CA . 19033 1
483 . 1 1 41 41 VAL CB C 13 34.428 0.164 . 1 . . . A 41 VAL CB . 19033 1
484 . 1 1 41 41 VAL CG1 C 13 17.176 0.164 . 2 . . . A 41 VAL CG1 . 19033 1
485 . 1 1 41 41 VAL CG2 C 13 19.304 0.164 . 2 . . . A 41 VAL CG2 . 19033 1
486 . 1 1 41 41 VAL N N 15 120.754 0.121 . 1 . . . A 41 VAL N . 19033 1
487 . 1 1 42 42 THR H H 1 8.142 0.003 . 1 . . . A 42 THR H . 19033 1
488 . 1 1 42 42 THR HA H 1 4.999 0.003 . 1 . . . A 42 THR HA . 19033 1
489 . 1 1 42 42 THR HB H 1 3.865 0.003 . 1 . . . A 42 THR HB . 19033 1
490 . 1 1 42 42 THR HG21 H 1 1.003 0.003 . 1 . . . A 42 THR QG2 . 19033 1
491 . 1 1 42 42 THR HG22 H 1 1.003 0.003 . 1 . . . A 42 THR QG2 . 19033 1
492 . 1 1 42 42 THR HG23 H 1 1.003 0.003 . 1 . . . A 42 THR QG2 . 19033 1
493 . 1 1 42 42 THR CA C 13 59.763 0.164 . 1 . . . A 42 THR CA . 19033 1
494 . 1 1 42 42 THR CB C 13 68.696 0.164 . 1 . . . A 42 THR CB . 19033 1
495 . 1 1 42 42 THR CG2 C 13 18.970 0.164 . 1 . . . A 42 THR CG2 . 19033 1
496 . 1 1 42 42 THR N N 15 112.967 0.121 . 1 . . . A 42 THR N . 19033 1
497 . 1 1 43 43 ASN H H 1 8.848 0.003 . 1 . . . A 43 ASN H . 19033 1
498 . 1 1 43 43 ASN HA H 1 4.409 0.003 . 1 . . . A 43 ASN HA . 19033 1
499 . 1 1 43 43 ASN HB2 H 1 2.361 0.003 . 2 . . . A 43 ASN HB2 . 19033 1
500 . 1 1 43 43 ASN HB3 H 1 3.361 0.003 . 2 . . . A 43 ASN HB3 . 19033 1
501 . 1 1 43 43 ASN HD21 H 1 6.356 0.003 . 1 . . . A 43 ASN HD21 . 19033 1
502 . 1 1 43 43 ASN HD22 H 1 7.352 0.003 . 1 . . . A 43 ASN HD22 . 19033 1
503 . 1 1 43 43 ASN CA C 13 50.340 0.164 . 1 . . . A 43 ASN CA . 19033 1
504 . 1 1 43 43 ASN CB C 13 36.786 0.164 . 1 . . . A 43 ASN CB . 19033 1
505 . 1 1 43 43 ASN N N 15 124.680 0.121 . 1 . . . A 43 ASN N . 19033 1
506 . 1 1 43 43 ASN ND2 N 15 109.898 0.121 . 1 . . . A 43 ASN ND2 . 19033 1
507 . 1 1 44 44 LEU H H 1 8.841 0.003 . 1 . . . A 44 LEU H . 19033 1
508 . 1 1 44 44 LEU HA H 1 4.049 0.003 . 1 . . . A 44 LEU HA . 19033 1
509 . 1 1 44 44 LEU HB2 H 1 1.483 0.003 . 2 . . . A 44 LEU HB2 . 19033 1
510 . 1 1 44 44 LEU HB3 H 1 1.343 0.003 . 2 . . . A 44 LEU HB3 . 19033 1
511 . 1 1 44 44 LEU HG H 1 1.443 0.003 . 1 . . . A 44 LEU HG . 19033 1
512 . 1 1 44 44 LEU HD11 H 1 0.747 0.003 . 2 . . . A 44 LEU QD1 . 19033 1
513 . 1 1 44 44 LEU HD12 H 1 0.747 0.003 . 2 . . . A 44 LEU QD1 . 19033 1
514 . 1 1 44 44 LEU HD13 H 1 0.747 0.003 . 2 . . . A 44 LEU QD1 . 19033 1
515 . 1 1 44 44 LEU HD21 H 1 1.001 0.003 . 2 . . . A 44 LEU QD2 . 19033 1
516 . 1 1 44 44 LEU HD22 H 1 1.001 0.003 . 2 . . . A 44 LEU QD2 . 19033 1
517 . 1 1 44 44 LEU HD23 H 1 1.001 0.003 . 2 . . . A 44 LEU QD2 . 19033 1
518 . 1 1 44 44 LEU CA C 13 54.255 0.164 . 1 . . . A 44 LEU CA . 19033 1
519 . 1 1 44 44 LEU CB C 13 38.647 0.164 . 1 . . . A 44 LEU CB . 19033 1
520 . 1 1 44 44 LEU CG C 13 24.744 0.164 . 1 . . . A 44 LEU CG . 19033 1
521 . 1 1 44 44 LEU CD1 C 13 19.524 0.164 . 2 . . . A 44 LEU CD1 . 19033 1
522 . 1 1 44 44 LEU CD2 C 13 18.875 0.164 . 2 . . . A 44 LEU CD2 . 19033 1
523 . 1 1 44 44 LEU N N 15 126.753 0.121 . 1 . . . A 44 LEU N . 19033 1
524 . 1 1 45 45 ARG H H 1 8.452 0.003 . 1 . . . A 45 ARG H . 19033 1
525 . 1 1 45 45 ARG HA H 1 4.155 0.003 . 1 . . . A 45 ARG HA . 19033 1
526 . 1 1 45 45 ARG HB2 H 1 1.670 0.003 . 2 . . . A 45 ARG HB2 . 19033 1
527 . 1 1 45 45 ARG HB3 H 1 1.807 0.003 . 2 . . . A 45 ARG HB3 . 19033 1
528 . 1 1 45 45 ARG HG2 H 1 1.375 0.003 . 2 . . . A 45 ARG QG . 19033 1
529 . 1 1 45 45 ARG HG3 H 1 1.375 0.003 . 2 . . . A 45 ARG QG . 19033 1
530 . 1 1 45 45 ARG HD2 H 1 2.911 0.003 . 2 . . . A 45 ARG HD2 . 19033 1
531 . 1 1 45 45 ARG HD3 H 1 3.366 0.003 . 2 . . . A 45 ARG HD3 . 19033 1
532 . 1 1 45 45 ARG HE H 1 9.500 0.003 . 1 . . . A 45 ARG HE . 19033 1
533 . 1 1 45 45 ARG CA C 13 56.319 0.164 . 1 . . . A 45 ARG CA . 19033 1
534 . 1 1 45 45 ARG CB C 13 27.552 0.164 . 1 . . . A 45 ARG CB . 19033 1
535 . 1 1 45 45 ARG CG C 13 24.535 0.164 . 1 . . . A 45 ARG CG . 19033 1
536 . 1 1 45 45 ARG CD C 13 39.390 0.164 . 1 . . . A 45 ARG CD . 19033 1
537 . 1 1 45 45 ARG N N 15 119.154 0.121 . 1 . . . A 45 ARG N . 19033 1
538 . 1 1 45 45 ARG NE N 15 82.243 0.121 . 1 . . . A 45 ARG NE . 19033 1
539 . 1 1 46 46 THR H H 1 6.842 0.003 . 1 . . . A 46 THR H . 19033 1
540 . 1 1 46 46 THR HA H 1 4.180 0.003 . 1 . . . A 46 THR HA . 19033 1
541 . 1 1 46 46 THR HB H 1 4.298 0.003 . 1 . . . A 46 THR HB . 19033 1
542 . 1 1 46 46 THR HG21 H 1 1.046 0.003 . 1 . . . A 46 THR QG2 . 19033 1
543 . 1 1 46 46 THR HG22 H 1 1.046 0.003 . 1 . . . A 46 THR QG2 . 19033 1
544 . 1 1 46 46 THR HG23 H 1 1.046 0.003 . 1 . . . A 46 THR QG2 . 19033 1
545 . 1 1 46 46 THR CA C 13 58.368 0.164 . 1 . . . A 46 THR CA . 19033 1
546 . 1 1 46 46 THR CB C 13 67.991 0.164 . 1 . . . A 46 THR CB . 19033 1
547 . 1 1 46 46 THR CG2 C 13 19.119 0.164 . 1 . . . A 46 THR CG2 . 19033 1
548 . 1 1 46 46 THR N N 15 105.128 0.121 . 1 . . . A 46 THR N . 19033 1
549 . 1 1 47 47 ASP H H 1 8.650 0.003 . 1 . . . A 47 ASP H . 19033 1
550 . 1 1 47 47 ASP HA H 1 4.273 0.003 . 1 . . . A 47 ASP HA . 19033 1
551 . 1 1 47 47 ASP HB2 H 1 2.607 0.003 . 2 . . . A 47 ASP HB2 . 19033 1
552 . 1 1 47 47 ASP HB3 H 1 2.972 0.003 . 2 . . . A 47 ASP HB3 . 19033 1
553 . 1 1 47 47 ASP CA C 13 53.593 0.164 . 1 . . . A 47 ASP CA . 19033 1
554 . 1 1 47 47 ASP CB C 13 37.748 0.164 . 1 . . . A 47 ASP CB . 19033 1
555 . 1 1 47 47 ASP N N 15 120.147 0.121 . 1 . . . A 47 ASP N . 19033 1
556 . 1 1 48 48 GLU H H 1 7.454 0.003 . 1 . . . A 48 GLU H . 19033 1
557 . 1 1 48 48 GLU HA H 1 4.294 0.003 . 1 . . . A 48 GLU HA . 19033 1
558 . 1 1 48 48 GLU HB2 H 1 1.857 0.003 . 2 . . . A 48 GLU HB2 . 19033 1
559 . 1 1 48 48 GLU HB3 H 1 1.938 0.003 . 2 . . . A 48 GLU HB3 . 19033 1
560 . 1 1 48 48 GLU HG2 H 1 2.197 0.003 . 2 . . . A 48 GLU HG2 . 19033 1
561 . 1 1 48 48 GLU HG3 H 1 2.270 0.003 . 2 . . . A 48 GLU HG3 . 19033 1
562 . 1 1 48 48 GLU CA C 13 53.743 0.164 . 1 . . . A 48 GLU CA . 19033 1
563 . 1 1 48 48 GLU CB C 13 29.503 0.164 . 1 . . . A 48 GLU CB . 19033 1
564 . 1 1 48 48 GLU CG C 13 34.649 0.164 . 1 . . . A 48 GLU CG . 19033 1
565 . 1 1 48 48 GLU N N 15 117.574 0.121 . 1 . . . A 48 GLU N . 19033 1
566 . 1 1 49 49 GLN H H 1 8.314 0.003 . 1 . . . A 49 GLN H . 19033 1
567 . 1 1 49 49 GLN HA H 1 5.649 0.003 . 1 . . . A 49 GLN HA . 19033 1
568 . 1 1 49 49 GLN HB2 H 1 1.877 0.003 . 2 . . . A 49 GLN HB2 . 19033 1
569 . 1 1 49 49 GLN HB3 H 1 1.957 0.003 . 2 . . . A 49 GLN HB3 . 19033 1
570 . 1 1 49 49 GLN HG2 H 1 2.480 0.003 . 2 . . . A 49 GLN HG2 . 19033 1
571 . 1 1 49 49 GLN HG3 H 1 2.362 0.003 . 2 . . . A 49 GLN HG3 . 19033 1
572 . 1 1 49 49 GLN HE21 H 1 6.658 0.003 . 1 . . . A 49 GLN HE21 . 19033 1
573 . 1 1 49 49 GLN HE22 H 1 7.247 0.003 . 1 . . . A 49 GLN HE22 . 19033 1
574 . 1 1 49 49 GLN CA C 13 50.614 0.164 . 1 . . . A 49 GLN CA . 19033 1
575 . 1 1 49 49 GLN CB C 13 29.447 0.164 . 1 . . . A 49 GLN CB . 19033 1
576 . 1 1 49 49 GLN CG C 13 31.724 0.164 . 1 . . . A 49 GLN CG . 19033 1
577 . 1 1 49 49 GLN N N 15 119.154 0.121 . 1 . . . A 49 GLN N . 19033 1
578 . 1 1 49 49 GLN NE2 N 15 111.613 0.121 . 1 . . . A 49 GLN NE2 . 19033 1
579 . 1 1 50 50 GLY H H 1 7.795 0.003 . 1 . . . A 50 GLY H . 19033 1
580 . 1 1 50 50 GLY HA2 H 1 3.700 0.003 . 2 . . . A 50 GLY HA2 . 19033 1
581 . 1 1 50 50 GLY HA3 H 1 2.154 0.003 . 2 . . . A 50 GLY HA3 . 19033 1
582 . 1 1 50 50 GLY CA C 13 42.255 0.164 . 1 . . . A 50 GLY CA . 19033 1
583 . 1 1 50 50 GLY N N 15 108.506 0.121 . 1 . . . A 50 GLY N . 19033 1
584 . 1 1 51 51 LEU H H 1 7.748 0.003 . 1 . . . A 51 LEU H . 19033 1
585 . 1 1 51 51 LEU HA H 1 5.378 0.003 . 1 . . . A 51 LEU HA . 19033 1
586 . 1 1 51 51 LEU HB2 H 1 1.343 0.003 . 2 . . . A 51 LEU HB2 . 19033 1
587 . 1 1 51 51 LEU HB3 H 1 1.721 0.003 . 2 . . . A 51 LEU HB3 . 19033 1
588 . 1 1 51 51 LEU HG H 1 1.674 0.003 . 1 . . . A 51 LEU HG . 19033 1
589 . 1 1 51 51 LEU HD11 H 1 0.643 0.003 . 2 . . . A 51 LEU QD1 . 19033 1
590 . 1 1 51 51 LEU HD12 H 1 0.643 0.003 . 2 . . . A 51 LEU QD1 . 19033 1
591 . 1 1 51 51 LEU HD13 H 1 0.643 0.003 . 2 . . . A 51 LEU QD1 . 19033 1
592 . 1 1 51 51 LEU HD21 H 1 0.946 0.003 . 2 . . . A 51 LEU QD2 . 19033 1
593 . 1 1 51 51 LEU HD22 H 1 0.946 0.003 . 2 . . . A 51 LEU QD2 . 19033 1
594 . 1 1 51 51 LEU HD23 H 1 0.946 0.003 . 2 . . . A 51 LEU QD2 . 19033 1
595 . 1 1 51 51 LEU CA C 13 51.274 0.164 . 1 . . . A 51 LEU CA . 19033 1
596 . 1 1 51 51 LEU CB C 13 43.574 0.164 . 1 . . . A 51 LEU CB . 19033 1
597 . 1 1 51 51 LEU CG C 13 24.275 0.164 . 1 . . . A 51 LEU CG . 19033 1
598 . 1 1 51 51 LEU CD1 C 13 23.742 0.164 . 2 . . . A 51 LEU CD1 . 19033 1
599 . 1 1 51 51 LEU CD2 C 13 22.204 0.164 . 2 . . . A 51 LEU CD2 . 19033 1
600 . 1 1 51 51 LEU N N 15 119.484 0.121 . 1 . . . A 51 LEU N . 19033 1
601 . 1 1 52 52 ILE H H 1 8.802 0.003 . 1 . . . A 52 ILE H . 19033 1
602 . 1 1 52 52 ILE HA H 1 4.645 0.003 . 1 . . . A 52 ILE HA . 19033 1
603 . 1 1 52 52 ILE HB H 1 1.302 0.003 . 1 . . . A 52 ILE HB . 19033 1
604 . 1 1 52 52 ILE HG12 H 1 0.644 0.003 . 2 . . . A 52 ILE HG12 . 19033 1
605 . 1 1 52 52 ILE HG13 H 1 0.366 0.003 . 2 . . . A 52 ILE HG13 . 19033 1
606 . 1 1 52 52 ILE HG21 H 1 0.432 0.003 . 1 . . . A 52 ILE QG2 . 19033 1
607 . 1 1 52 52 ILE HG22 H 1 0.432 0.003 . 1 . . . A 52 ILE QG2 . 19033 1
608 . 1 1 52 52 ILE HG23 H 1 0.432 0.003 . 1 . . . A 52 ILE QG2 . 19033 1
609 . 1 1 52 52 ILE HD11 H 1 -0.827 0.003 . 1 . . . A 52 ILE QD1 . 19033 1
610 . 1 1 52 52 ILE HD12 H 1 -0.827 0.003 . 1 . . . A 52 ILE QD1 . 19033 1
611 . 1 1 52 52 ILE HD13 H 1 -0.827 0.003 . 1 . . . A 52 ILE QD1 . 19033 1
612 . 1 1 52 52 ILE CA C 13 57.340 0.164 . 1 . . . A 52 ILE CA . 19033 1
613 . 1 1 52 52 ILE CB C 13 39.906 0.164 . 1 . . . A 52 ILE CB . 19033 1
614 . 1 1 52 52 ILE CG1 C 13 22.088 0.164 . 1 . . . A 52 ILE CG1 . 19033 1
615 . 1 1 52 52 ILE CG2 C 13 15.815 0.164 . 1 . . . A 52 ILE CG2 . 19033 1
616 . 1 1 52 52 ILE CD1 C 13 11.817 0.164 . 1 . . . A 52 ILE CD1 . 19033 1
617 . 1 1 52 52 ILE N N 15 114.127 0.121 . 1 . . . A 52 ILE N . 19033 1
618 . 1 1 53 53 VAL H H 1 7.495 0.003 . 1 . . . A 53 VAL H . 19033 1
619 . 1 1 53 53 VAL HA H 1 4.018 0.003 . 1 . . . A 53 VAL HA . 19033 1
620 . 1 1 53 53 VAL HB H 1 0.231 0.003 . 1 . . . A 53 VAL HB . 19033 1
621 . 1 1 53 53 VAL HG11 H 1 0.013 0.003 . 2 . . . A 53 VAL QG1 . 19033 1
622 . 1 1 53 53 VAL HG12 H 1 0.013 0.003 . 2 . . . A 53 VAL QG1 . 19033 1
623 . 1 1 53 53 VAL HG13 H 1 0.013 0.003 . 2 . . . A 53 VAL QG1 . 19033 1
624 . 1 1 53 53 VAL HG21 H 1 0.058 0.003 . 2 . . . A 53 VAL QG2 . 19033 1
625 . 1 1 53 53 VAL HG22 H 1 0.058 0.003 . 2 . . . A 53 VAL QG2 . 19033 1
626 . 1 1 53 53 VAL HG23 H 1 0.058 0.003 . 2 . . . A 53 VAL QG2 . 19033 1
627 . 1 1 53 53 VAL CA C 13 56.467 0.164 . 1 . . . A 53 VAL CA . 19033 1
628 . 1 1 53 53 VAL CB C 13 30.327 0.164 . 1 . . . A 53 VAL CB . 19033 1
629 . 1 1 53 53 VAL CG1 C 13 18.468 0.164 . 2 . . . A 53 VAL CG1 . 19033 1
630 . 1 1 53 53 VAL CG2 C 13 17.419 0.164 . 2 . . . A 53 VAL CG2 . 19033 1
631 . 1 1 53 53 VAL N N 15 120.370 0.121 . 1 . . . A 53 VAL N . 19033 1
632 . 1 1 54 54 GLU H H 1 8.104 0.003 . 1 . . . A 54 GLU H . 19033 1
633 . 1 1 54 54 GLU HA H 1 3.590 0.003 . 1 . . . A 54 GLU HA . 19033 1
634 . 1 1 54 54 GLU HB2 H 1 1.849 0.003 . 2 . . . A 54 GLU HB2 . 19033 1
635 . 1 1 54 54 GLU HB3 H 1 1.801 0.003 . 2 . . . A 54 GLU HB3 . 19033 1
636 . 1 1 54 54 GLU HG2 H 1 2.220 0.003 . 2 . . . A 54 GLU HG2 . 19033 1
637 . 1 1 54 54 GLU HG3 H 1 1.999 0.003 . 2 . . . A 54 GLU HG3 . 19033 1
638 . 1 1 54 54 GLU CA C 13 55.564 0.164 . 1 . . . A 54 GLU CA . 19033 1
639 . 1 1 54 54 GLU CB C 13 26.426 0.164 . 1 . . . A 54 GLU CB . 19033 1
640 . 1 1 54 54 GLU CG C 13 32.226 0.164 . 1 . . . A 54 GLU CG . 19033 1
641 . 1 1 54 54 GLU N N 15 122.759 0.121 . 1 . . . A 54 GLU N . 19033 1
642 . 1 1 55 55 ASP H H 1 7.394 0.003 . 1 . . . A 55 ASP H . 19033 1
643 . 1 1 55 55 ASP HA H 1 4.204 0.003 . 1 . . . A 55 ASP HA . 19033 1
644 . 1 1 55 55 ASP HB2 H 1 2.524 0.003 . 2 . . . A 55 ASP HB2 . 19033 1
645 . 1 1 55 55 ASP HB3 H 1 2.126 0.003 . 2 . . . A 55 ASP HB3 . 19033 1
646 . 1 1 55 55 ASP CA C 13 53.286 0.164 . 1 . . . A 55 ASP CA . 19033 1
647 . 1 1 55 55 ASP CB C 13 38.115 0.164 . 1 . . . A 55 ASP CB . 19033 1
648 . 1 1 55 55 ASP N N 15 114.708 0.121 . 1 . . . A 55 ASP N . 19033 1
649 . 1 1 56 56 LEU H H 1 7.121 0.003 . 1 . . . A 56 LEU H . 19033 1
650 . 1 1 56 56 LEU HA H 1 4.398 0.003 . 1 . . . A 56 LEU HA . 19033 1
651 . 1 1 56 56 LEU HB2 H 1 2.106 0.003 . 2 . . . A 56 LEU HB2 . 19033 1
652 . 1 1 56 56 LEU HB3 H 1 1.579 0.003 . 2 . . . A 56 LEU HB3 . 19033 1
653 . 1 1 56 56 LEU HG H 1 1.303 0.003 . 1 . . . A 56 LEU HG . 19033 1
654 . 1 1 56 56 LEU HD11 H 1 0.681 0.003 . 2 . . . A 56 LEU QD1 . 19033 1
655 . 1 1 56 56 LEU HD12 H 1 0.681 0.003 . 2 . . . A 56 LEU QD1 . 19033 1
656 . 1 1 56 56 LEU HD13 H 1 0.681 0.003 . 2 . . . A 56 LEU QD1 . 19033 1
657 . 1 1 56 56 LEU HD21 H 1 0.741 0.003 . 2 . . . A 56 LEU QD2 . 19033 1
658 . 1 1 56 56 LEU HD22 H 1 0.741 0.003 . 2 . . . A 56 LEU QD2 . 19033 1
659 . 1 1 56 56 LEU HD23 H 1 0.741 0.003 . 2 . . . A 56 LEU QD2 . 19033 1
660 . 1 1 56 56 LEU CA C 13 51.899 0.164 . 1 . . . A 56 LEU CA . 19033 1
661 . 1 1 56 56 LEU CB C 13 39.564 0.164 . 1 . . . A 56 LEU CB . 19033 1
662 . 1 1 56 56 LEU CG C 13 25.453 0.164 . 1 . . . A 56 LEU CG . 19033 1
663 . 1 1 56 56 LEU CD1 C 13 23.639 0.164 . 2 . . . A 56 LEU CD1 . 19033 1
664 . 1 1 56 56 LEU CD2 C 13 21.171 0.164 . 2 . . . A 56 LEU CD2 . 19033 1
665 . 1 1 56 56 LEU N N 15 116.100 0.121 . 1 . . . A 56 LEU N . 19033 1
666 . 1 1 57 57 VAL H H 1 7.438 0.003 . 1 . . . A 57 VAL H . 19033 1
667 . 1 1 57 57 VAL HA H 1 5.381 0.003 . 1 . . . A 57 VAL HA . 19033 1
668 . 1 1 57 57 VAL HB H 1 1.711 0.003 . 1 . . . A 57 VAL HB . 19033 1
669 . 1 1 57 57 VAL HG11 H 1 0.478 0.003 . 2 . . . A 57 VAL QG1 . 19033 1
670 . 1 1 57 57 VAL HG12 H 1 0.478 0.003 . 2 . . . A 57 VAL QG1 . 19033 1
671 . 1 1 57 57 VAL HG13 H 1 0.478 0.003 . 2 . . . A 57 VAL QG1 . 19033 1
672 . 1 1 57 57 VAL HG21 H 1 0.169 0.003 . 2 . . . A 57 VAL QG2 . 19033 1
673 . 1 1 57 57 VAL HG22 H 1 0.169 0.003 . 2 . . . A 57 VAL QG2 . 19033 1
674 . 1 1 57 57 VAL HG23 H 1 0.169 0.003 . 2 . . . A 57 VAL QG2 . 19033 1
675 . 1 1 57 57 VAL CA C 13 55.560 0.164 . 1 . . . A 57 VAL CA . 19033 1
676 . 1 1 57 57 VAL CB C 13 33.744 0.164 . 1 . . . A 57 VAL CB . 19033 1
677 . 1 1 57 57 VAL CG1 C 13 15.103 0.164 . 2 . . . A 57 VAL CG1 . 19033 1
678 . 1 1 57 57 VAL CG2 C 13 18.520 0.164 . 2 . . . A 57 VAL CG2 . 19033 1
679 . 1 1 57 57 VAL N N 15 109.850 0.121 . 1 . . . A 57 VAL N . 19033 1
680 . 1 1 58 58 GLU H H 1 8.886 0.003 . 1 . . . A 58 GLU H . 19033 1
681 . 1 1 58 58 GLU HA H 1 4.835 0.003 . 1 . . . A 58 GLU HA . 19033 1
682 . 1 1 58 58 GLU HB2 H 1 1.963 0.003 . 2 . . . A 58 GLU HB2 . 19033 1
683 . 1 1 58 58 GLU HB3 H 1 1.752 0.003 . 2 . . . A 58 GLU HB3 . 19033 1
684 . 1 1 58 58 GLU HG2 H 1 1.982 0.003 . 2 . . . A 58 GLU HG2 . 19033 1
685 . 1 1 58 58 GLU HG3 H 1 2.252 0.003 . 2 . . . A 58 GLU HG3 . 19033 1
686 . 1 1 58 58 GLU CA C 13 50.156 0.164 . 1 . . . A 58 GLU CA . 19033 1
687 . 1 1 58 58 GLU CB C 13 30.354 0.164 . 1 . . . A 58 GLU CB . 19033 1
688 . 1 1 58 58 GLU CG C 13 32.080 0.164 . 1 . . . A 58 GLU CG . 19033 1
689 . 1 1 58 58 GLU N N 15 116.558 0.121 . 1 . . . A 58 GLU N . 19033 1
690 . 1 1 59 59 GLU H H 1 8.659 0.003 . 1 . . . A 59 GLU H . 19033 1
691 . 1 1 59 59 GLU HA H 1 4.229 0.003 . 1 . . . A 59 GLU HA . 19033 1
692 . 1 1 59 59 GLU HB2 H 1 1.950 0.003 . 2 . . . A 59 GLU HB2 . 19033 1
693 . 1 1 59 59 GLU HB3 H 1 1.853 0.003 . 2 . . . A 59 GLU HB3 . 19033 1
694 . 1 1 59 59 GLU HG2 H 1 2.200 0.003 . 2 . . . A 59 GLU HG2 . 19033 1
695 . 1 1 59 59 GLU HG3 H 1 2.259 0.003 . 2 . . . A 59 GLU HG3 . 19033 1
696 . 1 1 59 59 GLU CA C 13 54.417 0.164 . 1 . . . A 59 GLU CA . 19033 1
697 . 1 1 59 59 GLU CB C 13 27.517 0.164 . 1 . . . A 59 GLU CB . 19033 1
698 . 1 1 59 59 GLU CG C 13 33.530 0.164 . 1 . . . A 59 GLU CG . 19033 1
699 . 1 1 59 59 GLU N N 15 121.900 0.121 . 1 . . . A 59 GLU N . 19033 1
700 . 1 1 60 60 VAL H H 1 8.069 0.003 . 1 . . . A 60 VAL H . 19033 1
701 . 1 1 60 60 VAL HA H 1 4.087 0.003 . 1 . . . A 60 VAL HA . 19033 1
702 . 1 1 60 60 VAL HB H 1 1.825 0.003 . 1 . . . A 60 VAL HB . 19033 1
703 . 1 1 60 60 VAL HG11 H 1 0.714 0.003 . 2 . . . A 60 VAL QG1 . 19033 1
704 . 1 1 60 60 VAL HG12 H 1 0.714 0.003 . 2 . . . A 60 VAL QG1 . 19033 1
705 . 1 1 60 60 VAL HG13 H 1 0.714 0.003 . 2 . . . A 60 VAL QG1 . 19033 1
706 . 1 1 60 60 VAL HG21 H 1 0.800 0.003 . 2 . . . A 60 VAL QG2 . 19033 1
707 . 1 1 60 60 VAL HG22 H 1 0.800 0.003 . 2 . . . A 60 VAL QG2 . 19033 1
708 . 1 1 60 60 VAL HG23 H 1 0.800 0.003 . 2 . . . A 60 VAL QG2 . 19033 1
709 . 1 1 60 60 VAL CA C 13 59.466 0.164 . 1 . . . A 60 VAL CA . 19033 1
710 . 1 1 60 60 VAL CB C 13 30.306 0.164 . 1 . . . A 60 VAL CB . 19033 1
711 . 1 1 60 60 VAL CG1 C 13 19.041 0.164 . 2 . . . A 60 VAL CG1 . 19033 1
712 . 1 1 60 60 VAL CG2 C 13 18.623 0.164 . 2 . . . A 60 VAL CG2 . 19033 1
713 . 1 1 60 60 VAL N N 15 122.505 0.121 . 1 . . . A 60 VAL N . 19033 1
714 . 1 1 61 61 GLY H H 1 8.383 0.003 . 1 . . . A 61 GLY H . 19033 1
715 . 1 1 61 61 GLY HA2 H 1 3.959 0.003 . 2 . . . A 61 GLY HA2 . 19033 1
716 . 1 1 61 61 GLY HA3 H 1 3.881 0.003 . 2 . . . A 61 GLY HA3 . 19033 1
717 . 1 1 61 61 GLY CA C 13 42.709 0.164 . 1 . . . A 61 GLY CA . 19033 1
718 . 1 1 61 61 GLY N N 15 112.799 0.121 . 1 . . . A 61 GLY N . 19033 1
719 . 1 1 62 62 ARG H H 1 7.848 0.003 . 1 . . . A 62 ARG H . 19033 1
720 . 1 1 62 62 ARG HA H 1 4.111 0.003 . 1 . . . A 62 ARG HA . 19033 1
721 . 1 1 62 62 ARG HB2 H 1 1.762 0.003 . 2 . . . A 62 ARG HB2 . 19033 1
722 . 1 1 62 62 ARG HB3 H 1 1.613 0.003 . 2 . . . A 62 ARG HB3 . 19033 1
723 . 1 1 62 62 ARG HG2 H 1 1.498 0.003 . 2 . . . A 62 ARG QG . 19033 1
724 . 1 1 62 62 ARG HG3 H 1 1.498 0.003 . 2 . . . A 62 ARG QG . 19033 1
725 . 1 1 62 62 ARG HD2 H 1 3.088 0.003 . 2 . . . A 62 ARG QD . 19033 1
726 . 1 1 62 62 ARG HD3 H 1 3.088 0.003 . 2 . . . A 62 ARG QD . 19033 1
727 . 1 1 62 62 ARG HE H 1 6.892 0.003 . 1 . . . A 62 ARG HE . 19033 1
728 . 1 1 62 62 ARG CA C 13 54.805 0.164 . 1 . . . A 62 ARG CA . 19033 1
729 . 1 1 62 62 ARG CB C 13 28.899 0.164 . 1 . . . A 62 ARG CB . 19033 1
730 . 1 1 62 62 ARG CG C 13 24.620 0.164 . 1 . . . A 62 ARG CG . 19033 1
731 . 1 1 62 62 ARG CD C 13 41.015 0.164 . 1 . . . A 62 ARG CD . 19033 1
732 . 1 1 62 62 ARG N N 15 125.359 0.121 . 1 . . . A 62 ARG N . 19033 1
733 . 1 1 62 62 ARG NE N 15 72.344 0.121 . 1 . . . A 62 ARG NE . 19033 1
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