Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30598
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.04
_Assigned_chem_shift_list.Chem_shift_13C_err 0.5
_Assigned_chem_shift_list.Chem_shift_15N_err 0.5
_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' . . . 30598 1
2 '2D 1H-13C HSQC' . . . 30598 1
3 '3D CBCA(CO)NH' . . . 30598 1
4 '3D HNCO' . . . 30598 1
5 '3D HNCACB' . . . 30598 1
6 '3D HBHA(CO)NH' . . . 30598 1
7 '3D 1H-15N NOESY' . . . 30598 1
8 '3D 1H-13C NOESY aliphatic' . . . 30598 1
9 '3D 1H-13C NOESY aromatic' . . . 30598 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 GLY HA2 H 1 3.855 0.001 . 2 . . . . A 1 GLY HA2 . 30598 1
2 . 1 . 1 1 1 GLY HA3 H 1 3.855 0.001 . 2 . . . . A 1 GLY HA3 . 30598 1
3 . 1 . 1 1 1 GLY C C 13 172.997 0.000 . 1 . . . . A 1 GLY C . 30598 1
4 . 1 . 1 1 1 GLY CA C 13 43.453 0.023 . 1 . . . . A 1 GLY CA . 30598 1
5 . 1 . 1 2 2 GLU H H 1 8.633 0.002 . 1 . . . . A 2 GLU H . 30598 1
6 . 1 . 1 2 2 GLU HA H 1 4.375 0.003 . 1 . . . . A 2 GLU HA . 30598 1
7 . 1 . 1 2 2 GLU HB2 H 1 2.097 0.006 . 2 . . . . A 2 GLU HB2 . 30598 1
8 . 1 . 1 2 2 GLU HB3 H 1 1.922 0.001 . 2 . . . . A 2 GLU HB3 . 30598 1
9 . 1 . 1 2 2 GLU HG2 H 1 2.299 0.000 . 2 . . . . A 2 GLU HG2 . 30598 1
10 . 1 . 1 2 2 GLU HG3 H 1 2.299 0.000 . 2 . . . . A 2 GLU HG3 . 30598 1
11 . 1 . 1 2 2 GLU C C 13 179.439 0.000 . 1 . . . . A 2 GLU C . 30598 1
12 . 1 . 1 2 2 GLU CA C 13 56.337 0.001 . 1 . . . . A 2 GLU CA . 30598 1
13 . 1 . 1 2 2 GLU CB C 13 30.565 0.002 . 1 . . . . A 2 GLU CB . 30598 1
14 . 1 . 1 2 2 GLU CG C 13 36.148 0.002 . 1 . . . . A 2 GLU CG . 30598 1
15 . 1 . 1 2 2 GLU N N 15 120.169 0.004 . 1 . . . . A 2 GLU N . 30598 1
16 . 1 . 1 3 3 GLU H H 1 8.789 0.001 . 1 . . . . A 3 GLU H . 30598 1
17 . 1 . 1 3 3 GLU HA H 1 4.335 0.006 . 1 . . . . A 3 GLU HA . 30598 1
18 . 1 . 1 3 3 GLU HB2 H 1 2.056 0.003 . 1 . . . . A 3 GLU HB2 . 30598 1
19 . 1 . 1 3 3 GLU HB3 H 1 1.930 0.008 . 1 . . . . A 3 GLU HB3 . 30598 1
20 . 1 . 1 3 3 GLU HG2 H 1 2.360 0.001 . 1 . . . . A 3 GLU HG2 . 30598 1
21 . 1 . 1 3 3 GLU HG3 H 1 2.229 0.000 . 1 . . . . A 3 GLU HG3 . 30598 1
22 . 1 . 1 3 3 GLU C C 13 179.063 0.000 . 1 . . . . A 3 GLU C . 30598 1
23 . 1 . 1 3 3 GLU CA C 13 57.027 0.023 . 1 . . . . A 3 GLU CA . 30598 1
24 . 1 . 1 3 3 GLU CB C 13 30.287 0.058 . 1 . . . . A 3 GLU CB . 30598 1
25 . 1 . 1 3 3 GLU CG C 13 36.278 0.027 . 1 . . . . A 3 GLU CG . 30598 1
26 . 1 . 1 3 3 GLU N N 15 122.137 0.007 . 1 . . . . A 3 GLU N . 30598 1
27 . 1 . 1 4 4 VAL H H 1 7.884 0.000 . 1 . . . . A 4 VAL H . 30598 1
28 . 1 . 1 4 4 VAL HA H 1 4.951 0.000 . 1 . . . . A 4 VAL HA . 30598 1
29 . 1 . 1 4 4 VAL HB H 1 1.316 0.004 . 1 . . . . A 4 VAL HB . 30598 1
30 . 1 . 1 4 4 VAL HG11 H 1 0.659 0.003 . 1 . . . . A 4 VAL HG11 . 30598 1
31 . 1 . 1 4 4 VAL HG12 H 1 0.659 0.003 . 1 . . . . A 4 VAL HG12 . 30598 1
32 . 1 . 1 4 4 VAL HG13 H 1 0.659 0.003 . 1 . . . . A 4 VAL HG13 . 30598 1
33 . 1 . 1 4 4 VAL HG21 H 1 0.658 0.002 . 1 . . . . A 4 VAL HG21 . 30598 1
34 . 1 . 1 4 4 VAL HG22 H 1 0.658 0.002 . 1 . . . . A 4 VAL HG22 . 30598 1
35 . 1 . 1 4 4 VAL HG23 H 1 0.658 0.002 . 1 . . . . A 4 VAL HG23 . 30598 1
36 . 1 . 1 4 4 VAL C C 13 177.546 0.000 . 1 . . . . A 4 VAL C . 30598 1
37 . 1 . 1 4 4 VAL CA C 13 58.545 0.021 . 1 . . . . A 4 VAL CA . 30598 1
38 . 1 . 1 4 4 VAL CB C 13 36.130 0.001 . 1 . . . . A 4 VAL CB . 30598 1
39 . 1 . 1 4 4 VAL CG1 C 13 21.636 0.000 . 1 . . . . A 4 VAL CG1 . 30598 1
40 . 1 . 1 4 4 VAL CG2 C 13 17.628 0.000 . 1 . . . . A 4 VAL CG2 . 30598 1
41 . 1 . 1 4 4 VAL N N 15 113.358 0.000 . 1 . . . . A 4 VAL N . 30598 1
42 . 1 . 1 5 5 ARG H H 1 8.736 0.002 . 1 . . . . A 5 ARG H . 30598 1
43 . 1 . 1 5 5 ARG HA H 1 4.622 0.004 . 1 . . . . A 5 ARG HA . 30598 1
44 . 1 . 1 5 5 ARG HB2 H 1 1.662 0.001 . 1 . . . . A 5 ARG HB2 . 30598 1
45 . 1 . 1 5 5 ARG HB3 H 1 1.882 0.014 . 1 . . . . A 5 ARG HB3 . 30598 1
46 . 1 . 1 5 5 ARG HG2 H 1 1.302 0.001 . 1 . . . . A 5 ARG HG2 . 30598 1
47 . 1 . 1 5 5 ARG HG3 H 1 1.251 0.000 . 1 . . . . A 5 ARG HG3 . 30598 1
48 . 1 . 1 5 5 ARG HD2 H 1 3.007 0.000 . 1 . . . . A 5 ARG HD2 . 30598 1
49 . 1 . 1 5 5 ARG HD3 H 1 2.955 0.000 . 1 . . . . A 5 ARG HD3 . 30598 1
50 . 1 . 1 5 5 ARG C C 13 175.673 0.000 . 1 . . . . A 5 ARG C . 30598 1
51 . 1 . 1 5 5 ARG CA C 13 54.725 0.018 . 1 . . . . A 5 ARG CA . 30598 1
52 . 1 . 1 5 5 ARG CB C 13 32.848 0.048 . 1 . . . . A 5 ARG CB . 30598 1
53 . 1 . 1 5 5 ARG CG C 13 25.258 0.007 . 1 . . . . A 5 ARG CG . 30598 1
54 . 1 . 1 5 5 ARG CD C 13 44.434 0.025 . 1 . . . . A 5 ARG CD . 30598 1
55 . 1 . 1 5 5 ARG N N 15 116.628 0.007 . 1 . . . . A 5 ARG N . 30598 1
56 . 1 . 1 6 6 ASP H H 1 8.147 0.000 . 1 . . . . A 6 ASP H . 30598 1
57 . 1 . 1 6 6 ASP HA H 1 5.159 0.008 . 1 . . . . A 6 ASP HA . 30598 1
58 . 1 . 1 6 6 ASP HB2 H 1 2.583 0.002 . 2 . . . . A 6 ASP HB2 . 30598 1
59 . 1 . 1 6 6 ASP HB3 H 1 2.451 0.005 . 2 . . . . A 6 ASP HB3 . 30598 1
60 . 1 . 1 6 6 ASP C C 13 178.031 0.000 . 1 . . . . A 6 ASP C . 30598 1
61 . 1 . 1 6 6 ASP CA C 13 52.062 0.051 . 1 . . . . A 6 ASP CA . 30598 1
62 . 1 . 1 6 6 ASP CB C 13 40.089 0.031 . 1 . . . . A 6 ASP CB . 30598 1
63 . 1 . 1 6 6 ASP N N 15 122.893 0.002 . 1 . . . . A 6 ASP N . 30598 1
64 . 1 . 1 7 7 ALA H H 1 7.594 0.001 . 1 . . . . A 7 ALA H . 30598 1
65 . 1 . 1 7 7 ALA HA H 1 3.484 0.002 . 1 . . . . A 7 ALA HA . 30598 1
66 . 1 . 1 7 7 ALA HB1 H 1 1.047 0.008 . 1 . . . . A 7 ALA HB1 . 30598 1
67 . 1 . 1 7 7 ALA HB2 H 1 1.047 0.008 . 1 . . . . A 7 ALA HB2 . 30598 1
68 . 1 . 1 7 7 ALA HB3 H 1 1.047 0.008 . 1 . . . . A 7 ALA HB3 . 30598 1
69 . 1 . 1 7 7 ALA C C 13 178.669 0.000 . 1 . . . . A 7 ALA C . 30598 1
70 . 1 . 1 7 7 ALA CA C 13 51.730 0.013 . 1 . . . . A 7 ALA CA . 30598 1
71 . 1 . 1 7 7 ALA CB C 13 23.183 0.026 . 1 . . . . A 7 ALA CB . 30598 1
72 . 1 . 1 7 7 ALA N N 15 123.908 0.023 . 1 . . . . A 7 ALA N . 30598 1
73 . 1 . 1 8 8 TYR H H 1 8.163 0.002 . 1 . . . . A 8 TYR H . 30598 1
74 . 1 . 1 8 8 TYR HA H 1 5.304 0.006 . 1 . . . . A 8 TYR HA . 30598 1
75 . 1 . 1 8 8 TYR HB2 H 1 2.926 0.001 . 2 . . . . A 8 TYR HB2 . 30598 1
76 . 1 . 1 8 8 TYR HB3 H 1 2.926 0.001 . 2 . . . . A 8 TYR HB3 . 30598 1
77 . 1 . 1 8 8 TYR HD1 H 1 7.438 0.003 . 1 . . . . A 8 TYR HD1 . 30598 1
78 . 1 . 1 8 8 TYR HD2 H 1 7.438 0.003 . 1 . . . . A 8 TYR HD2 . 30598 1
79 . 1 . 1 8 8 TYR HE1 H 1 7.019 0.018 . 1 . . . . A 8 TYR HE1 . 30598 1
80 . 1 . 1 8 8 TYR HE2 H 1 7.019 0.018 . 1 . . . . A 8 TYR HE2 . 30598 1
81 . 1 . 1 8 8 TYR C C 13 178.101 0.000 . 1 . . . . A 8 TYR C . 30598 1
82 . 1 . 1 8 8 TYR CA C 13 57.896 0.038 . 1 . . . . A 8 TYR CA . 30598 1
83 . 1 . 1 8 8 TYR CB C 13 37.612 0.015 . 1 . . . . A 8 TYR CB . 30598 1
84 . 1 . 1 8 8 TYR CD1 C 13 134.566 0.000 . 1 . . . . A 8 TYR CD1 . 30598 1
85 . 1 . 1 8 8 TYR CE1 C 13 119.217 0.010 . 1 . . . . A 8 TYR CE1 . 30598 1
86 . 1 . 1 8 8 TYR N N 15 118.010 0.001 . 1 . . . . A 8 TYR N . 30598 1
87 . 1 . 1 9 9 ILE H H 1 6.533 0.001 . 1 . . . . A 9 ILE H . 30598 1
88 . 1 . 1 9 9 ILE HA H 1 4.215 0.004 . 1 . . . . A 9 ILE HA . 30598 1
89 . 1 . 1 9 9 ILE HB H 1 1.665 0.001 . 1 . . . . A 9 ILE HB . 30598 1
90 . 1 . 1 9 9 ILE HG12 H 1 1.775 0.000 . 1 . . . . A 9 ILE HG12 . 30598 1
91 . 1 . 1 9 9 ILE HG13 H 1 1.100 0.000 . 1 . . . . A 9 ILE HG13 . 30598 1
92 . 1 . 1 9 9 ILE HG21 H 1 0.612 0.000 . 1 . . . . A 9 ILE HG21 . 30598 1
93 . 1 . 1 9 9 ILE HG22 H 1 0.612 0.000 . 1 . . . . A 9 ILE HG22 . 30598 1
94 . 1 . 1 9 9 ILE HG23 H 1 0.612 0.000 . 1 . . . . A 9 ILE HG23 . 30598 1
95 . 1 . 1 9 9 ILE HD11 H 1 0.239 0.000 . 1 . . . . A 9 ILE HD11 . 30598 1
96 . 1 . 1 9 9 ILE HD12 H 1 0.239 0.000 . 1 . . . . A 9 ILE HD12 . 30598 1
97 . 1 . 1 9 9 ILE HD13 H 1 0.239 0.000 . 1 . . . . A 9 ILE HD13 . 30598 1
98 . 1 . 1 9 9 ILE C C 13 175.618 0.000 . 1 . . . . A 9 ILE C . 30598 1
99 . 1 . 1 9 9 ILE CA C 13 60.866 0.012 . 1 . . . . A 9 ILE CA . 30598 1
100 . 1 . 1 9 9 ILE CB C 13 39.296 0.014 . 1 . . . . A 9 ILE CB . 30598 1
101 . 1 . 1 9 9 ILE CG1 C 13 28.593 0.000 . 1 . . . . A 9 ILE CG1 . 30598 1
102 . 1 . 1 9 9 ILE CG2 C 13 15.199 0.044 . 1 . . . . A 9 ILE CG2 . 30598 1
103 . 1 . 1 9 9 ILE CD1 C 13 13.032 0.004 . 1 . . . . A 9 ILE CD1 . 30598 1
104 . 1 . 1 9 9 ILE N N 15 124.088 0.007 . 1 . . . . A 9 ILE N . 30598 1
105 . 1 . 1 10 10 ALA H H 1 7.750 0.002 . 1 . . . . A 10 ALA H . 30598 1
106 . 1 . 1 10 10 ALA HA H 1 5.346 0.002 . 1 . . . . A 10 ALA HA . 30598 1
107 . 1 . 1 10 10 ALA HB1 H 1 0.843 0.002 . 1 . . . . A 10 ALA HB1 . 30598 1
108 . 1 . 1 10 10 ALA HB2 H 1 0.843 0.002 . 1 . . . . A 10 ALA HB2 . 30598 1
109 . 1 . 1 10 10 ALA HB3 H 1 0.843 0.002 . 1 . . . . A 10 ALA HB3 . 30598 1
110 . 1 . 1 10 10 ALA C C 13 179.320 0.000 . 1 . . . . A 10 ALA C . 30598 1
111 . 1 . 1 10 10 ALA CA C 13 49.636 0.010 . 1 . . . . A 10 ALA CA . 30598 1
112 . 1 . 1 10 10 ALA CB C 13 21.575 0.006 . 1 . . . . A 10 ALA CB . 30598 1
113 . 1 . 1 10 10 ALA N N 15 126.408 0.010 . 1 . . . . A 10 ALA N . 30598 1
114 . 1 . 1 11 11 GLN H H 1 9.130 0.000 . 1 . . . . A 11 GLN H . 30598 1
115 . 1 . 1 11 11 GLN HA H 1 4.762 0.001 . 1 . . . . A 11 GLN HA . 30598 1
116 . 1 . 1 11 11 GLN HB2 H 1 1.835 0.001 . 2 . . . . A 11 GLN HB2 . 30598 1
117 . 1 . 1 11 11 GLN HB3 H 1 1.275 0.002 . 2 . . . . A 11 GLN HB3 . 30598 1
118 . 1 . 1 11 11 GLN HG2 H 1 1.305 0.000 . 1 . . . . A 11 GLN HG2 . 30598 1
119 . 1 . 1 11 11 GLN HG3 H 1 1.409 0.003 . 1 . . . . A 11 GLN HG3 . 30598 1
120 . 1 . 1 11 11 GLN HE21 H 1 6.196 0.000 . 2 . . . . A 11 GLN HE21 . 30598 1
121 . 1 . 1 11 11 GLN HE22 H 1 6.455 0.000 . 2 . . . . A 11 GLN HE22 . 30598 1
122 . 1 . 1 11 11 GLN CB C 13 28.594 0.015 . 1 . . . . A 11 GLN CB . 30598 1
123 . 1 . 1 11 11 GLN CG C 13 31.706 0.021 . 1 . . . . A 11 GLN CG . 30598 1
124 . 1 . 1 11 11 GLN N N 15 119.895 0.006 . 1 . . . . A 11 GLN N . 30598 1
125 . 1 . 1 11 11 GLN NE2 N 15 111.296 0.001 . 1 . . . . A 11 GLN NE2 . 30598 1
126 . 1 . 1 12 12 PRO HA H 1 4.297 0.002 . 1 . . . . A 12 PRO HA . 30598 1
127 . 1 . 1 12 12 PRO HB2 H 1 1.226 0.001 . 1 . . . . A 12 PRO HB2 . 30598 1
128 . 1 . 1 12 12 PRO HB3 H 1 1.270 0.001 . 1 . . . . A 12 PRO HB3 . 30598 1
129 . 1 . 1 12 12 PRO HG2 H 1 1.956 0.000 . 2 . . . . A 12 PRO HG2 . 30598 1
130 . 1 . 1 12 12 PRO HG3 H 1 1.781 0.002 . 2 . . . . A 12 PRO HG3 . 30598 1
131 . 1 . 1 12 12 PRO HD2 H 1 3.442 0.002 . 1 . . . . A 12 PRO HD2 . 30598 1
132 . 1 . 1 12 12 PRO HD3 H 1 3.715 0.002 . 1 . . . . A 12 PRO HD3 . 30598 1
133 . 1 . 1 12 12 PRO C C 13 180.249 0.000 . 1 . . . . A 12 PRO C . 30598 1
134 . 1 . 1 12 12 PRO CA C 13 58.674 0.000 . 1 . . . . A 12 PRO CA . 30598 1
135 . 1 . 1 12 12 PRO CB C 13 31.214 0.010 . 1 . . . . A 12 PRO CB . 30598 1
136 . 1 . 1 12 12 PRO CG C 13 28.048 0.014 . 1 . . . . A 12 PRO CG . 30598 1
137 . 1 . 1 12 12 PRO CD C 13 50.342 0.045 . 1 . . . . A 12 PRO CD . 30598 1
138 . 1 . 1 13 13 HIS H H 1 7.603 0.002 . 1 . . . . A 13 HIS H . 30598 1
139 . 1 . 1 13 13 HIS HA H 1 4.413 0.002 . 1 . . . . A 13 HIS HA . 30598 1
140 . 1 . 1 13 13 HIS HB2 H 1 2.630 0.003 . 2 . . . . A 13 HIS HB2 . 30598 1
141 . 1 . 1 13 13 HIS HB3 H 1 2.157 0.005 . 2 . . . . A 13 HIS HB3 . 30598 1
142 . 1 . 1 13 13 HIS HD2 H 1 7.252 0.000 . 1 . . . . A 13 HIS HD2 . 30598 1
143 . 1 . 1 13 13 HIS HE1 H 1 8.396 0.001 . 1 . . . . A 13 HIS HE1 . 30598 1
144 . 1 . 1 13 13 HIS CA C 13 58.946 0.011 . 1 . . . . A 13 HIS CA . 30598 1
145 . 1 . 1 13 13 HIS CB C 13 27.264 0.034 . 1 . . . . A 13 HIS CB . 30598 1
146 . 1 . 1 13 13 HIS CD2 C 13 120.618 0.063 . 1 . . . . A 13 HIS CD2 . 30598 1
147 . 1 . 1 13 13 HIS CE1 C 13 136.893 0.007 . 1 . . . . A 13 HIS CE1 . 30598 1
148 . 1 . 1 13 13 HIS N N 15 123.505 0.004 . 1 . . . . A 13 HIS N . 30598 1
149 . 1 . 1 14 14 ASN H H 1 9.108 0.001 . 1 . . . . A 14 ASN H . 30598 1
150 . 1 . 1 14 14 ASN HA H 1 4.183 0.009 . 1 . . . . A 14 ASN HA . 30598 1
151 . 1 . 1 14 14 ASN HB2 H 1 3.870 0.002 . 2 . . . . A 14 ASN HB2 . 30598 1
152 . 1 . 1 14 14 ASN HB3 H 1 2.264 0.009 . 2 . . . . A 14 ASN HB3 . 30598 1
153 . 1 . 1 14 14 ASN HD21 H 1 6.522 0.000 . 1 . . . . A 14 ASN HD21 . 30598 1
154 . 1 . 1 14 14 ASN HD22 H 1 7.195 0.000 . 1 . . . . A 14 ASN HD22 . 30598 1
155 . 1 . 1 14 14 ASN C C 13 176.505 0.000 . 1 . . . . A 14 ASN C . 30598 1
156 . 1 . 1 14 14 ASN CA C 13 53.757 0.046 . 1 . . . . A 14 ASN CA . 30598 1
157 . 1 . 1 14 14 ASN CB C 13 37.850 0.022 . 1 . . . . A 14 ASN CB . 30598 1
158 . 1 . 1 14 14 ASN N N 15 121.915 0.000 . 1 . . . . A 14 ASN N . 30598 1
159 . 1 . 1 14 14 ASN ND2 N 15 109.094 0.003 . 1 . . . . A 14 ASN ND2 . 30598 1
160 . 1 . 1 15 15 CYS H H 1 8.314 0.001 . 1 . . . . A 15 CYS H . 30598 1
161 . 1 . 1 15 15 CYS HA H 1 5.038 0.001 . 1 . . . . A 15 CYS HA . 30598 1
162 . 1 . 1 15 15 CYS HB2 H 1 2.415 0.005 . 1 . . . . A 15 CYS HB2 . 30598 1
163 . 1 . 1 15 15 CYS HB3 H 1 3.123 0.003 . 1 . . . . A 15 CYS HB3 . 30598 1
164 . 1 . 1 15 15 CYS C C 13 177.575 0.000 . 1 . . . . A 15 CYS C . 30598 1
165 . 1 . 1 15 15 CYS CA C 13 54.891 0.014 . 1 . . . . A 15 CYS CA . 30598 1
166 . 1 . 1 15 15 CYS CB C 13 45.860 0.017 . 1 . . . . A 15 CYS CB . 30598 1
167 . 1 . 1 15 15 CYS N N 15 116.006 0.003 . 1 . . . . A 15 CYS N . 30598 1
168 . 1 . 1 16 16 VAL H H 1 8.108 0.000 . 1 . . . . A 16 VAL H . 30598 1
169 . 1 . 1 16 16 VAL HA H 1 4.423 0.007 . 1 . . . . A 16 VAL HA . 30598 1
170 . 1 . 1 16 16 VAL HB H 1 2.187 0.005 . 1 . . . . A 16 VAL HB . 30598 1
171 . 1 . 1 16 16 VAL HG11 H 1 -0.020 0.000 . 2 . . . . A 16 VAL HG11 . 30598 1
172 . 1 . 1 16 16 VAL HG12 H 1 -0.020 0.000 . 2 . . . . A 16 VAL HG12 . 30598 1
173 . 1 . 1 16 16 VAL HG13 H 1 -0.020 0.000 . 2 . . . . A 16 VAL HG13 . 30598 1
174 . 1 . 1 16 16 VAL HG21 H 1 0.070 0.001 . 2 . . . . A 16 VAL HG21 . 30598 1
175 . 1 . 1 16 16 VAL HG22 H 1 0.070 0.001 . 2 . . . . A 16 VAL HG22 . 30598 1
176 . 1 . 1 16 16 VAL HG23 H 1 0.070 0.001 . 2 . . . . A 16 VAL HG23 . 30598 1
177 . 1 . 1 16 16 VAL C C 13 178.951 0.000 . 1 . . . . A 16 VAL C . 30598 1
178 . 1 . 1 16 16 VAL CA C 13 61.019 0.018 . 1 . . . . A 16 VAL CA . 30598 1
179 . 1 . 1 16 16 VAL CB C 13 31.855 0.007 . 1 . . . . A 16 VAL CB . 30598 1
180 . 1 . 1 16 16 VAL CG1 C 13 16.151 0.002 . 1 . . . . A 16 VAL CG1 . 30598 1
181 . 1 . 1 16 16 VAL CG2 C 13 21.469 0.013 . 1 . . . . A 16 VAL CG2 . 30598 1
182 . 1 . 1 16 16 VAL N N 15 113.434 0.000 . 1 . . . . A 16 VAL N . 30598 1
183 . 1 . 1 17 17 TYR H H 1 8.863 0.001 . 1 . . . . A 17 TYR H . 30598 1
184 . 1 . 1 17 17 TYR HA H 1 4.443 0.008 . 1 . . . . A 17 TYR HA . 30598 1
185 . 1 . 1 17 17 TYR HB2 H 1 2.795 0.006 . 2 . . . . A 17 TYR HB2 . 30598 1
186 . 1 . 1 17 17 TYR HB3 H 1 2.653 0.009 . 2 . . . . A 17 TYR HB3 . 30598 1
187 . 1 . 1 17 17 TYR HD1 H 1 7.078 0.000 . 1 . . . . A 17 TYR HD1 . 30598 1
188 . 1 . 1 17 17 TYR HD2 H 1 7.078 0.000 . 1 . . . . A 17 TYR HD2 . 30598 1
189 . 1 . 1 17 17 TYR HE1 H 1 6.346 0.001 . 1 . . . . A 17 TYR HE1 . 30598 1
190 . 1 . 1 17 17 TYR HE2 H 1 6.346 0.001 . 1 . . . . A 17 TYR HE2 . 30598 1
191 . 1 . 1 17 17 TYR C C 13 178.637 0.000 . 1 . . . . A 17 TYR C . 30598 1
192 . 1 . 1 17 17 TYR CA C 13 57.398 0.001 . 1 . . . . A 17 TYR CA . 30598 1
193 . 1 . 1 17 17 TYR CB C 13 37.773 0.046 . 1 . . . . A 17 TYR CB . 30598 1
194 . 1 . 1 17 17 TYR CD1 C 13 134.321 0.013 . 1 . . . . A 17 TYR CD1 . 30598 1
195 . 1 . 1 17 17 TYR CE1 C 13 117.347 0.008 . 1 . . . . A 17 TYR CE1 . 30598 1
196 . 1 . 1 17 17 TYR N N 15 120.460 0.003 . 1 . . . . A 17 TYR N . 30598 1
197 . 1 . 1 18 18 HIS H H 1 8.389 0.002 . 1 . . . . A 18 HIS H . 30598 1
198 . 1 . 1 18 18 HIS HA H 1 4.904 0.002 . 1 . . . . A 18 HIS HA . 30598 1
199 . 1 . 1 18 18 HIS HB2 H 1 3.097 0.001 . 2 . . . . A 18 HIS HB2 . 30598 1
200 . 1 . 1 18 18 HIS HB3 H 1 3.052 0.001 . 2 . . . . A 18 HIS HB3 . 30598 1
201 . 1 . 1 18 18 HIS HD2 H 1 7.164 0.002 . 1 . . . . A 18 HIS HD2 . 30598 1
202 . 1 . 1 18 18 HIS HE1 H 1 8.099 0.001 . 1 . . . . A 18 HIS HE1 . 30598 1
203 . 1 . 1 18 18 HIS CA C 13 56.485 0.010 . 1 . . . . A 18 HIS CA . 30598 1
204 . 1 . 1 18 18 HIS CB C 13 29.016 0.012 . 1 . . . . A 18 HIS CB . 30598 1
205 . 1 . 1 18 18 HIS CD2 C 13 121.405 0.016 . 1 . . . . A 18 HIS CD2 . 30598 1
206 . 1 . 1 18 18 HIS CE1 C 13 137.020 0.004 . 1 . . . . A 18 HIS CE1 . 30598 1
207 . 1 . 1 18 18 HIS N N 15 121.698 0.012 . 1 . . . . A 18 HIS N . 30598 1
208 . 1 . 1 19 19 CYS H H 1 7.242 0.000 . 1 . . . . A 19 CYS H . 30598 1
209 . 1 . 1 19 19 CYS HA H 1 4.746 0.002 . 1 . . . . A 19 CYS HA . 30598 1
210 . 1 . 1 19 19 CYS HB2 H 1 3.158 0.002 . 2 . . . . A 19 CYS HB2 . 30598 1
211 . 1 . 1 19 19 CYS HB3 H 1 3.158 0.002 . 2 . . . . A 19 CYS HB3 . 30598 1
212 . 1 . 1 19 19 CYS C C 13 174.463 0.000 . 1 . . . . A 19 CYS C . 30598 1
213 . 1 . 1 19 19 CYS CA C 13 53.707 0.000 . 1 . . . . A 19 CYS CA . 30598 1
214 . 1 . 1 19 19 CYS CB C 13 48.017 0.033 . 1 . . . . A 19 CYS CB . 30598 1
215 . 1 . 1 19 19 CYS N N 15 113.800 0.004 . 1 . . . . A 19 CYS N . 30598 1
216 . 1 . 1 20 20 PHE H H 1 8.990 0.001 . 1 . . . . A 20 PHE H . 30598 1
217 . 1 . 1 20 20 PHE HA H 1 4.686 0.002 . 1 . . . . A 20 PHE HA . 30598 1
218 . 1 . 1 20 20 PHE HB2 H 1 3.263 0.000 . 2 . . . . A 20 PHE HB2 . 30598 1
219 . 1 . 1 20 20 PHE HB3 H 1 2.931 0.002 . 2 . . . . A 20 PHE HB3 . 30598 1
220 . 1 . 1 20 20 PHE HD1 H 1 7.267 0.000 . 1 . . . . A 20 PHE HD1 . 30598 1
221 . 1 . 1 20 20 PHE HD2 H 1 7.267 0.000 . 1 . . . . A 20 PHE HD2 . 30598 1
222 . 1 . 1 20 20 PHE HE1 H 1 7.306 0.002 . 1 . . . . A 20 PHE HE1 . 30598 1
223 . 1 . 1 20 20 PHE HE2 H 1 7.306 0.002 . 1 . . . . A 20 PHE HE2 . 30598 1
224 . 1 . 1 20 20 PHE C C 13 178.247 0.000 . 1 . . . . A 20 PHE C . 30598 1
225 . 1 . 1 20 20 PHE CA C 13 58.518 0.000 . 1 . . . . A 20 PHE CA . 30598 1
226 . 1 . 1 20 20 PHE CB C 13 41.610 0.021 . 1 . . . . A 20 PHE CB . 30598 1
227 . 1 . 1 20 20 PHE CD1 C 13 132.277 0.020 . 1 . . . . A 20 PHE CD1 . 30598 1
228 . 1 . 1 20 20 PHE CE1 C 13 132.164 0.013 . 1 . . . . A 20 PHE CE1 . 30598 1
229 . 1 . 1 20 20 PHE N N 15 115.071 0.005 . 1 . . . . A 20 PHE N . 30598 1
230 . 1 . 1 21 21 ARG H H 1 7.819 0.000 . 1 . . . . A 21 ARG H . 30598 1
231 . 1 . 1 21 21 ARG HA H 1 4.910 0.006 . 1 . . . . A 21 ARG HA . 30598 1
232 . 1 . 1 21 21 ARG HB2 H 1 2.081 0.006 . 1 . . . . A 21 ARG HB2 . 30598 1
233 . 1 . 1 21 21 ARG HB3 H 1 1.964 0.001 . 1 . . . . A 21 ARG HB3 . 30598 1
234 . 1 . 1 21 21 ARG HG2 H 1 1.732 0.003 . 2 . . . . A 21 ARG HG2 . 30598 1
235 . 1 . 1 21 21 ARG HG3 H 1 1.732 0.003 . 2 . . . . A 21 ARG HG3 . 30598 1
236 . 1 . 1 21 21 ARG HD2 H 1 3.279 0.004 . 2 . . . . A 21 ARG HD2 . 30598 1
237 . 1 . 1 21 21 ARG HD3 H 1 3.279 0.004 . 2 . . . . A 21 ARG HD3 . 30598 1
238 . 1 . 1 21 21 ARG C C 13 179.639 0.000 . 1 . . . . A 21 ARG C . 30598 1
239 . 1 . 1 21 21 ARG CA C 13 54.709 0.004 . 1 . . . . A 21 ARG CA . 30598 1
240 . 1 . 1 21 21 ARG CB C 13 33.284 0.016 . 1 . . . . A 21 ARG CB . 30598 1
241 . 1 . 1 21 21 ARG CG C 13 27.278 0.008 . 1 . . . . A 21 ARG CG . 30598 1
242 . 1 . 1 21 21 ARG CD C 13 43.487 0.007 . 1 . . . . A 21 ARG CD . 30598 1
243 . 1 . 1 21 21 ARG N N 15 117.905 0.008 . 1 . . . . A 21 ARG N . 30598 1
244 . 1 . 1 22 22 ASP H H 1 9.076 0.002 . 1 . . . . A 22 ASP H . 30598 1
245 . 1 . 1 22 22 ASP HA H 1 4.282 0.004 . 1 . . . . A 22 ASP HA . 30598 1
246 . 1 . 1 22 22 ASP HB2 H 1 2.997 0.007 . 2 . . . . A 22 ASP HB2 . 30598 1
247 . 1 . 1 22 22 ASP HB3 H 1 2.724 0.006 . 2 . . . . A 22 ASP HB3 . 30598 1
248 . 1 . 1 22 22 ASP C C 13 181.613 0.000 . 1 . . . . A 22 ASP C . 30598 1
249 . 1 . 1 22 22 ASP CA C 13 58.718 0.030 . 1 . . . . A 22 ASP CA . 30598 1
250 . 1 . 1 22 22 ASP CB C 13 40.859 0.025 . 1 . . . . A 22 ASP CB . 30598 1
251 . 1 . 1 22 22 ASP N N 15 124.188 0.005 . 1 . . . . A 22 ASP N . 30598 1
252 . 1 . 1 23 23 SER H H 1 8.930 0.001 . 1 . . . . A 23 SER H . 30598 1
253 . 1 . 1 23 23 SER HA H 1 4.118 0.000 . 1 . . . . A 23 SER HA . 30598 1
254 . 1 . 1 23 23 SER HB2 H 1 4.005 0.001 . 2 . . . . A 23 SER HB2 . 30598 1
255 . 1 . 1 23 23 SER HB3 H 1 3.956 0.000 . 2 . . . . A 23 SER HB3 . 30598 1
256 . 1 . 1 23 23 SER C C 13 179.282 0.000 . 1 . . . . A 23 SER C . 30598 1
257 . 1 . 1 23 23 SER CA C 13 61.488 0.015 . 1 . . . . A 23 SER CA . 30598 1
258 . 1 . 1 23 23 SER CB C 13 61.740 0.011 . 1 . . . . A 23 SER CB . 30598 1
259 . 1 . 1 23 23 SER N N 15 114.722 0.003 . 1 . . . . A 23 SER N . 30598 1
260 . 1 . 1 24 24 TYR H H 1 6.634 0.001 . 1 . . . . A 24 TYR H . 30598 1
261 . 1 . 1 24 24 TYR HA H 1 4.410 0.000 . 1 . . . . A 24 TYR HA . 30598 1
262 . 1 . 1 24 24 TYR HB2 H 1 3.438 0.002 . 2 . . . . A 24 TYR HB2 . 30598 1
263 . 1 . 1 24 24 TYR HB3 H 1 3.178 0.002 . 2 . . . . A 24 TYR HB3 . 30598 1
264 . 1 . 1 24 24 TYR HD1 H 1 7.142 0.001 . 1 . . . . A 24 TYR HD1 . 30598 1
265 . 1 . 1 24 24 TYR HD2 H 1 7.142 0.001 . 1 . . . . A 24 TYR HD2 . 30598 1
266 . 1 . 1 24 24 TYR HE1 H 1 6.806 0.001 . 1 . . . . A 24 TYR HE1 . 30598 1
267 . 1 . 1 24 24 TYR HE2 H 1 6.806 0.001 . 1 . . . . A 24 TYR HE2 . 30598 1
268 . 1 . 1 24 24 TYR C C 13 180.195 0.000 . 1 . . . . A 24 TYR C . 30598 1
269 . 1 . 1 24 24 TYR CA C 13 60.390 0.019 . 1 . . . . A 24 TYR CA . 30598 1
270 . 1 . 1 24 24 TYR CB C 13 39.180 0.029 . 1 . . . . A 24 TYR CB . 30598 1
271 . 1 . 1 24 24 TYR CD1 C 13 133.772 0.050 . 1 . . . . A 24 TYR CD1 . 30598 1
272 . 1 . 1 24 24 TYR CE1 C 13 118.582 0.036 . 1 . . . . A 24 TYR CE1 . 30598 1
273 . 1 . 1 24 24 TYR N N 15 121.972 0.009 . 1 . . . . A 24 TYR N . 30598 1
274 . 1 . 1 25 25 CYS H H 1 6.885 0.001 . 1 . . . . A 25 CYS H . 30598 1
275 . 1 . 1 25 25 CYS HA H 1 4.179 0.002 . 1 . . . . A 25 CYS HA . 30598 1
276 . 1 . 1 25 25 CYS HB2 H 1 2.662 0.007 . 2 . . . . A 25 CYS HB2 . 30598 1
277 . 1 . 1 25 25 CYS HB3 H 1 2.381 0.002 . 2 . . . . A 25 CYS HB3 . 30598 1
278 . 1 . 1 25 25 CYS C C 13 179.223 0.000 . 1 . . . . A 25 CYS C . 30598 1
279 . 1 . 1 25 25 CYS CA C 13 53.990 0.039 . 1 . . . . A 25 CYS CA . 30598 1
280 . 1 . 1 25 25 CYS CB C 13 33.792 0.013 . 1 . . . . A 25 CYS CB . 30598 1
281 . 1 . 1 25 25 CYS N N 15 116.724 0.002 . 1 . . . . A 25 CYS N . 30598 1
282 . 1 . 1 26 26 ASN H H 1 9.154 0.002 . 1 . . . . A 26 ASN H . 30598 1
283 . 1 . 1 26 26 ASN HA H 1 4.011 0.005 . 1 . . . . A 26 ASN HA . 30598 1
284 . 1 . 1 26 26 ASN HB2 H 1 2.789 0.000 . 1 . . . . A 26 ASN HB2 . 30598 1
285 . 1 . 1 26 26 ASN HB3 H 1 2.786 0.003 . 1 . . . . A 26 ASN HB3 . 30598 1
286 . 1 . 1 26 26 ASN HD21 H 1 7.751 0.000 . 1 . . . . A 26 ASN HD21 . 30598 1
287 . 1 . 1 26 26 ASN HD22 H 1 6.725 0.000 . 1 . . . . A 26 ASN HD22 . 30598 1
288 . 1 . 1 26 26 ASN C C 13 178.683 0.000 . 1 . . . . A 26 ASN C . 30598 1
289 . 1 . 1 26 26 ASN CA C 13 58.052 0.005 . 1 . . . . A 26 ASN CA . 30598 1
290 . 1 . 1 26 26 ASN CB C 13 39.254 0.015 . 1 . . . . A 26 ASN CB . 30598 1
291 . 1 . 1 26 26 ASN N N 15 123.382 0.008 . 1 . . . . A 26 ASN N . 30598 1
292 . 1 . 1 26 26 ASN ND2 N 15 114.771 0.001 . 1 . . . . A 26 ASN ND2 . 30598 1
293 . 1 . 1 27 27 ASP H H 1 7.657 0.001 . 1 . . . . A 27 ASP H . 30598 1
294 . 1 . 1 27 27 ASP HA H 1 4.194 0.007 . 1 . . . . A 27 ASP HA . 30598 1
295 . 1 . 1 27 27 ASP HB2 H 1 2.714 0.018 . 2 . . . . A 27 ASP HB2 . 30598 1
296 . 1 . 1 27 27 ASP HB3 H 1 2.524 0.003 . 2 . . . . A 27 ASP HB3 . 30598 1
297 . 1 . 1 27 27 ASP C C 13 180.826 0.000 . 1 . . . . A 27 ASP C . 30598 1
298 . 1 . 1 27 27 ASP CA C 13 57.477 0.017 . 1 . . . . A 27 ASP CA . 30598 1
299 . 1 . 1 27 27 ASP CB C 13 41.095 0.013 . 1 . . . . A 27 ASP CB . 30598 1
300 . 1 . 1 27 27 ASP N N 15 116.890 0.003 . 1 . . . . A 27 ASP N . 30598 1
301 . 1 . 1 28 28 LEU H H 1 7.560 0.001 . 1 . . . . A 28 LEU H . 30598 1
302 . 1 . 1 28 28 LEU HA H 1 3.817 0.007 . 1 . . . . A 28 LEU HA . 30598 1
303 . 1 . 1 28 28 LEU HB2 H 1 1.370 0.004 . 2 . . . . A 28 LEU HB2 . 30598 1
304 . 1 . 1 28 28 LEU HB3 H 1 0.982 0.001 . 2 . . . . A 28 LEU HB3 . 30598 1
305 . 1 . 1 28 28 LEU HG H 1 0.818 0.001 . 1 . . . . A 28 LEU HG . 30598 1
306 . 1 . 1 28 28 LEU HD11 H 1 -0.208 0.000 . 2 . . . . A 28 LEU HD11 . 30598 1
307 . 1 . 1 28 28 LEU HD12 H 1 -0.208 0.000 . 2 . . . . A 28 LEU HD12 . 30598 1
308 . 1 . 1 28 28 LEU HD13 H 1 -0.208 0.000 . 2 . . . . A 28 LEU HD13 . 30598 1
309 . 1 . 1 28 28 LEU HD21 H 1 0.359 0.000 . 2 . . . . A 28 LEU HD21 . 30598 1
310 . 1 . 1 28 28 LEU HD22 H 1 0.359 0.000 . 2 . . . . A 28 LEU HD22 . 30598 1
311 . 1 . 1 28 28 LEU HD23 H 1 0.359 0.000 . 2 . . . . A 28 LEU HD23 . 30598 1
312 . 1 . 1 28 28 LEU C C 13 181.547 0.000 . 1 . . . . A 28 LEU C . 30598 1
313 . 1 . 1 28 28 LEU CA C 13 58.235 0.000 . 1 . . . . A 28 LEU CA . 30598 1
314 . 1 . 1 28 28 LEU CB C 13 42.878 0.051 . 1 . . . . A 28 LEU CB . 30598 1
315 . 1 . 1 28 28 LEU CG C 13 26.799 0.014 . 1 . . . . A 28 LEU CG . 30598 1
316 . 1 . 1 28 28 LEU CD1 C 13 25.871 0.001 . 1 . . . . A 28 LEU CD1 . 30598 1
317 . 1 . 1 28 28 LEU CD2 C 13 23.288 0.007 . 1 . . . . A 28 LEU CD2 . 30598 1
318 . 1 . 1 28 28 LEU N N 15 120.574 0.006 . 1 . . . . A 28 LEU N . 30598 1
319 . 1 . 1 29 29 CYS H H 1 8.562 0.002 . 1 . . . . A 29 CYS H . 30598 1
320 . 1 . 1 29 29 CYS HA H 1 3.888 0.013 . 1 . . . . A 29 CYS HA . 30598 1
321 . 1 . 1 29 29 CYS HB2 H 1 2.565 0.000 . 1 . . . . A 29 CYS HB2 . 30598 1
322 . 1 . 1 29 29 CYS HB3 H 1 2.537 0.009 . 1 . . . . A 29 CYS HB3 . 30598 1
323 . 1 . 1 29 29 CYS C C 13 180.587 0.000 . 1 . . . . A 29 CYS C . 30598 1
324 . 1 . 1 29 29 CYS CA C 13 59.051 0.003 . 1 . . . . A 29 CYS CA . 30598 1
325 . 1 . 1 29 29 CYS CB C 13 36.258 0.006 . 1 . . . . A 29 CYS CB . 30598 1
326 . 1 . 1 29 29 CYS N N 15 116.035 0.003 . 1 . . . . A 29 CYS N . 30598 1
327 . 1 . 1 30 30 ILE H H 1 8.315 0.001 . 1 . . . . A 30 ILE H . 30598 1
328 . 1 . 1 30 30 ILE HA H 1 3.943 0.007 . 1 . . . . A 30 ILE HA . 30598 1
329 . 1 . 1 30 30 ILE HB H 1 1.775 0.003 . 1 . . . . A 30 ILE HB . 30598 1
330 . 1 . 1 30 30 ILE HG12 H 1 1.357 0.000 . 2 . . . . A 30 ILE HG12 . 30598 1
331 . 1 . 1 30 30 ILE HG13 H 1 0.884 0.000 . 2 . . . . A 30 ILE HG13 . 30598 1
332 . 1 . 1 30 30 ILE HG21 H 1 0.821 0.000 . 1 . . . . A 30 ILE HG21 . 30598 1
333 . 1 . 1 30 30 ILE HG22 H 1 0.821 0.000 . 1 . . . . A 30 ILE HG22 . 30598 1
334 . 1 . 1 30 30 ILE HG23 H 1 0.821 0.000 . 1 . . . . A 30 ILE HG23 . 30598 1
335 . 1 . 1 30 30 ILE HD11 H 1 0.747 0.000 . 1 . . . . A 30 ILE HD11 . 30598 1
336 . 1 . 1 30 30 ILE HD12 H 1 0.747 0.000 . 1 . . . . A 30 ILE HD12 . 30598 1
337 . 1 . 1 30 30 ILE HD13 H 1 0.747 0.000 . 1 . . . . A 30 ILE HD13 . 30598 1
338 . 1 . 1 30 30 ILE C C 13 183.885 0.000 . 1 . . . . A 30 ILE C . 30598 1
339 . 1 . 1 30 30 ILE CA C 13 65.539 0.026 . 1 . . . . A 30 ILE CA . 30598 1
340 . 1 . 1 30 30 ILE CB C 13 37.865 0.005 . 1 . . . . A 30 ILE CB . 30598 1
341 . 1 . 1 30 30 ILE CG1 C 13 29.807 0.041 . 1 . . . . A 30 ILE CG1 . 30598 1
342 . 1 . 1 30 30 ILE CG2 C 13 16.764 0.001 . 1 . . . . A 30 ILE CG2 . 30598 1
343 . 1 . 1 30 30 ILE CD1 C 13 13.906 0.009 . 1 . . . . A 30 ILE CD1 . 30598 1
344 . 1 . 1 30 30 ILE N N 15 123.265 0.003 . 1 . . . . A 30 ILE N . 30598 1
345 . 1 . 1 31 31 LYS H H 1 8.126 0.000 . 1 . . . . A 31 LYS H . 30598 1
346 . 1 . 1 31 31 LYS HA H 1 4.027 0.004 . 1 . . . . A 31 LYS HA . 30598 1
347 . 1 . 1 31 31 LYS HB2 H 1 1.982 0.004 . 2 . . . . A 31 LYS HB2 . 30598 1
348 . 1 . 1 31 31 LYS HB3 H 1 1.850 0.008 . 2 . . . . A 31 LYS HB3 . 30598 1
349 . 1 . 1 31 31 LYS HG2 H 1 1.313 0.000 . 2 . . . . A 31 LYS HG2 . 30598 1
350 . 1 . 1 31 31 LYS HG3 H 1 1.439 0.001 . 2 . . . . A 31 LYS HG3 . 30598 1
351 . 1 . 1 31 31 LYS HD2 H 1 1.551 0.000 . 2 . . . . A 31 LYS HD2 . 30598 1
352 . 1 . 1 31 31 LYS HD3 H 1 1.551 0.000 . 2 . . . . A 31 LYS HD3 . 30598 1
353 . 1 . 1 31 31 LYS HE2 H 1 2.896 0.001 . 2 . . . . A 31 LYS HE2 . 30598 1
354 . 1 . 1 31 31 LYS HE3 H 1 2.896 0.001 . 2 . . . . A 31 LYS HE3 . 30598 1
355 . 1 . 1 31 31 LYS C C 13 181.020 0.000 . 1 . . . . A 31 LYS C . 30598 1
356 . 1 . 1 31 31 LYS CA C 13 59.160 0.022 . 1 . . . . A 31 LYS CA . 30598 1
357 . 1 . 1 31 31 LYS CB C 13 31.792 0.007 . 1 . . . . A 31 LYS CB . 30598 1
358 . 1 . 1 31 31 LYS CG C 13 25.683 0.011 . 1 . . . . A 31 LYS CG . 30598 1
359 . 1 . 1 31 31 LYS CD C 13 29.072 0.043 . 1 . . . . A 31 LYS CD . 30598 1
360 . 1 . 1 31 31 LYS CE C 13 42.007 0.001 . 1 . . . . A 31 LYS CE . 30598 1
361 . 1 . 1 31 31 LYS N N 15 123.479 0.032 . 1 . . . . A 31 LYS N . 30598 1
362 . 1 . 1 32 32 HIS H H 1 7.360 0.000 . 1 . . . . A 32 HIS H . 30598 1
363 . 1 . 1 32 32 HIS HA H 1 4.359 0.003 . 1 . . . . A 32 HIS HA . 30598 1
364 . 1 . 1 32 32 HIS HB2 H 1 2.700 0.003 . 1 . . . . A 32 HIS HB2 . 30598 1
365 . 1 . 1 32 32 HIS HB3 H 1 3.537 0.001 . 1 . . . . A 32 HIS HB3 . 30598 1
366 . 1 . 1 32 32 HIS HD2 H 1 7.581 0.001 . 1 . . . . A 32 HIS HD2 . 30598 1
367 . 1 . 1 32 32 HIS HE1 H 1 8.556 0.003 . 1 . . . . A 32 HIS HE1 . 30598 1
368 . 1 . 1 32 32 HIS CA C 13 56.110 0.010 . 1 . . . . A 32 HIS CA . 30598 1
369 . 1 . 1 32 32 HIS CB C 13 28.334 0.022 . 1 . . . . A 32 HIS CB . 30598 1
370 . 1 . 1 32 32 HIS CD2 C 13 120.552 0.022 . 1 . . . . A 32 HIS CD2 . 30598 1
371 . 1 . 1 32 32 HIS CE1 C 13 135.774 0.013 . 1 . . . . A 32 HIS CE1 . 30598 1
372 . 1 . 1 32 32 HIS N N 15 115.530 0.008 . 1 . . . . A 32 HIS N . 30598 1
373 . 1 . 1 33 33 GLY H H 1 7.783 0.001 . 1 . . . . A 33 GLY H . 30598 1
374 . 1 . 1 33 33 GLY HA2 H 1 3.726 0.003 . 1 . . . . A 33 GLY HA2 . 30598 1
375 . 1 . 1 33 33 GLY HA3 H 1 4.119 0.001 . 1 . . . . A 33 GLY HA3 . 30598 1
376 . 1 . 1 33 33 GLY C C 13 177.393 0.000 . 1 . . . . A 33 GLY C . 30598 1
377 . 1 . 1 33 33 GLY CA C 13 45.597 0.007 . 1 . . . . A 33 GLY CA . 30598 1
378 . 1 . 1 33 33 GLY N N 15 104.854 0.007 . 1 . . . . A 33 GLY N . 30598 1
379 . 1 . 1 34 34 ALA H H 1 8.060 0.001 . 1 . . . . A 34 ALA H . 30598 1
380 . 1 . 1 34 34 ALA HA H 1 4.755 0.011 . 1 . . . . A 34 ALA HA . 30598 1
381 . 1 . 1 34 34 ALA HB1 H 1 1.236 0.000 . 1 . . . . A 34 ALA HB1 . 30598 1
382 . 1 . 1 34 34 ALA HB2 H 1 1.236 0.000 . 1 . . . . A 34 ALA HB2 . 30598 1
383 . 1 . 1 34 34 ALA HB3 H 1 1.236 0.000 . 1 . . . . A 34 ALA HB3 . 30598 1
384 . 1 . 1 34 34 ALA C C 13 178.344 0.000 . 1 . . . . A 34 ALA C . 30598 1
385 . 1 . 1 34 34 ALA CA C 13 50.284 0.000 . 1 . . . . A 34 ALA CA . 30598 1
386 . 1 . 1 34 34 ALA CB C 13 20.203 0.006 . 1 . . . . A 34 ALA CB . 30598 1
387 . 1 . 1 34 34 ALA N N 15 121.496 0.008 . 1 . . . . A 34 ALA N . 30598 1
388 . 1 . 1 35 35 GLU H H 1 8.114 0.000 . 1 . . . . A 35 GLU H . 30598 1
389 . 1 . 1 35 35 GLU HA H 1 4.090 0.001 . 1 . . . . A 35 GLU HA . 30598 1
390 . 1 . 1 35 35 GLU HB2 H 1 1.988 0.016 . 2 . . . . A 35 GLU HB2 . 30598 1
391 . 1 . 1 35 35 GLU HB3 H 1 1.811 0.013 . 2 . . . . A 35 GLU HB3 . 30598 1
392 . 1 . 1 35 35 GLU HG2 H 1 2.070 0.001 . 2 . . . . A 35 GLU HG2 . 30598 1
393 . 1 . 1 35 35 GLU HG3 H 1 2.215 0.000 . 2 . . . . A 35 GLU HG3 . 30598 1
394 . 1 . 1 35 35 GLU C C 13 179.331 0.000 . 1 . . . . A 35 GLU C . 30598 1
395 . 1 . 1 35 35 GLU CA C 13 58.619 0.000 . 1 . . . . A 35 GLU CA . 30598 1
396 . 1 . 1 35 35 GLU CB C 13 32.160 0.006 . 1 . . . . A 35 GLU CB . 30598 1
397 . 1 . 1 35 35 GLU CG C 13 37.256 0.017 . 1 . . . . A 35 GLU CG . 30598 1
398 . 1 . 1 35 35 GLU N N 15 117.966 0.015 . 1 . . . . A 35 GLU N . 30598 1
399 . 1 . 1 36 36 SER H H 1 7.542 0.001 . 1 . . . . A 36 SER H . 30598 1
400 . 1 . 1 36 36 SER HA H 1 4.551 0.000 . 1 . . . . A 36 SER HA . 30598 1
401 . 1 . 1 36 36 SER HB2 H 1 3.978 0.000 . 2 . . . . A 36 SER HB2 . 30598 1
402 . 1 . 1 36 36 SER HB3 H 1 4.003 0.014 . 2 . . . . A 36 SER HB3 . 30598 1
403 . 1 . 1 36 36 SER C C 13 175.833 0.000 . 1 . . . . A 36 SER C . 30598 1
404 . 1 . 1 36 36 SER CA C 13 57.456 0.004 . 1 . . . . A 36 SER CA . 30598 1
405 . 1 . 1 36 36 SER CB C 13 64.705 0.030 . 1 . . . . A 36 SER CB . 30598 1
406 . 1 . 1 36 36 SER N N 15 106.962 0.010 . 1 . . . . A 36 SER N . 30598 1
407 . 1 . 1 37 37 GLY H H 1 8.837 0.001 . 1 . . . . A 37 GLY H . 30598 1
408 . 1 . 1 37 37 GLY HA2 H 1 5.225 0.008 . 1 . . . . A 37 GLY HA2 . 30598 1
409 . 1 . 1 37 37 GLY HA3 H 1 3.922 0.002 . 1 . . . . A 37 GLY HA3 . 30598 1
410 . 1 . 1 37 37 GLY C C 13 173.802 0.000 . 1 . . . . A 37 GLY C . 30598 1
411 . 1 . 1 37 37 GLY CA C 13 46.420 0.000 . 1 . . . . A 37 GLY CA . 30598 1
412 . 1 . 1 37 37 GLY N N 15 106.522 0.001 . 1 . . . . A 37 GLY N . 30598 1
413 . 1 . 1 38 38 GLU H H 1 9.231 0.001 . 1 . . . . A 38 GLU H . 30598 1
414 . 1 . 1 38 38 GLU HA H 1 4.644 0.002 . 1 . . . . A 38 GLU HA . 30598 1
415 . 1 . 1 38 38 GLU HB2 H 1 2.062 0.001 . 1 . . . . A 38 GLU HB2 . 30598 1
416 . 1 . 1 38 38 GLU HB3 H 1 2.015 0.018 . 1 . . . . A 38 GLU HB3 . 30598 1
417 . 1 . 1 38 38 GLU HG2 H 1 2.269 0.000 . 2 . . . . A 38 GLU HG2 . 30598 1
418 . 1 . 1 38 38 GLU HG3 H 1 2.064 0.000 . 2 . . . . A 38 GLU HG3 . 30598 1
419 . 1 . 1 38 38 GLU C C 13 176.091 0.000 . 1 . . . . A 38 GLU C . 30598 1
420 . 1 . 1 38 38 GLU CA C 13 54.716 0.026 . 1 . . . . A 38 GLU CA . 30598 1
421 . 1 . 1 38 38 GLU CB C 13 33.648 0.020 . 1 . . . . A 38 GLU CB . 30598 1
422 . 1 . 1 38 38 GLU CG C 13 35.644 0.015 . 1 . . . . A 38 GLU CG . 30598 1
423 . 1 . 1 38 38 GLU N N 15 114.829 0.007 . 1 . . . . A 38 GLU N . 30598 1
424 . 1 . 1 39 39 CYS H H 1 10.118 0.002 . 1 . . . . A 39 CYS H . 30598 1
425 . 1 . 1 39 39 CYS HA H 1 5.227 0.005 . 1 . . . . A 39 CYS HA . 30598 1
426 . 1 . 1 39 39 CYS HB2 H 1 2.910 0.007 . 1 . . . . A 39 CYS HB2 . 30598 1
427 . 1 . 1 39 39 CYS HB3 H 1 2.908 0.000 . 1 . . . . A 39 CYS HB3 . 30598 1
428 . 1 . 1 39 39 CYS C C 13 175.683 0.000 . 1 . . . . A 39 CYS C . 30598 1
429 . 1 . 1 39 39 CYS CA C 13 55.458 0.038 . 1 . . . . A 39 CYS CA . 30598 1
430 . 1 . 1 39 39 CYS CB C 13 36.487 0.001 . 1 . . . . A 39 CYS CB . 30598 1
431 . 1 . 1 39 39 CYS N N 15 124.555 0.011 . 1 . . . . A 39 CYS N . 30598 1
432 . 1 . 1 40 40 LYS H H 1 8.715 0.002 . 1 . . . . A 40 LYS H . 30598 1
433 . 1 . 1 40 40 LYS HA H 1 4.752 0.008 . 1 . . . . A 40 LYS HA . 30598 1
434 . 1 . 1 40 40 LYS HB2 H 1 1.994 0.000 . 1 . . . . A 40 LYS HB2 . 30598 1
435 . 1 . 1 40 40 LYS HB3 H 1 1.778 0.000 . 1 . . . . A 40 LYS HB3 . 30598 1
436 . 1 . 1 40 40 LYS HG2 H 1 1.590 0.002 . 2 . . . . A 40 LYS HG2 . 30598 1
437 . 1 . 1 40 40 LYS HG3 H 1 1.350 0.001 . 2 . . . . A 40 LYS HG3 . 30598 1
438 . 1 . 1 40 40 LYS HD2 H 1 0.919 0.001 . 2 . . . . A 40 LYS HD2 . 30598 1
439 . 1 . 1 40 40 LYS HD3 H 1 0.796 0.001 . 2 . . . . A 40 LYS HD3 . 30598 1
440 . 1 . 1 40 40 LYS HE2 H 1 2.178 0.000 . 2 . . . . A 40 LYS HE2 . 30598 1
441 . 1 . 1 40 40 LYS HE3 H 1 2.151 0.001 . 2 . . . . A 40 LYS HE3 . 30598 1
442 . 1 . 1 40 40 LYS C C 13 177.634 0.000 . 1 . . . . A 40 LYS C . 30598 1
443 . 1 . 1 40 40 LYS CA C 13 55.313 0.000 . 1 . . . . A 40 LYS CA . 30598 1
444 . 1 . 1 40 40 LYS CB C 13 37.521 0.004 . 1 . . . . A 40 LYS CB . 30598 1
445 . 1 . 1 40 40 LYS CG C 13 24.968 0.016 . 1 . . . . A 40 LYS CG . 30598 1
446 . 1 . 1 40 40 LYS CD C 13 29.394 0.003 . 1 . . . . A 40 LYS CD . 30598 1
447 . 1 . 1 40 40 LYS CE C 13 41.602 0.005 . 1 . . . . A 40 LYS CE . 30598 1
448 . 1 . 1 40 40 LYS N N 15 131.085 0.009 . 1 . . . . A 40 LYS N . 30598 1
449 . 1 . 1 41 41 TRP H H 1 8.546 0.001 . 1 . . . . A 41 TRP H . 30598 1
450 . 1 . 1 41 41 TRP HA H 1 4.468 0.000 . 1 . . . . A 41 TRP HA . 30598 1
451 . 1 . 1 41 41 TRP HB2 H 1 3.210 0.000 . 1 . . . . A 41 TRP HB2 . 30598 1
452 . 1 . 1 41 41 TRP HB3 H 1 3.053 0.001 . 1 . . . . A 41 TRP HB3 . 30598 1
453 . 1 . 1 41 41 TRP HD1 H 1 7.234 0.000 . 1 . . . . A 41 TRP HD1 . 30598 1
454 . 1 . 1 41 41 TRP HE1 H 1 9.951 0.001 . 1 . . . . A 41 TRP HE1 . 30598 1
455 . 1 . 1 41 41 TRP HE3 H 1 7.372 0.000 . 1 . . . . A 41 TRP HE3 . 30598 1
456 . 1 . 1 41 41 TRP HZ2 H 1 7.339 0.000 . 1 . . . . A 41 TRP HZ2 . 30598 1
457 . 1 . 1 41 41 TRP HZ3 H 1 6.981 0.001 . 1 . . . . A 41 TRP HZ3 . 30598 1
458 . 1 . 1 41 41 TRP HH2 H 1 7.105 0.000 . 1 . . . . A 41 TRP HH2 . 30598 1
459 . 1 . 1 41 41 TRP CA C 13 60.198 0.000 . 1 . . . . A 41 TRP CA . 30598 1
460 . 1 . 1 41 41 TRP CB C 13 29.481 0.014 . 1 . . . . A 41 TRP CB . 30598 1
461 . 1 . 1 41 41 TRP CD1 C 13 127.809 0.001 . 1 . . . . A 41 TRP CD1 . 30598 1
462 . 1 . 1 41 41 TRP CE3 C 13 120.805 0.019 . 1 . . . . A 41 TRP CE3 . 30598 1
463 . 1 . 1 41 41 TRP CZ2 C 13 113.992 0.025 . 1 . . . . A 41 TRP CZ2 . 30598 1
464 . 1 . 1 41 41 TRP CZ3 C 13 122.100 0.006 . 1 . . . . A 41 TRP CZ3 . 30598 1
465 . 1 . 1 41 41 TRP CH2 C 13 124.163 0.042 . 1 . . . . A 41 TRP CH2 . 30598 1
466 . 1 . 1 41 41 TRP N N 15 125.131 0.002 . 1 . . . . A 41 TRP N . 30598 1
467 . 1 . 1 41 41 TRP NE1 N 15 129.439 0.000 . 1 . . . . A 41 TRP NE1 . 30598 1
468 . 1 . 1 43 43 THR H H 1 7.594 0.001 . 1 . . . . A 43 THR H . 30598 1
469 . 1 . 1 43 43 THR HA H 1 3.822 0.000 . 1 . . . . A 43 THR HA . 30598 1
470 . 1 . 1 43 43 THR HB H 1 4.201 0.001 . 1 . . . . A 43 THR HB . 30598 1
471 . 1 . 1 43 43 THR HG21 H 1 0.756 0.000 . 1 . . . . A 43 THR HG21 . 30598 1
472 . 1 . 1 43 43 THR HG22 H 1 0.756 0.000 . 1 . . . . A 43 THR HG22 . 30598 1
473 . 1 . 1 43 43 THR HG23 H 1 0.756 0.000 . 1 . . . . A 43 THR HG23 . 30598 1
474 . 1 . 1 43 43 THR C C 13 177.493 0.000 . 1 . . . . A 43 THR C . 30598 1
475 . 1 . 1 43 43 THR CA C 13 60.628 0.000 . 1 . . . . A 43 THR CA . 30598 1
476 . 1 . 1 43 43 THR CB C 13 72.143 0.005 . 1 . . . . A 43 THR CB . 30598 1
477 . 1 . 1 43 43 THR CG2 C 13 21.266 0.027 . 1 . . . . A 43 THR CG2 . 30598 1
478 . 1 . 1 43 43 THR N N 15 109.961 0.010 . 1 . . . . A 43 THR N . 30598 1
479 . 1 . 1 44 44 SER H H 1 8.616 0.001 . 1 . . . . A 44 SER H . 30598 1
480 . 1 . 1 44 44 SER HA H 1 4.263 0.001 . 1 . . . . A 44 SER HA . 30598 1
481 . 1 . 1 44 44 SER HB2 H 1 4.063 0.003 . 2 . . . . A 44 SER HB2 . 30598 1
482 . 1 . 1 44 44 SER HB3 H 1 4.032 0.000 . 2 . . . . A 44 SER HB3 . 30598 1
483 . 1 . 1 44 44 SER C C 13 177.868 0.000 . 1 . . . . A 44 SER C . 30598 1
484 . 1 . 1 44 44 SER CA C 13 60.617 0.046 . 1 . . . . A 44 SER CA . 30598 1
485 . 1 . 1 44 44 SER CB C 13 62.959 0.002 . 1 . . . . A 44 SER CB . 30598 1
486 . 1 . 1 44 44 SER N N 15 114.730 0.003 . 1 . . . . A 44 SER N . 30598 1
487 . 1 . 1 45 45 SER H H 1 7.949 0.000 . 1 . . . . A 45 SER H . 30598 1
488 . 1 . 1 45 45 SER HA H 1 4.536 0.003 . 1 . . . . A 45 SER HA . 30598 1
489 . 1 . 1 45 45 SER HB2 H 1 3.788 0.000 . 2 . . . . A 45 SER HB2 . 30598 1
490 . 1 . 1 45 45 SER HB3 H 1 3.732 0.001 . 2 . . . . A 45 SER HB3 . 30598 1
491 . 1 . 1 45 45 SER C C 13 176.937 0.000 . 1 . . . . A 45 SER C . 30598 1
492 . 1 . 1 45 45 SER CA C 13 58.500 0.016 . 1 . . . . A 45 SER CA . 30598 1
493 . 1 . 1 45 45 SER CB C 13 64.164 0.014 . 1 . . . . A 45 SER CB . 30598 1
494 . 1 . 1 45 45 SER N N 15 114.292 0.006 . 1 . . . . A 45 SER N . 30598 1
495 . 1 . 1 46 46 GLY H H 1 7.507 0.001 . 1 . . . . A 46 GLY H . 30598 1
496 . 1 . 1 46 46 GLY HA2 H 1 4.064 0.000 . 2 . . . . A 46 GLY HA2 . 30598 1
497 . 1 . 1 46 46 GLY HA3 H 1 3.804 0.001 . 2 . . . . A 46 GLY HA3 . 30598 1
498 . 1 . 1 46 46 GLY CA C 13 45.699 0.021 . 1 . . . . A 46 GLY CA . 30598 1
499 . 1 . 1 46 46 GLY N N 15 109.835 0.003 . 1 . . . . A 46 GLY N . 30598 1
500 . 1 . 1 47 47 ASN H H 1 8.707 0.000 . 1 . . . . A 47 ASN H . 30598 1
501 . 1 . 1 47 47 ASN HA H 1 5.176 0.000 . 1 . . . . A 47 ASN HA . 30598 1
502 . 1 . 1 47 47 ASN HB2 H 1 2.756 0.000 . 2 . . . . A 47 ASN HB2 . 30598 1
503 . 1 . 1 47 47 ASN HB3 H 1 2.645 0.001 . 2 . . . . A 47 ASN HB3 . 30598 1
504 . 1 . 1 47 47 ASN C C 13 178.292 0.000 . 1 . . . . A 47 ASN C . 30598 1
505 . 1 . 1 47 47 ASN CA C 13 52.446 0.031 . 1 . . . . A 47 ASN CA . 30598 1
506 . 1 . 1 47 47 ASN CB C 13 41.204 0.066 . 1 . . . . A 47 ASN CB . 30598 1
507 . 1 . 1 47 47 ASN N N 15 120.938 0.000 . 1 . . . . A 47 ASN N . 30598 1
508 . 1 . 1 48 48 ALA H H 1 9.717 0.001 . 1 . . . . A 48 ALA H . 30598 1
509 . 1 . 1 48 48 ALA HA H 1 5.259 0.005 . 1 . . . . A 48 ALA HA . 30598 1
510 . 1 . 1 48 48 ALA HB1 H 1 0.970 0.005 . 1 . . . . A 48 ALA HB1 . 30598 1
511 . 1 . 1 48 48 ALA HB2 H 1 0.970 0.005 . 1 . . . . A 48 ALA HB2 . 30598 1
512 . 1 . 1 48 48 ALA HB3 H 1 0.970 0.005 . 1 . . . . A 48 ALA HB3 . 30598 1
513 . 1 . 1 48 48 ALA C C 13 180.748 0.000 . 1 . . . . A 48 ALA C . 30598 1
514 . 1 . 1 48 48 ALA CA C 13 51.428 0.005 . 1 . . . . A 48 ALA CA . 30598 1
515 . 1 . 1 48 48 ALA CB C 13 23.626 0.085 . 1 . . . . A 48 ALA CB . 30598 1
516 . 1 . 1 48 48 ALA N N 15 123.980 0.011 . 1 . . . . A 48 ALA N . 30598 1
517 . 1 . 1 49 49 CYS H H 1 8.150 0.001 . 1 . . . . A 49 CYS H . 30598 1
518 . 1 . 1 49 49 CYS HA H 1 5.469 0.008 . 1 . . . . A 49 CYS HA . 30598 1
519 . 1 . 1 49 49 CYS HB2 H 1 2.635 0.002 . 1 . . . . A 49 CYS HB2 . 30598 1
520 . 1 . 1 49 49 CYS HB3 H 1 2.694 0.000 . 1 . . . . A 49 CYS HB3 . 30598 1
521 . 1 . 1 49 49 CYS C C 13 176.604 0.000 . 1 . . . . A 49 CYS C . 30598 1
522 . 1 . 1 49 49 CYS CA C 13 53.705 0.044 . 1 . . . . A 49 CYS CA . 30598 1
523 . 1 . 1 49 49 CYS CB C 13 33.632 0.019 . 1 . . . . A 49 CYS CB . 30598 1
524 . 1 . 1 49 49 CYS N N 15 115.798 0.003 . 1 . . . . A 49 CYS N . 30598 1
525 . 1 . 1 50 50 TRP H H 1 9.676 0.001 . 1 . . . . A 50 TRP H . 30598 1
526 . 1 . 1 50 50 TRP HA H 1 4.705 0.003 . 1 . . . . A 50 TRP HA . 30598 1
527 . 1 . 1 50 50 TRP HB2 H 1 3.060 0.000 . 1 . . . . A 50 TRP HB2 . 30598 1
528 . 1 . 1 50 50 TRP HB3 H 1 2.727 0.009 . 1 . . . . A 50 TRP HB3 . 30598 1
529 . 1 . 1 50 50 TRP HE1 H 1 10.262 0.000 . 1 . . . . A 50 TRP HE1 . 30598 1
530 . 1 . 1 50 50 TRP HZ2 H 1 7.283 0.001 . 1 . . . . A 50 TRP HZ2 . 30598 1
531 . 1 . 1 50 50 TRP HZ3 H 1 6.704 0.000 . 1 . . . . A 50 TRP HZ3 . 30598 1
532 . 1 . 1 50 50 TRP HH2 H 1 7.007 0.002 . 1 . . . . A 50 TRP HH2 . 30598 1
533 . 1 . 1 50 50 TRP C C 13 176.823 0.000 . 1 . . . . A 50 TRP C . 30598 1
534 . 1 . 1 50 50 TRP CA C 13 55.923 0.000 . 1 . . . . A 50 TRP CA . 30598 1
535 . 1 . 1 50 50 TRP CB C 13 32.764 0.010 . 1 . . . . A 50 TRP CB . 30598 1
536 . 1 . 1 50 50 TRP CZ2 C 13 114.283 0.033 . 1 . . . . A 50 TRP CZ2 . 30598 1
537 . 1 . 1 50 50 TRP CZ3 C 13 121.986 0.056 . 1 . . . . A 50 TRP CZ3 . 30598 1
538 . 1 . 1 50 50 TRP CH2 C 13 124.127 0.025 . 1 . . . . A 50 TRP CH2 . 30598 1
539 . 1 . 1 50 50 TRP N N 15 129.706 0.009 . 1 . . . . A 50 TRP N . 30598 1
540 . 1 . 1 50 50 TRP NE1 N 15 129.579 0.000 . 1 . . . . A 50 TRP NE1 . 30598 1
541 . 1 . 1 51 51 CYS H H 1 8.561 0.002 . 1 . . . . A 51 CYS H . 30598 1
542 . 1 . 1 51 51 CYS HA H 1 5.411 0.009 . 1 . . . . A 51 CYS HA . 30598 1
543 . 1 . 1 51 51 CYS HB2 H 1 2.368 0.001 . 1 . . . . A 51 CYS HB2 . 30598 1
544 . 1 . 1 51 51 CYS HB3 H 1 2.805 0.010 . 1 . . . . A 51 CYS HB3 . 30598 1
545 . 1 . 1 51 51 CYS C C 13 175.061 0.000 . 1 . . . . A 51 CYS C . 30598 1
546 . 1 . 1 51 51 CYS CA C 13 50.228 0.027 . 1 . . . . A 51 CYS CA . 30598 1
547 . 1 . 1 51 51 CYS CB C 13 38.980 0.034 . 1 . . . . A 51 CYS CB . 30598 1
548 . 1 . 1 51 51 CYS N N 15 121.710 0.000 . 1 . . . . A 51 CYS N . 30598 1
549 . 1 . 1 52 52 VAL H H 1 8.107 0.001 . 1 . . . . A 52 VAL H . 30598 1
550 . 1 . 1 52 52 VAL HA H 1 3.736 0.001 . 1 . . . . A 52 VAL HA . 30598 1
551 . 1 . 1 52 52 VAL HB H 1 1.930 0.003 . 1 . . . . A 52 VAL HB . 30598 1
552 . 1 . 1 52 52 VAL HG11 H 1 0.867 0.000 . 2 . . . . A 52 VAL HG11 . 30598 1
553 . 1 . 1 52 52 VAL HG12 H 1 0.867 0.000 . 2 . . . . A 52 VAL HG12 . 30598 1
554 . 1 . 1 52 52 VAL HG13 H 1 0.867 0.000 . 2 . . . . A 52 VAL HG13 . 30598 1
555 . 1 . 1 52 52 VAL HG21 H 1 0.819 0.000 . 2 . . . . A 52 VAL HG21 . 30598 1
556 . 1 . 1 52 52 VAL HG22 H 1 0.819 0.000 . 2 . . . . A 52 VAL HG22 . 30598 1
557 . 1 . 1 52 52 VAL HG23 H 1 0.819 0.000 . 2 . . . . A 52 VAL HG23 . 30598 1
558 . 1 . 1 52 52 VAL C C 13 178.515 0.000 . 1 . . . . A 52 VAL C . 30598 1
559 . 1 . 1 52 52 VAL CA C 13 61.508 0.047 . 1 . . . . A 52 VAL CA . 30598 1
560 . 1 . 1 52 52 VAL CB C 13 32.362 0.006 . 1 . . . . A 52 VAL CB . 30598 1
561 . 1 . 1 52 52 VAL CG1 C 13 21.041 0.004 . 1 . . . . A 52 VAL CG1 . 30598 1
562 . 1 . 1 52 52 VAL CG2 C 13 22.098 0.004 . 1 . . . . A 52 VAL CG2 . 30598 1
563 . 1 . 1 52 52 VAL N N 15 121.937 0.019 . 1 . . . . A 52 VAL N . 30598 1
564 . 1 . 1 53 53 LYS H H 1 9.418 0.002 . 1 . . . . A 53 LYS H . 30598 1
565 . 1 . 1 53 53 LYS HA H 1 3.137 0.003 . 1 . . . . A 53 LYS HA . 30598 1
566 . 1 . 1 53 53 LYS HB2 H 1 1.650 0.001 . 1 . . . . A 53 LYS HB2 . 30598 1
567 . 1 . 1 53 53 LYS HB3 H 1 1.933 0.009 . 1 . . . . A 53 LYS HB3 . 30598 1
568 . 1 . 1 53 53 LYS HG2 H 1 1.424 0.000 . 1 . . . . A 53 LYS HG2 . 30598 1
569 . 1 . 1 53 53 LYS HG3 H 1 1.179 0.000 . 1 . . . . A 53 LYS HG3 . 30598 1
570 . 1 . 1 53 53 LYS HD2 H 1 1.599 0.000 . 1 . . . . A 53 LYS HD2 . 30598 1
571 . 1 . 1 53 53 LYS HD3 H 1 1.494 0.000 . 1 . . . . A 53 LYS HD3 . 30598 1
572 . 1 . 1 53 53 LYS HE2 H 1 2.940 0.000 . 2 . . . . A 53 LYS HE2 . 30598 1
573 . 1 . 1 53 53 LYS HE3 H 1 2.857 0.000 . 2 . . . . A 53 LYS HE3 . 30598 1
574 . 1 . 1 53 53 LYS C C 13 177.532 0.000 . 1 . . . . A 53 LYS C . 30598 1
575 . 1 . 1 53 53 LYS CA C 13 58.033 0.005 . 1 . . . . A 53 LYS CA . 30598 1
576 . 1 . 1 53 53 LYS CB C 13 29.446 0.122 . 1 . . . . A 53 LYS CB . 30598 1
577 . 1 . 1 53 53 LYS CG C 13 25.729 0.005 . 1 . . . . A 53 LYS CG . 30598 1
578 . 1 . 1 53 53 LYS CD C 13 29.547 0.004 . 1 . . . . A 53 LYS CD . 30598 1
579 . 1 . 1 53 53 LYS CE C 13 42.510 0.000 . 1 . . . . A 53 LYS CE . 30598 1
580 . 1 . 1 53 53 LYS N N 15 124.126 0.003 . 1 . . . . A 53 LYS N . 30598 1
581 . 1 . 1 54 54 LEU H H 1 8.616 0.001 . 1 . . . . A 54 LEU H . 30598 1
582 . 1 . 1 54 54 LEU HA H 1 4.201 0.001 . 1 . . . . A 54 LEU HA . 30598 1
583 . 1 . 1 54 54 LEU HB2 H 1 1.936 0.001 . 2 . . . . A 54 LEU HB2 . 30598 1
584 . 1 . 1 54 54 LEU HB3 H 1 0.922 0.000 . 2 . . . . A 54 LEU HB3 . 30598 1
585 . 1 . 1 54 54 LEU HG H 1 0.533 0.001 . 1 . . . . A 54 LEU HG . 30598 1
586 . 1 . 1 54 54 LEU HD11 H 1 0.869 0.000 . 1 . . . . A 54 LEU HD11 . 30598 1
587 . 1 . 1 54 54 LEU HD12 H 1 0.869 0.000 . 1 . . . . A 54 LEU HD12 . 30598 1
588 . 1 . 1 54 54 LEU HD13 H 1 0.869 0.000 . 1 . . . . A 54 LEU HD13 . 30598 1
589 . 1 . 1 54 54 LEU HD21 H 1 1.608 0.000 . 1 . . . . A 54 LEU HD21 . 30598 1
590 . 1 . 1 54 54 LEU HD22 H 1 1.608 0.000 . 1 . . . . A 54 LEU HD22 . 30598 1
591 . 1 . 1 54 54 LEU HD23 H 1 1.608 0.000 . 1 . . . . A 54 LEU HD23 . 30598 1
592 . 1 . 1 54 54 LEU CA C 13 52.419 0.006 . 1 . . . . A 54 LEU CA . 30598 1
593 . 1 . 1 54 54 LEU CB C 13 43.969 0.007 . 1 . . . . A 54 LEU CB . 30598 1
594 . 1 . 1 54 54 LEU CG C 13 26.712 0.000 . 1 . . . . A 54 LEU CG . 30598 1
595 . 1 . 1 54 54 LEU CD1 C 13 25.447 0.000 . 1 . . . . A 54 LEU CD1 . 30598 1
596 . 1 . 1 54 54 LEU CD2 C 13 25.869 0.000 . 1 . . . . A 54 LEU CD2 . 30598 1
597 . 1 . 1 54 54 LEU N N 15 123.202 0.008 . 1 . . . . A 54 LEU N . 30598 1
598 . 1 . 1 55 55 PRO HA H 1 4.579 0.003 . 1 . . . . A 55 PRO HA . 30598 1
599 . 1 . 1 55 55 PRO HB2 H 1 1.945 0.002 . 1 . . . . A 55 PRO HB2 . 30598 1
600 . 1 . 1 55 55 PRO HB3 H 1 2.505 0.004 . 1 . . . . A 55 PRO HB3 . 30598 1
601 . 1 . 1 55 55 PRO HG2 H 1 2.274 0.000 . 1 . . . . A 55 PRO HG2 . 30598 1
602 . 1 . 1 55 55 PRO HG3 H 1 1.948 0.001 . 1 . . . . A 55 PRO HG3 . 30598 1
603 . 1 . 1 55 55 PRO HD2 H 1 3.639 0.000 . 1 . . . . A 55 PRO HD2 . 30598 1
604 . 1 . 1 55 55 PRO HD3 H 1 3.895 0.000 . 1 . . . . A 55 PRO HD3 . 30598 1
605 . 1 . 1 55 55 PRO C C 13 181.733 0.000 . 1 . . . . A 55 PRO C . 30598 1
606 . 1 . 1 55 55 PRO CA C 13 64.087 0.026 . 1 . . . . A 55 PRO CA . 30598 1
607 . 1 . 1 55 55 PRO CB C 13 32.812 0.012 . 1 . . . . A 55 PRO CB . 30598 1
608 . 1 . 1 55 55 PRO CG C 13 28.536 0.019 . 1 . . . . A 55 PRO CG . 30598 1
609 . 1 . 1 55 55 PRO CD C 13 51.070 0.034 . 1 . . . . A 55 PRO CD . 30598 1
610 . 1 . 1 56 56 LYS H H 1 8.414 0.001 . 1 . . . . A 56 LYS H . 30598 1
611 . 1 . 1 56 56 LYS HA H 1 3.831 0.002 . 1 . . . . A 56 LYS HA . 30598 1
612 . 1 . 1 56 56 LYS HB2 H 1 1.784 0.002 . 2 . . . . A 56 LYS HB2 . 30598 1
613 . 1 . 1 56 56 LYS HB3 H 1 1.653 0.006 . 2 . . . . A 56 LYS HB3 . 30598 1
614 . 1 . 1 56 56 LYS HG2 H 1 1.249 0.000 . 2 . . . . A 56 LYS HG2 . 30598 1
615 . 1 . 1 56 56 LYS HG3 H 1 1.189 0.000 . 2 . . . . A 56 LYS HG3 . 30598 1
616 . 1 . 1 56 56 LYS C C 13 177.900 0.000 . 1 . . . . A 56 LYS C . 30598 1
617 . 1 . 1 56 56 LYS CA C 13 59.382 0.022 . 1 . . . . A 56 LYS CA . 30598 1
618 . 1 . 1 56 56 LYS CB C 13 32.639 0.042 . 1 . . . . A 56 LYS CB . 30598 1
619 . 1 . 1 56 56 LYS CG C 13 25.829 0.003 . 1 . . . . A 56 LYS CG . 30598 1
620 . 1 . 1 56 56 LYS N N 15 124.380 0.005 . 1 . . . . A 56 LYS N . 30598 1
621 . 1 . 1 57 57 SER H H 1 7.794 0.002 . 1 . . . . A 57 SER H . 30598 1
622 . 1 . 1 57 57 SER HA H 1 4.090 0.011 . 1 . . . . A 57 SER HA . 30598 1
623 . 1 . 1 57 57 SER HB2 H 1 3.817 0.006 . 2 . . . . A 57 SER HB2 . 30598 1
624 . 1 . 1 57 57 SER HB3 H 1 3.990 0.000 . 2 . . . . A 57 SER HB3 . 30598 1
625 . 1 . 1 57 57 SER C C 13 178.344 0.000 . 1 . . . . A 57 SER C . 30598 1
626 . 1 . 1 57 57 SER CA C 13 59.460 0.006 . 1 . . . . A 57 SER CA . 30598 1
627 . 1 . 1 57 57 SER CB C 13 62.771 0.015 . 1 . . . . A 57 SER CB . 30598 1
628 . 1 . 1 57 57 SER N N 15 110.419 0.011 . 1 . . . . A 57 SER N . 30598 1
629 . 1 . 1 58 58 GLU H H 1 7.733 0.001 . 1 . . . . A 58 GLU H . 30598 1
630 . 1 . 1 58 58 GLU HA H 1 4.500 0.001 . 1 . . . . A 58 GLU HA . 30598 1
631 . 1 . 1 58 58 GLU HB2 H 1 2.135 0.000 . 2 . . . . A 58 GLU HB2 . 30598 1
632 . 1 . 1 58 58 GLU HB3 H 1 1.902 0.000 . 2 . . . . A 58 GLU HB3 . 30598 1
633 . 1 . 1 58 58 GLU HG2 H 1 2.255 0.000 . 2 . . . . A 58 GLU HG2 . 30598 1
634 . 1 . 1 58 58 GLU HG3 H 1 2.908 0.000 . 2 . . . . A 58 GLU HG3 . 30598 1
635 . 1 . 1 58 58 GLU CA C 13 53.874 0.000 . 1 . . . . A 58 GLU CA . 30598 1
636 . 1 . 1 58 58 GLU CB C 13 28.964 0.003 . 1 . . . . A 58 GLU CB . 30598 1
637 . 1 . 1 58 58 GLU CG C 13 36.518 0.005 . 1 . . . . A 58 GLU CG . 30598 1
638 . 1 . 1 58 58 GLU N N 15 123.347 0.003 . 1 . . . . A 58 GLU N . 30598 1
639 . 1 . 1 59 59 PRO HA H 1 4.353 0.001 . 1 . . . . A 59 PRO HA . 30598 1
640 . 1 . 1 59 59 PRO HB2 H 1 1.791 0.003 . 1 . . . . A 59 PRO HB2 . 30598 1
641 . 1 . 1 59 59 PRO HB3 H 1 2.154 0.000 . 1 . . . . A 59 PRO HB3 . 30598 1
642 . 1 . 1 59 59 PRO HG2 H 1 2.369 0.001 . 1 . . . . A 59 PRO HG2 . 30598 1
643 . 1 . 1 59 59 PRO HG3 H 1 1.971 0.000 . 1 . . . . A 59 PRO HG3 . 30598 1
644 . 1 . 1 59 59 PRO HD2 H 1 3.886 0.000 . 1 . . . . A 59 PRO HD2 . 30598 1
645 . 1 . 1 59 59 PRO HD3 H 1 3.833 0.001 . 1 . . . . A 59 PRO HD3 . 30598 1
646 . 1 . 1 59 59 PRO C C 13 178.809 0.000 . 1 . . . . A 59 PRO C . 30598 1
647 . 1 . 1 59 59 PRO CA C 13 63.051 0.037 . 1 . . . . A 59 PRO CA . 30598 1
648 . 1 . 1 59 59 PRO CB C 13 32.536 0.000 . 1 . . . . A 59 PRO CB . 30598 1
649 . 1 . 1 59 59 PRO CG C 13 27.357 0.008 . 1 . . . . A 59 PRO CG . 30598 1
650 . 1 . 1 59 59 PRO CD C 13 50.546 0.005 . 1 . . . . A 59 PRO CD . 30598 1
651 . 1 . 1 60 60 ILE H H 1 7.666 0.002 . 1 . . . . A 60 ILE H . 30598 1
652 . 1 . 1 60 60 ILE HA H 1 4.936 0.007 . 1 . . . . A 60 ILE HA . 30598 1
653 . 1 . 1 60 60 ILE HB H 1 1.736 0.006 . 1 . . . . A 60 ILE HB . 30598 1
654 . 1 . 1 60 60 ILE HG12 H 1 0.809 0.001 . 1 . . . . A 60 ILE HG12 . 30598 1
655 . 1 . 1 60 60 ILE HG13 H 1 1.135 0.000 . 1 . . . . A 60 ILE HG13 . 30598 1
656 . 1 . 1 60 60 ILE HG21 H 1 0.510 0.000 . 1 . . . . A 60 ILE HG21 . 30598 1
657 . 1 . 1 60 60 ILE HG22 H 1 0.510 0.000 . 1 . . . . A 60 ILE HG22 . 30598 1
658 . 1 . 1 60 60 ILE HG23 H 1 0.510 0.000 . 1 . . . . A 60 ILE HG23 . 30598 1
659 . 1 . 1 60 60 ILE HD11 H 1 0.653 0.001 . 1 . . . . A 60 ILE HD11 . 30598 1
660 . 1 . 1 60 60 ILE HD12 H 1 0.653 0.001 . 1 . . . . A 60 ILE HD12 . 30598 1
661 . 1 . 1 60 60 ILE HD13 H 1 0.653 0.001 . 1 . . . . A 60 ILE HD13 . 30598 1
662 . 1 . 1 60 60 ILE C C 13 178.739 0.000 . 1 . . . . A 60 ILE C . 30598 1
663 . 1 . 1 60 60 ILE CA C 13 58.504 0.019 . 1 . . . . A 60 ILE CA . 30598 1
664 . 1 . 1 60 60 ILE CB C 13 42.535 0.022 . 1 . . . . A 60 ILE CB . 30598 1
665 . 1 . 1 60 60 ILE CG1 C 13 24.799 0.030 . 1 . . . . A 60 ILE CG1 . 30598 1
666 . 1 . 1 60 60 ILE CG2 C 13 20.091 0.002 . 1 . . . . A 60 ILE CG2 . 30598 1
667 . 1 . 1 60 60 ILE CD1 C 13 14.112 0.045 . 1 . . . . A 60 ILE CD1 . 30598 1
668 . 1 . 1 60 60 ILE N N 15 111.822 0.005 . 1 . . . . A 60 ILE N . 30598 1
669 . 1 . 1 61 61 LYS H H 1 8.306 0.001 . 1 . . . . A 61 LYS H . 30598 1
670 . 1 . 1 61 61 LYS HA H 1 4.277 0.006 . 1 . . . . A 61 LYS HA . 30598 1
671 . 1 . 1 61 61 LYS HB2 H 1 2.024 0.013 . 2 . . . . A 61 LYS HB2 . 30598 1
672 . 1 . 1 61 61 LYS HB3 H 1 1.152 0.005 . 2 . . . . A 61 LYS HB3 . 30598 1
673 . 1 . 1 61 61 LYS HG2 H 1 1.231 0.000 . 2 . . . . A 61 LYS HG2 . 30598 1
674 . 1 . 1 61 61 LYS HG3 H 1 1.140 0.000 . 2 . . . . A 61 LYS HG3 . 30598 1
675 . 1 . 1 61 61 LYS HD2 H 1 1.720 0.002 . 2 . . . . A 61 LYS HD2 . 30598 1
676 . 1 . 1 61 61 LYS HD3 H 1 1.085 0.002 . 2 . . . . A 61 LYS HD3 . 30598 1
677 . 1 . 1 61 61 LYS HE2 H 1 3.275 0.002 . 2 . . . . A 61 LYS HE2 . 30598 1
678 . 1 . 1 61 61 LYS HE3 H 1 3.074 0.001 . 2 . . . . A 61 LYS HE3 . 30598 1
679 . 1 . 1 61 61 LYS C C 13 178.528 0.000 . 1 . . . . A 61 LYS C . 30598 1
680 . 1 . 1 61 61 LYS CA C 13 55.159 0.036 . 1 . . . . A 61 LYS CA . 30598 1
681 . 1 . 1 61 61 LYS CB C 13 32.892 0.020 . 1 . . . . A 61 LYS CB . 30598 1
682 . 1 . 1 61 61 LYS CG C 13 23.903 0.020 . 1 . . . . A 61 LYS CG . 30598 1
683 . 1 . 1 61 61 LYS CD C 13 28.049 0.017 . 1 . . . . A 61 LYS CD . 30598 1
684 . 1 . 1 61 61 LYS CE C 13 42.872 0.028 . 1 . . . . A 61 LYS CE . 30598 1
685 . 1 . 1 61 61 LYS N N 15 121.900 0.008 . 1 . . . . A 61 LYS N . 30598 1
686 . 1 . 1 62 62 VAL H H 1 9.112 0.001 . 1 . . . . A 62 VAL H . 30598 1
687 . 1 . 1 62 62 VAL HA H 1 4.881 0.000 . 1 . . . . A 62 VAL HA . 30598 1
688 . 1 . 1 62 62 VAL HB H 1 2.401 0.000 . 1 . . . . A 62 VAL HB . 30598 1
689 . 1 . 1 62 62 VAL HG11 H 1 0.792 0.000 . 2 . . . . A 62 VAL HG11 . 30598 1
690 . 1 . 1 62 62 VAL HG12 H 1 0.792 0.000 . 2 . . . . A 62 VAL HG12 . 30598 1
691 . 1 . 1 62 62 VAL HG13 H 1 0.792 0.000 . 2 . . . . A 62 VAL HG13 . 30598 1
692 . 1 . 1 62 62 VAL HG21 H 1 0.930 0.000 . 2 . . . . A 62 VAL HG21 . 30598 1
693 . 1 . 1 62 62 VAL HG22 H 1 0.930 0.000 . 2 . . . . A 62 VAL HG22 . 30598 1
694 . 1 . 1 62 62 VAL HG23 H 1 0.930 0.000 . 2 . . . . A 62 VAL HG23 . 30598 1
695 . 1 . 1 62 62 VAL CA C 13 58.721 0.000 . 1 . . . . A 62 VAL CA . 30598 1
696 . 1 . 1 62 62 VAL CB C 13 31.613 0.000 . 1 . . . . A 62 VAL CB . 30598 1
697 . 1 . 1 62 62 VAL CG1 C 13 17.334 0.003 . 1 . . . . A 62 VAL CG1 . 30598 1
698 . 1 . 1 62 62 VAL CG2 C 13 21.419 0.001 . 1 . . . . A 62 VAL CG2 . 30598 1
699 . 1 . 1 62 62 VAL N N 15 125.291 0.004 . 1 . . . . A 62 VAL N . 30598 1
700 . 1 . 1 63 63 PRO HA H 1 4.361 0.002 . 1 . . . . A 63 PRO HA . 30598 1
701 . 1 . 1 63 63 PRO HB2 H 1 2.309 0.006 . 2 . . . . A 63 PRO HB2 . 30598 1
702 . 1 . 1 63 63 PRO HB3 H 1 1.821 0.007 . 2 . . . . A 63 PRO HB3 . 30598 1
703 . 1 . 1 63 63 PRO HG2 H 1 2.174 0.000 . 2 . . . . A 63 PRO HG2 . 30598 1
704 . 1 . 1 63 63 PRO HG3 H 1 1.997 0.000 . 2 . . . . A 63 PRO HG3 . 30598 1
705 . 1 . 1 63 63 PRO HD2 H 1 3.865 0.000 . 2 . . . . A 63 PRO HD2 . 30598 1
706 . 1 . 1 63 63 PRO HD3 H 1 3.647 0.001 . 2 . . . . A 63 PRO HD3 . 30598 1
707 . 1 . 1 63 63 PRO C C 13 179.653 0.000 . 1 . . . . A 63 PRO C . 30598 1
708 . 1 . 1 63 63 PRO CA C 13 64.814 0.030 . 1 . . . . A 63 PRO CA . 30598 1
709 . 1 . 1 63 63 PRO CB C 13 31.471 0.040 . 1 . . . . A 63 PRO CB . 30598 1
710 . 1 . 1 63 63 PRO CG C 13 28.247 0.010 . 1 . . . . A 63 PRO CG . 30598 1
711 . 1 . 1 63 63 PRO CD C 13 50.640 0.010 . 1 . . . . A 63 PRO CD . 30598 1
712 . 1 . 1 64 64 GLY H H 1 8.364 0.001 . 1 . . . . A 64 GLY H . 30598 1
713 . 1 . 1 64 64 GLY HA2 H 1 4.562 0.010 . 2 . . . . A 64 GLY HA2 . 30598 1
714 . 1 . 1 64 64 GLY HA3 H 1 3.751 0.001 . 2 . . . . A 64 GLY HA3 . 30598 1
715 . 1 . 1 64 64 GLY C C 13 176.549 0.000 . 1 . . . . A 64 GLY C . 30598 1
716 . 1 . 1 64 64 GLY CA C 13 43.410 0.046 . 1 . . . . A 64 GLY CA . 30598 1
717 . 1 . 1 64 64 GLY N N 15 111.914 0.001 . 1 . . . . A 64 GLY N . 30598 1
718 . 1 . 1 65 65 LYS H H 1 8.427 0.002 . 1 . . . . A 65 LYS H . 30598 1
719 . 1 . 1 65 65 LYS HA H 1 4.319 0.012 . 1 . . . . A 65 LYS HA . 30598 1
720 . 1 . 1 65 65 LYS HB2 H 1 1.775 0.000 . 1 . . . . A 65 LYS HB2 . 30598 1
721 . 1 . 1 65 65 LYS HB3 H 1 1.738 0.009 . 1 . . . . A 65 LYS HB3 . 30598 1
722 . 1 . 1 65 65 LYS HG2 H 1 1.462 0.001 . 2 . . . . A 65 LYS HG2 . 30598 1
723 . 1 . 1 65 65 LYS HG3 H 1 1.415 0.001 . 2 . . . . A 65 LYS HG3 . 30598 1
724 . 1 . 1 65 65 LYS C C 13 180.266 0.000 . 1 . . . . A 65 LYS C . 30598 1
725 . 1 . 1 65 65 LYS CA C 13 56.952 0.002 . 1 . . . . A 65 LYS CA . 30598 1
726 . 1 . 1 65 65 LYS CB C 13 33.757 0.021 . 1 . . . . A 65 LYS CB . 30598 1
727 . 1 . 1 65 65 LYS CG C 13 24.876 0.056 . 1 . . . . A 65 LYS CG . 30598 1
728 . 1 . 1 65 65 LYS N N 15 119.081 0.004 . 1 . . . . A 65 LYS N . 30598 1
729 . 1 . 1 66 66 CYS H H 1 8.482 0.002 . 1 . . . . A 66 CYS H . 30598 1
730 . 1 . 1 66 66 CYS HA H 1 5.198 0.006 . 1 . . . . A 66 CYS HA . 30598 1
731 . 1 . 1 66 66 CYS HB2 H 1 3.731 0.003 . 2 . . . . A 66 CYS HB2 . 30598 1
732 . 1 . 1 66 66 CYS HB3 H 1 2.606 0.002 . 2 . . . . A 66 CYS HB3 . 30598 1
733 . 1 . 1 66 66 CYS C C 13 177.263 0.000 . 1 . . . . A 66 CYS C . 30598 1
734 . 1 . 1 66 66 CYS CA C 13 55.217 0.006 . 1 . . . . A 66 CYS CA . 30598 1
735 . 1 . 1 66 66 CYS CB C 13 39.321 0.072 . 1 . . . . A 66 CYS CB . 30598 1
736 . 1 . 1 66 66 CYS N N 15 123.545 0.011 . 1 . . . . A 66 CYS N . 30598 1
737 . 1 . 1 67 67 HIS H H 1 8.894 0.001 . 1 . . . . A 67 HIS H . 30598 1
738 . 1 . 1 67 67 HIS HA H 1 4.668 0.002 . 1 . . . . A 67 HIS HA . 30598 1
739 . 1 . 1 67 67 HIS HB2 H 1 3.293 0.001 . 2 . . . . A 67 HIS HB2 . 30598 1
740 . 1 . 1 67 67 HIS HB3 H 1 3.007 0.001 . 2 . . . . A 67 HIS HB3 . 30598 1
741 . 1 . 1 67 67 HIS HD2 H 1 7.172 0.001 . 1 . . . . A 67 HIS HD2 . 30598 1
742 . 1 . 1 67 67 HIS HE1 H 1 8.259 0.000 . 1 . . . . A 67 HIS HE1 . 30598 1
743 . 1 . 1 67 67 HIS CA C 13 56.290 0.001 . 1 . . . . A 67 HIS CA . 30598 1
744 . 1 . 1 67 67 HIS CB C 13 30.556 0.022 . 1 . . . . A 67 HIS CB . 30598 1
745 . 1 . 1 67 67 HIS CD2 C 13 120.937 0.016 . 1 . . . . A 67 HIS CD2 . 30598 1
746 . 1 . 1 67 67 HIS CE1 C 13 136.243 0.011 . 1 . . . . A 67 HIS CE1 . 30598 1
747 . 1 . 1 67 67 HIS N N 15 132.342 0.007 . 1 . . . . A 67 HIS N . 30598 1
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