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 18749
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_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 HNCACB' . . . 18749 1
2 '3D CBCA(CO)NH' . . . 18749 1
3 '3D 1H-15N TOCSY' . . . 18749 1
6 '3D H(CCO)NH' . . . 18749 1
7 '3D C(CO)NH' . . . 18749 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 4 4 PRO HA H 1 4.391 0.04 . 1 . . . A 4 PRO HA . 18749 1
2 . 1 1 4 4 PRO HB2 H 1 2.184 0.04 . 2 . . . A 4 PRO HB2 . 18749 1
3 . 1 1 4 4 PRO HB3 H 1 2.184 0.04 . 2 . . . A 4 PRO HB3 . 18749 1
4 . 1 1 4 4 PRO HG2 H 1 1.949 0.04 . 2 . . . A 4 PRO HG2 . 18749 1
5 . 1 1 4 4 PRO HG3 H 1 1.949 0.04 . 2 . . . A 4 PRO HG3 . 18749 1
6 . 1 1 4 4 PRO HD2 H 1 3.58 0.04 . 2 . . . A 4 PRO HD2 . 18749 1
7 . 1 1 4 4 PRO HD3 H 1 3.58 0.04 . 2 . . . A 4 PRO HD3 . 18749 1
8 . 1 1 4 4 PRO C C 13 176.097 0.5 . 1 . . . A 4 PRO C . 18749 1
9 . 1 1 4 4 PRO CA C 13 62.96475 0.5 . 1 . . . A 4 PRO CA . 18749 1
10 . 1 1 4 4 PRO CB C 13 31.90175 0.5 . 1 . . . A 4 PRO CB . 18749 1
11 . 1 1 4 4 PRO CG C 13 27.531 0.5 . 1 . . . A 4 PRO CG . 18749 1
12 . 1 1 4 4 PRO CD C 13 50.411 0.5 . 1 . . . A 4 PRO CD . 18749 1
13 . 1 1 5 5 VAL H H 1 8.149 0.04 . 1 . . . A 5 VAL H . 18749 1
14 . 1 1 5 5 VAL HA H 1 4.341 0.04 . 1 . . . A 5 VAL HA . 18749 1
15 . 1 1 5 5 VAL HB H 1 2.021 0.04 . 1 . . . A 5 VAL HB . 18749 1
16 . 1 1 5 5 VAL HG11 H 1 0.925 0.04 . 2 . . . A 5 VAL HG11 . 18749 1
17 . 1 1 5 5 VAL HG12 H 1 0.925 0.04 . 2 . . . A 5 VAL HG12 . 18749 1
18 . 1 1 5 5 VAL HG13 H 1 0.925 0.04 . 2 . . . A 5 VAL HG13 . 18749 1
19 . 1 1 5 5 VAL HG21 H 1 0.925 0.04 . 2 . . . A 5 VAL HG21 . 18749 1
20 . 1 1 5 5 VAL HG22 H 1 0.925 0.04 . 2 . . . A 5 VAL HG22 . 18749 1
21 . 1 1 5 5 VAL HG23 H 1 0.925 0.04 . 2 . . . A 5 VAL HG23 . 18749 1
22 . 1 1 5 5 VAL CA C 13 59.763 0.5 . 1 . . . A 5 VAL CA . 18749 1
23 . 1 1 5 5 VAL CB C 13 32.567 0.5 . 1 . . . A 5 VAL CB . 18749 1
24 . 1 1 5 5 VAL N N 15 121.993 0.3 . 1 . . . A 5 VAL N . 18749 1
25 . 1 1 6 6 PRO HA H 1 4.256 0.04 . 1 . . . A 6 PRO HA . 18749 1
26 . 1 1 6 6 PRO HB2 H 1 2.084 0.04 . 2 . . . A 6 PRO HB2 . 18749 1
27 . 1 1 6 6 PRO HB3 H 1 2.084 0.04 . 2 . . . A 6 PRO HB3 . 18749 1
28 . 1 1 6 6 PRO HG2 H 1 1.852 0.04 . 2 . . . A 6 PRO HG2 . 18749 1
29 . 1 1 6 6 PRO HG3 H 1 1.852 0.04 . 2 . . . A 6 PRO HG3 . 18749 1
30 . 1 1 6 6 PRO HD2 H 1 3.593 0.04 . 2 . . . A 6 PRO HD2 . 18749 1
31 . 1 1 6 6 PRO HD3 H 1 3.593 0.04 . 2 . . . A 6 PRO HD3 . 18749 1
32 . 1 1 6 6 PRO C C 13 176.167 0.5 . 1 . . . A 6 PRO C . 18749 1
33 . 1 1 6 6 PRO CA C 13 63.13775 0.5 . 1 . . . A 6 PRO CA . 18749 1
34 . 1 1 6 6 PRO CB C 13 31.87725 0.5 . 1 . . . A 6 PRO CB . 18749 1
35 . 1 1 6 6 PRO CG C 13 27.377 0.5 . 1 . . . A 6 PRO CG . 18749 1
36 . 1 1 6 6 PRO CD C 13 50.858 0.5 . 1 . . . A 6 PRO CD . 18749 1
37 . 1 1 7 7 TYR H H 1 7.945 0.04 . 1 . . . A 7 TYR H . 18749 1
38 . 1 1 7 7 TYR HA H 1 4.443 0.04 . 1 . . . A 7 TYR HA . 18749 1
39 . 1 1 7 7 TYR HB2 H 1 2.979 0.04 . 2 . . . A 7 TYR HB2 . 18749 1
40 . 1 1 7 7 TYR HB3 H 1 2.812 0.04 . 2 . . . A 7 TYR HB3 . 18749 1
41 . 1 1 7 7 TYR CA C 13 55.602 0.5 . 1 . . . A 7 TYR CA . 18749 1
42 . 1 1 7 7 TYR CB C 13 38.212 0.5 . 1 . . . A 7 TYR CB . 18749 1
43 . 1 1 7 7 TYR N N 15 121.107 0.3 . 1 . . . A 7 TYR N . 18749 1
44 . 1 1 8 8 PRO HA H 1 4.288 0.04 . 1 . . . A 8 PRO HA . 18749 1
45 . 1 1 8 8 PRO HB2 H 1 2.104 0.04 . 2 . . . A 8 PRO HB2 . 18749 1
46 . 1 1 8 8 PRO HB3 H 1 2.104 0.04 . 2 . . . A 8 PRO HB3 . 18749 1
47 . 1 1 8 8 PRO HG2 H 1 1.835 0.04 . 2 . . . A 8 PRO HG2 . 18749 1
48 . 1 1 8 8 PRO HG3 H 1 1.835 0.04 . 2 . . . A 8 PRO HG3 . 18749 1
49 . 1 1 8 8 PRO HD2 H 1 3.638 0.04 . 2 . . . A 8 PRO HD2 . 18749 1
50 . 1 1 8 8 PRO HD3 H 1 3.361 0.04 . 2 . . . A 8 PRO HD3 . 18749 1
51 . 1 1 8 8 PRO C C 13 176.122 0.5 . 1 . . . A 8 PRO C . 18749 1
52 . 1 1 8 8 PRO CA C 13 62.9835 0.5 . 1 . . . A 8 PRO CA . 18749 1
53 . 1 1 8 8 PRO CB C 13 31.91325 0.5 . 1 . . . A 8 PRO CB . 18749 1
54 . 1 1 8 8 PRO CG C 13 27.377 0.5 . 1 . . . A 8 PRO CG . 18749 1
55 . 1 1 8 8 PRO CD C 13 50.567 0.5 . 1 . . . A 8 PRO CD . 18749 1
56 . 1 1 9 9 ASP H H 1 8.204 0.04 . 1 . . . A 9 ASP H . 18749 1
57 . 1 1 9 9 ASP HA H 1 4.466 0.04 . 1 . . . A 9 ASP HA . 18749 1
58 . 1 1 9 9 ASP HB2 H 1 2.699 0.04 . 2 . . . A 9 ASP HB2 . 18749 1
59 . 1 1 9 9 ASP HB3 H 1 2.473 0.04 . 2 . . . A 9 ASP HB3 . 18749 1
60 . 1 1 9 9 ASP CA C 13 52.317 0.5 . 1 . . . A 9 ASP CA . 18749 1
61 . 1 1 9 9 ASP CB C 13 41.371 0.5 . 1 . . . A 9 ASP CB . 18749 1
62 . 1 1 9 9 ASP N N 15 122.332 0.3 . 1 . . . A 9 ASP N . 18749 1
63 . 1 1 10 10 PRO HA H 1 4.309 0.04 . 1 . . . A 10 PRO HA . 18749 1
64 . 1 1 10 10 PRO HB2 H 1 2.209 0.04 . 2 . . . A 10 PRO HB2 . 18749 1
65 . 1 1 10 10 PRO HB3 H 1 2.209 0.04 . 2 . . . A 10 PRO HB3 . 18749 1
66 . 1 1 10 10 PRO HG2 H 1 1.925 0.04 . 2 . . . A 10 PRO HG2 . 18749 1
67 . 1 1 10 10 PRO HG3 H 1 1.925 0.04 . 2 . . . A 10 PRO HG3 . 18749 1
68 . 1 1 10 10 PRO HD2 H 1 3.783 0.04 . 2 . . . A 10 PRO HD2 . 18749 1
69 . 1 1 10 10 PRO HD3 H 1 3.783 0.04 . 2 . . . A 10 PRO HD3 . 18749 1
70 . 1 1 10 10 PRO C C 13 177.003 0.5 . 1 . . . A 10 PRO C . 18749 1
71 . 1 1 10 10 PRO CA C 13 63.635 0.5 . 1 . . . A 10 PRO CA . 18749 1
72 . 1 1 10 10 PRO CB C 13 32.207 0.5 . 1 . . . A 10 PRO CB . 18749 1
73 . 1 1 10 10 PRO CG C 13 27.373 0.5 . 1 . . . A 10 PRO CG . 18749 1
74 . 1 1 10 10 PRO CD C 13 50.881 0.5 . 1 . . . A 10 PRO CD . 18749 1
75 . 1 1 11 11 LEU H H 1 8.295 0.04 . 1 . . . A 11 LEU H . 18749 1
76 . 1 1 11 11 LEU HA H 1 4.2205 0.04 . 1 . . . A 11 LEU HA . 18749 1
77 . 1 1 11 11 LEU HB2 H 1 1.649 0.04 . 2 . . . A 11 LEU HB2 . 18749 1
78 . 1 1 11 11 LEU HB3 H 1 1.649 0.04 . 2 . . . A 11 LEU HB3 . 18749 1
79 . 1 1 11 11 LEU HG H 1 1.496 0.04 . 1 . . . A 11 LEU HG . 18749 1
80 . 1 1 11 11 LEU HD11 H 1 0.799 0.04 . 2 . . . A 11 LEU HD11 . 18749 1
81 . 1 1 11 11 LEU HD12 H 1 0.799 0.04 . 2 . . . A 11 LEU HD12 . 18749 1
82 . 1 1 11 11 LEU HD13 H 1 0.799 0.04 . 2 . . . A 11 LEU HD13 . 18749 1
83 . 1 1 11 11 LEU HD21 H 1 0.799 0.04 . 2 . . . A 11 LEU HD21 . 18749 1
84 . 1 1 11 11 LEU HD22 H 1 0.799 0.04 . 2 . . . A 11 LEU HD22 . 18749 1
85 . 1 1 11 11 LEU HD23 H 1 0.799 0.04 . 2 . . . A 11 LEU HD23 . 18749 1
86 . 1 1 11 11 LEU C C 13 177.277 0.5 . 1 . . . A 11 LEU C . 18749 1
87 . 1 1 11 11 LEU CA C 13 54.93825 0.5 . 1 . . . A 11 LEU CA . 18749 1
88 . 1 1 11 11 LEU CB C 13 41.90825 0.5 . 1 . . . A 11 LEU CB . 18749 1
89 . 1 1 11 11 LEU CG C 13 27.209 0.5 . 1 . . . A 11 LEU CG . 18749 1
90 . 1 1 11 11 LEU CD1 C 13 25.05 0.5 . 2 . . . A 11 LEU CD1 . 18749 1
91 . 1 1 11 11 LEU CD2 C 13 23.246 0.5 . 2 . . . A 11 LEU CD2 . 18749 1
92 . 1 1 11 11 LEU N N 15 120.566 0.3 . 1 . . . A 11 LEU N . 18749 1
93 . 1 1 12 12 GLU H H 1 7.857 0.04 . 1 . . . A 12 GLU H . 18749 1
94 . 1 1 12 12 GLU HA H 1 4.384 0.04 . 1 . . . A 12 GLU HA . 18749 1
95 . 1 1 12 12 GLU HB2 H 1 1.839 0.04 . 2 . . . A 12 GLU HB2 . 18749 1
96 . 1 1 12 12 GLU HB3 H 1 1.839 0.04 . 2 . . . A 12 GLU HB3 . 18749 1
97 . 1 1 12 12 GLU HG2 H 1 2.154 0.04 . 2 . . . A 12 GLU HG2 . 18749 1
98 . 1 1 12 12 GLU HG3 H 1 2.154 0.04 . 2 . . . A 12 GLU HG3 . 18749 1
99 . 1 1 12 12 GLU CA C 13 54.384 0.5 . 1 . . . A 12 GLU CA . 18749 1
100 . 1 1 12 12 GLU CB C 13 29.988 0.5 . 1 . . . A 12 GLU CB . 18749 1
101 . 1 1 12 12 GLU N N 15 122.415 0.3 . 1 . . . A 12 GLU N . 18749 1
102 . 1 1 13 13 PRO HA H 1 4.249 0.04 . 1 . . . A 13 PRO HA . 18749 1
103 . 1 1 13 13 PRO HB2 H 1 2.1 0.04 . 2 . . . A 13 PRO HB2 . 18749 1
104 . 1 1 13 13 PRO HB3 H 1 2.1 0.04 . 2 . . . A 13 PRO HB3 . 18749 1
105 . 1 1 13 13 PRO HG2 H 1 1.847 0.04 . 2 . . . A 13 PRO HG2 . 18749 1
106 . 1 1 13 13 PRO HG3 H 1 1.847 0.04 . 2 . . . A 13 PRO HG3 . 18749 1
107 . 1 1 13 13 PRO HD2 H 1 3.551 0.04 . 2 . . . A 13 PRO HD2 . 18749 1
108 . 1 1 13 13 PRO HD3 H 1 3.551 0.04 . 2 . . . A 13 PRO HD3 . 18749 1
109 . 1 1 13 13 PRO C C 13 177.132 0.5 . 1 . . . A 13 PRO C . 18749 1
110 . 1 1 13 13 PRO CA C 13 63.45775 0.5 . 1 . . . A 13 PRO CA . 18749 1
111 . 1 1 13 13 PRO CB C 13 31.862 0.5 . 1 . . . A 13 PRO CB . 18749 1
112 . 1 1 13 13 PRO CG C 13 27.587 0.5 . 1 . . . A 13 PRO CG . 18749 1
113 . 1 1 13 13 PRO CD C 13 50.683 0.5 . 1 . . . A 13 PRO CD . 18749 1
114 . 1 1 14 14 ARG H H 1 8.337 0.04 . 1 . . . A 14 ARG H . 18749 1
115 . 1 1 14 14 ARG HA H 1 4.159 0.04 . 1 . . . A 14 ARG HA . 18749 1
116 . 1 1 14 14 ARG HG2 H 1 1.521 0.04 . 2 . . . A 14 ARG HG2 . 18749 1
117 . 1 1 14 14 ARG HG3 H 1 1.521 0.04 . 2 . . . A 14 ARG HG3 . 18749 1
118 . 1 1 14 14 ARG HD2 H 1 3.032 0.04 . 2 . . . A 14 ARG HD2 . 18749 1
119 . 1 1 14 14 ARG HD3 H 1 3.032 0.04 . 2 . . . A 14 ARG HD3 . 18749 1
120 . 1 1 14 14 ARG CA C 13 56.16225 0.5 . 1 . . . A 14 ARG CA . 18749 1
121 . 1 1 14 14 ARG CB C 13 30.632 0.5 . 1 . . . A 14 ARG CB . 18749 1
122 . 1 1 14 14 ARG CG C 13 27.236 0.5 . 1 . . . A 14 ARG CG . 18749 1
123 . 1 1 14 14 ARG CD C 13 43.526 0.5 . 1 . . . A 14 ARG CD . 18749 1
124 . 1 1 14 14 ARG N N 15 121.214 0.3 . 1 . . . A 14 ARG N . 18749 1
125 . 1 1 15 15 GLY H H 1 8.28 0.04 . 1 . . . A 15 GLY H . 18749 1
126 . 1 1 15 15 GLY HA2 H 1 3.843 0.04 . 2 . . . A 15 GLY HA2 . 18749 1
127 . 1 1 15 15 GLY HA3 H 1 3.843 0.04 . 2 . . . A 15 GLY HA3 . 18749 1
128 . 1 1 15 15 GLY C C 13 174.13 0.5 . 1 . . . A 15 GLY C . 18749 1
129 . 1 1 15 15 GLY CA C 13 45.312 0.5 . 1 . . . A 15 GLY CA . 18749 1
130 . 1 1 15 15 GLY N N 15 109.686 0.3 . 1 . . . A 15 GLY N . 18749 1
131 . 1 1 16 16 GLY H H 1 7.764 0.04 . 1 . . . A 16 GLY H . 18749 1
132 . 1 1 16 16 GLY HA2 H 1 3.513 0.04 . 2 . . . A 16 GLY HA2 . 18749 1
133 . 1 1 16 16 GLY HA3 H 1 3.253 0.04 . 2 . . . A 16 GLY HA3 . 18749 1
134 . 1 1 16 16 GLY C C 13 172.056 0.5 . 1 . . . A 16 GLY C . 18749 1
135 . 1 1 16 16 GLY CA C 13 44.89475 0.5 . 1 . . . A 16 GLY CA . 18749 1
136 . 1 1 16 16 GLY N N 15 108.011 0.3 . 1 . . . A 16 GLY N . 18749 1
137 . 1 1 17 17 LYS H H 1 7.347 0.04 . 1 . . . A 17 LYS H . 18749 1
138 . 1 1 17 17 LYS HA H 1 4.135 0.04 . 1 . . . A 17 LYS HA . 18749 1
139 . 1 1 17 17 LYS HG2 H 1 1.331 0.04 . 2 . . . A 17 LYS HG2 . 18749 1
140 . 1 1 17 17 LYS HG3 H 1 1.11 0.04 . 2 . . . A 17 LYS HG3 . 18749 1
141 . 1 1 17 17 LYS HD2 H 1 1.4435 0.04 . 2 . . . A 17 LYS HD2 . 18749 1
142 . 1 1 17 17 LYS HD3 H 1 1.4435 0.04 . 2 . . . A 17 LYS HD3 . 18749 1
143 . 1 1 17 17 LYS HE2 H 1 2.781 0.04 . 2 . . . A 17 LYS HE2 . 18749 1
144 . 1 1 17 17 LYS HE3 H 1 2.781 0.04 . 2 . . . A 17 LYS HE3 . 18749 1
145 . 1 1 17 17 LYS C C 13 175.259 0.5 . 1 . . . A 17 LYS C . 18749 1
146 . 1 1 17 17 LYS CA C 13 53.914 0.5 . 1 . . . A 17 LYS CA . 18749 1
147 . 1 1 17 17 LYS CB C 13 35.2195 0.5 . 1 . . . A 17 LYS CB . 18749 1
148 . 1 1 17 17 LYS CG C 13 24.318 0.5 . 1 . . . A 17 LYS CG . 18749 1
149 . 1 1 17 17 LYS CD C 13 29.08 0.5 . 1 . . . A 17 LYS CD . 18749 1
150 . 1 1 17 17 LYS CE C 13 42.618 0.5 . 1 . . . A 17 LYS CE . 18749 1
151 . 1 1 17 17 LYS N N 15 117.049 0.3 . 1 . . . A 17 LYS N . 18749 1
152 . 1 1 18 18 HIS H H 1 8.896 0.04 . 1 . . . A 18 HIS H . 18749 1
153 . 1 1 18 18 HIS HB2 H 1 2.825 0.04 . 2 . . . A 18 HIS HB2 . 18749 1
154 . 1 1 18 18 HIS HB3 H 1 2.269 0.04 . 2 . . . A 18 HIS HB3 . 18749 1
155 . 1 1 18 18 HIS C C 13 175.419 0.5 . 1 . . . A 18 HIS C . 18749 1
156 . 1 1 18 18 HIS CA C 13 57.086 0.5 . 1 . . . A 18 HIS CA . 18749 1
157 . 1 1 18 18 HIS CB C 13 30.49175 0.5 . 1 . . . A 18 HIS CB . 18749 1
158 . 1 1 18 18 HIS N N 15 120.426 0.3 . 1 . . . A 18 HIS N . 18749 1
159 . 1 1 19 19 ILE H H 1 8.18 0.04 . 1 . . . A 19 ILE H . 18749 1
160 . 1 1 19 19 ILE HA H 1 4.4535 0.04 . 1 . . . A 19 ILE HA . 18749 1
161 . 1 1 19 19 ILE HB H 1 1.824 0.04 . 1 . . . A 19 ILE HB . 18749 1
162 . 1 1 19 19 ILE HG12 H 1 1.296 0.04 . 2 . . . A 19 ILE HG12 . 18749 1
163 . 1 1 19 19 ILE HG13 H 1 1.296 0.04 . 2 . . . A 19 ILE HG13 . 18749 1
164 . 1 1 19 19 ILE HG21 H 1 0.665 0.04 . 1 . . . A 19 ILE HG21 . 18749 1
165 . 1 1 19 19 ILE HG22 H 1 0.665 0.04 . 1 . . . A 19 ILE HG22 . 18749 1
166 . 1 1 19 19 ILE HG23 H 1 0.665 0.04 . 1 . . . A 19 ILE HG23 . 18749 1
167 . 1 1 19 19 ILE C C 13 175.138 0.5 . 1 . . . A 19 ILE C . 18749 1
168 . 1 1 19 19 ILE CA C 13 59.18875 0.5 . 1 . . . A 19 ILE CA . 18749 1
169 . 1 1 19 19 ILE CB C 13 41.81575 0.5 . 1 . . . A 19 ILE CB . 18749 1
170 . 1 1 19 19 ILE CG1 C 13 27.493 0.5 . 1 . . . A 19 ILE CG1 . 18749 1
171 . 1 1 19 19 ILE CG2 C 13 17.219 0.5 . 1 . . . A 19 ILE CG2 . 18749 1
172 . 1 1 19 19 ILE N N 15 126.193 0.3 . 1 . . . A 19 ILE N . 18749 1
173 . 1 1 20 20 CYS H H 1 8.382 0.04 . 1 . . . A 20 CYS H . 18749 1
174 . 1 1 20 20 CYS HA H 1 4.915 0.04 . 1 . . . A 20 CYS HA . 18749 1
175 . 1 1 20 20 CYS HB2 H 1 3.1045 0.04 . 2 . . . A 20 CYS HB2 . 18749 1
176 . 1 1 20 20 CYS HB3 H 1 2.127 0.04 . 2 . . . A 20 CYS HB3 . 18749 1
177 . 1 1 20 20 CYS C C 13 174.996 0.5 . 1 . . . A 20 CYS C . 18749 1
178 . 1 1 20 20 CYS CA C 13 57.3695 0.5 . 1 . . . A 20 CYS CA . 18749 1
179 . 1 1 20 20 CYS CB C 13 32.008 0.5 . 1 . . . A 20 CYS CB . 18749 1
180 . 1 1 20 20 CYS N N 15 127.805 0.3 . 1 . . . A 20 CYS N . 18749 1
181 . 1 1 21 21 ALA H H 1 8.742 0.04 . 1 . . . A 21 ALA H . 18749 1
182 . 1 1 21 21 ALA HA H 1 4.1625 0.04 . 1 . . . A 21 ALA HA . 18749 1
183 . 1 1 21 21 ALA HB1 H 1 1.5515 0.04 . 1 . . . A 21 ALA HB1 . 18749 1
184 . 1 1 21 21 ALA HB2 H 1 1.5515 0.04 . 1 . . . A 21 ALA HB2 . 18749 1
185 . 1 1 21 21 ALA HB3 H 1 1.5515 0.04 . 1 . . . A 21 ALA HB3 . 18749 1
186 . 1 1 21 21 ALA C C 13 177.885 0.5 . 1 . . . A 21 ALA C . 18749 1
187 . 1 1 21 21 ALA CA C 13 54.4915 0.5 . 1 . . . A 21 ALA CA . 18749 1
188 . 1 1 21 21 ALA CB C 13 19.6245 0.5 . 1 . . . A 21 ALA CB . 18749 1
189 . 1 1 21 21 ALA N N 15 135.406 0.3 . 1 . . . A 21 ALA N . 18749 1
190 . 1 1 22 22 ILE H H 1 8.15 0.04 . 1 . . . A 22 ILE H . 18749 1
191 . 1 1 22 22 ILE HA H 1 3.8605 0.04 . 1 . . . A 22 ILE HA . 18749 1
192 . 1 1 22 22 ILE HB H 1 2.207 0.04 . 1 . . . A 22 ILE HB . 18749 1
193 . 1 1 22 22 ILE HG12 H 1 1.528 0.04 . 2 . . . A 22 ILE HG12 . 18749 1
194 . 1 1 22 22 ILE HG13 H 1 1.242 0.04 . 2 . . . A 22 ILE HG13 . 18749 1
195 . 1 1 22 22 ILE HG21 H 1 0.9155 0.04 . 1 . . . A 22 ILE HG21 . 18749 1
196 . 1 1 22 22 ILE HG22 H 1 0.9155 0.04 . 1 . . . A 22 ILE HG22 . 18749 1
197 . 1 1 22 22 ILE HG23 H 1 0.9155 0.04 . 1 . . . A 22 ILE HG23 . 18749 1
198 . 1 1 22 22 ILE C C 13 176.914 0.5 . 1 . . . A 22 ILE C . 18749 1
199 . 1 1 22 22 ILE CA C 13 63.2175 0.5 . 1 . . . A 22 ILE CA . 18749 1
200 . 1 1 22 22 ILE CB C 13 37.3715 0.5 . 1 . . . A 22 ILE CB . 18749 1
201 . 1 1 22 22 ILE CG1 C 13 27.608 0.5 . 1 . . . A 22 ILE CG1 . 18749 1
202 . 1 1 22 22 ILE CG2 C 13 18.192 0.5 . 1 . . . A 22 ILE CG2 . 18749 1
203 . 1 1 22 22 ILE N N 15 119.063 0.3 . 1 . . . A 22 ILE N . 18749 1
204 . 1 1 23 23 CYS H H 1 7.238 0.04 . 1 . . . A 23 CYS H . 18749 1
205 . 1 1 23 23 CYS HB2 H 1 3.057 0.04 . 2 . . . A 23 CYS HB2 . 18749 1
206 . 1 1 23 23 CYS HB3 H 1 3.057 0.04 . 2 . . . A 23 CYS HB3 . 18749 1
207 . 1 1 23 23 CYS C C 13 176.216 0.5 . 1 . . . A 23 CYS C . 18749 1
208 . 1 1 23 23 CYS CA C 13 57.878 0.5 . 1 . . . A 23 CYS CA . 18749 1
209 . 1 1 23 23 CYS CB C 13 30.456 0.5 . 1 . . . A 23 CYS CB . 18749 1
210 . 1 1 23 23 CYS N N 15 114.362 0.3 . 1 . . . A 23 CYS N . 18749 1
211 . 1 1 24 24 GLY H H 1 7.566 0.04 . 1 . . . A 24 GLY H . 18749 1
212 . 1 1 24 24 GLY HA2 H 1 3.977 0.04 . 2 . . . A 24 GLY HA2 . 18749 1
213 . 1 1 24 24 GLY HA3 H 1 3.7395 0.04 . 2 . . . A 24 GLY HA3 . 18749 1
214 . 1 1 24 24 GLY C C 13 173.367 0.5 . 1 . . . A 24 GLY C . 18749 1
215 . 1 1 24 24 GLY CA C 13 46.222 0.5 . 1 . . . A 24 GLY CA . 18749 1
216 . 1 1 24 24 GLY N N 15 111.898 0.3 . 1 . . . A 24 GLY N . 18749 1
217 . 1 1 25 25 ASN H H 1 7.781 0.04 . 1 . . . A 25 ASN H . 18749 1
218 . 1 1 25 25 ASN HA H 1 4.763 0.04 . 1 . . . A 25 ASN HA . 18749 1
219 . 1 1 25 25 ASN HB2 H 1 2.576 0.04 . 2 . . . A 25 ASN HB2 . 18749 1
220 . 1 1 25 25 ASN HB3 H 1 2.2915 0.04 . 2 . . . A 25 ASN HB3 . 18749 1
221 . 1 1 25 25 ASN C C 13 174.631 0.5 . 1 . . . A 25 ASN C . 18749 1
222 . 1 1 25 25 ASN CA C 13 51.9005 0.5 . 1 . . . A 25 ASN CA . 18749 1
223 . 1 1 25 25 ASN CB C 13 40.66575 0.5 . 1 . . . A 25 ASN CB . 18749 1
224 . 1 1 25 25 ASN N N 15 117.684 0.3 . 1 . . . A 25 ASN N . 18749 1
225 . 1 1 26 26 ASN H H 1 8.562 0.04 . 1 . . . A 26 ASN H . 18749 1
226 . 1 1 26 26 ASN HA H 1 4.57 0.04 . 1 . . . A 26 ASN HA . 18749 1
227 . 1 1 26 26 ASN HB2 H 1 2.872 0.04 . 2 . . . A 26 ASN HB2 . 18749 1
228 . 1 1 26 26 ASN HB3 H 1 2.872 0.04 . 2 . . . A 26 ASN HB3 . 18749 1
229 . 1 1 26 26 ASN C C 13 175.502 0.5 . 1 . . . A 26 ASN C . 18749 1
230 . 1 1 26 26 ASN CA C 13 53.98 0.5 . 1 . . . A 26 ASN CA . 18749 1
231 . 1 1 26 26 ASN CB C 13 38.0665 0.5 . 1 . . . A 26 ASN CB . 18749 1
232 . 1 1 26 26 ASN N N 15 118.294 0.3 . 1 . . . A 26 ASN N . 18749 1
233 . 1 1 27 27 ALA H H 1 8.217 0.04 . 1 . . . A 27 ALA H . 18749 1
234 . 1 1 27 27 ALA HB1 H 1 0.748 0.04 . 1 . . . A 27 ALA HB1 . 18749 1
235 . 1 1 27 27 ALA HB2 H 1 0.748 0.04 . 1 . . . A 27 ALA HB2 . 18749 1
236 . 1 1 27 27 ALA HB3 H 1 0.748 0.04 . 1 . . . A 27 ALA HB3 . 18749 1
237 . 1 1 27 27 ALA C C 13 177.92 0.5 . 1 . . . A 27 ALA C . 18749 1
238 . 1 1 27 27 ALA CA C 13 53.567 0.5 . 1 . . . A 27 ALA CA . 18749 1
239 . 1 1 27 27 ALA CB C 13 18.85225 0.5 . 1 . . . A 27 ALA CB . 18749 1
240 . 1 1 27 27 ALA N N 15 126.538 0.3 . 1 . . . A 27 ALA N . 18749 1
241 . 1 1 28 28 GLU H H 1 8.608 0.04 . 1 . . . A 28 GLU H . 18749 1
242 . 1 1 28 28 GLU HA H 1 4.099 0.04 . 1 . . . A 28 GLU HA . 18749 1
243 . 1 1 28 28 GLU HG2 H 1 2.138 0.04 . 2 . . . A 28 GLU HG2 . 18749 1
244 . 1 1 28 28 GLU HG3 H 1 2.138 0.04 . 2 . . . A 28 GLU HG3 . 18749 1
245 . 1 1 28 28 GLU C C 13 177.423 0.5 . 1 . . . A 28 GLU C . 18749 1
246 . 1 1 28 28 GLU CA C 13 57.783 0.5 . 1 . . . A 28 GLU CA . 18749 1
247 . 1 1 28 28 GLU CB C 13 30.926 0.5 . 1 . . . A 28 GLU CB . 18749 1
248 . 1 1 28 28 GLU CG C 13 37.655 0.5 . 1 . . . A 28 GLU CG . 18749 1
249 . 1 1 28 28 GLU N N 15 112.911 0.3 . 1 . . . A 28 GLU N . 18749 1
250 . 1 1 29 29 ASP H H 1 7.272 0.04 . 1 . . . A 29 ASP H . 18749 1
251 . 1 1 29 29 ASP HA H 1 4.434 0.04 . 1 . . . A 29 ASP HA . 18749 1
252 . 1 1 29 29 ASP HB2 H 1 2.401 0.04 . 2 . . . A 29 ASP HB2 . 18749 1
253 . 1 1 29 29 ASP HB3 H 1 2.401 0.04 . 2 . . . A 29 ASP HB3 . 18749 1
254 . 1 1 29 29 ASP C C 13 174.486 0.5 . 1 . . . A 29 ASP C . 18749 1
255 . 1 1 29 29 ASP CA C 13 55.34925 0.5 . 1 . . . A 29 ASP CA . 18749 1
256 . 1 1 29 29 ASP CB C 13 42.59625 0.5 . 1 . . . A 29 ASP CB . 18749 1
257 . 1 1 29 29 ASP N N 15 116.209 0.3 . 1 . . . A 29 ASP N . 18749 1
258 . 1 1 30 30 TYR H H 1 7.281 0.04 . 1 . . . A 30 TYR H . 18749 1
259 . 1 1 30 30 TYR HB2 H 1 3.308 0.04 . 2 . . . A 30 TYR HB2 . 18749 1
260 . 1 1 30 30 TYR HB3 H 1 2.558 0.04 . 2 . . . A 30 TYR HB3 . 18749 1
261 . 1 1 30 30 TYR CA C 13 57.018 0.5 . 1 . . . A 30 TYR CA . 18749 1
262 . 1 1 30 30 TYR CB C 13 43.459 0.5 . 1 . . . A 30 TYR CB . 18749 1
263 . 1 1 30 30 TYR N N 15 116.344 0.3 . 1 . . . A 30 TYR N . 18749 1
264 . 1 1 31 31 LYS C C 13 177.018 0.5 . 1 . . . A 31 LYS C . 18749 1
265 . 1 1 32 32 HIS H H 1 7.691 0.04 . 1 . . . A 32 HIS H . 18749 1
266 . 1 1 32 32 HIS HA H 1 3.802 0.04 . 1 . . . A 32 HIS HA . 18749 1
267 . 1 1 32 32 HIS HB2 H 1 1.944 0.04 . 2 . . . A 32 HIS HB2 . 18749 1
268 . 1 1 32 32 HIS HB3 H 1 1.944 0.04 . 2 . . . A 32 HIS HB3 . 18749 1
269 . 1 1 32 32 HIS C C 13 173.979 0.5 . 1 . . . A 32 HIS C . 18749 1
270 . 1 1 32 32 HIS CA C 13 55.1355 0.5 . 1 . . . A 32 HIS CA . 18749 1
271 . 1 1 32 32 HIS CB C 13 33.12775 0.5 . 1 . . . A 32 HIS CB . 18749 1
272 . 1 1 32 32 HIS N N 15 116.17 0.3 . 1 . . . A 32 HIS N . 18749 1
273 . 1 1 33 33 THR H H 1 8.051 0.04 . 1 . . . A 33 THR H . 18749 1
274 . 1 1 33 33 THR HA H 1 4.424 0.04 . 1 . . . A 33 THR HA . 18749 1
275 . 1 1 33 33 THR HG21 H 1 1.114 0.04 . 1 . . . A 33 THR HG21 . 18749 1
276 . 1 1 33 33 THR HG22 H 1 1.114 0.04 . 1 . . . A 33 THR HG22 . 18749 1
277 . 1 1 33 33 THR HG23 H 1 1.114 0.04 . 1 . . . A 33 THR HG23 . 18749 1
278 . 1 1 33 33 THR C C 13 175.107 0.5 . 1 . . . A 33 THR C . 18749 1
279 . 1 1 33 33 THR CA C 13 60.21825 0.5 . 1 . . . A 33 THR CA . 18749 1
280 . 1 1 33 33 THR CB C 13 69.476 0.5 . 1 . . . A 33 THR CB . 18749 1
281 . 1 1 33 33 THR N N 15 108.605 0.3 . 1 . . . A 33 THR N . 18749 1
282 . 1 1 34 34 ASP H H 1 7.973 0.04 . 1 . . . A 34 ASP H . 18749 1
283 . 1 1 34 34 ASP HA H 1 4.5895 0.04 . 1 . . . A 34 ASP HA . 18749 1
284 . 1 1 34 34 ASP HB2 H 1 3.002 0.04 . 2 . . . A 34 ASP HB2 . 18749 1
285 . 1 1 34 34 ASP HB3 H 1 2.745 0.04 . 2 . . . A 34 ASP HB3 . 18749 1
286 . 1 1 34 34 ASP C C 13 175.334 0.5 . 1 . . . A 34 ASP C . 18749 1
287 . 1 1 34 34 ASP CA C 13 53.56375 0.5 . 1 . . . A 34 ASP CA . 18749 1
288 . 1 1 34 34 ASP CB C 13 40.42025 0.5 . 1 . . . A 34 ASP CB . 18749 1
289 . 1 1 34 34 ASP N N 15 121.404 0.3 . 1 . . . A 34 ASP N . 18749 1
290 . 1 1 35 35 MET H H 1 7.585 0.04 . 1 . . . A 35 MET H . 18749 1
291 . 1 1 35 35 MET HA H 1 4.398 0.04 . 1 . . . A 35 MET HA . 18749 1
292 . 1 1 35 35 MET HB2 H 1 1.732 0.04 . 2 . . . A 35 MET HB2 . 18749 1
293 . 1 1 35 35 MET HB3 H 1 1.732 0.04 . 2 . . . A 35 MET HB3 . 18749 1
294 . 1 1 35 35 MET HG2 H 1 2.3435 0.04 . 2 . . . A 35 MET HG2 . 18749 1
295 . 1 1 35 35 MET HG3 H 1 2.3435 0.04 . 2 . . . A 35 MET HG3 . 18749 1
296 . 1 1 35 35 MET HE1 H 1 1.525 0.04 . 1 . . . A 35 MET HE1 . 18749 1
297 . 1 1 35 35 MET HE2 H 1 1.525 0.04 . 1 . . . A 35 MET HE2 . 18749 1
298 . 1 1 35 35 MET HE3 H 1 1.525 0.04 . 1 . . . A 35 MET HE3 . 18749 1
299 . 1 1 35 35 MET C C 13 174.846 0.5 . 1 . . . A 35 MET C . 18749 1
300 . 1 1 35 35 MET CA C 13 55.631 0.5 . 1 . . . A 35 MET CA . 18749 1
301 . 1 1 35 35 MET CB C 13 33.382 0.5 . 1 . . . A 35 MET CB . 18749 1
302 . 1 1 35 35 MET CG C 13 32.353 0.5 . 1 . . . A 35 MET CG . 18749 1
303 . 1 1 35 35 MET N N 15 119.898 0.3 . 1 . . . A 35 MET N . 18749 1
304 . 1 1 36 36 ASP H H 1 8.36 0.04 . 1 . . . A 36 ASP H . 18749 1
305 . 1 1 36 36 ASP HA H 1 4.486 0.04 . 1 . . . A 36 ASP HA . 18749 1
306 . 1 1 36 36 ASP HB2 H 1 2.57 0.04 . 2 . . . A 36 ASP HB2 . 18749 1
307 . 1 1 36 36 ASP HB3 H 1 2.57 0.04 . 2 . . . A 36 ASP HB3 . 18749 1
308 . 1 1 36 36 ASP C C 13 176.456 0.5 . 1 . . . A 36 ASP C . 18749 1
309 . 1 1 36 36 ASP CA C 13 54.279 0.5 . 1 . . . A 36 ASP CA . 18749 1
310 . 1 1 36 36 ASP CB C 13 41.156 0.5 . 1 . . . A 36 ASP CB . 18749 1
311 . 1 1 36 36 ASP N N 15 123.631 0.3 . 1 . . . A 36 ASP N . 18749 1
312 . 1 1 37 37 LEU H H 1 8.224 0.04 . 1 . . . A 37 LEU H . 18749 1
313 . 1 1 37 37 LEU HA H 1 4.303 0.04 . 1 . . . A 37 LEU HA . 18749 1
314 . 1 1 37 37 LEU HD11 H 1 0.792 0.04 . 2 . . . A 37 LEU HD11 . 18749 1
315 . 1 1 37 37 LEU HD12 H 1 0.792 0.04 . 2 . . . A 37 LEU HD12 . 18749 1
316 . 1 1 37 37 LEU HD13 H 1 0.792 0.04 . 2 . . . A 37 LEU HD13 . 18749 1
317 . 1 1 37 37 LEU HD21 H 1 0.792 0.04 . 2 . . . A 37 LEU HD21 . 18749 1
318 . 1 1 37 37 LEU HD22 H 1 0.792 0.04 . 2 . . . A 37 LEU HD22 . 18749 1
319 . 1 1 37 37 LEU HD23 H 1 0.792 0.04 . 2 . . . A 37 LEU HD23 . 18749 1
320 . 1 1 37 37 LEU C C 13 177.554 0.5 . 1 . . . A 37 LEU C . 18749 1
321 . 1 1 37 37 LEU CA C 13 55.317 0.5 . 1 . . . A 37 LEU CA . 18749 1
322 . 1 1 37 37 LEU CB C 13 41.945 0.5 . 1 . . . A 37 LEU CB . 18749 1
323 . 1 1 37 37 LEU CG C 13 26.995 0.5 . 1 . . . A 37 LEU CG . 18749 1
324 . 1 1 37 37 LEU CD1 C 13 25.388 0.5 . 2 . . . A 37 LEU CD1 . 18749 1
325 . 1 1 37 37 LEU CD2 C 13 23.235 0.5 . 2 . . . A 37 LEU CD2 . 18749 1
326 . 1 1 37 37 LEU N N 15 123.812 0.3 . 1 . . . A 37 LEU N . 18749 1
327 . 1 1 38 38 THR H H 1 8.321 0.04 . 1 . . . A 38 THR H . 18749 1
328 . 1 1 38 38 THR HA H 1 4.153 0.04 . 1 . . . A 38 THR HA . 18749 1
329 . 1 1 38 38 THR HB H 1 4.029 0.04 . 1 . . . A 38 THR HB . 18749 1
330 . 1 1 38 38 THR HG21 H 1 1.001 0.04 . 1 . . . A 38 THR HG21 . 18749 1
331 . 1 1 38 38 THR HG22 H 1 1.001 0.04 . 1 . . . A 38 THR HG22 . 18749 1
332 . 1 1 38 38 THR HG23 H 1 1.001 0.04 . 1 . . . A 38 THR HG23 . 18749 1
333 . 1 1 38 38 THR C C 13 174.786 0.5 . 1 . . . A 38 THR C . 18749 1
334 . 1 1 38 38 THR CA C 13 62.673 0.5 . 1 . . . A 38 THR CA . 18749 1
335 . 1 1 38 38 THR CB C 13 69.79225 0.5 . 1 . . . A 38 THR CB . 18749 1
336 . 1 1 38 38 THR N N 15 113.723 0.3 . 1 . . . A 38 THR N . 18749 1
337 . 1 1 39 39 TYR H H 1 7.92 0.04 . 1 . . . A 39 TYR H . 18749 1
338 . 1 1 39 39 TYR HB2 H 1 2.921 0.04 . 2 . . . A 39 TYR HB2 . 18749 1
339 . 1 1 39 39 TYR HB3 H 1 2.921 0.04 . 2 . . . A 39 TYR HB3 . 18749 1
340 . 1 1 39 39 TYR C C 13 175.992 0.5 . 1 . . . A 39 TYR C . 18749 1
341 . 1 1 39 39 TYR CA C 13 58.083 0.5 . 1 . . . A 39 TYR CA . 18749 1
342 . 1 1 39 39 TYR CB C 13 38.3085 0.5 . 1 . . . A 39 TYR CB . 18749 1
343 . 1 1 39 39 TYR N N 15 121.098 0.3 . 1 . . . A 39 TYR N . 18749 1
344 . 1 1 40 40 THR H H 1 7.885 0.04 . 1 . . . A 40 THR H . 18749 1
345 . 1 1 40 40 THR HB H 1 4.231 0.04 . 1 . . . A 40 THR HB . 18749 1
346 . 1 1 40 40 THR HG21 H 1 1.063 0.04 . 1 . . . A 40 THR HG21 . 18749 1
347 . 1 1 40 40 THR HG22 H 1 1.063 0.04 . 1 . . . A 40 THR HG22 . 18749 1
348 . 1 1 40 40 THR HG23 H 1 1.063 0.04 . 1 . . . A 40 THR HG23 . 18749 1
349 . 1 1 40 40 THR C C 13 174.356 0.5 . 1 . . . A 40 THR C . 18749 1
350 . 1 1 40 40 THR CA C 13 61.8015 0.5 . 1 . . . A 40 THR CA . 18749 1
351 . 1 1 40 40 THR CB C 13 69.96475 0.5 . 1 . . . A 40 THR CB . 18749 1
352 . 1 1 40 40 THR N N 15 113.38 0.3 . 1 . . . A 40 THR N . 18749 1
353 . 1 1 41 41 ASP H H 1 8.184 0.04 . 1 . . . A 41 ASP H . 18749 1
354 . 1 1 41 41 ASP HA H 1 4.468 0.04 . 1 . . . A 41 ASP HA . 18749 1
355 . 1 1 41 41 ASP HB2 H 1 2.654 0.04 . 2 . . . A 41 ASP HB2 . 18749 1
356 . 1 1 41 41 ASP HB3 H 1 2.654 0.04 . 2 . . . A 41 ASP HB3 . 18749 1
357 . 1 1 41 41 ASP C C 13 176.338 0.5 . 1 . . . A 41 ASP C . 18749 1
358 . 1 1 41 41 ASP CA C 13 54.67375 0.5 . 1 . . . A 41 ASP CA . 18749 1
359 . 1 1 41 41 ASP CB C 13 40.996 0.5 . 1 . . . A 41 ASP CB . 18749 1
360 . 1 1 41 41 ASP N N 15 121.537 0.3 . 1 . . . A 41 ASP N . 18749 1
361 . 1 1 42 42 ARG H H 1 7.997 0.04 . 1 . . . A 42 ARG H . 18749 1
362 . 1 1 42 42 ARG HA H 1 4.1715 0.04 . 1 . . . A 42 ARG HA . 18749 1
363 . 1 1 42 42 ARG HB2 H 1 1.727 0.04 . 2 . . . A 42 ARG HB2 . 18749 1
364 . 1 1 42 42 ARG HB3 H 1 1.727 0.04 . 2 . . . A 42 ARG HB3 . 18749 1
365 . 1 1 42 42 ARG HG2 H 1 1.535 0.04 . 2 . . . A 42 ARG HG2 . 18749 1
366 . 1 1 42 42 ARG HG3 H 1 1.535 0.04 . 2 . . . A 42 ARG HG3 . 18749 1
367 . 1 1 42 42 ARG HD2 H 1 3.068 0.04 . 2 . . . A 42 ARG HD2 . 18749 1
368 . 1 1 42 42 ARG HD3 H 1 3.068 0.04 . 2 . . . A 42 ARG HD3 . 18749 1
369 . 1 1 42 42 ARG C C 13 175.906 0.5 . 1 . . . A 42 ARG C . 18749 1
370 . 1 1 42 42 ARG CA C 13 56.644 0.5 . 1 . . . A 42 ARG CA . 18749 1
371 . 1 1 42 42 ARG CB C 13 30.788 0.5 . 1 . . . A 42 ARG CB . 18749 1
372 . 1 1 42 42 ARG CG C 13 26.924 0.5 . 1 . . . A 42 ARG CG . 18749 1
373 . 1 1 42 42 ARG CD C 13 43.459 0.5 . 1 . . . A 42 ARG CD . 18749 1
374 . 1 1 42 42 ARG N N 15 119.745 0.3 . 1 . . . A 42 ARG N . 18749 1
375 . 1 1 43 43 ASP H H 1 8.181 0.04 . 1 . . . A 43 ASP H . 18749 1
376 . 1 1 43 43 ASP HA H 1 4.503 0.04 . 1 . . . A 43 ASP HA . 18749 1
377 . 1 1 43 43 ASP HB2 H 1 2.526 0.04 . 2 . . . A 43 ASP HB2 . 18749 1
378 . 1 1 43 43 ASP HB3 H 1 2.526 0.04 . 2 . . . A 43 ASP HB3 . 18749 1
379 . 1 1 43 43 ASP C C 13 175.599 0.5 . 1 . . . A 43 ASP C . 18749 1
380 . 1 1 43 43 ASP CA C 13 54.3685 0.5 . 1 . . . A 43 ASP CA . 18749 1
381 . 1 1 43 43 ASP CB C 13 41.07125 0.5 . 1 . . . A 43 ASP CB . 18749 1
382 . 1 1 43 43 ASP N N 15 119.314 0.3 . 1 . . . A 43 ASP N . 18749 1
383 . 1 1 44 44 TYR H H 1 7.806 0.04 . 1 . . . A 44 TYR H . 18749 1
384 . 1 1 44 44 TYR HA H 1 4.324 0.04 . 1 . . . A 44 TYR HA . 18749 1
385 . 1 1 44 44 TYR HB2 H 1 2.9275 0.04 . 2 . . . A 44 TYR HB2 . 18749 1
386 . 1 1 44 44 TYR HB3 H 1 2.9275 0.04 . 2 . . . A 44 TYR HB3 . 18749 1
387 . 1 1 44 44 TYR C C 13 175.321 0.5 . 1 . . . A 44 TYR C . 18749 1
388 . 1 1 44 44 TYR CA C 13 58.5525 0.5 . 1 . . . A 44 TYR CA . 18749 1
389 . 1 1 44 44 TYR CB C 13 38.61375 0.5 . 1 . . . A 44 TYR CB . 18749 1
390 . 1 1 44 44 TYR N N 15 120.178 0.3 . 1 . . . A 44 TYR N . 18749 1
391 . 1 1 45 45 LYS H H 1 7.731 0.04 . 1 . . . A 45 LYS H . 18749 1
392 . 1 1 45 45 LYS CA C 13 55.745 0.5 . 1 . . . A 45 LYS CA . 18749 1
393 . 1 1 45 45 LYS CB C 13 33.789 0.5 . 1 . . . A 45 LYS CB . 18749 1
394 . 1 1 45 45 LYS N N 15 123.353 0.3 . 1 . . . A 45 LYS N . 18749 1
395 . 1 1 47 47 CYS H H 1 8.811 0.04 . 1 . . . A 47 CYS H . 18749 1
396 . 1 1 47 47 CYS N N 15 125.06 0.3 . 1 . . . A 47 CYS N . 18749 1
397 . 1 1 48 48 GLU C C 13 178.473 0.5 . 1 . . . A 48 GLU C . 18749 1
398 . 1 1 49 49 SER H H 1 8.737 0.04 . 1 . . . A 49 SER H . 18749 1
399 . 1 1 49 49 SER C C 13 172.276 0.5 . 1 . . . A 49 SER C . 18749 1
400 . 1 1 49 49 SER CA C 13 61.125 0.5 . 1 . . . A 49 SER CA . 18749 1
401 . 1 1 49 49 SER CB C 13 63.2235 0.5 . 1 . . . A 49 SER CB . 18749 1
402 . 1 1 49 49 SER N N 15 120.359 0.3 . 1 . . . A 49 SER N . 18749 1
403 . 1 1 50 50 TYR H H 1 6.326 0.04 . 1 . . . A 50 TYR H . 18749 1
404 . 1 1 50 50 TYR C C 13 175.624 0.5 . 1 . . . A 50 TYR C . 18749 1
405 . 1 1 50 50 TYR CA C 13 59.205 0.5 . 1 . . . A 50 TYR CA . 18749 1
406 . 1 1 50 50 TYR CB C 13 38.1965 0.5 . 1 . . . A 50 TYR CB . 18749 1
407 . 1 1 50 50 TYR N N 15 110.556 0.3 . 1 . . . A 50 TYR N . 18749 1
408 . 1 1 51 51 HIS H H 1 5.89 0.04 . 1 . . . A 51 HIS H . 18749 1
409 . 1 1 51 51 HIS HA H 1 3.757 0.04 . 1 . . . A 51 HIS HA . 18749 1
410 . 1 1 51 51 HIS C C 13 176.588 0.5 . 1 . . . A 51 HIS C . 18749 1
411 . 1 1 51 51 HIS CA C 13 59.323 0.5 . 1 . . . A 51 HIS CA . 18749 1
412 . 1 1 51 51 HIS CB C 13 27.5135 0.5 . 1 . . . A 51 HIS CB . 18749 1
413 . 1 1 51 51 HIS N N 15 119.871 0.3 . 1 . . . A 51 HIS N . 18749 1
414 . 1 1 52 52 LYS H H 1 7.66 0.04 . 1 . . . A 52 LYS H . 18749 1
415 . 1 1 52 52 LYS C C 13 178.958 0.5 . 1 . . . A 52 LYS C . 18749 1
416 . 1 1 52 52 LYS CA C 13 58.9215 0.5 . 1 . . . A 52 LYS CA . 18749 1
417 . 1 1 52 52 LYS CB C 13 31.2915 0.5 . 1 . . . A 52 LYS CB . 18749 1
418 . 1 1 52 52 LYS N N 15 122.505 0.3 . 1 . . . A 52 LYS N . 18749 1
419 . 1 1 53 53 CYS H H 1 8.256 0.04 . 1 . . . A 53 CYS H . 18749 1
420 . 1 1 53 53 CYS HB2 H 1 3.159 0.04 . 2 . . . A 53 CYS HB2 . 18749 1
421 . 1 1 53 53 CYS HB3 H 1 2.863 0.04 . 2 . . . A 53 CYS HB3 . 18749 1
422 . 1 1 53 53 CYS C C 13 179.241 0.5 . 1 . . . A 53 CYS C . 18749 1
423 . 1 1 53 53 CYS CA C 13 64.8025 0.5 . 1 . . . A 53 CYS CA . 18749 1
424 . 1 1 53 53 CYS CB C 13 30.90625 0.5 . 1 . . . A 53 CYS CB . 18749 1
425 . 1 1 53 53 CYS N N 15 117.268 0.3 . 1 . . . A 53 CYS N . 18749 1
426 . 1 1 54 54 SER H H 1 7.671 0.04 . 1 . . . A 54 SER H . 18749 1
427 . 1 1 54 54 SER HA H 1 3.839 0.04 . 1 . . . A 54 SER HA . 18749 1
428 . 1 1 54 54 SER HB2 H 1 3.574 0.04 . 2 . . . A 54 SER HB2 . 18749 1
429 . 1 1 54 54 SER HB3 H 1 3.394 0.04 . 2 . . . A 54 SER HB3 . 18749 1
430 . 1 1 54 54 SER C C 13 175.922 0.5 . 1 . . . A 54 SER C . 18749 1
431 . 1 1 54 54 SER CA C 13 60.263 0.5 . 1 . . . A 54 SER CA . 18749 1
432 . 1 1 54 54 SER CB C 13 64.1195 0.5 . 1 . . . A 54 SER CB . 18749 1
433 . 1 1 54 54 SER N N 15 111.716 0.3 . 1 . . . A 54 SER N . 18749 1
434 . 1 1 55 55 ASP H H 1 7.438 0.04 . 1 . . . A 55 ASP H . 18749 1
435 . 1 1 55 55 ASP HA H 1 4.295 0.04 . 1 . . . A 55 ASP HA . 18749 1
436 . 1 1 55 55 ASP HB2 H 1 2.788 0.04 . 2 . . . A 55 ASP HB2 . 18749 1
437 . 1 1 55 55 ASP HB3 H 1 2.577 0.04 . 2 . . . A 55 ASP HB3 . 18749 1
438 . 1 1 55 55 ASP C C 13 178.101 0.5 . 1 . . . A 55 ASP C . 18749 1
439 . 1 1 55 55 ASP CA C 13 57.387 0.5 . 1 . . . A 55 ASP CA . 18749 1
440 . 1 1 55 55 ASP CB C 13 40.31475 0.5 . 1 . . . A 55 ASP CB . 18749 1
441 . 1 1 55 55 ASP N N 15 119.056 0.3 . 1 . . . A 55 ASP N . 18749 1
442 . 1 1 56 56 LEU H H 1 7.565 0.04 . 1 . . . A 56 LEU H . 18749 1
443 . 1 1 56 56 LEU HA H 1 4.168 0.04 . 1 . . . A 56 LEU HA . 18749 1
444 . 1 1 56 56 LEU HD11 H 1 0.727 0.04 . 2 . . . A 56 LEU HD11 . 18749 1
445 . 1 1 56 56 LEU HD12 H 1 0.727 0.04 . 2 . . . A 56 LEU HD12 . 18749 1
446 . 1 1 56 56 LEU HD13 H 1 0.727 0.04 . 2 . . . A 56 LEU HD13 . 18749 1
447 . 1 1 56 56 LEU HD21 H 1 0.727 0.04 . 2 . . . A 56 LEU HD21 . 18749 1
448 . 1 1 56 56 LEU HD22 H 1 0.727 0.04 . 2 . . . A 56 LEU HD22 . 18749 1
449 . 1 1 56 56 LEU HD23 H 1 0.727 0.04 . 2 . . . A 56 LEU HD23 . 18749 1
450 . 1 1 56 56 LEU C C 13 176.25 0.5 . 1 . . . A 56 LEU C . 18749 1
451 . 1 1 56 56 LEU CA C 13 55.33275 0.5 . 1 . . . A 56 LEU CA . 18749 1
452 . 1 1 56 56 LEU CB C 13 43.17325 0.5 . 1 . . . A 56 LEU CB . 18749 1
453 . 1 1 56 56 LEU CG C 13 25.857 0.5 . 1 . . . A 56 LEU CG . 18749 1
454 . 1 1 56 56 LEU CD1 C 13 22.475 0.5 . 2 . . . A 56 LEU CD1 . 18749 1
455 . 1 1 56 56 LEU CD2 C 13 22.475 0.5 . 2 . . . A 56 LEU CD2 . 18749 1
456 . 1 1 56 56 LEU N N 15 118.324 0.3 . 1 . . . A 56 LEU N . 18749 1
457 . 1 1 57 57 CYS H H 1 7.265 0.04 . 1 . . . A 57 CYS H . 18749 1
458 . 1 1 57 57 CYS HA H 1 4.255 0.04 . 1 . . . A 57 CYS HA . 18749 1
459 . 1 1 57 57 CYS HB2 H 1 3.339 0.04 . 2 . . . A 57 CYS HB2 . 18749 1
460 . 1 1 57 57 CYS HB3 H 1 3.339 0.04 . 2 . . . A 57 CYS HB3 . 18749 1
461 . 1 1 57 57 CYS C C 13 177.371 0.5 . 1 . . . A 57 CYS C . 18749 1
462 . 1 1 57 57 CYS CA C 13 59.255 0.5 . 1 . . . A 57 CYS CA . 18749 1
463 . 1 1 57 57 CYS CB C 13 30.1285 0.5 . 1 . . . A 57 CYS CB . 18749 1
464 . 1 1 57 57 CYS N N 15 124.095 0.3 . 1 . . . A 57 CYS N . 18749 1
465 . 1 1 58 58 GLN H H 1 9.451 0.04 . 1 . . . A 58 GLN H . 18749 1
466 . 1 1 58 58 GLN HA H 1 3.923 0.04 . 1 . . . A 58 GLN HA . 18749 1
467 . 1 1 58 58 GLN HG2 H 1 2.426 0.04 . 2 . . . A 58 GLN HG2 . 18749 1
468 . 1 1 58 58 GLN HG3 H 1 2.426 0.04 . 2 . . . A 58 GLN HG3 . 18749 1
469 . 1 1 58 58 GLN C C 13 178.435 0.5 . 1 . . . A 58 GLN C . 18749 1
470 . 1 1 58 58 GLN CA C 13 59.28775 0.5 . 1 . . . A 58 GLN CA . 18749 1
471 . 1 1 58 58 GLN CB C 13 28.1945 0.5 . 1 . . . A 58 GLN CB . 18749 1
472 . 1 1 58 58 GLN CG C 13 33.997 0.5 . 1 . . . A 58 GLN CG . 18749 1
473 . 1 1 58 58 GLN N N 15 131.839 0.3 . 1 . . . A 58 GLN N . 18749 1
474 . 1 1 59 59 TYR H H 1 8.699 0.04 . 1 . . . A 59 TYR H . 18749 1
475 . 1 1 59 59 TYR HA H 1 4.4295 0.04 . 1 . . . A 59 TYR HA . 18749 1
476 . 1 1 59 59 TYR HB2 H 1 2.732 0.04 . 2 . . . A 59 TYR HB2 . 18749 1
477 . 1 1 59 59 TYR HB3 H 1 2.085 0.04 . 2 . . . A 59 TYR HB3 . 18749 1
478 . 1 1 59 59 TYR C C 13 178.722 0.5 . 1 . . . A 59 TYR C . 18749 1
479 . 1 1 59 59 TYR CA C 13 60.2955 0.5 . 1 . . . A 59 TYR CA . 18749 1
480 . 1 1 59 59 TYR CB C 13 38.59075 0.5 . 1 . . . A 59 TYR CB . 18749 1
481 . 1 1 59 59 TYR N N 15 124.026 0.3 . 1 . . . A 59 TYR N . 18749 1
482 . 1 1 60 60 CYS H H 1 8.432 0.04 . 1 . . . A 60 CYS H . 18749 1
483 . 1 1 60 60 CYS HA H 1 4.317 0.04 . 1 . . . A 60 CYS HA . 18749 1
484 . 1 1 60 60 CYS HB2 H 1 3.381 0.04 . 2 . . . A 60 CYS HB2 . 18749 1
485 . 1 1 60 60 CYS HB3 H 1 2.924 0.04 . 2 . . . A 60 CYS HB3 . 18749 1
486 . 1 1 60 60 CYS C C 13 176.011 0.5 . 1 . . . A 60 CYS C . 18749 1
487 . 1 1 60 60 CYS CA C 13 64.4985 0.5 . 1 . . . A 60 CYS CA . 18749 1
488 . 1 1 60 60 CYS CB C 13 30.20325 0.5 . 1 . . . A 60 CYS CB . 18749 1
489 . 1 1 60 60 CYS N N 15 122.268 0.3 . 1 . . . A 60 CYS N . 18749 1
490 . 1 1 61 61 ARG H H 1 7.265 0.04 . 1 . . . A 61 ARG H . 18749 1
491 . 1 1 61 61 ARG HA H 1 3.895 0.04 . 1 . . . A 61 ARG HA . 18749 1
492 . 1 1 61 61 ARG HG2 H 1 1.623 0.04 . 2 . . . A 61 ARG HG2 . 18749 1
493 . 1 1 61 61 ARG HG3 H 1 1.623 0.04 . 2 . . . A 61 ARG HG3 . 18749 1
494 . 1 1 61 61 ARG HD2 H 1 3.069 0.04 . 2 . . . A 61 ARG HD2 . 18749 1
495 . 1 1 61 61 ARG HD3 H 1 3.069 0.04 . 2 . . . A 61 ARG HD3 . 18749 1
496 . 1 1 61 61 ARG C C 13 176.965 0.5 . 1 . . . A 61 ARG C . 18749 1
497 . 1 1 61 61 ARG CA C 13 58.3355 0.5 . 1 . . . A 61 ARG CA . 18749 1
498 . 1 1 61 61 ARG CB C 13 29.7715 0.5 . 1 . . . A 61 ARG CB . 18749 1
499 . 1 1 61 61 ARG CG C 13 27.378 0.5 . 1 . . . A 61 ARG CG . 18749 1
500 . 1 1 61 61 ARG CD C 13 43.319 0.5 . 1 . . . A 61 ARG CD . 18749 1
501 . 1 1 61 61 ARG N N 15 116.449 0.3 . 1 . . . A 61 ARG N . 18749 1
502 . 1 1 62 62 TYR H H 1 7.259 0.04 . 1 . . . A 62 TYR H . 18749 1
503 . 1 1 62 62 TYR HA H 1 4.469 0.04 . 1 . . . A 62 TYR HA . 18749 1
504 . 1 1 62 62 TYR HB2 H 1 2.955 0.04 . 2 . . . A 62 TYR HB2 . 18749 1
505 . 1 1 62 62 TYR HB3 H 1 2.778 0.04 . 2 . . . A 62 TYR HB3 . 18749 1
506 . 1 1 62 62 TYR C C 13 175.562 0.5 . 1 . . . A 62 TYR C . 18749 1
507 . 1 1 62 62 TYR CA C 13 58.5655 0.5 . 1 . . . A 62 TYR CA . 18749 1
508 . 1 1 62 62 TYR CB C 13 39.18175 0.5 . 1 . . . A 62 TYR CB . 18749 1
509 . 1 1 62 62 TYR N N 15 117.341 0.3 . 1 . . . A 62 TYR N . 18749 1
510 . 1 1 63 63 GLN H H 1 7.856 0.04 . 1 . . . A 63 GLN H . 18749 1
511 . 1 1 63 63 GLN HA H 1 4.2105 0.04 . 1 . . . A 63 GLN HA . 18749 1
512 . 1 1 63 63 GLN HB2 H 1 1.706 0.04 . 2 . . . A 63 GLN HB2 . 18749 1
513 . 1 1 63 63 GLN HB3 H 1 1.358 0.04 . 2 . . . A 63 GLN HB3 . 18749 1
514 . 1 1 63 63 GLN HG2 H 1 2.006 0.04 . 2 . . . A 63 GLN HG2 . 18749 1
515 . 1 1 63 63 GLN HG3 H 1 2.006 0.04 . 2 . . . A 63 GLN HG3 . 18749 1
516 . 1 1 63 63 GLN C C 13 173.076 0.5 . 1 . . . A 63 GLN C . 18749 1
517 . 1 1 63 63 GLN CA C 13 54.492 0.5 . 1 . . . A 63 GLN CA . 18749 1
518 . 1 1 63 63 GLN CB C 13 29.4015 0.5 . 1 . . . A 63 GLN CB . 18749 1
519 . 1 1 63 63 GLN CG C 13 33.812 0.5 . 1 . . . A 63 GLN CG . 18749 1
520 . 1 1 63 63 GLN N N 15 121.663 0.3 . 1 . . . A 63 GLN N . 18749 1
521 . 1 1 64 64 LYS H H 1 8.204 0.04 . 1 . . . A 64 LYS H . 18749 1
522 . 1 1 64 64 LYS HA H 1 4.301 0.04 . 1 . . . A 64 LYS HA . 18749 1
523 . 1 1 64 64 LYS HB2 H 1 1.732 0.04 . 2 . . . A 64 LYS HB2 . 18749 1
524 . 1 1 64 64 LYS HB3 H 1 1.732 0.04 . 2 . . . A 64 LYS HB3 . 18749 1
525 . 1 1 64 64 LYS HD2 H 1 1.399 0.04 . 2 . . . A 64 LYS HD2 . 18749 1
526 . 1 1 64 64 LYS HD3 H 1 1.399 0.04 . 2 . . . A 64 LYS HD3 . 18749 1
527 . 1 1 64 64 LYS C C 13 177.301 0.5 . 1 . . . A 64 LYS C . 18749 1
528 . 1 1 64 64 LYS CA C 13 58.18175 0.5 . 1 . . . A 64 LYS CA . 18749 1
529 . 1 1 64 64 LYS CB C 13 32.5135 0.5 . 1 . . . A 64 LYS CB . 18749 1
530 . 1 1 64 64 LYS CG C 13 24.642 0.5 . 1 . . . A 64 LYS CG . 18749 1
531 . 1 1 64 64 LYS CD C 13 29.546 0.5 . 1 . . . A 64 LYS CD . 18749 1
532 . 1 1 64 64 LYS N N 15 127.668 0.3 . 1 . . . A 64 LYS N . 18749 1
533 . 1 1 65 65 ASP H H 1 8.677 0.04 . 1 . . . A 65 ASP H . 18749 1
534 . 1 1 65 65 ASP HB2 H 1 2.5175 0.04 . 2 . . . A 65 ASP HB2 . 18749 1
535 . 1 1 65 65 ASP HB3 H 1 2.265 0.04 . 2 . . . A 65 ASP HB3 . 18749 1
536 . 1 1 65 65 ASP C C 13 174.529 0.5 . 1 . . . A 65 ASP C . 18749 1
537 . 1 1 65 65 ASP CA C 13 53.23175 0.5 . 1 . . . A 65 ASP CA . 18749 1
538 . 1 1 65 65 ASP CB C 13 41.22225 0.5 . 1 . . . A 65 ASP CB . 18749 1
539 . 1 1 65 65 ASP N N 15 131.04 0.3 . 1 . . . A 65 ASP N . 18749 1
540 . 1 1 66 66 LEU H H 1 8.733 0.04 . 1 . . . A 66 LEU H . 18749 1
541 . 1 1 66 66 LEU HA H 1 4.088 0.04 . 1 . . . A 66 LEU HA . 18749 1
542 . 1 1 66 66 LEU HB2 H 1 1.764 0.04 . 2 . . . A 66 LEU HB2 . 18749 1
543 . 1 1 66 66 LEU HB3 H 1 1.454 0.04 . 2 . . . A 66 LEU HB3 . 18749 1
544 . 1 1 66 66 LEU HD11 H 1 0.953 0.04 . 2 . . . A 66 LEU HD11 . 18749 1
545 . 1 1 66 66 LEU HD12 H 1 0.953 0.04 . 2 . . . A 66 LEU HD12 . 18749 1
546 . 1 1 66 66 LEU HD13 H 1 0.953 0.04 . 2 . . . A 66 LEU HD13 . 18749 1
547 . 1 1 66 66 LEU HD21 H 1 0.953 0.04 . 2 . . . A 66 LEU HD21 . 18749 1
548 . 1 1 66 66 LEU HD22 H 1 0.953 0.04 . 2 . . . A 66 LEU HD22 . 18749 1
549 . 1 1 66 66 LEU HD23 H 1 0.953 0.04 . 2 . . . A 66 LEU HD23 . 18749 1
550 . 1 1 66 66 LEU C C 13 178.676 0.5 . 1 . . . A 66 LEU C . 18749 1
551 . 1 1 66 66 LEU CA C 13 57.83575 0.5 . 1 . . . A 66 LEU CA . 18749 1
552 . 1 1 66 66 LEU CB C 13 43.196 0.5 . 1 . . . A 66 LEU CB . 18749 1
553 . 1 1 66 66 LEU CD1 C 13 25.628 0.5 . 2 . . . A 66 LEU CD1 . 18749 1
554 . 1 1 66 66 LEU CD2 C 13 25.628 0.5 . 2 . . . A 66 LEU CD2 . 18749 1
555 . 1 1 66 66 LEU N N 15 125.688 0.3 . 1 . . . A 66 LEU N . 18749 1
556 . 1 1 67 67 ALA H H 1 8.076 0.04 . 1 . . . A 67 ALA H . 18749 1
557 . 1 1 67 67 ALA HB1 H 1 1.388 0.04 . 1 . . . A 67 ALA HB1 . 18749 1
558 . 1 1 67 67 ALA HB2 H 1 1.388 0.04 . 1 . . . A 67 ALA HB2 . 18749 1
559 . 1 1 67 67 ALA HB3 H 1 1.388 0.04 . 1 . . . A 67 ALA HB3 . 18749 1
560 . 1 1 67 67 ALA C C 13 180.513 0.5 . 1 . . . A 67 ALA C . 18749 1
561 . 1 1 67 67 ALA CA C 13 55.1505 0.5 . 1 . . . A 67 ALA CA . 18749 1
562 . 1 1 67 67 ALA CB C 13 18.11825 0.5 . 1 . . . A 67 ALA CB . 18749 1
563 . 1 1 67 67 ALA N N 15 119.916 0.3 . 1 . . . A 67 ALA N . 18749 1
564 . 1 1 68 68 ILE H H 1 7.342 0.04 . 1 . . . A 68 ILE H . 18749 1
565 . 1 1 68 68 ILE HA H 1 3.6595 0.04 . 1 . . . A 68 ILE HA . 18749 1
566 . 1 1 68 68 ILE HG12 H 1 1.194 0.04 . 2 . . . A 68 ILE HG12 . 18749 1
567 . 1 1 68 68 ILE HG13 H 1 0.953 0.04 . 2 . . . A 68 ILE HG13 . 18749 1
568 . 1 1 68 68 ILE HG21 H 1 0.65 0.04 . 1 . . . A 68 ILE HG21 . 18749 1
569 . 1 1 68 68 ILE HG22 H 1 0.65 0.04 . 1 . . . A 68 ILE HG22 . 18749 1
570 . 1 1 68 68 ILE HG23 H 1 0.65 0.04 . 1 . . . A 68 ILE HG23 . 18749 1
571 . 1 1 68 68 ILE HD11 H 1 0.212 0.04 . 1 . . . A 68 ILE HD11 . 18749 1
572 . 1 1 68 68 ILE HD12 H 1 0.212 0.04 . 1 . . . A 68 ILE HD12 . 18749 1
573 . 1 1 68 68 ILE HD13 H 1 0.212 0.04 . 1 . . . A 68 ILE HD13 . 18749 1
574 . 1 1 68 68 ILE C C 13 177.647 0.5 . 1 . . . A 68 ILE C . 18749 1
575 . 1 1 68 68 ILE CA C 13 63.2675 0.5 . 1 . . . A 68 ILE CA . 18749 1
576 . 1 1 68 68 ILE CB C 13 37.338 0.5 . 1 . . . A 68 ILE CB . 18749 1
577 . 1 1 68 68 ILE CG1 C 13 29.063 0.5 . 1 . . . A 68 ILE CG1 . 18749 1
578 . 1 1 68 68 ILE N N 15 119.735 0.3 . 1 . . . A 68 ILE N . 18749 1
579 . 1 1 69 69 HIS H H 1 6.608 0.04 . 1 . . . A 69 HIS H . 18749 1
580 . 1 1 69 69 HIS HA H 1 4.303 0.04 . 1 . . . A 69 HIS HA . 18749 1
581 . 1 1 69 69 HIS CA C 13 59.224 0.5 . 1 . . . A 69 HIS CA . 18749 1
582 . 1 1 69 69 HIS CB C 13 28.569 0.5 . 1 . . . A 69 HIS CB . 18749 1
583 . 1 1 69 69 HIS N N 15 119.542 0.3 . 1 . . . A 69 HIS N . 18749 1
584 . 1 1 84 84 GLY HA2 H 1 3.948 0.04 . 2 . . . A 84 GLY HA2 . 18749 1
585 . 1 1 84 84 GLY HA3 H 1 3.948 0.04 . 2 . . . A 84 GLY HA3 . 18749 1
586 . 1 1 84 84 GLY C C 13 174.391 0.5 . 1 . . . A 84 GLY C . 18749 1
587 . 1 1 84 84 GLY CA C 13 45.472 0.5 . 1 . . . A 84 GLY CA . 18749 1
588 . 1 1 85 85 THR H H 1 8.012 0.04 . 1 . . . A 85 THR H . 18749 1
589 . 1 1 85 85 THR HG21 H 1 1.067 0.04 . 1 . . . A 85 THR HG21 . 18749 1
590 . 1 1 85 85 THR HG22 H 1 1.067 0.04 . 1 . . . A 85 THR HG22 . 18749 1
591 . 1 1 85 85 THR HG23 H 1 1.067 0.04 . 1 . . . A 85 THR HG23 . 18749 1
592 . 1 1 85 85 THR C C 13 175.056 0.5 . 1 . . . A 85 THR C . 18749 1
593 . 1 1 85 85 THR CA C 13 61.9805 0.5 . 1 . . . A 85 THR CA . 18749 1
594 . 1 1 85 85 THR CB C 13 69.868 0.5 . 1 . . . A 85 THR CB . 18749 1
595 . 1 1 85 85 THR N N 15 112.734 0.3 . 1 . . . A 85 THR N . 18749 1
596 . 1 1 86 86 GLY H H 1 8.276 0.04 . 1 . . . A 86 GLY H . 18749 1
597 . 1 1 86 86 GLY HA2 H 1 3.789 0.04 . 2 . . . A 86 GLY HA2 . 18749 1
598 . 1 1 86 86 GLY HA3 H 1 3.789 0.04 . 2 . . . A 86 GLY HA3 . 18749 1
599 . 1 1 86 86 GLY C C 13 172.909 0.5 . 1 . . . A 86 GLY C . 18749 1
600 . 1 1 86 86 GLY CA C 13 45.26775 0.5 . 1 . . . A 86 GLY CA . 18749 1
601 . 1 1 86 86 GLY N N 15 111.173 0.3 . 1 . . . A 86 GLY N . 18749 1
602 . 1 1 87 87 TYR H H 1 7.541 0.04 . 1 . . . A 87 TYR H . 18749 1
603 . 1 1 87 87 TYR HA H 1 4.335 0.04 . 1 . . . A 87 TYR HA . 18749 1
604 . 1 1 87 87 TYR HB2 H 1 2.983 0.04 . 2 . . . A 87 TYR HB2 . 18749 1
605 . 1 1 87 87 TYR HB3 H 1 2.802 0.04 . 2 . . . A 87 TYR HB3 . 18749 1
606 . 1 1 87 87 TYR CA C 13 59.109 0.5 . 1 . . . A 87 TYR CA . 18749 1
607 . 1 1 87 87 TYR CB C 13 39.454 0.5 . 1 . . . A 87 TYR CB . 18749 1
608 . 1 1 87 87 TYR N N 15 124.767 0.3 . 1 . . . A 87 TYR N . 18749 1
stop_
save_