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 17033
_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 '2D 1H-15N HSQC' . . . 17033 1
3 '2D 1H-13C HSQC' . . . 17033 1
5 '2D 1H-13C HSQC' . . . 17033 1
6 '3D CBCA(CO)NH' . . . 17033 1
7 '3D HNCO' . . . 17033 1
8 '3D HNCA' . . . 17033 1
9 '3D HNCACB' . . . 17033 1
10 '3D HBHA(CO)NH' . . . 17033 1
11 '3D C(CO)NH-TOCSY' . . . 17033 1
12 '3D CCH-TOCSY' . . . 17033 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
4 $PINE . . 17033 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 9 9 SER HA H 1 4.310 0.06 . 1 . . . . 9 Ser HA . 17033 1
2 . 1 1 9 9 SER HB2 H 1 3.670 0.06 . 1 . . . . 9 Ser HB2 . 17033 1
3 . 1 1 9 9 SER CA C 13 59.224 0.55 . 1 . . . . 9 Ser CA . 17033 1
4 . 1 1 9 9 SER CB C 13 63.884 0.55 . 1 . . . . 9 Ser CB . 17033 1
5 . 1 1 10 10 HIS H H 1 8.770 0.06 . 1 . . . . 10 His H . 17033 1
6 . 1 1 10 10 HIS HA H 1 4.995 0.06 . 1 . . . . 10 His HA . 17033 1
7 . 1 1 10 10 HIS HB2 H 1 3.228 0.06 . 2 . . . . 10 His HB2 . 17033 1
8 . 1 1 10 10 HIS HB3 H 1 3.228 0.06 . 2 . . . . 10 His HB3 . 17033 1
9 . 1 1 10 10 HIS CA C 13 54.495 0.55 . 1 . . . . 10 His CA . 17033 1
10 . 1 1 10 10 HIS CB C 13 30.327 0.55 . 1 . . . . 10 His CB . 17033 1
11 . 1 1 10 10 HIS N N 15 123.239 0.55 . 1 . . . . 10 His N . 17033 1
12 . 1 1 11 11 MET H H 1 7.861 0.06 . 1 . . . . 11 Met H . 17033 1
13 . 1 1 11 11 MET CA C 13 55.79 0.55 . 1 . . . . 11 Met CA . 17033 1
14 . 1 1 11 11 MET N N 15 120.394 0.55 . 1 . . . . 11 Met N . 17033 1
15 . 1 1 12 12 VAL HA H 1 4.904 0.06 . 1 . . . . 12 Val HA . 17033 1
16 . 1 1 12 12 VAL HB H 1 2.109 0.06 . 1 . . . . 12 Val HB . 17033 1
17 . 1 1 12 12 VAL HG11 H 1 0.911 0.06 . 2 . . . . 12 Val HG1 . 17033 1
18 . 1 1 12 12 VAL HG12 H 1 0.911 0.06 . 2 . . . . 12 Val HG1 . 17033 1
19 . 1 1 12 12 VAL HG13 H 1 0.911 0.06 . 2 . . . . 12 Val HG1 . 17033 1
20 . 1 1 12 12 VAL HG21 H 1 0.975 0.06 . 2 . . . . 12 Val HG2 . 17033 1
21 . 1 1 12 12 VAL HG22 H 1 0.975 0.06 . 2 . . . . 12 Val HG2 . 17033 1
22 . 1 1 12 12 VAL HG23 H 1 0.975 0.06 . 2 . . . . 12 Val HG2 . 17033 1
23 . 1 1 12 12 VAL CA C 13 60.411 0.55 . 1 . . . . 12 Val CA . 17033 1
24 . 1 1 12 12 VAL CB C 13 34.556 0.55 . 1 . . . . 12 Val CB . 17033 1
25 . 1 1 12 12 VAL CG1 C 13 22.58 0.55 . 2 . . . . 12 Val CG1 . 17033 1
26 . 1 1 12 12 VAL CG2 C 13 22.37 0.55 . 2 . . . . 12 Val CG2 . 17033 1
27 . 1 1 13 13 VAL H H 1 9.026 0.06 . 1 . . . . 13 Val H . 17033 1
28 . 1 1 13 13 VAL HA H 1 5.06 0.06 . 1 . . . . 13 Val HA . 17033 1
29 . 1 1 13 13 VAL HB H 1 1.769 0.06 . 1 . . . . 13 Val HB . 17033 1
30 . 1 1 13 13 VAL HG11 H 1 0.48 0.06 . 2 . . . . 13 Val HG1 . 17033 1
31 . 1 1 13 13 VAL HG12 H 1 0.48 0.06 . 2 . . . . 13 Val HG1 . 17033 1
32 . 1 1 13 13 VAL HG13 H 1 0.48 0.06 . 2 . . . . 13 Val HG1 . 17033 1
33 . 1 1 13 13 VAL HG21 H 1 0.788 0.06 . 2 . . . . 13 Val HG2 . 17033 1
34 . 1 1 13 13 VAL HG22 H 1 0.788 0.06 . 2 . . . . 13 Val HG2 . 17033 1
35 . 1 1 13 13 VAL HG23 H 1 0.788 0.06 . 2 . . . . 13 Val HG2 . 17033 1
36 . 1 1 13 13 VAL CA C 13 58.791 0.55 . 1 . . . . 13 Val CA . 17033 1
37 . 1 1 13 13 VAL CB C 13 35.292 0.55 . 1 . . . . 13 Val CB . 17033 1
38 . 1 1 13 13 VAL CG1 C 13 21.89 0.55 . 2 . . . . 13 Val CG1 . 17033 1
39 . 1 1 13 13 VAL CG2 C 13 20.48 0.55 . 2 . . . . 13 Val CG2 . 17033 1
40 . 1 1 13 13 VAL N N 15 123.517 0.55 . 1 . . . . 13 Val N . 17033 1
41 . 1 1 14 14 ILE H H 1 8.995 0.06 . 1 . . . . 14 Ile H . 17033 1
42 . 1 1 14 14 ILE HA H 1 5.264 0.06 . 1 . . . . 14 Ile HA . 17033 1
43 . 1 1 14 14 ILE HB H 1 1.669 0.06 . 1 . . . . 14 Ile HB . 17033 1
44 . 1 1 14 14 ILE HD11 H 1 0.781 0.06 . 1 . . . . 14 Ile HD1 . 17033 1
45 . 1 1 14 14 ILE HD12 H 1 0.781 0.06 . 1 . . . . 14 Ile HD1 . 17033 1
46 . 1 1 14 14 ILE HD13 H 1 0.781 0.06 . 1 . . . . 14 Ile HD1 . 17033 1
47 . 1 1 14 14 ILE HG12 H 1 1.629 0.06 . 2 . . . . 14 Ile HG12 . 17033 1
48 . 1 1 14 14 ILE HG13 H 1 1.008 0.06 . 2 . . . . 14 Ile HG13 . 17033 1
49 . 1 1 14 14 ILE HG21 H 1 0.938 0.06 . 1 . . . . 14 Ile HG2 . 17033 1
50 . 1 1 14 14 ILE HG22 H 1 0.938 0.06 . 1 . . . . 14 Ile HG2 . 17033 1
51 . 1 1 14 14 ILE HG23 H 1 0.938 0.06 . 1 . . . . 14 Ile HG2 . 17033 1
52 . 1 1 14 14 ILE CA C 13 59.0 0.55 . 1 . . . . 14 Ile CA . 17033 1
53 . 1 1 14 14 ILE CB C 13 40.39 0.55 . 1 . . . . 14 Ile CB . 17033 1
54 . 1 1 14 14 ILE CD1 C 13 14.8 0.55 . 1 . . . . 14 Ile CD1 . 17033 1
55 . 1 1 14 14 ILE CG1 C 13 28.041 0.55 . 1 . . . . 14 Ile CG1 . 17033 1
56 . 1 1 14 14 ILE CG2 C 13 17.116 0.55 . 1 . . . . 14 Ile CG2 . 17033 1
57 . 1 1 14 14 ILE N N 15 125.765 0.55 . 1 . . . . 14 Ile N . 17033 1
58 . 1 1 15 15 ARG H H 1 9.590 0.06 . 1 . . . . 15 Arg H . 17033 1
59 . 1 1 15 15 ARG N N 15 123.550 0.55 . 1 . . . . 15 Arg N . 17033 1
60 . 1 1 16 16 ARG HA H 1 3.17 0.06 . 1 . . . . 16 Arg HA . 17033 1
61 . 1 1 16 16 ARG HB2 H 1 2.06 0.06 . 2 . . . . 16 Arg HB2 . 17033 1
62 . 1 1 16 16 ARG HB3 H 1 2.06 0.06 . 2 . . . . 16 Arg HB3 . 17033 1
63 . 1 1 16 16 ARG HD2 H 1 2.7 0.06 . 2 . . . . 16 Arg HD2 . 17033 1
64 . 1 1 16 16 ARG HD3 H 1 2.7 0.06 . 2 . . . . 16 Arg HD3 . 17033 1
65 . 1 1 16 16 ARG HG2 H 1 0.98 0.06 . 2 . . . . 16 Arg HG2 . 17033 1
66 . 1 1 16 16 ARG HG3 H 1 0.98 0.06 . 2 . . . . 16 Arg HG3 . 17033 1
67 . 1 1 16 16 ARG CA C 13 57.06 0.55 . 1 . . . . 16 Arg CA . 17033 1
68 . 1 1 16 16 ARG CB C 13 28.5 0.55 . 1 . . . . 16 Arg CB . 17033 1
69 . 1 1 16 16 ARG CD C 13 43.39 0.55 . 1 . . . . 16 Arg CD . 17033 1
70 . 1 1 16 16 ARG CG C 13 28.5 0.55 . 1 . . . . 16 Arg CG . 17033 1
71 . 1 1 17 17 LEU H H 1 7.47 0.06 . 1 . . . . 17 Leu H . 17033 1
72 . 1 1 17 17 LEU HA H 1 4.41 0.06 . 1 . . . . 17 Leu HA . 17033 1
73 . 1 1 17 17 LEU HB2 H 1 1.67 0.06 . 2 . . . . 17 Leu HB2 . 17033 1
74 . 1 1 17 17 LEU HB3 H 1 1.67 0.06 . 2 . . . . 17 Leu HB3 . 17033 1
75 . 1 1 17 17 LEU HD11 H 1 0.043 0.06 . 2 . . . . 17 Leu HD1 . 17033 1
76 . 1 1 17 17 LEU HD12 H 1 0.043 0.06 . 2 . . . . 17 Leu HD1 . 17033 1
77 . 1 1 17 17 LEU HD13 H 1 0.043 0.06 . 2 . . . . 17 Leu HD1 . 17033 1
78 . 1 1 17 17 LEU HD21 H 1 0.043 0.06 . 2 . . . . 17 Leu HD2 . 17033 1
79 . 1 1 17 17 LEU HD22 H 1 0.043 0.06 . 2 . . . . 17 Leu HD2 . 17033 1
80 . 1 1 17 17 LEU HD23 H 1 0.043 0.06 . 2 . . . . 17 Leu HD2 . 17033 1
81 . 1 1 17 17 LEU HG H 1 0.45 0.06 . 1 . . . . 17 Leu HG . 17033 1
82 . 1 1 17 17 LEU CA C 13 52.59 0.55 . 1 . . . . 17 Leu CA . 17033 1
83 . 1 1 17 17 LEU CB C 13 40.4 0.55 . 1 . . . . 17 Leu CB . 17033 1
84 . 1 1 17 17 LEU CD1 C 13 22.05 0.55 . 2 . . . . 17 Leu CD1 . 17033 1
85 . 1 1 17 17 LEU CD2 C 13 22.05 0.55 . 2 . . . . 17 Leu CD2 . 17033 1
86 . 1 1 17 17 LEU CG C 13 26.2 0.55 . 1 . . . . 17 Leu CG . 17033 1
87 . 1 1 17 17 LEU N N 15 116 0.55 . 1 . . . . 17 Leu N . 17033 1
88 . 1 1 19 19 PRO HA H 1 4.247 0.06 . 1 . . . . 19 Pro HA . 17033 1
89 . 1 1 19 19 PRO HB2 H 1 1.92 0.06 . 2 . . . . 19 Pro HB2 . 17033 1
90 . 1 1 19 19 PRO HB3 H 1 1.92 0.06 . 2 . . . . 19 Pro HB3 . 17033 1
91 . 1 1 19 19 PRO CA C 13 63.866 0.55 . 1 . . . . 19 Pro CA . 17033 1
92 . 1 1 19 19 PRO CB C 13 31.461 0.55 . 1 . . . . 19 Pro CB . 17033 1
93 . 1 1 20 20 GLY H H 1 8.696 0.06 . 1 . . . . 20 Gly H . 17033 1
94 . 1 1 20 20 GLY HA2 H 1 4.094 0.06 . 2 . . . . 20 Gly HA2 . 17033 1
95 . 1 1 20 20 GLY HA3 H 1 3.734 0.06 . 2 . . . . 20 Gly HA3 . 17033 1
96 . 1 1 20 20 GLY CA C 13 44.908 0.55 . 1 . . . . 20 Gly CA . 17033 1
97 . 1 1 20 20 GLY N N 15 108.382 0.55 . 1 . . . . 20 Gly N . 17033 1
98 . 1 1 21 21 LEU H H 1 6.830 0.06 . 1 . . . . 21 Leu H . 17033 1
99 . 1 1 21 21 LEU HA H 1 4.315 0.06 . 1 . . . . 21 Leu HA . 17033 1
100 . 1 1 21 21 LEU HB2 H 1 1.683 0.06 . 2 . . . . 21 Leu HB2 . 17033 1
101 . 1 1 21 21 LEU HB3 H 1 1.389 0.06 . 2 . . . . 21 Leu HB3 . 17033 1
102 . 1 1 21 21 LEU HD11 H 1 0.937 0.06 . 2 . . . . 21 Leu HD1 . 17033 1
103 . 1 1 21 21 LEU HD12 H 1 0.937 0.06 . 2 . . . . 21 Leu HD1 . 17033 1
104 . 1 1 21 21 LEU HD13 H 1 0.937 0.06 . 2 . . . . 21 Leu HD1 . 17033 1
105 . 1 1 21 21 LEU HD21 H 1 0.937 0.06 . 2 . . . . 21 Leu HD2 . 17033 1
106 . 1 1 21 21 LEU HD22 H 1 0.937 0.06 . 2 . . . . 21 Leu HD2 . 17033 1
107 . 1 1 21 21 LEU HD23 H 1 0.937 0.06 . 2 . . . . 21 Leu HD2 . 17033 1
108 . 1 1 21 21 LEU HG H 1 0.724 0.06 . 1 . . . . 21 Leu HG . 17033 1
109 . 1 1 21 21 LEU CA C 13 55.24 0.55 . 1 . . . . 21 Leu CA . 17033 1
110 . 1 1 21 21 LEU CB C 13 44.150 0.55 . 1 . . . . 21 Leu CB . 17033 1
111 . 1 1 21 21 LEU CD1 C 13 25.190 0.55 . 2 . . . . 21 Leu CD1 . 17033 1
112 . 1 1 21 21 LEU CD2 C 13 25.19 0.55 . 2 . . . . 21 Leu CD2 . 17033 1
113 . 1 1 21 21 LEU CG C 13 28.1 0.55 . 1 . . . . 21 Leu CG . 17033 1
114 . 1 1 21 21 LEU N N 15 122.077 0.55 . 1 . . . . 21 Leu N . 17033 1
115 . 1 1 22 22 THR H H 1 7.352 0.06 . 1 . . . . 22 Thr H . 17033 1
116 . 1 1 22 22 THR HA H 1 4.433 0.06 . 1 . . . . 22 Thr HA . 17033 1
117 . 1 1 22 22 THR HB H 1 4.433 0.06 . 1 . . . . 22 Thr HB . 17033 1
118 . 1 1 22 22 THR CA C 13 58.892 0.55 . 1 . . . . 22 Thr CA . 17033 1
119 . 1 1 22 22 THR CB C 13 71.894 0.55 . 1 . . . . 22 Thr CB . 17033 1
120 . 1 1 22 22 THR N N 15 111.530 0.55 . 1 . . . . 22 Thr N . 17033 1
121 . 1 1 23 23 LYS H H 1 8.396 0.06 . 1 . . . . 23 Lys H . 17033 1
122 . 1 1 23 23 LYS HA H 1 2.707 0.06 . 1 . . . . 23 Lys HA . 17033 1
123 . 1 1 23 23 LYS HB2 H 1 1.44 0.06 . 2 . . . . 23 Lys HB2 . 17033 1
124 . 1 1 23 23 LYS HB3 H 1 1.44 0.06 . 2 . . . . 23 Lys HB3 . 17033 1
125 . 1 1 23 23 LYS HD2 H 1 1.392 0.06 . 2 . . . . 23 Lys HD2 . 17033 1
126 . 1 1 23 23 LYS HD3 H 1 1.392 0.06 . 2 . . . . 23 Lys HD3 . 17033 1
127 . 1 1 23 23 LYS HE2 H 1 2.184 0.06 . 2 . . . . 23 Lys HE2 . 17033 1
128 . 1 1 23 23 LYS HE3 H 1 2.012 0.06 . 2 . . . . 23 Lys HE3 . 17033 1
129 . 1 1 23 23 LYS HG2 H 1 1.1 0.06 . 2 . . . . 23 Lys HG2 . 17033 1
130 . 1 1 23 23 LYS HG3 H 1 0.652 0.06 . 2 . . . . 23 Lys HG3 . 17033 1
131 . 1 1 23 23 LYS CA C 13 60.071 0.55 . 1 . . . . 23 Lys CA . 17033 1
132 . 1 1 23 23 LYS CB C 13 32.504 0.55 . 1 . . . . 23 Lys CB . 17033 1
133 . 1 1 23 23 LYS CD C 13 29.722 0.55 . 1 . . . . 23 Lys CD . 17033 1
134 . 1 1 23 23 LYS CE C 13 41.58 0.55 . 1 . . . . 23 Lys CE . 17033 1
135 . 1 1 23 23 LYS CG C 13 25.205 0.55 . 1 . . . . 23 Lys CG . 17033 1
136 . 1 1 23 23 LYS N N 15 122.145 0.55 . 1 . . . . 23 Lys N . 17033 1
137 . 1 1 24 24 GLU H H 1 8.519 0.06 . 1 . . . . 24 Glu H . 17033 1
138 . 1 1 24 24 GLU HA H 1 3.974 0.06 . 1 . . . . 24 Glu HA . 17033 1
139 . 1 1 24 24 GLU HB2 H 1 1.947 0.06 . 2 . . . . 24 Glu HB2 . 17033 1
140 . 1 1 24 24 GLU HB3 H 1 1.844 0.06 . 2 . . . . 24 Glu HB3 . 17033 1
141 . 1 1 24 24 GLU HG2 H 1 2.387 0.06 . 2 . . . . 24 Glu HG2 . 17033 1
142 . 1 1 24 24 GLU HG3 H 1 2.182 0.06 . 2 . . . . 24 Glu HG3 . 17033 1
143 . 1 1 24 24 GLU CA C 13 60.273 0.55 . 1 . . . . 24 Glu CA . 17033 1
144 . 1 1 24 24 GLU CB C 13 28.758 0.55 . 1 . . . . 24 Glu CB . 17033 1
145 . 1 1 24 24 GLU CG C 13 37.38 0.55 . 1 . . . . 24 Glu CG . 17033 1
146 . 1 1 24 24 GLU N N 15 116.344 0.55 . 1 . . . . 24 Glu N . 17033 1
147 . 1 1 25 25 GLN H H 1 7.489 0.06 . 1 . . . . 25 Gln H . 17033 1
148 . 1 1 25 25 GLN HA H 1 4.09 0.06 . 1 . . . . 25 Gln HA . 17033 1
149 . 1 1 25 25 GLN HB2 H 1 2.17 0.06 . 2 . . . . 25 Gln HB2 . 17033 1
150 . 1 1 25 25 GLN HB3 H 1 1.925 0.06 . 2 . . . . 25 Gln HB3 . 17033 1
151 . 1 1 25 25 GLN HE21 H 1 7.43 0.06 . 2 . . . . 25 Gln HE21 . 17033 1
152 . 1 1 25 25 GLN HE22 H 1 6.7 0.06 . 2 . . . . 25 Gln HE22 . 17033 1
153 . 1 1 25 25 GLN HG2 H 1 2.4 0.06 . 2 . . . . 25 Gln HG2 . 17033 1
154 . 1 1 25 25 GLN HG3 H 1 2.4 0.06 . 2 . . . . 25 Gln HG3 . 17033 1
155 . 1 1 25 25 GLN CA C 13 58.200 0.55 . 1 . . . . 25 Gln CA . 17033 1
156 . 1 1 25 25 GLN CB C 13 29.3 0.55 . 1 . . . . 25 Gln CB . 17033 1
157 . 1 1 25 25 GLN CG C 13 34.45 0.55 . 1 . . . . 25 Gln CG . 17033 1
158 . 1 1 25 25 GLN N N 15 119.290 0.55 . 1 . . . . 25 Gln N . 17033 1
159 . 1 1 25 25 GLN NE2 N 15 110.2 0.55 . 1 . . . . 25 Gln NE2 . 17033 1
160 . 1 1 26 26 LEU H H 1 8.113 0.06 . 1 . . . . 26 Leu H . 17033 1
161 . 1 1 26 26 LEU HA H 1 4.045 0.06 . 1 . . . . 26 Leu HA . 17033 1
162 . 1 1 26 26 LEU HB2 H 1 1.977 0.06 . 2 . . . . 26 Leu HB2 . 17033 1
163 . 1 1 26 26 LEU HB3 H 1 1.196 0.06 . 2 . . . . 26 Leu HB3 . 17033 1
164 . 1 1 26 26 LEU HD11 H 1 0.75 0.06 . 2 . . . . 26 Leu HD1 . 17033 1
165 . 1 1 26 26 LEU HD12 H 1 0.75 0.06 . 2 . . . . 26 Leu HD1 . 17033 1
166 . 1 1 26 26 LEU HD13 H 1 0.75 0.06 . 2 . . . . 26 Leu HD1 . 17033 1
167 . 1 1 26 26 LEU HD21 H 1 0.75 0.06 . 2 . . . . 26 Leu HD2 . 17033 1
168 . 1 1 26 26 LEU HD22 H 1 0.75 0.06 . 2 . . . . 26 Leu HD2 . 17033 1
169 . 1 1 26 26 LEU HD23 H 1 0.75 0.06 . 2 . . . . 26 Leu HD2 . 17033 1
170 . 1 1 26 26 LEU HG H 1 0.858 0.06 . 1 . . . . 26 Leu HG . 17033 1
171 . 1 1 26 26 LEU CA C 13 58.14 0.55 . 1 . . . . 26 Leu CA . 17033 1
172 . 1 1 26 26 LEU CB C 13 40.706 0.55 . 1 . . . . 26 Leu CB . 17033 1
173 . 1 1 26 26 LEU CD1 C 13 23.82 0.55 . 2 . . . . 26 Leu CD1 . 17033 1
174 . 1 1 26 26 LEU CD2 C 13 23.82 0.55 . 2 . . . . 26 Leu CD2 . 17033 1
175 . 1 1 26 26 LEU CG C 13 27.57 0.55 . 1 . . . . 26 Leu CG . 17033 1
176 . 1 1 26 26 LEU N N 15 120.572 0.55 . 1 . . . . 26 Leu N . 17033 1
177 . 1 1 27 27 GLU H H 1 8.730 0.06 . 1 . . . . 27 Glu H . 17033 1
178 . 1 1 27 27 GLU HA H 1 3.516 0.06 . 1 . . . . 27 Glu HA . 17033 1
179 . 1 1 27 27 GLU HB2 H 1 2.033 0.06 . 2 . . . . 27 Glu HB2 . 17033 1
180 . 1 1 27 27 GLU HB3 H 1 2.033 0.06 . 2 . . . . 27 Glu HB3 . 17033 1
181 . 1 1 27 27 GLU HG2 H 1 2.29 0.06 . 2 . . . . 27 Glu HG2 . 17033 1
182 . 1 1 27 27 GLU HG3 H 1 2.027 0.06 . 2 . . . . 27 Glu HG3 . 17033 1
183 . 1 1 27 27 GLU CA C 13 60.984 0.55 . 1 . . . . 27 Glu CA . 17033 1
184 . 1 1 27 27 GLU CB C 13 29.548 0.55 . 1 . . . . 27 Glu CB . 17033 1
185 . 1 1 27 27 GLU CG C 13 37.140 0.55 . 1 . . . . 27 Glu CG . 17033 1
186 . 1 1 27 27 GLU N N 15 118.183 0.55 . 1 . . . . 27 Glu N . 17033 1
187 . 1 1 28 28 GLU H H 1 7.550 0.06 . 1 . . . . 28 Glu H . 17033 1
188 . 1 1 28 28 GLU HA H 1 3.92 0.06 . 1 . . . . 28 Glu HA . 17033 1
189 . 1 1 28 28 GLU HB2 H 1 2.151 0.06 . 2 . . . . 28 Glu HB2 . 17033 1
190 . 1 1 28 28 GLU HB3 H 1 2.08 0.06 . 2 . . . . 28 Glu HB3 . 17033 1
191 . 1 1 28 28 GLU HG2 H 1 2.325 0.06 . 2 . . . . 28 Glu HG2 . 17033 1
192 . 1 1 28 28 GLU HG3 H 1 2.277 0.06 . 2 . . . . 28 Glu HG3 . 17033 1
193 . 1 1 28 28 GLU CA C 13 59.278 0.55 . 1 . . . . 28 Glu CA . 17033 1
194 . 1 1 28 28 GLU CB C 13 29.55 0.55 . 1 . . . . 28 Glu CB . 17033 1
195 . 1 1 28 28 GLU CG C 13 35.944 0.55 . 1 . . . . 28 Glu CG . 17033 1
196 . 1 1 28 28 GLU N N 15 115.918 0.55 . 1 . . . . 28 Glu N . 17033 1
197 . 1 1 29 29 GLN H H 1 7.481 0.06 . 1 . . . . 29 Gln H . 17033 1
198 . 1 1 29 29 GLN HA H 1 4.208 0.06 . 1 . . . . 29 Gln HA . 17033 1
199 . 1 1 29 29 GLN HB2 H 1 2.203 0.06 . 2 . . . . 29 Gln HB2 . 17033 1
200 . 1 1 29 29 GLN HB3 H 1 2.133 0.06 . 2 . . . . 29 Gln HB3 . 17033 1
201 . 1 1 29 29 GLN HE21 H 1 7.56 0.06 . 2 . . . . 29 Gln HE21 . 17033 1
202 . 1 1 29 29 GLN HE22 H 1 7.12 0.06 . 2 . . . . 29 Gln HE22 . 17033 1
203 . 1 1 29 29 GLN HG2 H 1 2.598 0.06 . 2 . . . . 29 Gln HG2 . 17033 1
204 . 1 1 29 29 GLN HG3 H 1 2.521 0.06 . 2 . . . . 29 Gln HG3 . 17033 1
205 . 1 1 29 29 GLN CA C 13 57.584 0.55 . 1 . . . . 29 Gln CA . 17033 1
206 . 1 1 29 29 GLN CB C 13 29.587 0.55 . 1 . . . . 29 Gln CB . 17033 1
207 . 1 1 29 29 GLN CG C 13 34.484 0.55 . 1 . . . . 29 Gln CG . 17033 1
208 . 1 1 29 29 GLN N N 15 115.680 0.55 . 1 . . . . 29 Gln N . 17033 1
209 . 1 1 29 29 GLN NE2 N 15 112.9 0.55 . 1 . . . . 29 Gln NE2 . 17033 1
210 . 1 1 30 30 LEU H H 1 7.594 0.06 . 1 . . . . 30 Leu H . 17033 1
211 . 1 1 30 30 LEU HA H 1 4.139 0.06 . 1 . . . . 30 Leu HA . 17033 1
212 . 1 1 30 30 LEU HB2 H 1 1.481 0.06 . 2 . . . . 30 Leu HB2 . 17033 1
213 . 1 1 30 30 LEU HB3 H 1 1.326 0.06 . 2 . . . . 30 Leu HB3 . 17033 1
214 . 1 1 30 30 LEU HD11 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD1 . 17033 1
215 . 1 1 30 30 LEU HD12 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD1 . 17033 1
216 . 1 1 30 30 LEU HD13 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD1 . 17033 1
217 . 1 1 30 30 LEU HD21 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD2 . 17033 1
218 . 1 1 30 30 LEU HD22 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD2 . 17033 1
219 . 1 1 30 30 LEU HD23 H 1 -0.23 0.06 . 2 . . . . 30 Leu HD2 . 17033 1
220 . 1 1 30 30 LEU HG H 1 0.488 0.06 . 1 . . . . 30 Leu HG . 17033 1
221 . 1 1 30 30 LEU CA C 13 54.75 0.55 . 1 . . . . 30 Leu CA . 17033 1
222 . 1 1 30 30 LEU CB C 13 42.377 0.55 . 1 . . . . 30 Leu CB . 17033 1
223 . 1 1 30 30 LEU CD1 C 13 20.582 0.55 . 2 . . . . 30 Leu CD1 . 17033 1
224 . 1 1 30 30 LEU CD2 C 13 20.582 0.55 . 2 . . . . 30 Leu CD2 . 17033 1
225 . 1 1 30 30 LEU CG C 13 25.89 0.55 . 1 . . . . 30 Leu CG . 17033 1
226 . 1 1 30 30 LEU N N 15 116.083 0.55 . 1 . . . . 30 Leu N . 17033 1
227 . 1 1 31 31 ARG H H 1 7.117 0.06 . 1 . . . . 31 Arg H . 17033 1
228 . 1 1 31 31 ARG HA H 1 4.241 0.06 . 1 . . . . 31 Arg HA . 17033 1
229 . 1 1 31 31 ARG HB2 H 1 1.938 0.06 . 2 . . . . 31 Arg HB2 . 17033 1
230 . 1 1 31 31 ARG HB3 H 1 1.78 0.06 . 2 . . . . 31 Arg HB3 . 17033 1
231 . 1 1 31 31 ARG HD2 H 1 3.211 0.06 . 2 . . . . 31 Arg HD2 . 17033 1
232 . 1 1 31 31 ARG HD3 H 1 3.18 0.06 . 2 . . . . 31 Arg HD3 . 17033 1
233 . 1 1 31 31 ARG HG2 H 1 1.85 0.06 . 2 . . . . 31 Arg HG2 . 17033 1
234 . 1 1 31 31 ARG HG3 H 1 1.649 0.06 . 2 . . . . 31 Arg HG3 . 17033 1
235 . 1 1 31 31 ARG CA C 13 55.36 0.55 . 1 . . . . 31 Arg CA . 17033 1
236 . 1 1 31 31 ARG CB C 13 30.422 0.55 . 1 . . . . 31 Arg CB . 17033 1
237 . 1 1 31 31 ARG CD C 13 43.9 0.55 . 1 . . . . 31 Arg CD . 17033 1
238 . 1 1 31 31 ARG CG C 13 26.5 0.55 . 1 . . . . 31 Arg CG . 17033 1
239 . 1 1 31 31 ARG N N 15 117.111 0.55 . 1 . . . . 31 Arg N . 17033 1
240 . 1 1 32 32 PRO HA H 1 4.64 0.06 . 1 . . . . 32 Pro HA . 17033 1
241 . 1 1 32 32 PRO HB2 H 1 2.27 0.06 . 2 . . . . 32 Pro HB2 . 17033 1
242 . 1 1 32 32 PRO HB3 H 1 2.027 0.06 . 2 . . . . 32 Pro HB3 . 17033 1
243 . 1 1 32 32 PRO HD2 H 1 3.669 0.06 . 2 . . . . 32 Pro HD2 . 17033 1
244 . 1 1 32 32 PRO HD3 H 1 3.566 0.06 . 2 . . . . 32 Pro HD3 . 17033 1
245 . 1 1 32 32 PRO HG2 H 1 2.162 0.06 . 2 . . . . 32 Pro HG2 . 17033 1
246 . 1 1 32 32 PRO HG3 H 1 1.961 0.06 . 2 . . . . 32 Pro HG3 . 17033 1
247 . 1 1 32 32 PRO CA C 13 61.886 0.55 . 1 . . . . 32 Pro CA . 17033 1
248 . 1 1 32 32 PRO CB C 13 33.350 0.55 . 1 . . . . 32 Pro CB . 17033 1
249 . 1 1 32 32 PRO CD C 13 50.27 0.55 . 1 . . . . 32 Pro CD . 17033 1
250 . 1 1 32 32 PRO CG C 13 24.662 0.55 . 1 . . . . 32 Pro CG . 17033 1
251 . 1 1 33 33 LEU H H 1 9.155 0.06 . 1 . . . . 33 Leu H . 17033 1
252 . 1 1 33 33 LEU HA H 1 4.75 0.06 . 1 . . . . 33 Leu HA . 17033 1
253 . 1 1 33 33 LEU HB2 H 1 1.66 0.06 . 2 . . . . 33 Leu HB2 . 17033 1
254 . 1 1 33 33 LEU HB3 H 1 1.532 0.06 . 2 . . . . 33 Leu HB3 . 17033 1
255 . 1 1 33 33 LEU HD11 H 1 0.570 0.06 . 2 . . . . 33 Leu HD1 . 17033 1
256 . 1 1 33 33 LEU HD12 H 1 0.570 0.06 . 2 . . . . 33 Leu HD1 . 17033 1
257 . 1 1 33 33 LEU HD13 H 1 0.570 0.06 . 2 . . . . 33 Leu HD1 . 17033 1
258 . 1 1 33 33 LEU HD21 H 1 0.533 0.06 . 2 . . . . 33 Leu HD2 . 17033 1
259 . 1 1 33 33 LEU HD22 H 1 0.533 0.06 . 2 . . . . 33 Leu HD2 . 17033 1
260 . 1 1 33 33 LEU HD23 H 1 0.533 0.06 . 2 . . . . 33 Leu HD2 . 17033 1
261 . 1 1 33 33 LEU HG H 1 1.59 0.06 . 1 . . . . 33 Leu HG . 17033 1
262 . 1 1 33 33 LEU CA C 13 53.250 0.55 . 1 . . . . 33 Leu CA . 17033 1
263 . 1 1 33 33 LEU CB C 13 43.314 0.55 . 1 . . . . 33 Leu CB . 17033 1
264 . 1 1 33 33 LEU CD1 C 13 25.7 0.55 . 2 . . . . 33 Leu CD1 . 17033 1
265 . 1 1 33 33 LEU CD2 C 13 25.6 0.55 . 2 . . . . 33 Leu CD2 . 17033 1
266 . 1 1 33 33 LEU CG C 13 27.27 0.55 . 1 . . . . 33 Leu CG . 17033 1
267 . 1 1 33 33 LEU N N 15 129.31 0.55 . 1 . . . . 33 Leu N . 17033 1
268 . 1 1 34 34 PRO HA H 1 4.512 0.06 . 1 . . . . 34 Pro HA . 17033 1
269 . 1 1 34 34 PRO HB2 H 1 2.392 0.06 . 2 . . . . 34 Pro HB2 . 17033 1
270 . 1 1 34 34 PRO HB3 H 1 1.65 0.06 . 2 . . . . 34 Pro HB3 . 17033 1
271 . 1 1 34 34 PRO HD2 H 1 4.249 0.06 . 2 . . . . 34 Pro HD2 . 17033 1
272 . 1 1 34 34 PRO HD3 H 1 3.409 0.06 . 2 . . . . 34 Pro HD3 . 17033 1
273 . 1 1 34 34 PRO HG2 H 1 1.99 0.06 . 2 . . . . 34 Pro HG2 . 17033 1
274 . 1 1 34 34 PRO HG3 H 1 1.99 0.06 . 2 . . . . 34 Pro HG3 . 17033 1
275 . 1 1 34 34 PRO CA C 13 62.030 0.55 . 1 . . . . 34 Pro CA . 17033 1
276 . 1 1 34 34 PRO CB C 13 32.045 0.55 . 1 . . . . 34 Pro CB . 17033 1
277 . 1 1 34 34 PRO CD C 13 50.88 0.55 . 1 . . . . 34 Pro CD . 17033 1
278 . 1 1 34 34 PRO CG C 13 27.61 0.55 . 1 . . . . 34 Pro CG . 17033 1
279 . 1 1 35 35 ALA H H 1 8.643 0.06 . 1 . . . . 35 Ala H . 17033 1
280 . 1 1 35 35 ALA HA H 1 4.25 0.06 . 1 . . . . 35 Ala HA . 17033 1
281 . 1 1 35 35 ALA HB1 H 1 1.409 0.06 . 1 . . . . 35 Ala HB . 17033 1
282 . 1 1 35 35 ALA HB2 H 1 1.409 0.06 . 1 . . . . 35 Ala HB . 17033 1
283 . 1 1 35 35 ALA HB3 H 1 1.409 0.06 . 1 . . . . 35 Ala HB . 17033 1
284 . 1 1 35 35 ALA CA C 13 53.37 0.55 . 1 . . . . 35 Ala CA . 17033 1
285 . 1 1 35 35 ALA CB C 13 18.61 0.55 . 1 . . . . 35 Ala CB . 17033 1
286 . 1 1 35 35 ALA N N 15 122.4 0.55 . 1 . . . . 35 Ala N . 17033 1
287 . 1 1 36 36 HIS H H 1 8.412 0.06 . 1 . . . . 36 His H . 17033 1
288 . 1 1 36 36 HIS HA H 1 5.251 0.06 . 1 . . . . 36 His HA . 17033 1
289 . 1 1 36 36 HIS HB2 H 1 3.0 0.06 . 2 . . . . 36 His HB2 . 17033 1
290 . 1 1 36 36 HIS HB3 H 1 2.686 0.06 . 2 . . . . 36 His HB3 . 17033 1
291 . 1 1 36 36 HIS CA C 13 55.757 0.55 . 1 . . . . 36 His CA . 17033 1
292 . 1 1 36 36 HIS CB C 13 32.24 0.55 . 1 . . . . 36 His CB . 17033 1
293 . 1 1 36 36 HIS N N 15 119.5 0.55 . 1 . . . . 36 His N . 17033 1
294 . 1 1 37 37 ASP H H 1 8.544 0.06 . 1 . . . . 37 Asp H . 17033 1
295 . 1 1 37 37 ASP HA H 1 4.798 0.06 . 1 . . . . 37 Asp HA . 17033 1
296 . 1 1 37 37 ASP HB2 H 1 2.98 0.06 . 2 . . . . 37 Asp HB2 . 17033 1
297 . 1 1 37 37 ASP HB3 H 1 2.421 0.06 . 2 . . . . 37 Asp HB3 . 17033 1
298 . 1 1 37 37 ASP CA C 13 52.850 0.55 . 1 . . . . 37 Asp CA . 17033 1
299 . 1 1 37 37 ASP CB C 13 41.642 0.55 . 1 . . . . 37 Asp CB . 17033 1
300 . 1 1 37 37 ASP N N 15 117.480 0.55 . 1 . . . . 37 Asp N . 17033 1
301 . 1 1 38 38 TYR H H 1 7.485 0.06 . 1 . . . . 38 Tyr H . 17033 1
302 . 1 1 38 38 TYR HA H 1 4.652 0.06 . 1 . . . . 38 Tyr HA . 17033 1
303 . 1 1 38 38 TYR HB2 H 1 3.16 0.06 . 2 . . . . 38 Tyr HB2 . 17033 1
304 . 1 1 38 38 TYR HB3 H 1 2.482 0.06 . 2 . . . . 38 Tyr HB3 . 17033 1
305 . 1 1 38 38 TYR HD1 H 1 6.86 0.06 . 3 . . . . 38 Tyr HD1 . 17033 1
306 . 1 1 38 38 TYR HD2 H 1 6.86 0.06 . 3 . . . . 38 Tyr HD2 . 17033 1
307 . 1 1 38 38 TYR CA C 13 58.249 0.55 . 1 . . . . 38 Tyr CA . 17033 1
308 . 1 1 38 38 TYR CB C 13 41.45 0.55 . 1 . . . . 38 Tyr CB . 17033 1
309 . 1 1 38 38 TYR CD1 C 13 132.93 0.55 . 3 . . . . 38 Tyr CD1 . 17033 1
310 . 1 1 38 38 TYR CD2 C 13 132.93 0.55 . 3 . . . . 38 Tyr CD2 . 17033 1
311 . 1 1 38 38 TYR N N 15 120.448 0.55 . 1 . . . . 38 Tyr N . 17033 1
312 . 1 1 39 39 PHE H H 1 8.473 0.06 . 1 . . . . 39 Phe H . 17033 1
313 . 1 1 39 39 PHE HA H 1 5.347 0.06 . 1 . . . . 39 Phe HA . 17033 1
314 . 1 1 39 39 PHE HB2 H 1 2.862 0.06 . 2 . . . . 39 Phe HB2 . 17033 1
315 . 1 1 39 39 PHE HB3 H 1 2.862 0.06 . 2 . . . . 39 Phe HB3 . 17033 1
316 . 1 1 39 39 PHE HD1 H 1 7.08 0.06 . 3 . . . . 39 Phe HD1 . 17033 1
317 . 1 1 39 39 PHE HD2 H 1 7.08 0.06 . 3 . . . . 39 Phe HD2 . 17033 1
318 . 1 1 39 39 PHE HE1 H 1 6.86 0.06 . 3 . . . . 39 Phe HE1 . 17033 1
319 . 1 1 39 39 PHE HE2 H 1 6.86 0.06 . 3 . . . . 39 Phe HE2 . 17033 1
320 . 1 1 39 39 PHE CA C 13 54.855 0.55 . 1 . . . . 39 Phe CA . 17033 1
321 . 1 1 39 39 PHE CB C 13 39.688 0.55 . 1 . . . . 39 Phe CB . 17033 1
322 . 1 1 39 39 PHE CD1 C 13 133.0 0.55 . 3 . . . . 39 Phe CD1 . 17033 1
323 . 1 1 39 39 PHE CD2 C 13 133.0 0.55 . 3 . . . . 39 Phe CD2 . 17033 1
324 . 1 1 39 39 PHE CE1 C 13 130.89 0.55 . 3 . . . . 39 Phe CE1 . 17033 1
325 . 1 1 39 39 PHE CE2 C 13 130.89 0.55 . 3 . . . . 39 Phe CE2 . 17033 1
326 . 1 1 39 39 PHE N N 15 129.771 0.55 . 1 . . . . 39 Phe N . 17033 1
327 . 1 1 40 40 GLU H H 1 8.682 0.06 . 1 . . . . 40 Glu H . 17033 1
328 . 1 1 40 40 GLU HA H 1 4.336 0.06 . 1 . . . . 40 Glu HA . 17033 1
329 . 1 1 40 40 GLU HB2 H 1 1.76 0.06 . 2 . . . . 40 Glu HB2 . 17033 1
330 . 1 1 40 40 GLU HB3 H 1 1.52 0.06 . 2 . . . . 40 Glu HB3 . 17033 1
331 . 1 1 40 40 GLU HG2 H 1 1.917 0.06 . 2 . . . . 40 Glu HG2 . 17033 1
332 . 1 1 40 40 GLU HG3 H 1 1.519 0.06 . 2 . . . . 40 Glu HG3 . 17033 1
333 . 1 1 40 40 GLU CA C 13 54.632 0.55 . 1 . . . . 40 Glu CA . 17033 1
334 . 1 1 40 40 GLU CB C 13 33.3 0.55 . 1 . . . . 40 Glu CB . 17033 1
335 . 1 1 40 40 GLU CG C 13 36.28 0.55 . 1 . . . . 40 Glu CG . 17033 1
336 . 1 1 40 40 GLU N N 15 127.701 0.55 . 1 . . . . 40 Glu N . 17033 1
337 . 1 1 41 41 PHE H H 1 8.6 0.06 . 1 . . . . 41 Phe H . 17033 1
338 . 1 1 41 41 PHE HA H 1 4.783 0.06 . 1 . . . . 41 Phe HA . 17033 1
339 . 1 1 41 41 PHE HB2 H 1 2.8 0.06 . 2 . . . . 41 Phe HB2 . 17033 1
340 . 1 1 41 41 PHE HB3 H 1 2.445 0.06 . 2 . . . . 41 Phe HB3 . 17033 1
341 . 1 1 41 41 PHE HD1 H 1 6.86 0.06 . 3 . . . . 41 Phe HD1 . 17033 1
342 . 1 1 41 41 PHE HD2 H 1 6.876 0.06 . 3 . . . . 41 Phe HD2 . 17033 1
343 . 1 1 41 41 PHE HE1 H 1 6.912 0.06 . 3 . . . . 41 Phe HE1 . 17033 1
344 . 1 1 41 41 PHE HE2 H 1 6.912 0.06 . 3 . . . . 41 Phe HE2 . 17033 1
345 . 1 1 41 41 PHE CA C 13 56.683 0.55 . 1 . . . . 41 Phe CA . 17033 1
346 . 1 1 41 41 PHE CB C 13 43.22 0.55 . 1 . . . . 41 Phe CB . 17033 1
347 . 1 1 41 41 PHE CD1 C 13 132.94 0.55 . 3 . . . . 41 Phe CD1 . 17033 1
348 . 1 1 41 41 PHE CD2 C 13 132.94 0.55 . 3 . . . . 41 Phe CD2 . 17033 1
349 . 1 1 41 41 PHE CE1 C 13 130.94 0.55 . 3 . . . . 41 Phe CE1 . 17033 1
350 . 1 1 41 41 PHE CE2 C 13 130.94 0.55 . 3 . . . . 41 Phe CE2 . 17033 1
351 . 1 1 41 41 PHE N N 15 125.93 0.55 . 1 . . . . 41 Phe N . 17033 1
352 . 1 1 42 42 PHE H H 1 8.692 0.06 . 1 . . . . 42 Phe H . 17033 1
353 . 1 1 42 42 PHE HA H 1 4.419 0.06 . 1 . . . . 42 Phe HA . 17033 1
354 . 1 1 42 42 PHE HB2 H 1 2.581 0.06 . 2 . . . . 42 Phe HB2 . 17033 1
355 . 1 1 42 42 PHE HB3 H 1 2.581 0.06 . 2 . . . . 42 Phe HB3 . 17033 1
356 . 1 1 42 42 PHE HD1 H 1 7.078 0.06 . 3 . . . . 42 Phe HD1 . 17033 1
357 . 1 1 42 42 PHE HD2 H 1 7.078 0.06 . 3 . . . . 42 Phe HD2 . 17033 1
358 . 1 1 42 42 PHE CA C 13 56.73 0.55 . 1 . . . . 42 Phe CA . 17033 1
359 . 1 1 42 42 PHE CB C 13 40.426 0.55 . 1 . . . . 42 Phe CB . 17033 1
360 . 1 1 42 42 PHE CD1 C 13 131.256 0.55 . 3 . . . . 42 Phe CD1 . 17033 1
361 . 1 1 42 42 PHE CD2 C 13 131.256 0.55 . 3 . . . . 42 Phe CD2 . 17033 1
362 . 1 1 42 42 PHE N N 15 128.068 0.55 . 1 . . . . 42 Phe N . 17033 1
363 . 1 1 43 43 ALA H H 1 8.114 0.06 . 1 . . . . 43 Ala H . 17033 1
364 . 1 1 43 43 ALA HA H 1 4.124 0.06 . 1 . . . . 43 Ala HA . 17033 1
365 . 1 1 43 43 ALA HB1 H 1 1.474 0.06 . 1 . . . . 43 Ala HB . 17033 1
366 . 1 1 43 43 ALA HB2 H 1 1.474 0.06 . 1 . . . . 43 Ala HB . 17033 1
367 . 1 1 43 43 ALA HB3 H 1 1.474 0.06 . 1 . . . . 43 Ala HB . 17033 1
368 . 1 1 43 43 ALA CA C 13 51.75 0.55 . 1 . . . . 43 Ala CA . 17033 1
369 . 1 1 43 43 ALA CB C 13 19.82 0.55 . 1 . . . . 43 Ala CB . 17033 1
370 . 1 1 43 43 ALA N N 15 125.320 0.55 . 1 . . . . 43 Ala N . 17033 1
371 . 1 1 44 44 ALA H H 1 7.909 0.06 . 1 . . . . 44 Ala H . 17033 1
372 . 1 1 44 44 ALA N N 15 121.865 0.55 . 1 . . . . 44 Ala N . 17033 1
373 . 1 1 46 46 LEU HA H 1 4.375 0.06 . 1 . . . . 46 Leu HA . 17033 1
374 . 1 1 46 46 LEU HB2 H 1 1.835 0.06 . 2 . . . . 46 Leu HB2 . 17033 1
375 . 1 1 46 46 LEU HB3 H 1 1.835 0.06 . 2 . . . . 46 Leu HB3 . 17033 1
376 . 1 1 46 46 LEU HD11 H 1 0.964 0.06 . 2 . . . . 46 Leu HD1 . 17033 1
377 . 1 1 46 46 LEU HD12 H 1 0.964 0.06 . 2 . . . . 46 Leu HD1 . 17033 1
378 . 1 1 46 46 LEU HD13 H 1 0.964 0.06 . 2 . . . . 46 Leu HD1 . 17033 1
379 . 1 1 46 46 LEU HD21 H 1 0.964 0.06 . 2 . . . . 46 Leu HD2 . 17033 1
380 . 1 1 46 46 LEU HD22 H 1 0.964 0.06 . 2 . . . . 46 Leu HD2 . 17033 1
381 . 1 1 46 46 LEU HD23 H 1 0.964 0.06 . 2 . . . . 46 Leu HD2 . 17033 1
382 . 1 1 46 46 LEU HG H 1 1.602 0.06 . 1 . . . . 46 Leu HG . 17033 1
383 . 1 1 46 46 LEU CA C 13 55.946 0.55 . 1 . . . . 46 Leu CA . 17033 1
384 . 1 1 46 46 LEU CB C 13 41.630 0.55 . 1 . . . . 46 Leu CB . 17033 1
385 . 1 1 46 46 LEU CD1 C 13 24.64 0.55 . 2 . . . . 46 Leu CD1 . 17033 1
386 . 1 1 46 46 LEU CD2 C 13 24.64 0.55 . 2 . . . . 46 Leu CD2 . 17033 1
387 . 1 1 46 46 LEU CG C 13 27.7 0.55 . 1 . . . . 46 Leu CG . 17033 1
388 . 1 1 47 47 SER H H 1 8.238 0.06 . 1 . . . . 47 Ser H . 17033 1
389 . 1 1 47 47 SER CA C 13 59.879 0.55 . 1 . . . . 47 Ser CA . 17033 1
390 . 1 1 47 47 SER N N 15 114.63 0.55 . 1 . . . . 47 Ser N . 17033 1
391 . 1 1 53 53 TYR HA H 1 5.08 0.06 . 1 . . . . 53 Tyr HA . 17033 1
392 . 1 1 53 53 TYR HB2 H 1 3.47 0.06 . 2 . . . . 53 Tyr HB2 . 17033 1
393 . 1 1 53 53 TYR HB3 H 1 3.7 0.06 . 2 . . . . 53 Tyr HB3 . 17033 1
394 . 1 1 53 53 TYR HE1 H 1 6.84 0.06 . 3 . . . . 53 Tyr HE1 . 17033 1
395 . 1 1 53 53 TYR HE2 H 1 6.84 0.06 . 3 . . . . 53 Tyr HE2 . 17033 1
396 . 1 1 53 53 TYR CA C 13 56.4 0.55 . 1 . . . . 53 Tyr CA . 17033 1
397 . 1 1 53 53 TYR CB C 13 43.8 0.55 . 1 . . . . 53 Tyr CB . 17033 1
398 . 1 1 53 53 TYR CE1 C 13 118.4 0.55 . 3 . . . . 53 Tyr CE1 . 17033 1
399 . 1 1 53 53 TYR CE2 C 13 118.4 0.55 . 3 . . . . 53 Tyr CE2 . 17033 1
400 . 1 1 54 54 SER H H 1 8.17 0.06 . 1 . . . . 54 Ser H . 17033 1
401 . 1 1 54 54 SER HA H 1 4.622 0.06 . 1 . . . . 54 Ser HA . 17033 1
402 . 1 1 54 54 SER CA C 13 57.909 0.55 . 1 . . . . 54 Ser CA . 17033 1
403 . 1 1 54 54 SER N N 15 117.6 0.55 . 1 . . . . 54 Ser N . 17033 1
404 . 1 1 55 55 ARG H H 1 8.115 0.06 . 1 . . . . 55 Arg H . 17033 1
405 . 1 1 55 55 ARG HA H 1 5.157 0.06 . 1 . . . . 55 Arg HA . 17033 1
406 . 1 1 55 55 ARG HB2 H 1 1.89 0.06 . 2 . . . . 55 Arg HB2 . 17033 1
407 . 1 1 55 55 ARG HB3 H 1 1.89 0.06 . 2 . . . . 55 Arg HB3 . 17033 1
408 . 1 1 55 55 ARG HD2 H 1 2.911 0.06 . 2 . . . . 55 Arg HD2 . 17033 1
409 . 1 1 55 55 ARG HD3 H 1 2.911 0.06 . 2 . . . . 55 Arg HD3 . 17033 1
410 . 1 1 55 55 ARG CA C 13 55.048 0.55 . 1 . . . . 55 Arg CA . 17033 1
411 . 1 1 55 55 ARG CB C 13 33.9 0.55 . 1 . . . . 55 Arg CB . 17033 1
412 . 1 1 55 55 ARG CD C 13 44.07 0.55 . 1 . . . . 55 Arg CD . 17033 1
413 . 1 1 55 55 ARG CG C 13 25.58 0.55 . 1 . . . . 55 Arg CG . 17033 1
414 . 1 1 55 55 ARG N N 15 115.104 0.55 . 1 . . . . 55 Arg N . 17033 1
415 . 1 1 56 56 ALA H H 1 9.044 0.06 . 1 . . . . 56 Ala H . 17033 1
416 . 1 1 56 56 ALA HA H 1 5.355 0.06 . 1 . . . . 56 Ala HA . 17033 1
417 . 1 1 56 56 ALA HB1 H 1 1.253 0.06 . 1 . . . . 56 Ala HB . 17033 1
418 . 1 1 56 56 ALA HB2 H 1 1.253 0.06 . 1 . . . . 56 Ala HB . 17033 1
419 . 1 1 56 56 ALA HB3 H 1 1.253 0.06 . 1 . . . . 56 Ala HB . 17033 1
420 . 1 1 56 56 ALA CA C 13 50.696 0.55 . 1 . . . . 56 Ala CA . 17033 1
421 . 1 1 56 56 ALA CB C 13 24.231 0.55 . 1 . . . . 56 Ala CB . 17033 1
422 . 1 1 56 56 ALA N N 15 120.189 0.55 . 1 . . . . 56 Ala N . 17033 1
423 . 1 1 57 57 TYR H H 1 8.807 0.06 . 1 . . . . 57 Tyr H . 17033 1
424 . 1 1 57 57 TYR HA H 1 5.528 0.06 . 1 . . . . 57 Tyr HA . 17033 1
425 . 1 1 57 57 TYR HB2 H 1 3.42 0.06 . 2 . . . . 57 Tyr HB2 . 17033 1
426 . 1 1 57 57 TYR HB3 H 1 2.87 0.06 . 2 . . . . 57 Tyr HB3 . 17033 1
427 . 1 1 57 57 TYR HD1 H 1 7.11 0.06 . 3 . . . . 57 Tyr HD1 . 17033 1
428 . 1 1 57 57 TYR HD2 H 1 7.11 0.06 . 3 . . . . 57 Tyr HD2 . 17033 1
429 . 1 1 57 57 TYR HE1 H 1 6.47 0.06 . 3 . . . . 57 Tyr HE1 . 17033 1
430 . 1 1 57 57 TYR HE2 H 1 6.47 0.06 . 3 . . . . 57 Tyr HE2 . 17033 1
431 . 1 1 57 57 TYR CA C 13 56.032 0.55 . 1 . . . . 57 Tyr CA . 17033 1
432 . 1 1 57 57 TYR CB C 13 42.403 0.55 . 1 . . . . 57 Tyr CB . 17033 1
433 . 1 1 57 57 TYR CD1 C 13 132.95 0.55 . 3 . . . . 57 Tyr CD1 . 17033 1
434 . 1 1 57 57 TYR CD2 C 13 132.95 0.55 . 3 . . . . 57 Tyr CD2 . 17033 1
435 . 1 1 57 57 TYR CE1 C 13 118.08 0.55 . 3 . . . . 57 Tyr CE1 . 17033 1
436 . 1 1 57 57 TYR CE2 C 13 118.08 0.55 . 3 . . . . 57 Tyr CE2 . 17033 1
437 . 1 1 57 57 TYR N N 15 118.807 0.55 . 1 . . . . 57 Tyr N . 17033 1
438 . 1 1 58 58 ILE H H 1 8.754 0.06 . 1 . . . . 58 Ile H . 17033 1
439 . 1 1 58 58 ILE HA H 1 4.760 0.06 . 1 . . . . 58 Ile HA . 17033 1
440 . 1 1 58 58 ILE HB H 1 0.841 0.06 . 1 . . . . 58 Ile HB . 17033 1
441 . 1 1 58 58 ILE HD11 H 1 -0.123 0.06 . 1 . . . . 58 Ile HD1 . 17033 1
442 . 1 1 58 58 ILE HD12 H 1 -0.123 0.06 . 1 . . . . 58 Ile HD1 . 17033 1
443 . 1 1 58 58 ILE HD13 H 1 -0.123 0.06 . 1 . . . . 58 Ile HD1 . 17033 1
444 . 1 1 58 58 ILE HG12 H 1 1.017 0.06 . 2 . . . . 58 Ile HG12 . 17033 1
445 . 1 1 58 58 ILE HG13 H 1 0.049 0.06 . 2 . . . . 58 Ile HG13 . 17033 1
446 . 1 1 58 58 ILE HG21 H 1 -0.198 0.06 . 1 . . . . 58 Ile HG2 . 17033 1
447 . 1 1 58 58 ILE HG22 H 1 -0.198 0.06 . 1 . . . . 58 Ile HG2 . 17033 1
448 . 1 1 58 58 ILE HG23 H 1 -0.198 0.06 . 1 . . . . 58 Ile HG2 . 17033 1
449 . 1 1 58 58 ILE CA C 13 59.932 0.55 . 1 . . . . 58 Ile CA . 17033 1
450 . 1 1 58 58 ILE CB C 13 42.307 0.55 . 1 . . . . 58 Ile CB . 17033 1
451 . 1 1 58 58 ILE CD1 C 13 14.28 0.55 . 1 . . . . 58 Ile CD1 . 17033 1
452 . 1 1 58 58 ILE CG1 C 13 27.297 0.55 . 1 . . . . 58 Ile CG1 . 17033 1
453 . 1 1 58 58 ILE CG2 C 13 16.71 0.55 . 1 . . . . 58 Ile CG2 . 17033 1
454 . 1 1 58 58 ILE N N 15 119.742 0.55 . 1 . . . . 58 Ile N . 17033 1
455 . 1 1 59 59 ASN H H 1 8.569 0.06 . 1 . . . . 59 Asn H . 17033 1
456 . 1 1 59 59 ASN HA H 1 5.305 0.06 . 1 . . . . 59 Asn HA . 17033 1
457 . 1 1 59 59 ASN HB2 H 1 3.228 0.06 . 2 . . . . 59 Asn HB2 . 17033 1
458 . 1 1 59 59 ASN HB3 H 1 2.101 0.06 . 2 . . . . 59 Asn HB3 . 17033 1
459 . 1 1 59 59 ASN HD21 H 1 7.47 0.06 . 2 . . . . 59 Asn HD21 . 17033 1
460 . 1 1 59 59 ASN HD22 H 1 6.77 0.06 . 2 . . . . 59 Asn HD22 . 17033 1
461 . 1 1 59 59 ASN CA C 13 52.495 0.55 . 1 . . . . 59 Asn CA . 17033 1
462 . 1 1 59 59 ASN CB C 13 42.139 0.55 . 1 . . . . 59 Asn CB . 17033 1
463 . 1 1 59 59 ASN N N 15 125.611 0.55 . 1 . . . . 59 Asn N . 17033 1
464 . 1 1 59 59 ASN ND2 N 15 112.6 0.55 . 1 . . . . 59 Asn ND2 . 17033 1
465 . 1 1 60 60 PHE H H 1 8.362 0.06 . 1 . . . . 60 Phe H . 17033 1
466 . 1 1 60 60 PHE HA H 1 4.726 0.06 . 1 . . . . 60 Phe HA . 17033 1
467 . 1 1 60 60 PHE HB2 H 1 2.662 0.06 . 2 . . . . 60 Phe HB2 . 17033 1
468 . 1 1 60 60 PHE HB3 H 1 2.662 0.06 . 2 . . . . 60 Phe HB3 . 17033 1
469 . 1 1 60 60 PHE HD1 H 1 7.276 0.06 . 3 . . . . 60 Phe HD1 . 17033 1
470 . 1 1 60 60 PHE HD2 H 1 7.276 0.06 . 3 . . . . 60 Phe HD2 . 17033 1
471 . 1 1 60 60 PHE HE1 H 1 6.651 0.06 . 3 . . . . 60 Phe HE1 . 17033 1
472 . 1 1 60 60 PHE HE2 H 1 6.651 0.06 . 3 . . . . 60 Phe HE2 . 17033 1
473 . 1 1 60 60 PHE CA C 13 58.909 0.55 . 1 . . . . 60 Phe CA . 17033 1
474 . 1 1 60 60 PHE CB C 13 39.7 0.55 . 1 . . . . 60 Phe CB . 17033 1
475 . 1 1 60 60 PHE CD1 C 13 131.25 0.55 . 3 . . . . 60 Phe CD1 . 17033 1
476 . 1 1 60 60 PHE CD2 C 13 131.25 0.55 . 3 . . . . 60 Phe CD2 . 17033 1
477 . 1 1 60 60 PHE CE1 C 13 130.73 0.55 . 3 . . . . 60 Phe CE1 . 17033 1
478 . 1 1 60 60 PHE CE2 C 13 130.73 0.55 . 3 . . . . 60 Phe CE2 . 17033 1
479 . 1 1 60 60 PHE N N 15 124.936 0.55 . 1 . . . . 60 Phe N . 17033 1
480 . 1 1 61 61 ARG H H 1 7.959 0.06 . 1 . . . . 61 Arg H . 17033 1
481 . 1 1 61 61 ARG HA H 1 4.234 0.06 . 1 . . . . 61 Arg HA . 17033 1
482 . 1 1 61 61 ARG HB2 H 1 1.843 0.06 . 2 . . . . 61 Arg HB2 . 17033 1
483 . 1 1 61 61 ARG HB3 H 1 1.547 0.06 . 2 . . . . 61 Arg HB3 . 17033 1
484 . 1 1 61 61 ARG HD2 H 1 3.145 0.06 . 2 . . . . 61 Arg HD2 . 17033 1
485 . 1 1 61 61 ARG HD3 H 1 3.074 0.06 . 2 . . . . 61 Arg HD3 . 17033 1
486 . 1 1 61 61 ARG HG2 H 1 1.458 0.06 . 2 . . . . 61 Arg HG2 . 17033 1
487 . 1 1 61 61 ARG HG3 H 1 1.458 0.06 . 2 . . . . 61 Arg HG3 . 17033 1
488 . 1 1 61 61 ARG CA C 13 58.175 0.55 . 1 . . . . 61 Arg CA . 17033 1
489 . 1 1 61 61 ARG CB C 13 30.535 0.55 . 1 . . . . 61 Arg CB . 17033 1
490 . 1 1 61 61 ARG CD C 13 42.776 0.55 . 1 . . . . 61 Arg CD . 17033 1
491 . 1 1 61 61 ARG CG C 13 27.78 0.55 . 1 . . . . 61 Arg CG . 17033 1
492 . 1 1 61 61 ARG N N 15 118.956 0.55 . 1 . . . . 61 Arg N . 17033 1
493 . 1 1 62 62 ASN H H 1 9.219 0.06 . 1 . . . . 62 Asn H . 17033 1
494 . 1 1 62 62 ASN HA H 1 5.154 0.06 . 1 . . . . 62 Asn HA . 17033 1
495 . 1 1 62 62 ASN HB2 H 1 3.157 0.06 . 2 . . . . 62 Asn HB2 . 17033 1
496 . 1 1 62 62 ASN HB3 H 1 2.737 0.06 . 2 . . . . 62 Asn HB3 . 17033 1
497 . 1 1 62 62 ASN HD21 H 1 7.52 0.06 . 2 . . . . 62 Asn HD21 . 17033 1
498 . 1 1 62 62 ASN HD22 H 1 7.12 0.06 . 2 . . . . 62 Asn HD22 . 17033 1
499 . 1 1 62 62 ASN CA C 13 49.332 0.55 . 1 . . . . 62 Asn CA . 17033 1
500 . 1 1 62 62 ASN CB C 13 39.421 0.55 . 1 . . . . 62 Asn CB . 17033 1
501 . 1 1 62 62 ASN N N 15 118.223 0.55 . 1 . . . . 62 Asn N . 17033 1
502 . 1 1 62 62 ASN ND2 N 15 113.0 0.55 . 1 . . . . 62 Asn ND2 . 17033 1
503 . 1 1 63 63 PRO HA H 1 3.901 0.06 . 1 . . . . 63 Pro HA . 17033 1
504 . 1 1 63 63 PRO HB2 H 1 1.864 0.06 . 2 . . . . 63 Pro HB2 . 17033 1
505 . 1 1 63 63 PRO HB3 H 1 1.864 0.06 . 2 . . . . 63 Pro HB3 . 17033 1
506 . 1 1 63 63 PRO HD2 H 1 3.918 0.06 . 2 . . . . 63 Pro HD2 . 17033 1
507 . 1 1 63 63 PRO HD3 H 1 3.562 0.06 . 2 . . . . 63 Pro HD3 . 17033 1
508 . 1 1 63 63 PRO HG2 H 1 1.877 0.06 . 2 . . . . 63 Pro HG2 . 17033 1
509 . 1 1 63 63 PRO HG3 H 1 1.668 0.06 . 2 . . . . 63 Pro HG3 . 17033 1
510 . 1 1 63 63 PRO CA C 13 64.844 0.55 . 1 . . . . 63 Pro CA . 17033 1
511 . 1 1 63 63 PRO CB C 13 31.599 0.55 . 1 . . . . 63 Pro CB . 17033 1
512 . 1 1 63 63 PRO CD C 13 50.95 0.55 . 1 . . . . 63 Pro CD . 17033 1
513 . 1 1 63 63 PRO CG C 13 27.230 0.55 . 1 . . . . 63 Pro CG . 17033 1
514 . 1 1 64 64 ASP H H 1 8.227 0.06 . 1 . . . . 64 Asp H . 17033 1
515 . 1 1 64 64 ASP HA H 1 4.332 0.06 . 1 . . . . 64 Asp HA . 17033 1
516 . 1 1 64 64 ASP HB2 H 1 2.639 0.06 . 2 . . . . 64 Asp HB2 . 17033 1
517 . 1 1 64 64 ASP HB3 H 1 2.432 0.06 . 2 . . . . 64 Asp HB3 . 17033 1
518 . 1 1 64 64 ASP CA C 13 57.06 0.55 . 1 . . . . 64 Asp CA . 17033 1
519 . 1 1 64 64 ASP CB C 13 39.862 0.55 . 1 . . . . 64 Asp CB . 17033 1
520 . 1 1 64 64 ASP N N 15 118.118 0.55 . 1 . . . . 64 Asp N . 17033 1
521 . 1 1 65 65 ASP H H 1 7.791 0.06 . 1 . . . . 65 Asp H . 17033 1
522 . 1 1 65 65 ASP HA H 1 4.498 0.06 . 1 . . . . 65 Asp HA . 17033 1
523 . 1 1 65 65 ASP HB2 H 1 2.806 0.06 . 2 . . . . 65 Asp HB2 . 17033 1
524 . 1 1 65 65 ASP HB3 H 1 2.084 0.06 . 2 . . . . 65 Asp HB3 . 17033 1
525 . 1 1 65 65 ASP CA C 13 56.729 0.55 . 1 . . . . 65 Asp CA . 17033 1
526 . 1 1 65 65 ASP CB C 13 40.517 0.55 . 1 . . . . 65 Asp CB . 17033 1
527 . 1 1 65 65 ASP N N 15 117.848 0.55 . 1 . . . . 65 Asp N . 17033 1
528 . 1 1 66 66 ILE H H 1 7.308 0.06 . 1 . . . . 66 Ile H . 17033 1
529 . 1 1 66 66 ILE HA H 1 3.271 0.06 . 1 . . . . 66 Ile HA . 17033 1
530 . 1 1 66 66 ILE HB H 1 1.774 0.06 . 1 . . . . 66 Ile HB . 17033 1
531 . 1 1 66 66 ILE HD11 H 1 0.780 0.06 . 1 . . . . 66 Ile HD1 . 17033 1
532 . 1 1 66 66 ILE HD12 H 1 0.780 0.06 . 1 . . . . 66 Ile HD1 . 17033 1
533 . 1 1 66 66 ILE HD13 H 1 0.780 0.06 . 1 . . . . 66 Ile HD1 . 17033 1
534 . 1 1 66 66 ILE HG12 H 1 1.482 0.06 . 2 . . . . 66 Ile HG12 . 17033 1
535 . 1 1 66 66 ILE HG13 H 1 0.791 0.06 . 2 . . . . 66 Ile HG13 . 17033 1
536 . 1 1 66 66 ILE HG21 H 1 0.565 0.06 . 1 . . . . 66 Ile HG2 . 17033 1
537 . 1 1 66 66 ILE HG22 H 1 0.565 0.06 . 1 . . . . 66 Ile HG2 . 17033 1
538 . 1 1 66 66 ILE HG23 H 1 0.565 0.06 . 1 . . . . 66 Ile HG2 . 17033 1
539 . 1 1 66 66 ILE CA C 13 66.061 0.55 . 1 . . . . 66 Ile CA . 17033 1
540 . 1 1 66 66 ILE CB C 13 37.744 0.55 . 1 . . . . 66 Ile CB . 17033 1
541 . 1 1 66 66 ILE CD1 C 13 14.21 0.55 . 1 . . . . 66 Ile CD1 . 17033 1
542 . 1 1 66 66 ILE CG1 C 13 29.190 0.55 . 1 . . . . 66 Ile CG1 . 17033 1
543 . 1 1 66 66 ILE CG2 C 13 16.96 0.55 . 1 . . . . 66 Ile CG2 . 17033 1
544 . 1 1 66 66 ILE N N 15 119.036 0.55 . 1 . . . . 66 Ile N . 17033 1
545 . 1 1 67 67 LEU H H 1 7.135 0.06 . 1 . . . . 67 Leu H . 17033 1
546 . 1 1 67 67 LEU HA H 1 3.995 0.06 . 1 . . . . 67 Leu HA . 17033 1
547 . 1 1 67 67 LEU HB2 H 1 1.754 0.06 . 2 . . . . 67 Leu HB2 . 17033 1
548 . 1 1 67 67 LEU HB3 H 1 1.651 0.06 . 2 . . . . 67 Leu HB3 . 17033 1
549 . 1 1 67 67 LEU HD11 H 1 0.937 0.06 . 2 . . . . 67 Leu HD1 . 17033 1
550 . 1 1 67 67 LEU HD12 H 1 0.937 0.06 . 2 . . . . 67 Leu HD1 . 17033 1
551 . 1 1 67 67 LEU HD13 H 1 0.937 0.06 . 2 . . . . 67 Leu HD1 . 17033 1
552 . 1 1 67 67 LEU HD21 H 1 0.857 0.06 . 2 . . . . 67 Leu HD2 . 17033 1
553 . 1 1 67 67 LEU HD22 H 1 0.857 0.06 . 2 . . . . 67 Leu HD2 . 17033 1
554 . 1 1 67 67 LEU HD23 H 1 0.857 0.06 . 2 . . . . 67 Leu HD2 . 17033 1
555 . 1 1 67 67 LEU HG H 1 1.676 0.06 . 1 . . . . 67 Leu HG . 17033 1
556 . 1 1 67 67 LEU CA C 13 57.955 0.55 . 1 . . . . 67 Leu CA . 17033 1
557 . 1 1 67 67 LEU CB C 13 40.98 0.55 . 1 . . . . 67 Leu CB . 17033 1
558 . 1 1 67 67 LEU CD1 C 13 25.03 0.55 . 2 . . . . 67 Leu CD1 . 17033 1
559 . 1 1 67 67 LEU CD2 C 13 23.19 0.55 . 2 . . . . 67 Leu CD2 . 17033 1
560 . 1 1 67 67 LEU CG C 13 27.43 0.55 . 1 . . . . 67 Leu CG . 17033 1
561 . 1 1 67 67 LEU N N 15 117.748 0.55 . 1 . . . . 67 Leu N . 17033 1
562 . 1 1 68 68 LEU H H 1 6.999 0.06 . 1 . . . . 68 Leu H . 17033 1
563 . 1 1 68 68 LEU HA H 1 4.115 0.06 . 1 . . . . 68 Leu HA . 17033 1
564 . 1 1 68 68 LEU HB2 H 1 1.752 0.06 . 1 . . . . 68 Leu HB2 . 17033 1
565 . 1 1 68 68 LEU HB3 H 1 1.621 0.06 . 1 . . . . 68 Leu HB3 . 17033 1
566 . 1 1 68 68 LEU HD11 H 1 0.77 0.06 . 2 . . . . 68 Leu HD1 . 17033 1
567 . 1 1 68 68 LEU HD12 H 1 0.77 0.06 . 2 . . . . 68 Leu HD1 . 17033 1
568 . 1 1 68 68 LEU HD13 H 1 0.77 0.06 . 2 . . . . 68 Leu HD1 . 17033 1
569 . 1 1 68 68 LEU HD21 H 1 0.865 0.06 . 2 . . . . 68 Leu HD2 . 17033 1
570 . 1 1 68 68 LEU HD22 H 1 0.865 0.06 . 2 . . . . 68 Leu HD2 . 17033 1
571 . 1 1 68 68 LEU HD23 H 1 0.865 0.06 . 2 . . . . 68 Leu HD2 . 17033 1
572 . 1 1 68 68 LEU HG H 1 1.67 0.06 . 1 . . . . 68 Leu HG . 17033 1
573 . 1 1 68 68 LEU CA C 13 57.65 0.55 . 1 . . . . 68 Leu CA . 17033 1
574 . 1 1 68 68 LEU CB C 13 41.885 0.55 . 1 . . . . 68 Leu CB . 17033 1
575 . 1 1 68 68 LEU CD1 C 13 24.9 0.55 . 2 . . . . 68 Leu CD1 . 17033 1
576 . 1 1 68 68 LEU CD2 C 13 23.67 0.55 . 2 . . . . 68 Leu CD2 . 17033 1
577 . 1 1 68 68 LEU CG C 13 27.23 0.55 . 1 . . . . 68 Leu CG . 17033 1
578 . 1 1 68 68 LEU N N 15 117.757 0.55 . 1 . . . . 68 Leu N . 17033 1
579 . 1 1 69 69 PHE H H 1 8.070 0.06 . 1 . . . . 69 Phe H . 17033 1
580 . 1 1 69 69 PHE HA H 1 4.175 0.06 . 1 . . . . 69 Phe HA . 17033 1
581 . 1 1 69 69 PHE HB2 H 1 3.135 0.06 . 2 . . . . 69 Phe HB2 . 17033 1
582 . 1 1 69 69 PHE HB3 H 1 3.038 0.06 . 2 . . . . 69 Phe HB3 . 17033 1
583 . 1 1 69 69 PHE HD1 H 1 7.26 0.06 . 3 . . . . 69 Phe HD1 . 17033 1
584 . 1 1 69 69 PHE HD2 H 1 7.26 0.06 . 3 . . . . 69 Phe HD2 . 17033 1
585 . 1 1 69 69 PHE HE1 H 1 6.661 0.06 . 3 . . . . 69 Phe HE1 . 17033 1
586 . 1 1 69 69 PHE HE2 H 1 6.661 0.06 . 3 . . . . 69 Phe HE2 . 17033 1
587 . 1 1 69 69 PHE CA C 13 62.082 0.55 . 1 . . . . 69 Phe CA . 17033 1
588 . 1 1 69 69 PHE CB C 13 40.355 0.55 . 1 . . . . 69 Phe CB . 17033 1
589 . 1 1 69 69 PHE CD1 C 13 131.99 0.55 . 3 . . . . 69 Phe CD1 . 17033 1
590 . 1 1 69 69 PHE CD2 C 13 131.99 0.55 . 3 . . . . 69 Phe CD2 . 17033 1
591 . 1 1 69 69 PHE CE1 C 13 130.68 0.55 . 3 . . . . 69 Phe CE1 . 17033 1
592 . 1 1 69 69 PHE CE2 C 13 130.68 0.55 . 3 . . . . 69 Phe CE2 . 17033 1
593 . 1 1 69 69 PHE N N 15 120.401 0.55 . 1 . . . . 69 Phe N . 17033 1
594 . 1 1 70 70 ARG H H 1 8.589 0.06 . 1 . . . . 70 Arg H . 17033 1
595 . 1 1 70 70 ARG HA H 1 3.772 0.06 . 1 . . . . 70 Arg HA . 17033 1
596 . 1 1 70 70 ARG HB2 H 1 2.207 0.06 . 2 . . . . 70 Arg HB2 . 17033 1
597 . 1 1 70 70 ARG HB3 H 1 1.87 0.06 . 2 . . . . 70 Arg HB3 . 17033 1
598 . 1 1 70 70 ARG HD2 H 1 3.108 0.06 . 2 . . . . 70 Arg HD2 . 17033 1
599 . 1 1 70 70 ARG HD3 H 1 3.108 0.06 . 2 . . . . 70 Arg HD3 . 17033 1
600 . 1 1 70 70 ARG HG2 H 1 1.796 0.06 . 2 . . . . 70 Arg HG2 . 17033 1
601 . 1 1 70 70 ARG HG3 H 1 1.796 0.06 . 2 . . . . 70 Arg HG3 . 17033 1
602 . 1 1 70 70 ARG CA C 13 60.560 0.55 . 1 . . . . 70 Arg CA . 17033 1
603 . 1 1 70 70 ARG CB C 13 29.606 0.55 . 1 . . . . 70 Arg CB . 17033 1
604 . 1 1 70 70 ARG CD C 13 43.29 0.55 . 1 . . . . 70 Arg CD . 17033 1
605 . 1 1 70 70 ARG CG C 13 27.29 0.55 . 1 . . . . 70 Arg CG . 17033 1
606 . 1 1 70 70 ARG N N 15 119.671 0.55 . 1 . . . . 70 Arg N . 17033 1
607 . 1 1 71 71 ASP H H 1 8.292 0.06 . 1 . . . . 71 Asp H . 17033 1
608 . 1 1 71 71 ASP HA H 1 4.323 0.06 . 1 . . . . 71 Asp HA . 17033 1
609 . 1 1 71 71 ASP HB2 H 1 2.774 0.06 . 2 . . . . 71 Asp HB2 . 17033 1
610 . 1 1 71 71 ASP HB3 H 1 2.563 0.06 . 2 . . . . 71 Asp HB3 . 17033 1
611 . 1 1 71 71 ASP CA C 13 57.06 0.55 . 1 . . . . 71 Asp CA . 17033 1
612 . 1 1 71 71 ASP CB C 13 40.149 0.55 . 1 . . . . 71 Asp CB . 17033 1
613 . 1 1 71 71 ASP N N 15 117.865 0.55 . 1 . . . . 71 Asp N . 17033 1
614 . 1 1 72 72 ARG H H 1 7.533 0.06 . 1 . . . . 72 Arg H . 17033 1
615 . 1 1 72 72 ARG HA H 1 3.810 0.06 . 1 . . . . 72 Arg HA . 17033 1
616 . 1 1 72 72 ARG HB2 H 1 1.381 0.06 . 2 . . . . 72 Arg HB2 . 17033 1
617 . 1 1 72 72 ARG HB3 H 1 0.977 0.06 . 2 . . . . 72 Arg HB3 . 17033 1
618 . 1 1 72 72 ARG HD2 H 1 2.899 0.06 . 2 . . . . 72 Arg HD2 . 17033 1
619 . 1 1 72 72 ARG HD3 H 1 2.733 0.06 . 2 . . . . 72 Arg HD3 . 17033 1
620 . 1 1 72 72 ARG HG2 H 1 1.178 0.06 . 2 . . . . 72 Arg HG2 . 17033 1
621 . 1 1 72 72 ARG HG3 H 1 0.402 0.06 . 2 . . . . 72 Arg HG3 . 17033 1
622 . 1 1 72 72 ARG CA C 13 58.708 0.55 . 1 . . . . 72 Arg CA . 17033 1
623 . 1 1 72 72 ARG CB C 13 31.232 0.55 . 1 . . . . 72 Arg CB . 17033 1
624 . 1 1 72 72 ARG CD C 13 43.8 0.55 . 1 . . . . 72 Arg CD . 17033 1
625 . 1 1 72 72 ARG CG C 13 26.9 0.55 . 1 . . . . 72 Arg CG . 17033 1
626 . 1 1 72 72 ARG N N 15 117.536 0.55 . 1 . . . . 72 Arg N . 17033 1
627 . 1 1 73 73 PHE H H 1 7.788 0.06 . 1 . . . . 73 Phe H . 17033 1
628 . 1 1 73 73 PHE HA H 1 4.652 0.06 . 1 . . . . 73 Phe HA . 17033 1
629 . 1 1 73 73 PHE HB2 H 1 2.794 0.06 . 2 . . . . 73 Phe HB2 . 17033 1
630 . 1 1 73 73 PHE HB3 H 1 1.851 0.06 . 2 . . . . 73 Phe HB3 . 17033 1
631 . 1 1 73 73 PHE HD1 H 1 6.103 0.06 . 3 . . . . 73 Phe HD1 . 17033 1
632 . 1 1 73 73 PHE HD2 H 1 6.103 0.06 . 3 . . . . 73 Phe HD2 . 17033 1
633 . 1 1 73 73 PHE HE1 H 1 6.578 0.06 . 3 . . . . 73 Phe HE1 . 17033 1
634 . 1 1 73 73 PHE HE2 H 1 6.578 0.06 . 3 . . . . 73 Phe HE2 . 17033 1
635 . 1 1 73 73 PHE CA C 13 60.279 0.55 . 1 . . . . 73 Phe CA . 17033 1
636 . 1 1 73 73 PHE CB C 13 40.644 0.55 . 1 . . . . 73 Phe CB . 17033 1
637 . 1 1 73 73 PHE CD1 C 13 131.779 0.55 . 3 . . . . 73 Phe CD1 . 17033 1
638 . 1 1 73 73 PHE CD2 C 13 131.779 0.55 . 3 . . . . 73 Phe CD2 . 17033 1
639 . 1 1 73 73 PHE CE1 C 13 134.3 0.55 . 3 . . . . 73 Phe CE1 . 17033 1
640 . 1 1 73 73 PHE CE2 C 13 134.3 0.55 . 3 . . . . 73 Phe CE2 . 17033 1
641 . 1 1 73 73 PHE N N 15 112.378 0.55 . 1 . . . . 73 Phe N . 17033 1
642 . 1 1 74 74 ASP H H 1 8.762 0.06 . 1 . . . . 74 Asp H . 17033 1
643 . 1 1 74 74 ASP HA H 1 4.534 0.06 . 1 . . . . 74 Asp HA . 17033 1
644 . 1 1 74 74 ASP HB2 H 1 2.74 0.06 . 1 . . . . 74 Asp HB2 . 17033 1
645 . 1 1 74 74 ASP HB3 H 1 2.80 0.06 . 1 . . . . 74 Asp HB3 . 17033 1
646 . 1 1 74 74 ASP CA C 13 57.706 0.55 . 1 . . . . 74 Asp CA . 17033 1
647 . 1 1 74 74 ASP CB C 13 41.37 0.55 . 1 . . . . 74 Asp CB . 17033 1
648 . 1 1 74 74 ASP N N 15 122.329 0.55 . 1 . . . . 74 Asp N . 17033 1
649 . 1 1 75 75 GLY H H 1 8.912 0.06 . 1 . . . . 75 Gly H . 17033 1
650 . 1 1 75 75 GLY HA2 H 1 4.240 0.06 . 2 . . . . 75 Gly HA2 . 17033 1
651 . 1 1 75 75 GLY HA3 H 1 3.658 0.06 . 2 . . . . 75 Gly HA3 . 17033 1
652 . 1 1 75 75 GLY CA C 13 45.787 0.55 . 1 . . . . 75 Gly CA . 17033 1
653 . 1 1 75 75 GLY N N 15 118.705 0.55 . 1 . . . . 75 Gly N . 17033 1
654 . 1 1 76 76 TYR H H 1 8.027 0.06 . 1 . . . . 76 Tyr H . 17033 1
655 . 1 1 76 76 TYR HA H 1 4.041 0.06 . 1 . . . . 76 Tyr HA . 17033 1
656 . 1 1 76 76 TYR HB2 H 1 3.125 0.06 . 2 . . . . 76 Tyr HB2 . 17033 1
657 . 1 1 76 76 TYR HB3 H 1 3.125 0.06 . 2 . . . . 76 Tyr HB3 . 17033 1
658 . 1 1 76 76 TYR HD1 H 1 6.585 0.06 . 3 . . . . 76 Tyr HD1 . 17033 1
659 . 1 1 76 76 TYR HD2 H 1 6.585 0.06 . 3 . . . . 76 Tyr HD2 . 17033 1
660 . 1 1 76 76 TYR HE1 H 1 6.316 0.06 . 3 . . . . 76 Tyr HE1 . 17033 1
661 . 1 1 76 76 TYR HE2 H 1 6.316 0.06 . 3 . . . . 76 Tyr HE2 . 17033 1
662 . 1 1 76 76 TYR CA C 13 59.236 0.55 . 1 . . . . 76 Tyr CA . 17033 1
663 . 1 1 76 76 TYR CB C 13 40.304 0.55 . 1 . . . . 76 Tyr CB . 17033 1
664 . 1 1 76 76 TYR CD1 C 13 134.17 0.55 . 3 . . . . 76 Tyr CD1 . 17033 1
665 . 1 1 76 76 TYR CD2 C 13 134.17 0.55 . 3 . . . . 76 Tyr CD2 . 17033 1
666 . 1 1 76 76 TYR CE1 C 13 117.3 0.55 . 3 . . . . 76 Tyr CE1 . 17033 1
667 . 1 1 76 76 TYR CE2 C 13 117.3 0.55 . 3 . . . . 76 Tyr CE2 . 17033 1
668 . 1 1 76 76 TYR N N 15 123.833 0.55 . 1 . . . . 76 Tyr N . 17033 1
669 . 1 1 77 77 ILE H H 1 7.64 0.06 . 1 . . . . 77 Ile H . 17033 1
670 . 1 1 77 77 ILE HA H 1 3.965 0.06 . 1 . . . . 77 Ile HA . 17033 1
671 . 1 1 77 77 ILE HB H 1 1.555 0.06 . 1 . . . . 77 Ile HB . 17033 1
672 . 1 1 77 77 ILE HD11 H 1 0.729 0.06 . 1 . . . . 77 Ile HD1 . 17033 1
673 . 1 1 77 77 ILE HD12 H 1 0.729 0.06 . 1 . . . . 77 Ile HD1 . 17033 1
674 . 1 1 77 77 ILE HD13 H 1 0.729 0.06 . 1 . . . . 77 Ile HD1 . 17033 1
675 . 1 1 77 77 ILE HG12 H 1 1.603 0.06 . 2 . . . . 77 Ile HG12 . 17033 1
676 . 1 1 77 77 ILE HG13 H 1 0.974 0.06 . 2 . . . . 77 Ile HG13 . 17033 1
677 . 1 1 77 77 ILE HG21 H 1 0.679 0.06 . 1 . . . . 77 Ile HG2 . 17033 1
678 . 1 1 77 77 ILE HG22 H 1 0.679 0.06 . 1 . . . . 77 Ile HG2 . 17033 1
679 . 1 1 77 77 ILE HG23 H 1 0.679 0.06 . 1 . . . . 77 Ile HG2 . 17033 1
680 . 1 1 77 77 ILE CA C 13 61.833 0.55 . 1 . . . . 77 Ile CA . 17033 1
681 . 1 1 77 77 ILE CB C 13 37.189 0.55 . 1 . . . . 77 Ile CB . 17033 1
682 . 1 1 77 77 ILE CD1 C 13 12.02 0.55 . 1 . . . . 77 Ile CD1 . 17033 1
683 . 1 1 77 77 ILE CG1 C 13 28.141 0.55 . 1 . . . . 77 Ile CG1 . 17033 1
684 . 1 1 77 77 ILE CG2 C 13 18.16 0.55 . 1 . . . . 77 Ile CG2 . 17033 1
685 . 1 1 77 77 ILE N N 15 127.127 0.55 . 1 . . . . 77 Ile N . 17033 1
686 . 1 1 78 78 PHE H H 1 8.372 0.06 . 1 . . . . 78 Phe H . 17033 1
687 . 1 1 78 78 PHE HA H 1 4.601 0.06 . 1 . . . . 78 Phe HA . 17033 1
688 . 1 1 78 78 PHE HB2 H 1 3.264 0.06 . 2 . . . . 78 Phe HB2 . 17033 1
689 . 1 1 78 78 PHE HB3 H 1 2.907 0.06 . 2 . . . . 78 Phe HB3 . 17033 1
690 . 1 1 78 78 PHE HD1 H 1 7.602 0.06 . 3 . . . . 78 Phe HD1 . 17033 1
691 . 1 1 78 78 PHE HD2 H 1 7.602 0.06 . 3 . . . . 78 Phe HD2 . 17033 1
692 . 1 1 78 78 PHE CA C 13 57.652 0.55 . 1 . . . . 78 Phe CA . 17033 1
693 . 1 1 78 78 PHE CB C 13 41.676 0.55 . 1 . . . . 78 Phe CB . 17033 1
694 . 1 1 78 78 PHE CD1 C 13 132.625 0.55 . 3 . . . . 78 Phe CD1 . 17033 1
695 . 1 1 78 78 PHE CD2 C 13 132.625 0.55 . 3 . . . . 78 Phe CD2 . 17033 1
696 . 1 1 78 78 PHE N N 15 128.546 0.55 . 1 . . . . 78 Phe N . 17033 1
697 . 1 1 79 79 LEU H H 1 8.832 0.06 . 1 . . . . 79 Leu H . 17033 1
698 . 1 1 79 79 LEU HA H 1 5.68 0.06 . 1 . . . . 79 Leu HA . 17033 1
699 . 1 1 79 79 LEU HB2 H 1 1.762 0.06 . 2 . . . . 79 Leu HB2 . 17033 1
700 . 1 1 79 79 LEU HB3 H 1 1.534 0.06 . 2 . . . . 79 Leu HB3 . 17033 1
701 . 1 1 79 79 LEU HD11 H 1 0.886 0.06 . 2 . . . . 79 Leu HD1 . 17033 1
702 . 1 1 79 79 LEU HD12 H 1 0.886 0.06 . 2 . . . . 79 Leu HD1 . 17033 1
703 . 1 1 79 79 LEU HD13 H 1 0.886 0.06 . 2 . . . . 79 Leu HD1 . 17033 1
704 . 1 1 79 79 LEU HD21 H 1 0.759 0.06 . 2 . . . . 79 Leu HD2 . 17033 1
705 . 1 1 79 79 LEU HD22 H 1 0.759 0.06 . 2 . . . . 79 Leu HD2 . 17033 1
706 . 1 1 79 79 LEU HD23 H 1 0.759 0.06 . 2 . . . . 79 Leu HD2 . 17033 1
707 . 1 1 79 79 LEU HG H 1 1.611 0.06 . 1 . . . . 79 Leu HG . 17033 1
708 . 1 1 79 79 LEU CA C 13 53.524 0.55 . 1 . . . . 79 Leu CA . 17033 1
709 . 1 1 79 79 LEU CB C 13 45.29 0.55 . 1 . . . . 79 Leu CB . 17033 1
710 . 1 1 79 79 LEU CD1 C 13 25.5 0.55 . 2 . . . . 79 Leu CD1 . 17033 1
711 . 1 1 79 79 LEU CD2 C 13 24.7 0.55 . 2 . . . . 79 Leu CD2 . 17033 1
712 . 1 1 79 79 LEU CG C 13 27.32 0.55 . 1 . . . . 79 Leu CG . 17033 1
713 . 1 1 79 79 LEU N N 15 121.48 0.55 . 1 . . . . 79 Leu N . 17033 1
714 . 1 1 80 80 ASP H H 1 8.421 0.06 . 1 . . . . 80 Asp H . 17033 1
715 . 1 1 80 80 ASP HA H 1 4.85 0.06 . 1 . . . . 80 Asp HA . 17033 1
716 . 1 1 80 80 ASP HB2 H 1 3.5 0.06 . 2 . . . . 80 Asp HB2 . 17033 1
717 . 1 1 80 80 ASP HB3 H 1 2.7 0.06 . 2 . . . . 80 Asp HB3 . 17033 1
718 . 1 1 80 80 ASP CA C 13 52.011 0.55 . 1 . . . . 80 Asp CA . 17033 1
719 . 1 1 80 80 ASP CB C 13 42.57 0.55 . 1 . . . . 80 Asp CB . 17033 1
720 . 1 1 80 80 ASP N N 15 120.668 0.55 . 1 . . . . 80 Asp N . 17033 1
721 . 1 1 81 81 SER HA H 1 4.215 0.06 . 1 . . . . 81 Ser HA . 17033 1
722 . 1 1 81 81 SER HB2 H 1 4.031 0.06 . 2 . . . . 81 Ser HB2 . 17033 1
723 . 1 1 81 81 SER HB3 H 1 3.991 0.06 . 2 . . . . 81 Ser HB3 . 17033 1
724 . 1 1 81 81 SER CA C 13 60.73 0.55 . 1 . . . . 81 Ser CA . 17033 1
725 . 1 1 81 81 SER CB C 13 63.159 0.55 . 1 . . . . 81 Ser CB . 17033 1
726 . 1 1 82 82 LYS H H 1 8.155 0.06 . 1 . . . . 82 Lys H . 17033 1
727 . 1 1 82 82 LYS HA H 1 4.541 0.06 . 1 . . . . 82 Lys HA . 17033 1
728 . 1 1 82 82 LYS HB2 H 1 1.999 0.06 . 2 . . . . 82 Lys HB2 . 17033 1
729 . 1 1 82 82 LYS HB3 H 1 1.999 0.06 . 2 . . . . 82 Lys HB3 . 17033 1
730 . 1 1 82 82 LYS HD2 H 1 1.689 0.06 . 2 . . . . 82 Lys HD2 . 17033 1
731 . 1 1 82 82 LYS HD3 H 1 1.689 0.06 . 2 . . . . 82 Lys HD3 . 17033 1
732 . 1 1 82 82 LYS HE2 H 1 2.999 0.06 . 2 . . . . 82 Lys HE2 . 17033 1
733 . 1 1 82 82 LYS HE3 H 1 2.999 0.06 . 2 . . . . 82 Lys HE3 . 17033 1
734 . 1 1 82 82 LYS HG2 H 1 1.446 0.06 . 2 . . . . 82 Lys HG2 . 17033 1
735 . 1 1 82 82 LYS HG3 H 1 1.446 0.06 . 2 . . . . 82 Lys HG3 . 17033 1
736 . 1 1 82 82 LYS CA C 13 55.6 0.55 . 1 . . . . 82 Lys CA . 17033 1
737 . 1 1 82 82 LYS CB C 13 32.566 0.55 . 1 . . . . 82 Lys CB . 17033 1
738 . 1 1 82 82 LYS CD C 13 28.79 0.55 . 1 . . . . 82 Lys CD . 17033 1
739 . 1 1 82 82 LYS CE C 13 42.29 0.55 . 1 . . . . 82 Lys CE . 17033 1
740 . 1 1 82 82 LYS CG C 13 24.954 0.55 . 1 . . . . 82 Lys CG . 17033 1
741 . 1 1 82 82 LYS N N 15 120.795 0.55 . 1 . . . . 82 Lys N . 17033 1
742 . 1 1 83 83 GLY H H 1 8.082 0.06 . 1 . . . . 83 Gly H . 17033 1
743 . 1 1 83 83 GLY HA2 H 1 4.236 0.06 . 2 . . . . 83 Gly HA2 . 17033 1
744 . 1 1 83 83 GLY HA3 H 1 3.586 0.06 . 2 . . . . 83 Gly HA3 . 17033 1
745 . 1 1 83 83 GLY CA C 13 45.773 0.55 . 1 . . . . 83 Gly CA . 17033 1
746 . 1 1 83 83 GLY N N 15 108.810 0.55 . 1 . . . . 83 Gly N . 17033 1
747 . 1 1 84 84 LEU H H 1 8.750 0.06 . 1 . . . . 84 Leu H . 17033 1
748 . 1 1 84 84 LEU HA H 1 4.300 0.06 . 1 . . . . 84 Leu HA . 17033 1
749 . 1 1 84 84 LEU HB2 H 1 1.599 0.06 . 2 . . . . 84 Leu HB2 . 17033 1
750 . 1 1 84 84 LEU HB3 H 1 1.599 0.06 . 2 . . . . 84 Leu HB3 . 17033 1
751 . 1 1 84 84 LEU HD11 H 1 0.856 0.06 . 2 . . . . 84 Leu HD1 . 17033 1
752 . 1 1 84 84 LEU HD12 H 1 0.856 0.06 . 2 . . . . 84 Leu HD1 . 17033 1
753 . 1 1 84 84 LEU HD13 H 1 0.856 0.06 . 2 . . . . 84 Leu HD1 . 17033 1
754 . 1 1 84 84 LEU HD21 H 1 0.856 0.06 . 2 . . . . 84 Leu HD2 . 17033 1
755 . 1 1 84 84 LEU HD22 H 1 0.856 0.06 . 2 . . . . 84 Leu HD2 . 17033 1
756 . 1 1 84 84 LEU HD23 H 1 0.856 0.06 . 2 . . . . 84 Leu HD2 . 17033 1
757 . 1 1 84 84 LEU HG H 1 1.598 0.06 . 1 . . . . 84 Leu HG . 17033 1
758 . 1 1 84 84 LEU CA C 13 55.431 0.55 . 1 . . . . 84 Leu CA . 17033 1
759 . 1 1 84 84 LEU CB C 13 41.652 0.55 . 1 . . . . 84 Leu CB . 17033 1
760 . 1 1 84 84 LEU CD1 C 13 24.0 0.55 . 2 . . . . 84 Leu CD1 . 17033 1
761 . 1 1 84 84 LEU CD2 C 13 24.0 0.55 . 2 . . . . 84 Leu CD2 . 17033 1
762 . 1 1 84 84 LEU CG C 13 27.57 0.55 . 1 . . . . 84 Leu CG . 17033 1
763 . 1 1 84 84 LEU N N 15 124.566 0.55 . 1 . . . . 84 Leu N . 17033 1
764 . 1 1 85 85 GLU H H 1 8.132 0.06 . 1 . . . . 85 Glu H . 17033 1
765 . 1 1 85 85 GLU HA H 1 4.413 0.06 . 1 . . . . 85 Glu HA . 17033 1
766 . 1 1 85 85 GLU HB2 H 1 1.964 0.06 . 2 . . . . 85 Glu HB2 . 17033 1
767 . 1 1 85 85 GLU HB3 H 1 1.747 0.06 . 2 . . . . 85 Glu HB3 . 17033 1
768 . 1 1 85 85 GLU HG2 H 1 2.405 0.06 . 2 . . . . 85 Glu HG2 . 17033 1
769 . 1 1 85 85 GLU HG3 H 1 2.029 0.06 . 2 . . . . 85 Glu HG3 . 17033 1
770 . 1 1 85 85 GLU CA C 13 57.097 0.55 . 1 . . . . 85 Glu CA . 17033 1
771 . 1 1 85 85 GLU CB C 13 31.731 0.55 . 1 . . . . 85 Glu CB . 17033 1
772 . 1 1 85 85 GLU CG C 13 36.751 0.55 . 1 . . . . 85 Glu CG . 17033 1
773 . 1 1 85 85 GLU N N 15 119.846 0.55 . 1 . . . . 85 Glu N . 17033 1
774 . 1 1 86 86 TYR H H 1 9.524 0.06 . 1 . . . . 86 Tyr H . 17033 1
775 . 1 1 86 86 TYR HA H 1 4.87 0.06 . 1 . . . . 86 Tyr HA . 17033 1
776 . 1 1 86 86 TYR HB2 H 1 3.53 0.06 . 2 . . . . 86 Tyr HB2 . 17033 1
777 . 1 1 86 86 TYR HB3 H 1 3.53 0.06 . 2 . . . . 86 Tyr HB3 . 17033 1
778 . 1 1 86 86 TYR HD1 H 1 7.328 0.06 . 3 . . . . 86 Tyr HD1 . 17033 1
779 . 1 1 86 86 TYR HD2 H 1 7.328 0.06 . 3 . . . . 86 Tyr HD2 . 17033 1
780 . 1 1 86 86 TYR HE1 H 1 6.86 0.06 . 3 . . . . 86 Tyr HE1 . 17033 1
781 . 1 1 86 86 TYR HE2 H 1 6.86 0.06 . 3 . . . . 86 Tyr HE2 . 17033 1
782 . 1 1 86 86 TYR CA C 13 55.979 0.55 . 1 . . . . 86 Tyr CA . 17033 1
783 . 1 1 86 86 TYR CB C 13 39.282 0.55 . 1 . . . . 86 Tyr CB . 17033 1
784 . 1 1 86 86 TYR CD1 C 13 133.804 0.55 . 3 . . . . 86 Tyr CD1 . 17033 1
785 . 1 1 86 86 TYR CD2 C 13 133.804 0.55 . 3 . . . . 86 Tyr CD2 . 17033 1
786 . 1 1 86 86 TYR CE1 C 13 118.34 0.55 . 3 . . . . 86 Tyr CE1 . 17033 1
787 . 1 1 86 86 TYR CE2 C 13 118.34 0.55 . 3 . . . . 86 Tyr CE2 . 17033 1
788 . 1 1 86 86 TYR N N 15 123.234 0.55 . 1 . . . . 86 Tyr N . 17033 1
789 . 1 1 87 87 PRO HA H 1 4.779 0.06 . 1 . . . . 87 Pro HA . 17033 1
790 . 1 1 87 87 PRO HB2 H 1 2.07 0.06 . 2 . . . . 87 Pro HB2 . 17033 1
791 . 1 1 87 87 PRO HB3 H 1 1.954 0.06 . 2 . . . . 87 Pro HB3 . 17033 1
792 . 1 1 87 87 PRO HD2 H 1 3.66 0.06 . 2 . . . . 87 Pro HD2 . 17033 1
793 . 1 1 87 87 PRO HD3 H 1 3.514 0.06 . 2 . . . . 87 Pro HD3 . 17033 1
794 . 1 1 87 87 PRO HG2 H 1 2.193 0.06 . 2 . . . . 87 Pro HG2 . 17033 1
795 . 1 1 87 87 PRO HG3 H 1 1.887 0.06 . 2 . . . . 87 Pro HG3 . 17033 1
796 . 1 1 87 87 PRO CA C 13 61.621 0.55 . 1 . . . . 87 Pro CA . 17033 1
797 . 1 1 87 87 PRO CB C 13 30.42 0.55 . 1 . . . . 87 Pro CB . 17033 1
798 . 1 1 87 87 PRO CD C 13 50.5 0.55 . 1 . . . . 87 Pro CD . 17033 1
799 . 1 1 87 87 PRO CG C 13 27.865 0.55 . 1 . . . . 87 Pro CG . 17033 1
800 . 1 1 88 88 ALA H H 1 9.484 0.06 . 1 . . . . 88 Ala H . 17033 1
801 . 1 1 88 88 ALA HA H 1 4.432 0.06 . 1 . . . . 88 Ala HA . 17033 1
802 . 1 1 88 88 ALA HB1 H 1 1.792 0.06 . 1 . . . . 88 Ala HB . 17033 1
803 . 1 1 88 88 ALA HB2 H 1 1.792 0.06 . 1 . . . . 88 Ala HB . 17033 1
804 . 1 1 88 88 ALA HB3 H 1 1.792 0.06 . 1 . . . . 88 Ala HB . 17033 1
805 . 1 1 88 88 ALA CA C 13 52.784 0.55 . 1 . . . . 88 Ala CA . 17033 1
806 . 1 1 88 88 ALA CB C 13 20.028 0.55 . 1 . . . . 88 Ala CB . 17033 1
807 . 1 1 88 88 ALA N N 15 132.614 0.55 . 1 . . . . 88 Ala N . 17033 1
808 . 1 1 89 89 VAL H H 1 7.949 0.06 . 1 . . . . 89 Val H . 17033 1
809 . 1 1 89 89 VAL HA H 1 4.580 0.06 . 1 . . . . 89 Val HA . 17033 1
810 . 1 1 89 89 VAL HB H 1 1.534 0.06 . 1 . . . . 89 Val HB . 17033 1
811 . 1 1 89 89 VAL HG11 H 1 0.882 0.06 . 2 . . . . 89 Val HG1 . 17033 1
812 . 1 1 89 89 VAL HG12 H 1 0.882 0.06 . 2 . . . . 89 Val HG1 . 17033 1
813 . 1 1 89 89 VAL HG13 H 1 0.882 0.06 . 2 . . . . 89 Val HG1 . 17033 1
814 . 1 1 89 89 VAL HG21 H 1 0.802 0.06 . 2 . . . . 89 Val HG2 . 17033 1
815 . 1 1 89 89 VAL HG22 H 1 0.802 0.06 . 2 . . . . 89 Val HG2 . 17033 1
816 . 1 1 89 89 VAL HG23 H 1 0.802 0.06 . 2 . . . . 89 Val HG2 . 17033 1
817 . 1 1 89 89 VAL CA C 13 61.302 0.55 . 1 . . . . 89 Val CA . 17033 1
818 . 1 1 89 89 VAL CB C 13 34.567 0.55 . 1 . . . . 89 Val CB . 17033 1
819 . 1 1 89 89 VAL CG1 C 13 21.25 0.55 . 2 . . . . 89 Val CG1 . 17033 1
820 . 1 1 89 89 VAL CG2 C 13 20.6 0.55 . 2 . . . . 89 Val CG2 . 17033 1
821 . 1 1 89 89 VAL N N 15 121.500 0.55 . 1 . . . . 89 Val N . 17033 1
822 . 1 1 90 90 VAL H H 1 8.823 0.06 . 1 . . . . 90 Val H . 17033 1
823 . 1 1 90 90 VAL HA H 1 5.251 0.06 . 1 . . . . 90 Val HA . 17033 1
824 . 1 1 90 90 VAL HB H 1 1.878 0.06 . 1 . . . . 90 Val HB . 17033 1
825 . 1 1 90 90 VAL HG11 H 1 0.920 0.06 . 2 . . . . 90 Val HG1 . 17033 1
826 . 1 1 90 90 VAL HG12 H 1 0.920 0.06 . 2 . . . . 90 Val HG1 . 17033 1
827 . 1 1 90 90 VAL HG13 H 1 0.920 0.06 . 2 . . . . 90 Val HG1 . 17033 1
828 . 1 1 90 90 VAL HG21 H 1 0.920 0.06 . 2 . . . . 90 Val HG2 . 17033 1
829 . 1 1 90 90 VAL HG22 H 1 0.920 0.06 . 2 . . . . 90 Val HG2 . 17033 1
830 . 1 1 90 90 VAL HG23 H 1 0.920 0.06 . 2 . . . . 90 Val HG2 . 17033 1
831 . 1 1 90 90 VAL CA C 13 60.949 0.55 . 1 . . . . 90 Val CA . 17033 1
832 . 1 1 90 90 VAL CB C 13 33.696 0.55 . 1 . . . . 90 Val CB . 17033 1
833 . 1 1 90 90 VAL CG1 C 13 21.76 0.55 . 2 . . . . 90 Val CG1 . 17033 1
834 . 1 1 90 90 VAL CG2 C 13 21.76 0.55 . 2 . . . . 90 Val CG2 . 17033 1
835 . 1 1 90 90 VAL N N 15 126.842 0.55 . 1 . . . . 90 Val N . 17033 1
836 . 1 1 91 91 GLU H H 1 9.033 0.06 . 1 . . . . 91 Glu H . 17033 1
837 . 1 1 91 91 GLU HA H 1 4.632 0.06 . 1 . . . . 91 Glu HA . 17033 1
838 . 1 1 91 91 GLU HB2 H 1 1.894 0.06 . 2 . . . . 91 Glu HB2 . 17033 1
839 . 1 1 91 91 GLU HB3 H 1 1.894 0.06 . 2 . . . . 91 Glu HB3 . 17033 1
840 . 1 1 91 91 GLU HG2 H 1 2.088 0.06 . 2 . . . . 91 Glu HG2 . 17033 1
841 . 1 1 91 91 GLU HG3 H 1 2.018 0.06 . 2 . . . . 91 Glu HG3 . 17033 1
842 . 1 1 91 91 GLU CA C 13 53.742 0.55 . 1 . . . . 91 Glu CA . 17033 1
843 . 1 1 91 91 GLU CB C 13 33.814 0.55 . 1 . . . . 91 Glu CB . 17033 1
844 . 1 1 91 91 GLU CG C 13 35.99 0.55 . 1 . . . . 91 Glu CG . 17033 1
845 . 1 1 91 91 GLU N N 15 124.982 0.55 . 1 . . . . 91 Glu N . 17033 1
846 . 1 1 92 92 PHE H H 1 8.412 0.06 . 1 . . . . 92 Phe H . 17033 1
847 . 1 1 92 92 PHE HA H 1 5.099 0.06 . 1 . . . . 92 Phe HA . 17033 1
848 . 1 1 92 92 PHE HB2 H 1 3.19 0.06 . 2 . . . . 92 Phe HB2 . 17033 1
849 . 1 1 92 92 PHE HB3 H 1 2.998 0.06 . 2 . . . . 92 Phe HB3 . 17033 1
850 . 1 1 92 92 PHE HD1 H 1 7.26 0.06 . 3 . . . . 92 Phe HD1 . 17033 1
851 . 1 1 92 92 PHE HD2 H 1 7.26 0.06 . 3 . . . . 92 Phe HD2 . 17033 1
852 . 1 1 92 92 PHE CA C 13 56.735 0.55 . 1 . . . . 92 Phe CA . 17033 1
853 . 1 1 92 92 PHE CB C 13 39.7 0.55 . 1 . . . . 92 Phe CB . 17033 1
854 . 1 1 92 92 PHE CD1 C 13 131.8 0.55 . 3 . . . . 92 Phe CD1 . 17033 1
855 . 1 1 92 92 PHE CD2 C 13 131.9 0.55 . 3 . . . . 92 Phe CD2 . 17033 1
856 . 1 1 92 92 PHE N N 15 119.445 0.55 . 1 . . . . 92 Phe N . 17033 1
857 . 1 1 93 93 ALA H H 1 8.76 0.06 . 1 . . . . 93 Ala H . 17033 1
858 . 1 1 93 93 ALA HA H 1 4.65 0.06 . 1 . . . . 93 Ala HA . 17033 1
859 . 1 1 93 93 ALA HB1 H 1 1.21 0.06 . 1 . . . . 93 Ala HB . 17033 1
860 . 1 1 93 93 ALA HB2 H 1 1.21 0.06 . 1 . . . . 93 Ala HB . 17033 1
861 . 1 1 93 93 ALA HB3 H 1 1.21 0.06 . 1 . . . . 93 Ala HB . 17033 1
862 . 1 1 93 93 ALA CA C 13 50.21 0.55 . 1 . . . . 93 Ala CA . 17033 1
863 . 1 1 93 93 ALA CB C 13 19.05 0.55 . 1 . . . . 93 Ala CB . 17033 1
864 . 1 1 93 93 ALA N N 15 127.94 0.55 . 1 . . . . 93 Ala N . 17033 1
865 . 1 1 94 94 PRO HA H 1 4.35 0.06 . 1 . . . . 94 Pro HA . 17033 1
866 . 1 1 94 94 PRO HB2 H 1 2.106 0.06 . 2 . . . . 94 Pro HB2 . 17033 1
867 . 1 1 94 94 PRO HB3 H 1 1.702 0.06 . 2 . . . . 94 Pro HB3 . 17033 1
868 . 1 1 94 94 PRO HD2 H 1 3.495 0.06 . 2 . . . . 94 Pro HD2 . 17033 1
869 . 1 1 94 94 PRO HD3 H 1 3.452 0.06 . 2 . . . . 94 Pro HD3 . 17033 1
870 . 1 1 94 94 PRO HG2 H 1 1.852 0.06 . 2 . . . . 94 Pro HG2 . 17033 1
871 . 1 1 94 94 PRO HG3 H 1 1.852 0.06 . 2 . . . . 94 Pro HG3 . 17033 1
872 . 1 1 94 94 PRO CA C 13 62.98 0.55 . 1 . . . . 94 Pro CA . 17033 1
873 . 1 1 94 94 PRO CB C 13 31.734 0.55 . 1 . . . . 94 Pro CB . 17033 1
874 . 1 1 94 94 PRO CD C 13 50.57 0.55 . 1 . . . . 94 Pro CD . 17033 1
875 . 1 1 94 94 PRO CG C 13 27.33 0.55 . 1 . . . . 94 Pro CG . 17033 1
876 . 1 1 95 95 PHE H H 1 8.091 0.06 . 1 . . . . 95 Phe H . 17033 1
877 . 1 1 95 95 PHE HA H 1 4.504 0.06 . 1 . . . . 95 Phe HA . 17033 1
878 . 1 1 95 95 PHE HB2 H 1 2.962 0.06 . 2 . . . . 95 Phe HB2 . 17033 1
879 . 1 1 95 95 PHE HB3 H 1 2.962 0.06 . 2 . . . . 95 Phe HB3 . 17033 1
880 . 1 1 95 95 PHE HD1 H 1 7.063 0.06 . 3 . . . . 95 Phe HD1 . 17033 1
881 . 1 1 95 95 PHE HD2 H 1 7.063 0.06 . 3 . . . . 95 Phe HD2 . 17033 1
882 . 1 1 95 95 PHE CA C 13 57.314 0.55 . 1 . . . . 95 Phe CA . 17033 1
883 . 1 1 95 95 PHE CB C 13 39.422 0.55 . 1 . . . . 95 Phe CB . 17033 1
884 . 1 1 95 95 PHE CD1 C 13 131.69 0.55 . 3 . . . . 95 Phe CD1 . 17033 1
885 . 1 1 95 95 PHE CD2 C 13 131.69 0.55 . 3 . . . . 95 Phe CD2 . 17033 1
886 . 1 1 95 95 PHE N N 15 119.403 0.55 . 1 . . . . 95 Phe N . 17033 1
887 . 1 1 96 96 GLN H H 1 7.962 0.06 . 1 . . . . 96 Gln H . 17033 1
888 . 1 1 96 96 GLN HA H 1 4.176 0.06 . 1 . . . . 96 Gln HA . 17033 1
889 . 1 1 96 96 GLN HB2 H 1 1.952 0.06 . 2 . . . . 96 Gln HB2 . 17033 1
890 . 1 1 96 96 GLN HB3 H 1 1.768 0.06 . 2 . . . . 96 Gln HB3 . 17033 1
891 . 1 1 96 96 GLN HE21 H 1 7.53 0.06 . 2 . . . . 96 Gln HE21 . 17033 1
892 . 1 1 96 96 GLN HE22 H 1 7.12 0.06 . 2 . . . . 96 Gln HE22 . 17033 1
893 . 1 1 96 96 GLN HG2 H 1 2.348 0.06 . 2 . . . . 96 Gln HG2 . 17033 1
894 . 1 1 96 96 GLN HG3 H 1 2.136 0.06 . 2 . . . . 96 Gln HG3 . 17033 1
895 . 1 1 96 96 GLN CA C 13 55.624 0.55 . 1 . . . . 96 Gln CA . 17033 1
896 . 1 1 96 96 GLN CB C 13 29.899 0.55 . 1 . . . . 96 Gln CB . 17033 1
897 . 1 1 96 96 GLN CG C 13 33.80 0.55 . 1 . . . . 96 Gln CG . 17033 1
898 . 1 1 96 96 GLN N N 15 122.670 0.55 . 1 . . . . 96 Gln N . 17033 1
899 . 1 1 96 96 GLN NE2 N 15 112.8 0.55 . 1 . . . . 96 Gln NE2 . 17033 1
900 . 1 1 97 97 LYS H H 1 7.783 0.06 . 1 . . . . 97 Lys H . 17033 1
901 . 1 1 97 97 LYS HA H 1 3.992 0.06 . 1 . . . . 97 Lys HA . 17033 1
902 . 1 1 97 97 LYS HB2 H 1 1.69 0.06 . 2 . . . . 97 Lys HB2 . 17033 1
903 . 1 1 97 97 LYS HB3 H 1 1.568 0.06 . 2 . . . . 97 Lys HB3 . 17033 1
904 . 1 1 97 97 LYS HD2 H 1 1.573 0.06 . 2 . . . . 97 Lys HD2 . 17033 1
905 . 1 1 97 97 LYS HD3 H 1 1.573 0.06 . 2 . . . . 97 Lys HD3 . 17033 1
906 . 1 1 97 97 LYS HE2 H 1 2.87 0.06 . 2 . . . . 97 Lys HE2 . 17033 1
907 . 1 1 97 97 LYS HE3 H 1 2.87 0.06 . 2 . . . . 97 Lys HE3 . 17033 1
908 . 1 1 97 97 LYS HG2 H 1 1.251 0.06 . 2 . . . . 97 Lys HG2 . 17033 1
909 . 1 1 97 97 LYS HG3 H 1 1.251 0.06 . 2 . . . . 97 Lys HG3 . 17033 1
910 . 1 1 97 97 LYS CA C 13 57.732 0.55 . 1 . . . . 97 Lys CA . 17033 1
911 . 1 1 97 97 LYS CB C 13 33.809 0.55 . 1 . . . . 97 Lys CB . 17033 1
912 . 1 1 97 97 LYS CD C 13 29.2 0.55 . 1 . . . . 97 Lys CD . 17033 1
913 . 1 1 97 97 LYS CE C 13 42.15 0.55 . 1 . . . . 97 Lys CE . 17033 1
914 . 1 1 97 97 LYS CG C 13 24.89 0.55 . 1 . . . . 97 Lys CG . 17033 1
915 . 1 1 97 97 LYS N N 15 127.851 0.55 . 1 . . . . 97 Lys N . 17033 1
stop_
save_