Content for NMR-STAR saveframe, "SH3_35%_bound_cs"
save_SH3_35%_bound_cs
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode SH3_35%_bound_cs
_Assigned_chem_shift_list.Entry_ID 15912
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $isotropic_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
;
SH2 domain at 35% bound
3.4mM 14N 12C
1.5mM 15N 13C
;
_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' . . . 15912 2
2 '2D 1H-13C HSQC' . . . 15912 2
4 '3D HNCO' . . . 15912 2
5 '3D HNCACB' . . . 15912 2
6 '3D HBHA(CO)NH' . . . 15912 2
7 '3D HCCH-TOCSY' . . . 15912 2
9 '3D 1H-15N TOCSY' . . . 15912 2
15 (HB)CB(CGCDCE)HE . . . 15912 2
16 (HB)CB(CGCD)HD . . . 15912 2
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
2 $CARA . . 15912 2
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 1 1 GLY H H 1 8.57 0.02 . 1 . . . . 169 GLY H . 15912 2
2 . 1 1 1 1 GLY CA C 13 40.91 0.3 . 1 . . . . 169 GLY CA . 15912 2
3 . 1 1 1 1 GLY N N 15 107.98 0.3 . 1 . . . . 169 GLY N . 15912 2
4 . 1 1 2 2 SER HA H 1 4.48 0.02 . 1 . . . . 170 SER HA . 15912 2
5 . 1 1 2 2 SER CA C 13 53.34 0.3 . 1 . . . . 170 SER CA . 15912 2
6 . 1 1 2 2 SER CB C 13 61.22 0.3 . 1 . . . . 170 SER CB . 15912 2
7 . 1 1 3 3 PRO HA H 1 4.28 0.02 . 1 . . . . 171 PRO HA . 15912 2
8 . 1 1 3 3 PRO HB2 H 1 2.16 0.02 . 2 . . . . 171 PRO HB2 . 15912 2
9 . 1 1 3 3 PRO HB3 H 1 1.76 0.02 . 2 . . . . 171 PRO HB3 . 15912 2
10 . 1 1 3 3 PRO HG2 H 1 1.89 0.02 . 2 . . . . 171 PRO HG2 . 15912 2
11 . 1 1 3 3 PRO HG3 H 1 1.85 0.02 . 2 . . . . 171 PRO HG3 . 15912 2
12 . 1 1 3 3 PRO C C 13 174.29 0.3 . 1 . . . . 171 PRO C . 15912 2
13 . 1 1 3 3 PRO CA C 13 61.25 0.3 . 1 . . . . 171 PRO CA . 15912 2
14 . 1 1 3 3 PRO CB C 13 29.41 0.3 . 1 . . . . 171 PRO CB . 15912 2
15 . 1 1 3 3 PRO CD C 13 48.13 0.3 . 1 . . . . 171 PRO CD . 15912 2
16 . 1 1 3 3 PRO CG C 13 24.81 0.3 . 1 . . . . 171 PRO CG . 15912 2
17 . 1 1 4 4 GLU H H 1 8.32 0.02 . 1 . . . . 172 GLU H . 15912 2
18 . 1 1 4 4 GLU HA H 1 4.08 0.02 . 1 . . . . 172 GLU HA . 15912 2
19 . 1 1 4 4 GLU HB2 H 1 1.76 0.02 . 2 . . . . 172 GLU HB2 . 15912 2
20 . 1 1 4 4 GLU HB3 H 1 1.92 0.02 . 2 . . . . 172 GLU HB3 . 15912 2
21 . 1 1 4 4 GLU HG2 H 1 2.18 0.02 . 2 . . . . 172 GLU HG2 . 15912 2
22 . 1 1 4 4 GLU HG3 H 1 2.12 0.02 . 2 . . . . 172 GLU HG3 . 15912 2
23 . 1 1 4 4 GLU C C 13 173.56 0.3 . 1 . . . . 172 GLU C . 15912 2
24 . 1 1 4 4 GLU CA C 13 54.43 0.3 . 1 . . . . 172 GLU CA . 15912 2
25 . 1 1 4 4 GLU CB C 13 27.26 0.3 . 1 . . . . 172 GLU CB . 15912 2
26 . 1 1 4 4 GLU CG C 13 33.70 0.3 . 1 . . . . 172 GLU CG . 15912 2
27 . 1 1 4 4 GLU N N 15 119.35 0.3 . 1 . . . . 172 GLU N . 15912 2
28 . 1 1 5 5 GLU H H 1 8.03 0.02 . 1 . . . . 173 GLU H . 15912 2
29 . 1 1 5 5 GLU HA H 1 4.25 0.02 . 1 . . . . 173 GLU HA . 15912 2
30 . 1 1 5 5 GLU HG2 H 1 2.10 0.02 . 2 . . . . 173 GLU HG2 . 15912 2
31 . 1 1 5 5 GLU HG3 H 1 2.07 0.02 . 2 . . . . 173 GLU HG3 . 15912 2
32 . 1 1 5 5 GLU C C 13 173.22 0.3 . 1 . . . . 173 GLU C . 15912 2
33 . 1 1 5 5 GLU CA C 13 54.39 0.3 . 1 . . . . 173 GLU CA . 15912 2
34 . 1 1 5 5 GLU CB C 13 28.11 0.3 . 1 . . . . 173 GLU CB . 15912 2
35 . 1 1 5 5 GLU CG C 13 33.73 0.3 . 1 . . . . 173 GLU CG . 15912 2
36 . 1 1 5 5 GLU N N 15 120.55 0.3 . 1 . . . . 173 GLU N . 15912 2
37 . 1 1 6 6 THR H H 1 8.55 0.02 . 1 . . . . 174 THR H . 15912 2
38 . 1 1 6 6 THR HA H 1 4.27 0.02 . 1 . . . . 174 THR HA . 15912 2
39 . 1 1 6 6 THR HB H 1 4.01 0.02 . 1 . . . . 174 THR HB . 15912 2
40 . 1 1 6 6 THR HG21 H 1 1.05 0.02 . 1 . . . . 174 THR HG2 . 15912 2
41 . 1 1 6 6 THR HG22 H 1 1.05 0.02 . 1 . . . . 174 THR HG2 . 15912 2
42 . 1 1 6 6 THR HG23 H 1 1.05 0.02 . 1 . . . . 174 THR HG2 . 15912 2
43 . 1 1 6 6 THR C C 13 170.17 0.3 . 1 . . . . 174 THR C . 15912 2
44 . 1 1 6 6 THR CA C 13 59.95 0.3 . 1 . . . . 174 THR CA . 15912 2
45 . 1 1 6 6 THR CB C 13 67.50 0.3 . 1 . . . . 174 THR CB . 15912 2
46 . 1 1 6 6 THR CG2 C 13 19.17 0.3 . 1 . . . . 174 THR CG2 . 15912 2
47 . 1 1 6 6 THR N N 15 119.00 0.3 . 1 . . . . 174 THR N . 15912 2
48 . 1 1 7 7 LEU H H 1 8.43 0.02 . 1 . . . . 175 LEU H . 15912 2
49 . 1 1 7 7 LEU HA H 1 5.06 0.02 . 1 . . . . 175 LEU HA . 15912 2
50 . 1 1 7 7 LEU HB2 H 1 1.59 0.02 . 2 . . . . 175 LEU HB2 . 15912 2
51 . 1 1 7 7 LEU HB3 H 1 1.08 0.02 . 2 . . . . 175 LEU HB3 . 15912 2
52 . 1 1 7 7 LEU HD11 H 1 0.64 0.02 . 1 . . . . 175 LEU HD1 . 15912 2
53 . 1 1 7 7 LEU HD12 H 1 0.64 0.02 . 1 . . . . 175 LEU HD1 . 15912 2
54 . 1 1 7 7 LEU HD13 H 1 0.64 0.02 . 1 . . . . 175 LEU HD1 . 15912 2
55 . 1 1 7 7 LEU HD21 H 1 0.34 0.02 . 1 . . . . 175 LEU HD2 . 15912 2
56 . 1 1 7 7 LEU HD22 H 1 0.34 0.02 . 1 . . . . 175 LEU HD2 . 15912 2
57 . 1 1 7 7 LEU HD23 H 1 0.34 0.02 . 1 . . . . 175 LEU HD2 . 15912 2
58 . 1 1 7 7 LEU HG H 1 1.42 0.02 . 1 . . . . 175 LEU HG . 15912 2
59 . 1 1 7 7 LEU C C 13 174.37 0.3 . 1 . . . . 175 LEU C . 15912 2
60 . 1 1 7 7 LEU CA C 13 51.34 0.3 . 1 . . . . 175 LEU CA . 15912 2
61 . 1 1 7 7 LEU CB C 13 41.99 0.3 . 1 . . . . 175 LEU CB . 15912 2
62 . 1 1 7 7 LEU CD1 C 13 22.94 0.3 . 1 . . . . 175 LEU CD1 . 15912 2
63 . 1 1 7 7 LEU CD2 C 13 21.55 0.3 . 1 . . . . 175 LEU CD2 . 15912 2
64 . 1 1 7 7 LEU CG C 13 25.09 0.3 . 1 . . . . 175 LEU CG . 15912 2
65 . 1 1 7 7 LEU N N 15 127.13 0.3 . 1 . . . . 175 LEU N . 15912 2
66 . 1 1 8 8 VAL H H 1 9.20 0.02 . 1 . . . . 176 VAL H . 15912 2
67 . 1 1 8 8 VAL HA H 1 5.11 0.02 . 1 . . . . 176 VAL HA . 15912 2
68 . 1 1 8 8 VAL HB H 1 2.02 0.02 . 1 . . . . 176 VAL HB . 15912 2
69 . 1 1 8 8 VAL HG11 H 1 0.84 0.02 . 1 . . . . 176 VAL HG1 . 15912 2
70 . 1 1 8 8 VAL HG12 H 1 0.84 0.02 . 1 . . . . 176 VAL HG1 . 15912 2
71 . 1 1 8 8 VAL HG13 H 1 0.84 0.02 . 1 . . . . 176 VAL HG1 . 15912 2
72 . 1 1 8 8 VAL HG21 H 1 0.84 0.02 . 1 . . . . 176 VAL HG2 . 15912 2
73 . 1 1 8 8 VAL HG22 H 1 0.84 0.02 . 1 . . . . 176 VAL HG2 . 15912 2
74 . 1 1 8 8 VAL HG23 H 1 0.84 0.02 . 1 . . . . 176 VAL HG2 . 15912 2
75 . 1 1 8 8 VAL C C 13 170.92 0.3 . 1 . . . . 176 VAL C . 15912 2
76 . 1 1 8 8 VAL CA C 13 55.44 0.3 . 1 . . . . 176 VAL CA . 15912 2
77 . 1 1 8 8 VAL CB C 13 33.01 0.3 . 1 . . . . 176 VAL CB . 15912 2
78 . 1 1 8 8 VAL CG1 C 13 18.09 0.3 . 1 . . . . 176 VAL CG1 . 15912 2
79 . 1 1 8 8 VAL CG2 C 13 20.76 0.3 . 1 . . . . 176 VAL CG2 . 15912 2
80 . 1 1 8 8 VAL N N 15 114.51 0.3 . 1 . . . . 176 VAL N . 15912 2
81 . 1 1 9 9 ILE H H 1 9.26 0.02 . 1 . . . . 177 ILE H . 15912 2
82 . 1 1 9 9 ILE HA H 1 5.00 0.02 . 1 . . . . 177 ILE HA . 15912 2
83 . 1 1 9 9 ILE HB H 1 1.47 0.02 . 1 . . . . 177 ILE HB . 15912 2
84 . 1 1 9 9 ILE HD11 H 1 0.70 0.02 . 1 . . . . 177 ILE HD1 . 15912 2
85 . 1 1 9 9 ILE HD12 H 1 0.70 0.02 . 1 . . . . 177 ILE HD1 . 15912 2
86 . 1 1 9 9 ILE HD13 H 1 0.70 0.02 . 1 . . . . 177 ILE HD1 . 15912 2
87 . 1 1 9 9 ILE HG12 H 1 1.31 0.02 . 2 . . . . 177 ILE HG12 . 15912 2
88 . 1 1 9 9 ILE HG13 H 1 0.94 0.02 . 2 . . . . 177 ILE HG13 . 15912 2
89 . 1 1 9 9 ILE HG21 H 1 0.72 0.02 . 1 . . . . 177 ILE HG2 . 15912 2
90 . 1 1 9 9 ILE HG22 H 1 0.72 0.02 . 1 . . . . 177 ILE HG2 . 15912 2
91 . 1 1 9 9 ILE HG23 H 1 0.72 0.02 . 1 . . . . 177 ILE HG2 . 15912 2
92 . 1 1 9 9 ILE C C 13 173.31 0.3 . 1 . . . . 177 ILE C . 15912 2
93 . 1 1 9 9 ILE CA C 13 56.04 0.3 . 1 . . . . 177 ILE CA . 15912 2
94 . 1 1 9 9 ILE CB C 13 38.73 0.3 . 1 . . . . 177 ILE CB . 15912 2
95 . 1 1 9 9 ILE CD1 C 13 11.18 0.3 . 1 . . . . 177 ILE CD1 . 15912 2
96 . 1 1 9 9 ILE CG1 C 13 25.59 0.3 . 1 . . . . 177 ILE CG1 . 15912 2
97 . 1 1 9 9 ILE CG2 C 13 15.03 0.3 . 1 . . . . 177 ILE CG2 . 15912 2
98 . 1 1 9 9 ILE N N 15 120.63 0.3 . 1 . . . . 177 ILE N . 15912 2
99 . 1 1 10 10 ALA H H 1 8.14 0.02 . 1 . . . . 178 ALA H . 15912 2
100 . 1 1 10 10 ALA HA H 1 5.02 0.02 . 1 . . . . 178 ALA HA . 15912 2
101 . 1 1 10 10 ALA HB1 H 1 1.58 0.02 . 1 . . . . 178 ALA HB . 15912 2
102 . 1 1 10 10 ALA HB2 H 1 1.58 0.02 . 1 . . . . 178 ALA HB . 15912 2
103 . 1 1 10 10 ALA HB3 H 1 1.58 0.02 . 1 . . . . 178 ALA HB . 15912 2
104 . 1 1 10 10 ALA C C 13 176.10 0.3 . 1 . . . . 178 ALA C . 15912 2
105 . 1 1 10 10 ALA CA C 13 48.68 0.3 . 1 . . . . 178 ALA CA . 15912 2
106 . 1 1 10 10 ALA CB C 13 17.41 0.3 . 1 . . . . 178 ALA CB . 15912 2
107 . 1 1 10 10 ALA N N 15 125.35 0.3 . 1 . . . . 178 ALA N . 15912 2
108 . 1 1 11 11 LEU H H 1 9.27 0.02 . 1 . . . . 179 LEU H . 15912 2
109 . 1 1 11 11 LEU HA H 1 3.82 0.02 . 1 . . . . 179 LEU HA . 15912 2
110 . 1 1 11 11 LEU HB2 H 1 0.86 0.02 . 2 . . . . 179 LEU HB2 . 15912 2
111 . 1 1 11 11 LEU HB3 H 1 0.49 0.02 . 2 . . . . 179 LEU HB3 . 15912 2
112 . 1 1 11 11 LEU HD11 H 1 0.58 0.02 . 1 . . . . 179 LEU HD1 . 15912 2
113 . 1 1 11 11 LEU HD12 H 1 0.58 0.02 . 1 . . . . 179 LEU HD1 . 15912 2
114 . 1 1 11 11 LEU HD13 H 1 0.58 0.02 . 1 . . . . 179 LEU HD1 . 15912 2
115 . 1 1 11 11 LEU HD21 H 1 0.53 0.02 . 1 . . . . 179 LEU HD2 . 15912 2
116 . 1 1 11 11 LEU HD22 H 1 0.53 0.02 . 1 . . . . 179 LEU HD2 . 15912 2
117 . 1 1 11 11 LEU HD23 H 1 0.53 0.02 . 1 . . . . 179 LEU HD2 . 15912 2
118 . 1 1 11 11 LEU HG H 1 1.17 0.02 . 1 . . . . 179 LEU HG . 15912 2
119 . 1 1 11 11 LEU C C 13 172.83 0.3 . 1 . . . . 179 LEU C . 15912 2
120 . 1 1 11 11 LEU CA C 13 52.95 0.3 . 1 . . . . 179 LEU CA . 15912 2
121 . 1 1 11 11 LEU CB C 13 41.34 0.3 . 1 . . . . 179 LEU CB . 15912 2
122 . 1 1 11 11 LEU CD1 C 13 22.71 0.3 . 1 . . . . 179 LEU CD1 . 15912 2
123 . 1 1 11 11 LEU CD2 C 13 19.89 0.3 . 1 . . . . 179 LEU CD2 . 15912 2
124 . 1 1 11 11 LEU CG C 13 24.03 0.3 . 1 . . . . 179 LEU CG . 15912 2
125 . 1 1 11 11 LEU N N 15 125.92 0.3 . 1 . . . . 179 LEU N . 15912 2
126 . 1 1 12 12 TYR H H 1 6.95 0.02 . 1 . . . . 180 TYR H . 15912 2
127 . 1 1 12 12 TYR HA H 1 4.59 0.02 . 1 . . . . 180 TYR HA . 15912 2
128 . 1 1 12 12 TYR HB2 H 1 3.02 0.02 . 2 . . . . 180 TYR HB2 . 15912 2
129 . 1 1 12 12 TYR HB3 H 1 2.26 0.02 . 2 . . . . 180 TYR HB3 . 15912 2
130 . 1 1 12 12 TYR C C 13 170.94 0.3 . 1 . . . . 180 TYR C . 15912 2
131 . 1 1 12 12 TYR CA C 13 50.96 0.3 . 1 . . . . 180 TYR CA . 15912 2
132 . 1 1 12 12 TYR CB C 13 39.78 0.3 . 1 . . . . 180 TYR CB . 15912 2
133 . 1 1 12 12 TYR N N 15 111.35 0.3 . 1 . . . . 180 TYR N . 15912 2
134 . 1 1 13 13 ASP H H 1 8.15 0.02 . 1 . . . . 181 ASP H . 15912 2
135 . 1 1 13 13 ASP HA H 1 4.51 0.02 . 1 . . . . 181 ASP HA . 15912 2
136 . 1 1 13 13 ASP HB2 H 1 2.57 0.02 . 2 . . . . 181 ASP HB2 . 15912 2
137 . 1 1 13 13 ASP HB3 H 1 2.48 0.02 . 2 . . . . 181 ASP HB3 . 15912 2
138 . 1 1 13 13 ASP C C 13 173.29 0.3 . 1 . . . . 181 ASP C . 15912 2
139 . 1 1 13 13 ASP CA C 13 51.89 0.3 . 1 . . . . 181 ASP CA . 15912 2
140 . 1 1 13 13 ASP CB C 13 39.09 0.3 . 1 . . . . 181 ASP CB . 15912 2
141 . 1 1 13 13 ASP N N 15 117.63 0.3 . 1 . . . . 181 ASP N . 15912 2
142 . 1 1 14 14 TYR H H 1 8.65 0.02 . 1 . . . . 182 TYR H . 15912 2
143 . 1 1 14 14 TYR HA H 1 4.82 0.02 . 1 . . . . 182 TYR HA . 15912 2
144 . 1 1 14 14 TYR C C 13 171.14 0.3 . 1 . . . . 182 TYR C . 15912 2
145 . 1 1 14 14 TYR CA C 13 54.94 0.3 . 1 . . . . 182 TYR CA . 15912 2
146 . 1 1 14 14 TYR CB C 13 38.98 0.3 . 1 . . . . 182 TYR CB . 15912 2
147 . 1 1 14 14 TYR N N 15 121.64 0.3 . 1 . . . . 182 TYR N . 15912 2
148 . 1 1 15 15 GLN H H 1 7.88 0.02 . 1 . . . . 183 GLN H . 15912 2
149 . 1 1 15 15 GLN HA H 1 4.36 0.02 . 1 . . . . 183 GLN HA . 15912 2
150 . 1 1 15 15 GLN HB2 H 1 1.75 0.02 . 2 . . . . 183 GLN HB2 . 15912 2
151 . 1 1 15 15 GLN HB3 H 1 1.67 0.02 . 2 . . . . 183 GLN HB3 . 15912 2
152 . 1 1 15 15 GLN HE21 H 1 7.44 0.02 . 1 . . . . 183 GLN HE21 . 15912 2
153 . 1 1 15 15 GLN HE22 H 1 6.67 0.02 . 1 . . . . 183 GLN HE22 . 15912 2
154 . 1 1 15 15 GLN C C 13 171.20 0.3 . 1 . . . . 183 GLN C . 15912 2
155 . 1 1 15 15 GLN CA C 13 51.63 0.3 . 1 . . . . 183 GLN CA . 15912 2
156 . 1 1 15 15 GLN CB C 13 26.83 0.3 . 1 . . . . 183 GLN CB . 15912 2
157 . 1 1 15 15 GLN CG C 13 30.87 0.3 . 1 . . . . 183 GLN CG . 15912 2
158 . 1 1 15 15 GLN N N 15 126.05 0.3 . 1 . . . . 183 GLN N . 15912 2
159 . 1 1 15 15 GLN NE2 N 15 111.92 0.3 . 1 . . . . 183 GLN NE2 . 15912 2
160 . 1 1 16 16 THR H H 1 7.77 0.02 . 1 . . . . 184 THR H . 15912 2
161 . 1 1 16 16 THR HA H 1 4.22 0.02 . 1 . . . . 184 THR HA . 15912 2
162 . 1 1 16 16 THR HB H 1 3.84 0.02 . 1 . . . . 184 THR HB . 15912 2
163 . 1 1 16 16 THR HG21 H 1 0.85 0.02 . 1 . . . . 184 THR HG2 . 15912 2
164 . 1 1 16 16 THR HG22 H 1 0.85 0.02 . 1 . . . . 184 THR HG2 . 15912 2
165 . 1 1 16 16 THR HG23 H 1 0.85 0.02 . 1 . . . . 184 THR HG2 . 15912 2
166 . 1 1 16 16 THR C C 13 169.07 0.3 . 1 . . . . 184 THR C . 15912 2
167 . 1 1 16 16 THR CA C 13 56.94 0.3 . 1 . . . . 184 THR CA . 15912 2
168 . 1 1 16 16 THR CB C 13 66.05 0.3 . 1 . . . . 184 THR CB . 15912 2
169 . 1 1 16 16 THR CG2 C 13 16.99 0.3 . 1 . . . . 184 THR CG2 . 15912 2
170 . 1 1 16 16 THR N N 15 115.12 0.3 . 1 . . . . 184 THR N . 15912 2
171 . 1 1 17 17 ASN H H 1 8.59 0.02 . 1 . . . . 185 ASN H . 15912 2
172 . 1 1 17 17 ASN HA H 1 4.80 0.02 . 1 . . . . 185 ASN HA . 15912 2
173 . 1 1 17 17 ASN HB2 H 1 2.75 0.02 . 2 . . . . 185 ASN HB2 . 15912 2
174 . 1 1 17 17 ASN HB3 H 1 2.52 0.02 . 2 . . . . 185 ASN HB3 . 15912 2
175 . 1 1 17 17 ASN HD21 H 1 7.42 0.02 . 1 . . . . 185 ASN HD21 . 15912 2
176 . 1 1 17 17 ASN HD22 H 1 6.73 0.02 . 1 . . . . 185 ASN HD22 . 15912 2
177 . 1 1 17 17 ASN C C 13 172.01 0.3 . 1 . . . . 185 ASN C . 15912 2
178 . 1 1 17 17 ASN CA C 13 49.56 0.3 . 1 . . . . 185 ASN CA . 15912 2
179 . 1 1 17 17 ASN CB C 13 37.30 0.3 . 1 . . . . 185 ASN CB . 15912 2
180 . 1 1 17 17 ASN N N 15 122.67 0.3 . 1 . . . . 185 ASN N . 15912 2
181 . 1 1 17 17 ASN ND2 N 15 112.99 0.3 . 1 . . . . 185 ASN ND2 . 15912 2
182 . 1 1 18 18 ASP H H 1 8.37 0.02 . 1 . . . . 186 ASP H . 15912 2
183 . 1 1 18 18 ASP HA H 1 4.72 0.02 . 1 . . . . 186 ASP HA . 15912 2
184 . 1 1 18 18 ASP HB2 H 1 2.40 0.02 . 2 . . . . 186 ASP HB2 . 15912 2
185 . 1 1 18 18 ASP HB3 H 1 2.29 0.02 . 2 . . . . 186 ASP HB3 . 15912 2
186 . 1 1 18 18 ASP CA C 13 49.41 0.3 . 1 . . . . 186 ASP CA . 15912 2
187 . 1 1 18 18 ASP CB C 13 40.44 0.3 . 1 . . . . 186 ASP CB . 15912 2
188 . 1 1 18 18 ASP N N 15 125.63 0.3 . 1 . . . . 186 ASP N . 15912 2
189 . 1 1 19 19 PRO HA H 1 4.41 0.02 . 1 . . . . 187 PRO HA . 15912 2
190 . 1 1 19 19 PRO HB2 H 1 2.30 0.02 . 2 . . . . 187 PRO HB2 . 15912 2
191 . 1 1 19 19 PRO HB3 H 1 1.94 0.02 . 2 . . . . 187 PRO HB3 . 15912 2
192 . 1 1 19 19 PRO HD2 H 1 3.86 0.02 . 2 . . . . 187 PRO HD2 . 15912 2
193 . 1 1 19 19 PRO HD3 H 1 3.68 0.02 . 2 . . . . 187 PRO HD3 . 15912 2
194 . 1 1 19 19 PRO C C 13 174.97 0.3 . 1 . . . . 187 PRO C . 15912 2
195 . 1 1 19 19 PRO CA C 13 61.85 0.3 . 1 . . . . 187 PRO CA . 15912 2
196 . 1 1 19 19 PRO CB C 13 29.77 0.3 . 1 . . . . 187 PRO CB . 15912 2
197 . 1 1 19 19 PRO CD C 13 48.71 0.3 . 1 . . . . 187 PRO CD . 15912 2
198 . 1 1 19 19 PRO CG C 13 24.55 0.3 . 1 . . . . 187 PRO CG . 15912 2
199 . 1 1 20 20 GLN H H 1 8.82 0.02 . 1 . . . . 188 GLN H . 15912 2
200 . 1 1 20 20 GLN HA H 1 4.46 0.02 . 1 . . . . 188 GLN HA . 15912 2
201 . 1 1 20 20 GLN HB2 H 1 2.21 0.02 . 2 . . . . 188 GLN HB2 . 15912 2
202 . 1 1 20 20 GLN HB3 H 1 1.99 0.02 . 2 . . . . 188 GLN HB3 . 15912 2
203 . 1 1 20 20 GLN HE21 H 1 7.59 0.02 . 1 . . . . 188 GLN HE21 . 15912 2
204 . 1 1 20 20 GLN HE22 H 1 6.71 0.02 . 1 . . . . 188 GLN HE22 . 15912 2
205 . 1 1 20 20 GLN C C 13 174.07 0.3 . 1 . . . . 188 GLN C . 15912 2
206 . 1 1 20 20 GLN CA C 13 53.44 0.3 . 1 . . . . 188 GLN CA . 15912 2
207 . 1 1 20 20 GLN CB C 13 27.07 0.3 . 1 . . . . 188 GLN CB . 15912 2
208 . 1 1 20 20 GLN CG C 13 32.19 0.3 . 1 . . . . 188 GLN CG . 15912 2
209 . 1 1 20 20 GLN N N 15 115.81 0.3 . 1 . . . . 188 GLN N . 15912 2
210 . 1 1 20 20 GLN NE2 N 15 112.43 0.3 . 1 . . . . 188 GLN NE2 . 15912 2
211 . 1 1 21 21 GLU H H 1 7.87 0.02 . 1 . . . . 189 GLU H . 15912 2
212 . 1 1 21 21 GLU HA H 1 5.27 0.02 . 1 . . . . 189 GLU HA . 15912 2
213 . 1 1 21 21 GLU HB2 H 1 2.31 0.02 . 2 . . . . 189 GLU HB2 . 15912 2
214 . 1 1 21 21 GLU HB3 H 1 2.15 0.02 . 2 . . . . 189 GLU HB3 . 15912 2
215 . 1 1 21 21 GLU C C 13 171.58 0.3 . 1 . . . . 189 GLU C . 15912 2
216 . 1 1 21 21 GLU CA C 13 52.39 0.3 . 1 . . . . 189 GLU CA . 15912 2
217 . 1 1 21 21 GLU CB C 13 31.37 0.3 . 1 . . . . 189 GLU CB . 15912 2
218 . 1 1 21 21 GLU CG C 13 34.33 0.3 . 1 . . . . 189 GLU CG . 15912 2
219 . 1 1 21 21 GLU N N 15 120.38 0.3 . 1 . . . . 189 GLU N . 15912 2
220 . 1 1 22 22 LEU H H 1 8.07 0.02 . 1 . . . . 190 LEU H . 15912 2
221 . 1 1 22 22 LEU HA H 1 4.36 0.02 . 1 . . . . 190 LEU HA . 15912 2
222 . 1 1 22 22 LEU HB2 H 1 1.29 0.02 . 2 . . . . 190 LEU HB2 . 15912 2
223 . 1 1 22 22 LEU HB3 H 1 0.48 0.02 . 2 . . . . 190 LEU HB3 . 15912 2
224 . 1 1 22 22 LEU HD11 H 1 0.70 0.02 . 1 . . . . 190 LEU HD1 . 15912 2
225 . 1 1 22 22 LEU HD12 H 1 0.70 0.02 . 1 . . . . 190 LEU HD1 . 15912 2
226 . 1 1 22 22 LEU HD13 H 1 0.70 0.02 . 1 . . . . 190 LEU HD1 . 15912 2
227 . 1 1 22 22 LEU HD21 H 1 0.66 0.02 . 1 . . . . 190 LEU HD2 . 15912 2
228 . 1 1 22 22 LEU HD22 H 1 0.66 0.02 . 1 . . . . 190 LEU HD2 . 15912 2
229 . 1 1 22 22 LEU HD23 H 1 0.66 0.02 . 1 . . . . 190 LEU HD2 . 15912 2
230 . 1 1 22 22 LEU HG H 1 1.70 0.02 . 1 . . . . 190 LEU HG . 15912 2
231 . 1 1 22 22 LEU C C 13 170.93 0.3 . 1 . . . . 190 LEU C . 15912 2
232 . 1 1 22 22 LEU CA C 13 50.44 0.3 . 1 . . . . 190 LEU CA . 15912 2
233 . 1 1 22 22 LEU CB C 13 42.94 0.3 . 1 . . . . 190 LEU CB . 15912 2
234 . 1 1 22 22 LEU CD1 C 13 22.08 0.3 . 1 . . . . 190 LEU CD1 . 15912 2
235 . 1 1 22 22 LEU CD2 C 13 24.41 0.3 . 1 . . . . 190 LEU CD2 . 15912 2
236 . 1 1 22 22 LEU CG C 13 23.31 0.3 . 1 . . . . 190 LEU CG . 15912 2
237 . 1 1 22 22 LEU N N 15 123.04 0.3 . 1 . . . . 190 LEU N . 15912 2
238 . 1 1 23 23 ALA H H 1 7.77 0.02 . 1 . . . . 191 ALA H . 15912 2
239 . 1 1 23 23 ALA HA H 1 4.30 0.02 . 1 . . . . 191 ALA HA . 15912 2
240 . 1 1 23 23 ALA HB1 H 1 1.34 0.02 . 1 . . . . 191 ALA HB . 15912 2
241 . 1 1 23 23 ALA HB2 H 1 1.34 0.02 . 1 . . . . 191 ALA HB . 15912 2
242 . 1 1 23 23 ALA HB3 H 1 1.34 0.02 . 1 . . . . 191 ALA HB . 15912 2
243 . 1 1 23 23 ALA C C 13 174.83 0.3 . 1 . . . . 191 ALA C . 15912 2
244 . 1 1 23 23 ALA CA C 13 49.65 0.3 . 1 . . . . 191 ALA CA . 15912 2
245 . 1 1 23 23 ALA CB C 13 16.32 0.3 . 1 . . . . 191 ALA CB . 15912 2
246 . 1 1 23 23 ALA N N 15 124.77 0.3 . 1 . . . . 191 ALA N . 15912 2
247 . 1 1 24 24 LEU H H 1 8.53 0.02 . 1 . . . . 192 LEU H . 15912 2
248 . 1 1 24 24 LEU HA H 1 4.94 0.02 . 1 . . . . 192 LEU HA . 15912 2
249 . 1 1 24 24 LEU HB2 H 1 1.89 0.02 . 2 . . . . 192 LEU HB2 . 15912 2
250 . 1 1 24 24 LEU HB3 H 1 1.13 0.02 . 2 . . . . 192 LEU HB3 . 15912 2
251 . 1 1 24 24 LEU HD11 H 1 0.57 0.02 . 1 . . . . 192 LEU HD1 . 15912 2
252 . 1 1 24 24 LEU HD12 H 1 0.57 0.02 . 1 . . . . 192 LEU HD1 . 15912 2
253 . 1 1 24 24 LEU HD13 H 1 0.57 0.02 . 1 . . . . 192 LEU HD1 . 15912 2
254 . 1 1 24 24 LEU HD21 H 1 -0.10 0.02 . 1 . . . . 192 LEU HD2 . 15912 2
255 . 1 1 24 24 LEU HD22 H 1 -0.10 0.02 . 1 . . . . 192 LEU HD2 . 15912 2
256 . 1 1 24 24 LEU HD23 H 1 -0.10 0.02 . 1 . . . . 192 LEU HD2 . 15912 2
257 . 1 1 24 24 LEU HG H 1 1.71 0.02 . 1 . . . . 192 LEU HG . 15912 2
258 . 1 1 24 24 LEU C C 13 175.11 0.3 . 1 . . . . 192 LEU C . 15912 2
259 . 1 1 24 24 LEU CA C 13 50.02 0.3 . 1 . . . . 192 LEU CA . 15912 2
260 . 1 1 24 24 LEU CB C 13 42.37 0.3 . 1 . . . . 192 LEU CB . 15912 2
261 . 1 1 24 24 LEU CD1 C 13 23.42 0.3 . 1 . . . . 192 LEU CD1 . 15912 2
262 . 1 1 24 24 LEU CD2 C 13 18.44 0.3 . 1 . . . . 192 LEU CD2 . 15912 2
263 . 1 1 24 24 LEU CG C 13 23.90 0.3 . 1 . . . . 192 LEU CG . 15912 2
264 . 1 1 24 24 LEU N N 15 117.04 0.3 . 1 . . . . 192 LEU N . 15912 2
265 . 1 1 25 25 ARG H H 1 8.26 0.02 . 1 . . . . 193 ARG H . 15912 2
266 . 1 1 25 25 ARG HA H 1 4.84 0.02 . 1 . . . . 193 ARG HA . 15912 2
267 . 1 1 25 25 ARG HB2 H 1 1.70 0.02 . 2 . . . . 193 ARG HB2 . 15912 2
268 . 1 1 25 25 ARG HB3 H 1 1.57 0.02 . 2 . . . . 193 ARG HB3 . 15912 2
269 . 1 1 25 25 ARG HG2 H 1 1.51 0.02 . 2 . . . . 193 ARG HG2 . 15912 2
270 . 1 1 25 25 ARG HG3 H 1 1.57 0.02 . 2 . . . . 193 ARG HG3 . 15912 2
271 . 1 1 25 25 ARG C C 13 171.57 0.3 . 1 . . . . 193 ARG C . 15912 2
272 . 1 1 25 25 ARG CA C 13 51.00 0.3 . 1 . . . . 193 ARG CA . 15912 2
273 . 1 1 25 25 ARG CB C 13 29.93 0.3 . 1 . . . . 193 ARG CB . 15912 2
274 . 1 1 25 25 ARG CD C 13 40.57 0.3 . 1 . . . . 193 ARG CD . 15912 2
275 . 1 1 25 25 ARG CG C 13 24.67 0.3 . 1 . . . . 193 ARG CG . 15912 2
276 . 1 1 25 25 ARG N N 15 123.50 0.3 . 1 . . . . 193 ARG N . 15912 2
277 . 1 1 25 25 ARG NH1 N 15 85.21 0.3 . 1 . . . . 193 ARG NH1 . 15912 2
278 . 1 1 26 26 CYS H H 1 8.89 0.02 . 1 . . . . 194 CYS H . 15912 2
279 . 1 1 26 26 CYS HA H 1 3.24 0.02 . 1 . . . . 194 CYS HA . 15912 2
280 . 1 1 26 26 CYS C C 13 172.11 0.3 . 1 . . . . 194 CYS C . 15912 2
281 . 1 1 26 26 CYS CA C 13 58.74 0.3 . 1 . . . . 194 CYS CA . 15912 2
282 . 1 1 26 26 CYS CB C 13 24.00 0.3 . 1 . . . . 194 CYS CB . 15912 2
283 . 1 1 26 26 CYS N N 15 123.10 0.3 . 1 . . . . 194 CYS N . 15912 2
284 . 1 1 27 27 ASP H H 1 8.86 0.02 . 1 . . . . 195 ASP H . 15912 2
285 . 1 1 27 27 ASP HA H 1 4.15 0.02 . 1 . . . . 195 ASP HA . 15912 2
286 . 1 1 27 27 ASP HB2 H 1 3.14 0.02 . 2 . . . . 195 ASP HB2 . 15912 2
287 . 1 1 27 27 ASP HB3 H 1 2.71 0.02 . 2 . . . . 195 ASP HB3 . 15912 2
288 . 1 1 27 27 ASP C C 13 172.53 0.3 . 1 . . . . 195 ASP C . 15912 2
289 . 1 1 27 27 ASP CA C 13 55.06 0.3 . 1 . . . . 195 ASP CA . 15912 2
290 . 1 1 27 27 ASP CB C 13 37.07 0.3 . 1 . . . . 195 ASP CB . 15912 2
291 . 1 1 27 27 ASP N N 15 120.74 0.3 . 1 . . . . 195 ASP N . 15912 2
292 . 1 1 28 28 GLU H H 1 8.28 0.02 . 1 . . . . 196 GLU H . 15912 2
293 . 1 1 28 28 GLU HA H 1 4.18 0.02 . 1 . . . . 196 GLU HA . 15912 2
294 . 1 1 28 28 GLU C C 13 170.91 0.3 . 1 . . . . 196 GLU C . 15912 2
295 . 1 1 28 28 GLU CA C 13 54.05 0.3 . 1 . . . . 196 GLU CA . 15912 2
296 . 1 1 28 28 GLU CB C 13 27.26 0.3 . 1 . . . . 196 GLU CB . 15912 2
297 . 1 1 28 28 GLU CG C 13 34.44 0.3 . 1 . . . . 196 GLU CG . 15912 2
298 . 1 1 28 28 GLU N N 15 122.61 0.3 . 1 . . . . 196 GLU N . 15912 2
299 . 1 1 29 29 GLU H H 1 7.75 0.02 . 1 . . . . 197 GLU H . 15912 2
300 . 1 1 29 29 GLU HA H 1 5.05 0.02 . 1 . . . . 197 GLU HA . 15912 2
301 . 1 1 29 29 GLU HG2 H 1 2.07 0.02 . 2 . . . . 197 GLU HG2 . 15912 2
302 . 1 1 29 29 GLU HG3 H 1 1.86 0.02 . 2 . . . . 197 GLU HG3 . 15912 2
303 . 1 1 29 29 GLU C C 13 172.34 0.3 . 1 . . . . 197 GLU C . 15912 2
304 . 1 1 29 29 GLU CA C 13 51.65 0.3 . 1 . . . . 197 GLU CA . 15912 2
305 . 1 1 29 29 GLU CB C 13 29.81 0.3 . 1 . . . . 197 GLU CB . 15912 2
306 . 1 1 29 29 GLU CG C 13 33.92 0.3 . 1 . . . . 197 GLU CG . 15912 2
307 . 1 1 29 29 GLU N N 15 119.28 0.3 . 1 . . . . 197 GLU N . 15912 2
308 . 1 1 30 30 TYR H H 1 9.11 0.02 . 1 . . . . 198 TYR H . 15912 2
309 . 1 1 30 30 TYR HA H 1 4.41 0.02 . 1 . . . . 198 TYR HA . 15912 2
310 . 1 1 30 30 TYR HB2 H 1 2.68 0.02 . 2 . . . . 198 TYR HB2 . 15912 2
311 . 1 1 30 30 TYR HB3 H 1 2.27 0.02 . 2 . . . . 198 TYR HB3 . 15912 2
312 . 1 1 30 30 TYR C C 13 171.55 0.3 . 1 . . . . 198 TYR C . 15912 2
313 . 1 1 30 30 TYR CA C 13 53.79 0.3 . 1 . . . . 198 TYR CA . 15912 2
314 . 1 1 30 30 TYR CB C 13 39.45 0.3 . 1 . . . . 198 TYR CB . 15912 2
315 . 1 1 30 30 TYR N N 15 119.17 0.3 . 1 . . . . 198 TYR N . 15912 2
316 . 1 1 31 31 TYR H H 1 9.19 0.02 . 1 . . . . 199 TYR H . 15912 2
317 . 1 1 31 31 TYR HA H 1 4.78 0.02 . 1 . . . . 199 TYR HA . 15912 2
318 . 1 1 31 31 TYR HB2 H 1 2.89 0.02 . 2 . . . . 199 TYR HB2 . 15912 2
319 . 1 1 31 31 TYR HB3 H 1 2.70 0.02 . 2 . . . . 199 TYR HB3 . 15912 2
320 . 1 1 31 31 TYR C C 13 173.57 0.3 . 1 . . . . 199 TYR C . 15912 2
321 . 1 1 31 31 TYR CA C 13 54.93 0.3 . 1 . . . . 199 TYR CA . 15912 2
322 . 1 1 31 31 TYR CB C 13 36.36 0.3 . 1 . . . . 199 TYR CB . 15912 2
323 . 1 1 31 31 TYR N N 15 119.57 0.3 . 1 . . . . 199 TYR N . 15912 2
324 . 1 1 32 32 LEU H H 1 8.78 0.02 . 1 . . . . 200 LEU H . 15912 2
325 . 1 1 32 32 LEU HA H 1 4.31 0.02 . 1 . . . . 200 LEU HA . 15912 2
326 . 1 1 32 32 LEU HB2 H 1 1.74 0.02 . 2 . . . . 200 LEU HB2 . 15912 2
327 . 1 1 32 32 LEU HB3 H 1 1.01 0.02 . 2 . . . . 200 LEU HB3 . 15912 2
328 . 1 1 32 32 LEU HD11 H 1 0.19 0.02 . 1 . . . . 200 LEU HD1 . 15912 2
329 . 1 1 32 32 LEU HD12 H 1 0.19 0.02 . 1 . . . . 200 LEU HD1 . 15912 2
330 . 1 1 32 32 LEU HD13 H 1 0.19 0.02 . 1 . . . . 200 LEU HD1 . 15912 2
331 . 1 1 32 32 LEU HD21 H 1 0.40 0.02 . 1 . . . . 200 LEU HD2 . 15912 2
332 . 1 1 32 32 LEU HD22 H 1 0.40 0.02 . 1 . . . . 200 LEU HD2 . 15912 2
333 . 1 1 32 32 LEU HD23 H 1 0.40 0.02 . 1 . . . . 200 LEU HD2 . 15912 2
334 . 1 1 32 32 LEU HG H 1 0.99 0.02 . 1 . . . . 200 LEU HG . 15912 2
335 . 1 1 32 32 LEU C C 13 172.64 0.3 . 1 . . . . 200 LEU C . 15912 2
336 . 1 1 32 32 LEU CA C 13 52.20 0.3 . 1 . . . . 200 LEU CA . 15912 2
337 . 1 1 32 32 LEU CB C 13 40.01 0.3 . 1 . . . . 200 LEU CB . 15912 2
338 . 1 1 32 32 LEU CD1 C 13 22.40 0.3 . 1 . . . . 200 LEU CD1 . 15912 2
339 . 1 1 32 32 LEU CD2 C 13 21.36 0.3 . 1 . . . . 200 LEU CD2 . 15912 2
340 . 1 1 32 32 LEU CG C 13 24.31 0.3 . 1 . . . . 200 LEU CG . 15912 2
341 . 1 1 32 32 LEU N N 15 124.64 0.3 . 1 . . . . 200 LEU N . 15912 2
342 . 1 1 33 33 LEU H H 1 8.79 0.02 . 1 . . . . 201 LEU H . 15912 2
343 . 1 1 33 33 LEU HA H 1 4.37 0.02 . 1 . . . . 201 LEU HA . 15912 2
344 . 1 1 33 33 LEU HB2 H 1 1.33 0.02 . 2 . . . . 201 LEU HB2 . 15912 2
345 . 1 1 33 33 LEU HB3 H 1 1.16 0.02 . 2 . . . . 201 LEU HB3 . 15912 2
346 . 1 1 33 33 LEU HD11 H 1 0.63 0.02 . 1 . . . . 201 LEU HD1 . 15912 2
347 . 1 1 33 33 LEU HD12 H 1 0.63 0.02 . 1 . . . . 201 LEU HD1 . 15912 2
348 . 1 1 33 33 LEU HD13 H 1 0.63 0.02 . 1 . . . . 201 LEU HD1 . 15912 2
349 . 1 1 33 33 LEU HD21 H 1 0.59 0.02 . 1 . . . . 201 LEU HD2 . 15912 2
350 . 1 1 33 33 LEU HD22 H 1 0.59 0.02 . 1 . . . . 201 LEU HD2 . 15912 2
351 . 1 1 33 33 LEU HD23 H 1 0.59 0.02 . 1 . . . . 201 LEU HD2 . 15912 2
352 . 1 1 33 33 LEU HG H 1 1.41 0.02 . 1 . . . . 201 LEU HG . 15912 2
353 . 1 1 33 33 LEU C C 13 174.91 0.3 . 1 . . . . 201 LEU C . 15912 2
354 . 1 1 33 33 LEU CA C 13 52.88 0.3 . 1 . . . . 201 LEU CA . 15912 2
355 . 1 1 33 33 LEU CB C 13 39.66 0.3 . 1 . . . . 201 LEU CB . 15912 2
356 . 1 1 33 33 LEU CD1 C 13 23.37 0.3 . 1 . . . . 201 LEU CD1 . 15912 2
357 . 1 1 33 33 LEU CD2 C 13 19.28 0.3 . 1 . . . . 201 LEU CD2 . 15912 2
358 . 1 1 33 33 LEU CG C 13 24.47 0.3 . 1 . . . . 201 LEU CG . 15912 2
359 . 1 1 33 33 LEU N N 15 127.53 0.3 . 1 . . . . 201 LEU N . 15912 2
360 . 1 1 34 34 ASP H H 1 7.42 0.02 . 1 . . . . 202 ASP H . 15912 2
361 . 1 1 34 34 ASP HA H 1 4.64 0.02 . 1 . . . . 202 ASP HA . 15912 2
362 . 1 1 34 34 ASP C C 13 172.52 0.3 . 1 . . . . 202 ASP C . 15912 2
363 . 1 1 34 34 ASP CA C 13 52.11 0.3 . 1 . . . . 202 ASP CA . 15912 2
364 . 1 1 34 34 ASP CB C 13 40.81 0.3 . 1 . . . . 202 ASP CB . 15912 2
365 . 1 1 34 34 ASP N N 15 114.90 0.3 . 1 . . . . 202 ASP N . 15912 2
366 . 1 1 35 35 SER H H 1 8.96 0.02 . 1 . . . . 203 SER H . 15912 2
367 . 1 1 35 35 SER HA H 1 4.25 0.02 . 1 . . . . 203 SER HA . 15912 2
368 . 1 1 35 35 SER HB2 H 1 3.19 0.02 . 2 . . . . 203 SER HB2 . 15912 2
369 . 1 1 35 35 SER HB3 H 1 2.16 0.02 . 2 . . . . 203 SER HB3 . 15912 2
370 . 1 1 35 35 SER C C 13 171.52 0.3 . 1 . . . . 203 SER C . 15912 2
371 . 1 1 35 35 SER CA C 13 54.28 0.3 . 1 . . . . 203 SER CA . 15912 2
372 . 1 1 35 35 SER CB C 13 59.68 0.3 . 1 . . . . 203 SER CB . 15912 2
373 . 1 1 35 35 SER N N 15 123.77 0.3 . 1 . . . . 203 SER N . 15912 2
374 . 1 1 36 36 SER H H 1 8.51 0.02 . 1 . . . . 204 SER H . 15912 2
375 . 1 1 36 36 SER HA H 1 3.98 0.02 . 1 . . . . 204 SER HA . 15912 2
376 . 1 1 36 36 SER HB2 H 1 3.88 0.02 . 2 . . . . 204 SER HB2 . 15912 2
377 . 1 1 36 36 SER HB3 H 1 3.85 0.02 . 2 . . . . 204 SER HB3 . 15912 2
378 . 1 1 36 36 SER C C 13 172.96 0.3 . 1 . . . . 204 SER C . 15912 2
379 . 1 1 36 36 SER CA C 13 59.31 0.3 . 1 . . . . 204 SER CA . 15912 2
380 . 1 1 36 36 SER CB C 13 60.67 0.3 . 1 . . . . 204 SER CB . 15912 2
381 . 1 1 36 36 SER N N 15 118.69 0.3 . 1 . . . . 204 SER N . 15912 2
382 . 1 1 37 37 GLU H H 1 8.77 0.02 . 1 . . . . 205 GLU H . 15912 2
383 . 1 1 37 37 GLU HA H 1 4.56 0.02 . 1 . . . . 205 GLU HA . 15912 2
384 . 1 1 37 37 GLU HG2 H 1 2.38 0.02 . 2 . . . . 205 GLU HG2 . 15912 2
385 . 1 1 37 37 GLU HG3 H 1 2.27 0.02 . 2 . . . . 205 GLU HG3 . 15912 2
386 . 1 1 37 37 GLU C C 13 173.99 0.3 . 1 . . . . 205 GLU C . 15912 2
387 . 1 1 37 37 GLU CA C 13 52.94 0.3 . 1 . . . . 205 GLU CA . 15912 2
388 . 1 1 37 37 GLU CB C 13 27.15 0.3 . 1 . . . . 205 GLU CB . 15912 2
389 . 1 1 37 37 GLU CG C 13 34.02 0.3 . 1 . . . . 205 GLU CG . 15912 2
390 . 1 1 37 37 GLU N N 15 123.11 0.3 . 1 . . . . 205 GLU N . 15912 2
391 . 1 1 38 38 ILE H H 1 8.13 0.02 . 1 . . . . 206 ILE H . 15912 2
392 . 1 1 38 38 ILE HA H 1 3.77 0.02 . 1 . . . . 206 ILE HA . 15912 2
393 . 1 1 38 38 ILE HB H 1 1.49 0.02 . 1 . . . . 206 ILE HB . 15912 2
394 . 1 1 38 38 ILE HD11 H 1 0.72 0.02 . 1 . . . . 206 ILE HD1 . 15912 2
395 . 1 1 38 38 ILE HD12 H 1 0.72 0.02 . 1 . . . . 206 ILE HD1 . 15912 2
396 . 1 1 38 38 ILE HD13 H 1 0.72 0.02 . 1 . . . . 206 ILE HD1 . 15912 2
397 . 1 1 38 38 ILE HG12 H 1 1.31 0.02 . 2 . . . . 206 ILE HG12 . 15912 2
398 . 1 1 38 38 ILE HG13 H 1 1.01 0.02 . 2 . . . . 206 ILE HG13 . 15912 2
399 . 1 1 38 38 ILE HG21 H 1 0.27 0.02 . 1 . . . . 206 ILE HG2 . 15912 2
400 . 1 1 38 38 ILE HG22 H 1 0.27 0.02 . 1 . . . . 206 ILE HG2 . 15912 2
401 . 1 1 38 38 ILE HG23 H 1 0.27 0.02 . 1 . . . . 206 ILE HG2 . 15912 2
402 . 1 1 38 38 ILE C C 13 176.12 0.3 . 1 . . . . 206 ILE C . 15912 2
403 . 1 1 38 38 ILE CA C 13 62.00 0.3 . 1 . . . . 206 ILE CA . 15912 2
404 . 1 1 38 38 ILE CB C 13 35.53 0.3 . 1 . . . . 206 ILE CB . 15912 2
405 . 1 1 38 38 ILE CD1 C 13 10.00 0.3 . 1 . . . . 206 ILE CD1 . 15912 2
406 . 1 1 38 38 ILE CG1 C 13 25.10 0.3 . 1 . . . . 206 ILE CG1 . 15912 2
407 . 1 1 38 38 ILE CG2 C 13 13.84 0.3 . 1 . . . . 206 ILE CG2 . 15912 2
408 . 1 1 38 38 ILE N N 15 117.03 0.3 . 1 . . . . 206 ILE N . 15912 2
409 . 1 1 39 39 HIS H H 1 8.46 0.02 . 1 . . . . 207 HIS H . 15912 2
410 . 1 1 39 39 HIS HA H 1 4.19 0.02 . 1 . . . . 207 HIS HA . 15912 2
411 . 1 1 39 39 HIS HB2 H 1 2.96 0.02 . 2 . . . . 207 HIS HB2 . 15912 2
412 . 1 1 39 39 HIS HB3 H 1 2.71 0.02 . 2 . . . . 207 HIS HB3 . 15912 2
413 . 1 1 39 39 HIS HD1 H 1 6.62 0.02 . 1 . . . . 207 HIS HD1 . 15912 2
414 . 1 1 39 39 HIS HD2 H 1 6.77 0.02 . 1 . . . . 207 HIS HD2 . 15912 2
415 . 1 1 39 39 HIS HE1 H 1 7.56 0.02 . 1 . . . . 207 HIS HE1 . 15912 2
416 . 1 1 39 39 HIS C C 13 173.02 0.3 . 1 . . . . 207 HIS C . 15912 2
417 . 1 1 39 39 HIS CA C 13 55.49 0.3 . 1 . . . . 207 HIS CA . 15912 2
418 . 1 1 39 39 HIS CB C 13 29.18 0.3 . 1 . . . . 207 HIS CB . 15912 2
419 . 1 1 39 39 HIS CD2 C 13 117.45 0.3 . 1 . . . . 207 HIS CD2 . 15912 2
420 . 1 1 39 39 HIS CE1 C 13 135.91 0.3 . 1 . . . . 207 HIS CE1 . 15912 2
421 . 1 1 39 39 HIS N N 15 116.55 0.3 . 1 . . . . 207 HIS N . 15912 2
422 . 1 1 40 40 TRP H H 1 7.11 0.02 . 1 . . . . 208 TRP H . 15912 2
423 . 1 1 40 40 TRP HA H 1 4.83 0.02 . 1 . . . . 208 TRP HA . 15912 2
424 . 1 1 40 40 TRP HB2 H 1 2.86 0.02 . 2 . . . . 208 TRP HB2 . 15912 2
425 . 1 1 40 40 TRP HB3 H 1 2.68 0.02 . 2 . . . . 208 TRP HB3 . 15912 2
426 . 1 1 40 40 TRP HD1 H 1 7.00 0.02 . 1 . . . . 208 TRP HD1 . 15912 2
427 . 1 1 40 40 TRP HE1 H 1 10.06 0.02 . 1 . . . . 208 TRP HE1 . 15912 2
428 . 1 1 40 40 TRP HE3 H 1 6.91 0.02 . 1 . . . . 208 TRP HE3 . 15912 2
429 . 1 1 40 40 TRP HH2 H 1 7.09 0.02 . 1 . . . . 208 TRP HH2 . 15912 2
430 . 1 1 40 40 TRP HZ2 H 1 7.22 0.02 . 1 . . . . 208 TRP HZ2 . 15912 2
431 . 1 1 40 40 TRP HZ3 H 1 6.48 0.02 . 1 . . . . 208 TRP HZ3 . 15912 2
432 . 1 1 40 40 TRP C C 13 171.26 0.3 . 1 . . . . 208 TRP C . 15912 2
433 . 1 1 40 40 TRP CA C 13 53.52 0.3 . 1 . . . . 208 TRP CA . 15912 2
434 . 1 1 40 40 TRP CB C 13 29.81 0.3 . 1 . . . . 208 TRP CB . 15912 2
435 . 1 1 40 40 TRP CD1 C 13 124.56 0.3 . 1 . . . . 208 TRP CD1 . 15912 2
436 . 1 1 40 40 TRP CE3 C 13 116.16 0.3 . 1 . . . . 208 TRP CE3 . 15912 2
437 . 1 1 40 40 TRP CH2 C 13 122.60 0.3 . 1 . . . . 208 TRP CH2 . 15912 2
438 . 1 1 40 40 TRP CZ2 C 13 111.85 0.3 . 1 . . . . 208 TRP CZ2 . 15912 2
439 . 1 1 40 40 TRP CZ3 C 13 118.22 0.3 . 1 . . . . 208 TRP CZ3 . 15912 2
440 . 1 1 40 40 TRP N N 15 119.72 0.3 . 1 . . . . 208 TRP N . 15912 2
441 . 1 1 40 40 TRP NE1 N 15 129.51 0.3 . 1 . . . . 208 TRP NE1 . 15912 2
442 . 1 1 41 41 TRP H H 1 9.23 0.02 . 1 . . . . 209 TRP H . 15912 2
443 . 1 1 41 41 TRP HA H 1 5.39 0.02 . 1 . . . . 209 TRP HA . 15912 2
444 . 1 1 41 41 TRP HB2 H 1 2.83 0.02 . 2 . . . . 209 TRP HB2 . 15912 2
445 . 1 1 41 41 TRP HB3 H 1 2.67 0.02 . 2 . . . . 209 TRP HB3 . 15912 2
446 . 1 1 41 41 TRP HD1 H 1 7.18 0.02 . 1 . . . . 209 TRP HD1 . 15912 2
447 . 1 1 41 41 TRP HE1 H 1 9.62 0.02 . 1 . . . . 209 TRP HE1 . 15912 2
448 . 1 1 41 41 TRP HE3 H 1 7.08 0.02 . 1 . . . . 209 TRP HE3 . 15912 2
449 . 1 1 41 41 TRP HH2 H 1 6.99 0.02 . 1 . . . . 209 TRP HH2 . 15912 2
450 . 1 1 41 41 TRP HZ2 H 1 7.42 0.02 . 1 . . . . 209 TRP HZ2 . 15912 2
451 . 1 1 41 41 TRP HZ3 H 1 6.59 0.02 . 1 . . . . 209 TRP HZ3 . 15912 2
452 . 1 1 41 41 TRP C C 13 172.08 0.3 . 1 . . . . 209 TRP C . 15912 2
453 . 1 1 41 41 TRP CA C 13 50.44 0.3 . 1 . . . . 209 TRP CA . 15912 2
454 . 1 1 41 41 TRP CB C 13 29.62 0.3 . 1 . . . . 209 TRP CB . 15912 2
455 . 1 1 41 41 TRP CD1 C 13 121.21 0.3 . 1 . . . . 209 TRP CD1 . 15912 2
456 . 1 1 41 41 TRP CE3 C 13 122.02 0.3 . 1 . . . . 209 TRP CE3 . 15912 2
457 . 1 1 41 41 TRP CH2 C 13 117.70 0.3 . 1 . . . . 209 TRP CH2 . 15912 2
458 . 1 1 41 41 TRP CZ2 C 13 111.84 0.3 . 1 . . . . 209 TRP CZ2 . 15912 2
459 . 1 1 41 41 TRP CZ3 C 13 118.46 0.3 . 1 . . . . 209 TRP CZ3 . 15912 2
460 . 1 1 41 41 TRP N N 15 124.04 0.3 . 1 . . . . 209 TRP N . 15912 2
461 . 1 1 41 41 TRP NE1 N 15 128.46 0.3 . 1 . . . . 209 TRP NE1 . 15912 2
462 . 1 1 42 42 ARG H H 1 8.81 0.02 . 1 . . . . 210 ARG H . 15912 2
463 . 1 1 42 42 ARG HA H 1 4.42 0.02 . 1 . . . . 210 ARG HA . 15912 2
464 . 1 1 42 42 ARG HB2 H 1 1.61 0.02 . 2 . . . . 210 ARG HB2 . 15912 2
465 . 1 1 42 42 ARG HB3 H 1 1.22 0.02 . 2 . . . . 210 ARG HB3 . 15912 2
466 . 1 1 42 42 ARG HG2 H 1 1.02 0.02 . 2 . . . . 210 ARG HG2 . 15912 2
467 . 1 1 42 42 ARG HG3 H 1 0.72 0.02 . 2 . . . . 210 ARG HG3 . 15912 2
468 . 1 1 42 42 ARG C C 13 172.58 0.3 . 1 . . . . 210 ARG C . 15912 2
469 . 1 1 42 42 ARG CA C 13 52.81 0.3 . 1 . . . . 210 ARG CA . 15912 2
470 . 1 1 42 42 ARG CB C 13 29.32 0.3 . 1 . . . . 210 ARG CB . 15912 2
471 . 1 1 42 42 ARG CD C 13 40.30 0.3 . 1 . . . . 210 ARG CD . 15912 2
472 . 1 1 42 42 ARG CG C 13 25.78 0.3 . 1 . . . . 210 ARG CG . 15912 2
473 . 1 1 42 42 ARG N N 15 123.41 0.3 . 1 . . . . 210 ARG N . 15912 2
474 . 1 1 42 42 ARG NH1 N 15 83.17 0.3 . 1 . . . . 210 ARG NH1 . 15912 2
475 . 1 1 43 43 VAL H H 1 8.89 0.02 . 1 . . . . 211 VAL H . 15912 2
476 . 1 1 43 43 VAL HA H 1 5.36 0.02 . 1 . . . . 211 VAL HA . 15912 2
477 . 1 1 43 43 VAL HB H 1 2.02 0.02 . 1 . . . . 211 VAL HB . 15912 2
478 . 1 1 43 43 VAL HG11 H 1 0.75 0.02 . 1 . . . . 211 VAL HG1 . 15912 2
479 . 1 1 43 43 VAL HG12 H 1 0.75 0.02 . 1 . . . . 211 VAL HG1 . 15912 2
480 . 1 1 43 43 VAL HG13 H 1 0.75 0.02 . 1 . . . . 211 VAL HG1 . 15912 2
481 . 1 1 43 43 VAL HG21 H 1 0.56 0.02 . 1 . . . . 211 VAL HG2 . 15912 2
482 . 1 1 43 43 VAL HG22 H 1 0.56 0.02 . 1 . . . . 211 VAL HG2 . 15912 2
483 . 1 1 43 43 VAL HG23 H 1 0.56 0.02 . 1 . . . . 211 VAL HG2 . 15912 2
484 . 1 1 43 43 VAL C C 13 170.48 0.3 . 1 . . . . 211 VAL C . 15912 2
485 . 1 1 43 43 VAL CA C 13 56.19 0.3 . 1 . . . . 211 VAL CA . 15912 2
486 . 1 1 43 43 VAL CB C 13 34.09 0.3 . 1 . . . . 211 VAL CB . 15912 2
487 . 1 1 43 43 VAL CG1 C 13 20.26 0.3 . 1 . . . . 211 VAL CG1 . 15912 2
488 . 1 1 43 43 VAL CG2 C 13 16.33 0.3 . 1 . . . . 211 VAL CG2 . 15912 2
489 . 1 1 43 43 VAL N N 15 121.44 0.3 . 1 . . . . 211 VAL N . 15912 2
490 . 1 1 44 44 GLN H H 1 8.91 0.02 . 1 . . . . 212 GLN H . 15912 2
491 . 1 1 44 44 GLN HA H 1 5.61 0.02 . 1 . . . . 212 GLN HA . 15912 2
492 . 1 1 44 44 GLN HB2 H 1 2.11 0.02 . 2 . . . . 212 GLN HB2 . 15912 2
493 . 1 1 44 44 GLN HB3 H 1 1.89 0.02 . 2 . . . . 212 GLN HB3 . 15912 2
494 . 1 1 44 44 GLN HE21 H 1 7.58 0.02 . 1 . . . . 212 GLN HE21 . 15912 2
495 . 1 1 44 44 GLN HE22 H 1 6.60 0.02 . 1 . . . . 212 GLN HE22 . 15912 2
496 . 1 1 44 44 GLN HG2 H 1 2.75 0.02 . 2 . . . . 212 GLN HG2 . 15912 2
497 . 1 1 44 44 GLN HG3 H 1 2.08 0.02 . 2 . . . . 212 GLN HG3 . 15912 2
498 . 1 1 44 44 GLN C C 13 172.98 0.3 . 1 . . . . 212 GLN C . 15912 2
499 . 1 1 44 44 GLN CA C 13 50.81 0.3 . 1 . . . . 212 GLN CA . 15912 2
500 . 1 1 44 44 GLN CB C 13 32.44 0.3 . 1 . . . . 212 GLN CB . 15912 2
501 . 1 1 44 44 GLN CG C 13 31.65 0.3 . 1 . . . . 212 GLN CG . 15912 2
502 . 1 1 44 44 GLN N N 15 119.20 0.3 . 1 . . . . 212 GLN N . 15912 2
503 . 1 1 44 44 GLN NE2 N 15 111.65 0.3 . 1 . . . . 212 GLN NE2 . 15912 2
504 . 1 1 45 45 ASP H H 1 9.17 0.02 . 1 . . . . 213 ASP H . 15912 2
505 . 1 1 45 45 ASP HA H 1 4.97 0.02 . 1 . . . . 213 ASP HA . 15912 2
506 . 1 1 45 45 ASP HB2 H 1 3.55 0.02 . 2 . . . . 213 ASP HB2 . 15912 2
507 . 1 1 45 45 ASP HB3 H 1 2.88 0.02 . 2 . . . . 213 ASP HB3 . 15912 2
508 . 1 1 45 45 ASP C C 13 175.57 0.3 . 1 . . . . 213 ASP C . 15912 2
509 . 1 1 45 45 ASP CA C 13 49.92 0.3 . 1 . . . . 213 ASP CA . 15912 2
510 . 1 1 45 45 ASP CB C 13 40.39 0.3 . 1 . . . . 213 ASP CB . 15912 2
511 . 1 1 45 45 ASP N N 15 125.56 0.3 . 1 . . . . 213 ASP N . 15912 2
512 . 1 1 46 46 LYS H H 1 8.86 0.02 . 1 . . . . 214 LYS H . 15912 2
513 . 1 1 46 46 LYS HA H 1 4.10 0.02 . 1 . . . . 214 LYS HA . 15912 2
514 . 1 1 46 46 LYS HB2 H 1 1.89 0.02 . 2 . . . . 214 LYS HB2 . 15912 2
515 . 1 1 46 46 LYS HB3 H 1 1.72 0.02 . 2 . . . . 214 LYS HB3 . 15912 2
516 . 1 1 46 46 LYS C C 13 174.13 0.3 . 1 . . . . 214 LYS C . 15912 2
517 . 1 1 46 46 LYS CA C 13 55.74 0.3 . 1 . . . . 214 LYS CA . 15912 2
518 . 1 1 46 46 LYS CB C 13 28.87 0.3 . 1 . . . . 214 LYS CB . 15912 2
519 . 1 1 46 46 LYS CD C 13 26.45 0.3 . 1 . . . . 214 LYS CD . 15912 2
520 . 1 1 46 46 LYS CE C 13 39.26 0.3 . 1 . . . . 214 LYS CE . 15912 2
521 . 1 1 46 46 LYS CG C 13 22.39 0.3 . 1 . . . . 214 LYS CG . 15912 2
522 . 1 1 46 46 LYS N N 15 117.32 0.3 . 1 . . . . 214 LYS N . 15912 2
523 . 1 1 47 47 ASN H H 1 8.24 0.02 . 1 . . . . 215 ASN H . 15912 2
524 . 1 1 47 47 ASN HA H 1 4.79 0.02 . 1 . . . . 215 ASN HA . 15912 2
525 . 1 1 47 47 ASN HB2 H 1 2.77 0.02 . 2 . . . . 215 ASN HB2 . 15912 2
526 . 1 1 47 47 ASN HB3 H 1 2.61 0.02 . 2 . . . . 215 ASN HB3 . 15912 2
527 . 1 1 47 47 ASN HD21 H 1 7.73 0.02 . 1 . . . . 215 ASN HD21 . 15912 2
528 . 1 1 47 47 ASN HD22 H 1 6.90 0.02 . 1 . . . . 215 ASN HD22 . 15912 2
529 . 1 1 47 47 ASN C C 13 172.46 0.3 . 1 . . . . 215 ASN C . 15912 2
530 . 1 1 47 47 ASN CA C 13 50.43 0.3 . 1 . . . . 215 ASN CA . 15912 2
531 . 1 1 47 47 ASN CB C 13 37.10 0.3 . 1 . . . . 215 ASN CB . 15912 2
532 . 1 1 47 47 ASN N N 15 117.03 0.3 . 1 . . . . 215 ASN N . 15912 2
533 . 1 1 47 47 ASN ND2 N 15 114.42 0.3 . 1 . . . . 215 ASN ND2 . 15912 2
534 . 1 1 48 48 GLY H H 1 7.96 0.02 . 1 . . . . 216 GLY H . 15912 2
535 . 1 1 48 48 GLY HA2 H 1 4.10 0.02 . 2 . . . . 216 GLY HA2 . 15912 2
536 . 1 1 48 48 GLY HA3 H 1 3.41 0.02 . 2 . . . . 216 GLY HA3 . 15912 2
537 . 1 1 48 48 GLY C C 13 171.73 0.3 . 1 . . . . 216 GLY C . 15912 2
538 . 1 1 48 48 GLY CA C 13 42.80 0.3 . 1 . . . . 216 GLY CA . 15912 2
539 . 1 1 48 48 GLY N N 15 107.55 0.3 . 1 . . . . 216 GLY N . 15912 2
540 . 1 1 49 49 HIS H H 1 8.50 0.02 . 1 . . . . 217 HIS H . 15912 2
541 . 1 1 49 49 HIS HA H 1 4.61 0.02 . 1 . . . . 217 HIS HA . 15912 2
542 . 1 1 49 49 HIS HB2 H 1 3.21 0.02 . 2 . . . . 217 HIS HB2 . 15912 2
543 . 1 1 49 49 HIS HB3 H 1 3.08 0.02 . 2 . . . . 217 HIS HB3 . 15912 2
544 . 1 1 49 49 HIS HD1 H 1 7.69 0.02 . 1 . . . . 217 HIS HD1 . 15912 2
545 . 1 1 49 49 HIS HD2 H 1 7.14 0.02 . 1 . . . . 217 HIS HD2 . 15912 2
546 . 1 1 49 49 HIS HE1 H 1 8.06 0.02 . 1 . . . . 217 HIS HE1 . 15912 2
547 . 1 1 49 49 HIS C C 13 171.24 0.3 . 1 . . . . 217 HIS C . 15912 2
548 . 1 1 49 49 HIS CA C 13 53.44 0.3 . 1 . . . . 217 HIS CA . 15912 2
549 . 1 1 49 49 HIS CB C 13 26.73 0.3 . 1 . . . . 217 HIS CB . 15912 2
550 . 1 1 49 49 HIS CD2 C 13 117.54 0.3 . 1 . . . . 217 HIS CD2 . 15912 2
551 . 1 1 49 49 HIS CE1 C 13 134.25 0.3 . 1 . . . . 217 HIS CE1 . 15912 2
552 . 1 1 49 49 HIS N N 15 123.11 0.3 . 1 . . . . 217 HIS N . 15912 2
553 . 1 1 50 50 GLU H H 1 8.60 0.02 . 1 . . . . 218 GLU H . 15912 2
554 . 1 1 50 50 GLU HA H 1 5.68 0.02 . 1 . . . . 218 GLU HA . 15912 2
555 . 1 1 50 50 GLU HB2 H 1 1.83 0.02 . 2 . . . . 218 GLU HB2 . 15912 2
556 . 1 1 50 50 GLU HB3 H 1 1.72 0.02 . 2 . . . . 218 GLU HB3 . 15912 2
557 . 1 1 50 50 GLU C C 13 173.37 0.3 . 1 . . . . 218 GLU C . 15912 2
558 . 1 1 50 50 GLU CA C 13 51.36 0.3 . 1 . . . . 218 GLU CA . 15912 2
559 . 1 1 50 50 GLU CB C 13 32.01 0.3 . 1 . . . . 218 GLU CB . 15912 2
560 . 1 1 50 50 GLU CG C 13 33.54 0.3 . 1 . . . . 218 GLU CG . 15912 2
561 . 1 1 50 50 GLU N N 15 120.37 0.3 . 1 . . . . 218 GLU N . 15912 2
562 . 1 1 51 51 GLY H H 1 8.49 0.02 . 1 . . . . 219 GLY H . 15912 2
563 . 1 1 51 51 GLY HA2 H 1 3.79 0.02 . 2 . . . . 219 GLY HA2 . 15912 2
564 . 1 1 51 51 GLY HA3 H 1 3.65 0.02 . 2 . . . . 219 GLY HA3 . 15912 2
565 . 1 1 51 51 GLY C C 13 168.05 0.3 . 1 . . . . 219 GLY C . 15912 2
566 . 1 1 51 51 GLY CA C 13 42.53 0.3 . 1 . . . . 219 GLY CA . 15912 2
567 . 1 1 51 51 GLY N N 15 106.33 0.3 . 1 . . . . 219 GLY N . 15912 2
568 . 1 1 52 52 TYR H H 1 8.78 0.02 . 1 . . . . 220 TYR H . 15912 2
569 . 1 1 52 52 TYR HA H 1 5.22 0.02 . 1 . . . . 220 TYR HA . 15912 2
570 . 1 1 52 52 TYR HB2 H 1 2.81 0.02 . 2 . . . . 220 TYR HB2 . 15912 2
571 . 1 1 52 52 TYR HB3 H 1 2.47 0.02 . 2 . . . . 220 TYR HB3 . 15912 2
572 . 1 1 52 52 TYR C C 13 172.70 0.3 . 1 . . . . 220 TYR C . 15912 2
573 . 1 1 52 52 TYR CA C 13 56.49 0.3 . 1 . . . . 220 TYR CA . 15912 2
574 . 1 1 52 52 TYR CB C 13 38.49 0.3 . 1 . . . . 220 TYR CB . 15912 2
575 . 1 1 52 52 TYR N N 15 118.11 0.3 . 1 . . . . 220 TYR N . 15912 2
576 . 1 1 53 53 ALA H H 1 9.35 0.02 . 1 . . . . 221 ALA H . 15912 2
577 . 1 1 53 53 ALA HA H 1 4.75 0.02 . 1 . . . . 221 ALA HA . 15912 2
578 . 1 1 53 53 ALA HB1 H 1 1.08 0.02 . 1 . . . . 221 ALA HB . 15912 2
579 . 1 1 53 53 ALA HB2 H 1 1.08 0.02 . 1 . . . . 221 ALA HB . 15912 2
580 . 1 1 53 53 ALA HB3 H 1 1.08 0.02 . 1 . . . . 221 ALA HB . 15912 2
581 . 1 1 53 53 ALA CA C 13 47.01 0.3 . 1 . . . . 221 ALA CA . 15912 2
582 . 1 1 53 53 ALA CB C 13 18.81 0.3 . 1 . . . . 221 ALA CB . 15912 2
583 . 1 1 53 53 ALA N N 15 122.25 0.3 . 1 . . . . 221 ALA N . 15912 2
584 . 1 1 54 54 PRO HA H 1 3.46 0.02 . 1 . . . . 222 PRO HA . 15912 2
585 . 1 1 54 54 PRO HB2 H 1 1.08 0.02 . 2 . . . . 222 PRO HB2 . 15912 2
586 . 1 1 54 54 PRO HB3 H 1 1.01 0.02 . 2 . . . . 222 PRO HB3 . 15912 2
587 . 1 1 54 54 PRO HD2 H 1 2.38 0.02 . 2 . . . . 222 PRO HD2 . 15912 2
588 . 1 1 54 54 PRO HD3 H 1 2.04 0.02 . 2 . . . . 222 PRO HD3 . 15912 2
589 . 1 1 54 54 PRO HG2 H 1 0.32 0.02 . 2 . . . . 222 PRO HG2 . 15912 2
590 . 1 1 54 54 PRO HG3 H 1 0.27 0.02 . 2 . . . . 222 PRO HG3 . 15912 2
591 . 1 1 54 54 PRO C C 13 175.42 0.3 . 1 . . . . 222 PRO C . 15912 2
592 . 1 1 54 54 PRO CA C 13 59.05 0.3 . 1 . . . . 222 PRO CA . 15912 2
593 . 1 1 54 54 PRO CB C 13 28.11 0.3 . 1 . . . . 222 PRO CB . 15912 2
594 . 1 1 54 54 PRO CD C 13 47.17 0.3 . 1 . . . . 222 PRO CD . 15912 2
595 . 1 1 54 54 PRO CG C 13 24.42 0.3 . 1 . . . . 222 PRO CG . 15912 2
596 . 1 1 55 55 SER H H 1 7.56 0.02 . 1 . . . . 223 SER H . 15912 2
597 . 1 1 55 55 SER HA H 1 2.62 0.02 . 1 . . . . 223 SER HA . 15912 2
598 . 1 1 55 55 SER HB2 H 1 1.80 0.02 . 2 . . . . 223 SER HB2 . 15912 2
599 . 1 1 55 55 SER HB3 H 1 1.61 0.02 . 2 . . . . 223 SER HB3 . 15912 2
600 . 1 1 55 55 SER C C 13 173.93 0.3 . 1 . . . . 223 SER C . 15912 2
601 . 1 1 55 55 SER CA C 13 57.60 0.3 . 1 . . . . 223 SER CA . 15912 2
602 . 1 1 55 55 SER CB C 13 57.45 0.3 . 1 . . . . 223 SER CB . 15912 2
603 . 1 1 55 55 SER N N 15 121.75 0.3 . 1 . . . . 223 SER N . 15912 2
604 . 1 1 56 56 SER H H 1 8.02 0.02 . 1 . . . . 224 SER H . 15912 2
605 . 1 1 56 56 SER HA H 1 3.97 0.02 . 1 . . . . 224 SER HA . 15912 2
606 . 1 1 56 56 SER HB2 H 1 3.75 0.02 . 2 . . . . 224 SER HB2 . 15912 2
607 . 1 1 56 56 SER HB3 H 1 3.89 0.02 . 2 . . . . 224 SER HB3 . 15912 2
608 . 1 1 56 56 SER C C 13 172.38 0.3 . 1 . . . . 224 SER C . 15912 2
609 . 1 1 56 56 SER CA C 13 57.35 0.3 . 1 . . . . 224 SER CA . 15912 2
610 . 1 1 56 56 SER CB C 13 60.19 0.3 . 1 . . . . 224 SER CB . 15912 2
611 . 1 1 56 56 SER N N 15 115.18 0.3 . 1 . . . . 224 SER N . 15912 2
612 . 1 1 57 57 TYR H H 1 7.45 0.02 . 1 . . . . 225 TYR H . 15912 2
613 . 1 1 57 57 TYR HA H 1 4.43 0.02 . 1 . . . . 225 TYR HA . 15912 2
614 . 1 1 57 57 TYR HB2 H 1 3.11 0.02 . 2 . . . . 225 TYR HB2 . 15912 2
615 . 1 1 57 57 TYR HB3 H 1 2.84 0.02 . 2 . . . . 225 TYR HB3 . 15912 2
616 . 1 1 57 57 TYR C C 13 171.47 0.3 . 1 . . . . 225 TYR C . 15912 2
617 . 1 1 57 57 TYR CA C 13 55.18 0.3 . 1 . . . . 225 TYR CA . 15912 2
618 . 1 1 57 57 TYR CB C 13 35.61 0.3 . 1 . . . . 225 TYR CB . 15912 2
619 . 1 1 57 57 TYR N N 15 121.76 0.3 . 1 . . . . 225 TYR N . 15912 2
620 . 1 1 58 58 LEU H H 1 7.29 0.02 . 1 . . . . 226 LEU H . 15912 2
621 . 1 1 58 58 LEU HA H 1 5.23 0.02 . 1 . . . . 226 LEU HA . 15912 2
622 . 1 1 58 58 LEU HB2 H 1 1.58 0.02 . 2 . . . . 226 LEU HB2 . 15912 2
623 . 1 1 58 58 LEU HB3 H 1 1.04 0.02 . 2 . . . . 226 LEU HB3 . 15912 2
624 . 1 1 58 58 LEU HD11 H 1 0.63 0.02 . 1 . . . . 226 LEU HD1 . 15912 2
625 . 1 1 58 58 LEU HD12 H 1 0.63 0.02 . 1 . . . . 226 LEU HD1 . 15912 2
626 . 1 1 58 58 LEU HD13 H 1 0.63 0.02 . 1 . . . . 226 LEU HD1 . 15912 2
627 . 1 1 58 58 LEU HD21 H 1 0.56 0.02 . 1 . . . . 226 LEU HD2 . 15912 2
628 . 1 1 58 58 LEU HD22 H 1 0.56 0.02 . 1 . . . . 226 LEU HD2 . 15912 2
629 . 1 1 58 58 LEU HD23 H 1 0.56 0.02 . 1 . . . . 226 LEU HD2 . 15912 2
630 . 1 1 58 58 LEU HG H 1 1.27 0.02 . 1 . . . . 226 LEU HG . 15912 2
631 . 1 1 58 58 LEU C C 13 172.40 0.3 . 1 . . . . 226 LEU C . 15912 2
632 . 1 1 58 58 LEU CA C 13 51.15 0.3 . 1 . . . . 226 LEU CA . 15912 2
633 . 1 1 58 58 LEU CB C 13 44.74 0.3 . 1 . . . . 226 LEU CB . 15912 2
634 . 1 1 58 58 LEU CD1 C 13 25.09 0.3 . 1 . . . . 226 LEU CD1 . 15912 2
635 . 1 1 58 58 LEU CD2 C 13 20.46 0.3 . 1 . . . . 226 LEU CD2 . 15912 2
636 . 1 1 58 58 LEU CG C 13 23.31 0.3 . 1 . . . . 226 LEU CG . 15912 2
637 . 1 1 58 58 LEU N N 15 120.93 0.3 . 1 . . . . 226 LEU N . 15912 2
638 . 1 1 59 59 VAL H H 1 8.48 0.02 . 1 . . . . 227 VAL H . 15912 2
639 . 1 1 59 59 VAL HA H 1 4.59 0.02 . 1 . . . . 227 VAL HA . 15912 2
640 . 1 1 59 59 VAL HB H 1 1.92 0.02 . 1 . . . . 227 VAL HB . 15912 2
641 . 1 1 59 59 VAL HG11 H 1 0.91 0.02 . 1 . . . . 227 VAL HG1 . 15912 2
642 . 1 1 59 59 VAL HG12 H 1 0.91 0.02 . 1 . . . . 227 VAL HG1 . 15912 2
643 . 1 1 59 59 VAL HG13 H 1 0.91 0.02 . 1 . . . . 227 VAL HG1 . 15912 2
644 . 1 1 59 59 VAL HG21 H 1 0.80 0.02 . 1 . . . . 227 VAL HG2 . 15912 2
645 . 1 1 59 59 VAL HG22 H 1 0.80 0.02 . 1 . . . . 227 VAL HG2 . 15912 2
646 . 1 1 59 59 VAL HG23 H 1 0.80 0.02 . 1 . . . . 227 VAL HG2 . 15912 2
647 . 1 1 59 59 VAL C C 13 171.70 0.3 . 1 . . . . 227 VAL C . 15912 2
648 . 1 1 59 59 VAL CA C 13 56.85 0.3 . 1 . . . . 227 VAL CA . 15912 2
649 . 1 1 59 59 VAL CB C 13 33.19 0.3 . 1 . . . . 227 VAL CB . 15912 2
650 . 1 1 59 59 VAL CG1 C 13 18.02 0.3 . 1 . . . . 227 VAL CG1 . 15912 2
651 . 1 1 59 59 VAL CG2 C 13 18.26 0.3 . 1 . . . . 227 VAL CG2 . 15912 2
652 . 1 1 59 59 VAL N N 15 115.55 0.3 . 1 . . . . 227 VAL N . 15912 2
653 . 1 1 60 60 GLU H H 1 8.92 0.02 . 1 . . . . 228 GLU H . 15912 2
654 . 1 1 60 60 GLU HA H 1 4.30 0.02 . 1 . . . . 228 GLU HA . 15912 2
655 . 1 1 60 60 GLU HG2 H 1 2.19 0.02 . 2 . . . . 228 GLU HG2 . 15912 2
656 . 1 1 60 60 GLU HG3 H 1 2.08 0.02 . 2 . . . . 228 GLU HG3 . 15912 2
657 . 1 1 60 60 GLU C C 13 173.57 0.3 . 1 . . . . 228 GLU C . 15912 2
658 . 1 1 60 60 GLU CA C 13 55.28 0.3 . 1 . . . . 228 GLU CA . 15912 2
659 . 1 1 60 60 GLU CB C 13 27.61 0.3 . 1 . . . . 228 GLU CB . 15912 2
660 . 1 1 60 60 GLU CG C 13 34.37 0.3 . 1 . . . . 228 GLU CG . 15912 2
661 . 1 1 60 60 GLU N N 15 124.86 0.3 . 1 . . . . 228 GLU N . 15912 2
662 . 1 1 61 61 LYS H H 1 8.30 0.02 . 1 . . . . 229 LYS H . 15912 2
663 . 1 1 61 61 LYS HA H 1 4.08 0.02 . 1 . . . . 229 LYS HA . 15912 2
664 . 1 1 61 61 LYS HB2 H 1 1.67 0.02 . 2 . . . . 229 LYS HB2 . 15912 2
665 . 1 1 61 61 LYS HB3 H 1 1.26 0.02 . 2 . . . . 229 LYS HB3 . 15912 2
666 . 1 1 61 61 LYS HD2 H 1 1.46 0.02 . 2 . . . . 229 LYS HD2 . 15912 2
667 . 1 1 61 61 LYS HD3 H 1 1.43 0.02 . 2 . . . . 229 LYS HD3 . 15912 2
668 . 1 1 61 61 LYS HE2 H 1 2.81 0.02 . 2 . . . . 229 LYS HE2 . 15912 2
669 . 1 1 61 61 LYS HE3 H 1 2.78 0.02 . 2 . . . . 229 LYS HE3 . 15912 2
670 . 1 1 61 61 LYS C C 13 173.43 0.3 . 1 . . . . 229 LYS C . 15912 2
671 . 1 1 61 61 LYS CA C 13 54.22 0.3 . 1 . . . . 229 LYS CA . 15912 2
672 . 1 1 61 61 LYS CB C 13 31.39 0.3 . 1 . . . . 229 LYS CB . 15912 2
673 . 1 1 61 61 LYS CD C 13 27.44 0.3 . 1 . . . . 229 LYS CD . 15912 2
674 . 1 1 61 61 LYS CE C 13 39.59 0.3 . 1 . . . . 229 LYS CE . 15912 2
675 . 1 1 61 61 LYS CG C 13 22.66 0.3 . 1 . . . . 229 LYS CG . 15912 2
676 . 1 1 61 61 LYS N N 15 125.78 0.3 . 1 . . . . 229 LYS N . 15912 2
677 . 1 1 62 62 SER H H 1 8.55 0.02 . 1 . . . . 230 SER H . 15912 2
678 . 1 1 62 62 SER HA H 1 4.67 0.02 . 1 . . . . 230 SER HA . 15912 2
679 . 1 1 62 62 SER HB2 H 1 3.79 0.02 . 2 . . . . 230 SER HB2 . 15912 2
680 . 1 1 62 62 SER HB3 H 1 3.72 0.02 . 2 . . . . 230 SER HB3 . 15912 2
681 . 1 1 62 62 SER CA C 13 53.68 0.3 . 1 . . . . 230 SER CA . 15912 2
682 . 1 1 62 62 SER CB C 13 60.67 0.3 . 1 . . . . 230 SER CB . 15912 2
683 . 1 1 62 62 SER N N 15 121.10 0.3 . 1 . . . . 230 SER N . 15912 2
684 . 1 1 63 63 PRO HA H 1 4.35 0.02 . 1 . . . . 231 PRO HA . 15912 2
685 . 1 1 63 63 PRO HB2 H 1 2.14 0.02 . 2 . . . . 231 PRO HB2 . 15912 2
686 . 1 1 63 63 PRO HB3 H 1 1.89 0.02 . 2 . . . . 231 PRO HB3 . 15912 2
687 . 1 1 63 63 PRO HD2 H 1 3.63 0.02 . 2 . . . . 231 PRO HD2 . 15912 2
688 . 1 1 63 63 PRO HD3 H 1 3.59 0.02 . 2 . . . . 231 PRO HD3 . 15912 2
689 . 1 1 63 63 PRO C C 13 173.22 0.3 . 1 . . . . 231 PRO C . 15912 2
690 . 1 1 63 63 PRO CA C 13 60.82 0.3 . 1 . . . . 231 PRO CA . 15912 2
691 . 1 1 63 63 PRO CB C 13 29.42 0.3 . 1 . . . . 231 PRO CB . 15912 2
692 . 1 1 63 63 PRO CD C 13 48.10 0.3 . 1 . . . . 231 PRO CD . 15912 2
693 . 1 1 63 63 PRO CG C 13 24.53 0.3 . 1 . . . . 231 PRO CG . 15912 2
694 . 1 1 64 64 ASN H H 1 7.91 0.02 . 1 . . . . 232 ASN H . 15912 2
695 . 1 1 64 64 ASN HA H 1 4.32 0.02 . 1 . . . . 232 ASN HA . 15912 2
696 . 1 1 64 64 ASN HB2 H 1 2.63 0.02 . 2 . . . . 232 ASN HB2 . 15912 2
697 . 1 1 64 64 ASN HB3 H 1 2.53 0.02 . 2 . . . . 232 ASN HB3 . 15912 2
698 . 1 1 64 64 ASN HD21 H 1 7.48 0.02 . 1 . . . . 232 ASN HD21 . 15912 2
699 . 1 1 64 64 ASN HD22 H 1 6.77 0.02 . 1 . . . . 232 ASN HD22 . 15912 2
700 . 1 1 64 64 ASN CA C 13 52.43 0.3 . 1 . . . . 232 ASN CA . 15912 2
701 . 1 1 64 64 ASN CB C 13 37.71 0.3 . 1 . . . . 232 ASN CB . 15912 2
702 . 1 1 64 64 ASN N N 15 123.77 0.3 . 1 . . . . 232 ASN N . 15912 2
703 . 1 1 64 64 ASN ND2 N 15 112.83 0.3 . 1 . . . . 232 ASN ND2 . 15912 2
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save_