Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17476
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H NOESY' . . . 17476 1
2 '3D CBCA(CO)NH' . . . 17476 1
3 '3D HNCACB' . . . 17476 1
4 '3D HNCO' . . . 17476 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 ARG HA H 1 4.241 0.001 . 1 . . . . . 36 Arg HA . 17476 1
2 . 1 . 1 1 1 ARG HB2 H 1 1.773 0.001 . 2 . . . . . 36 Arg HB2 . 17476 1
3 . 1 . 1 1 1 ARG HB3 H 1 1.704 0.001 . 2 . . . . . 36 Arg HB3 . 17476 1
4 . 1 . 1 1 1 ARG HG2 H 1 1.563 0.001 . 2 . . . . . 36 Arg HG2 . 17476 1
5 . 1 . 1 1 1 ARG HG3 H 1 1.616 0.001 . 2 . . . . . 36 Arg HG3 . 17476 1
6 . 1 . 1 1 1 ARG HD2 H 1 3.078 0.001 . 2 . . . . . 36 Arg HD . 17476 1
7 . 1 . 1 1 1 ARG HD3 H 1 3.078 0.001 . 2 . . . . . 36 Arg HD . 17476 1
8 . 1 . 1 1 1 ARG HE H 1 7.260 0.001 . 1 . . . . . 36 Arg HE . 17476 1
9 . 1 . 1 1 1 ARG C C 13 175.940 0.010 . 1 . . . . . 36 Arg CO . 17476 1
10 . 1 . 1 1 1 ARG CA C 13 56.290 0.010 . 1 . . . . . 36 Arg CA . 17476 1
11 . 1 . 1 1 1 ARG CB C 13 30.670 0.010 . 1 . . . . . 36 Arg CB . 17476 1
12 . 1 . 1 2 2 ASN H H 1 8.248 0.001 . 1 . . . . . 37 Asn HN . 17476 1
13 . 1 . 1 2 2 ASN HA H 1 4.648 0.001 . 1 . . . . . 37 Asn HA . 17476 1
14 . 1 . 1 2 2 ASN HB2 H 1 2.701 0.001 . 2 . . . . . 37 Asn HB2 . 17476 1
15 . 1 . 1 2 2 ASN HB3 H 1 2.780 0.001 . 2 . . . . . 37 Asn HB3 . 17476 1
16 . 1 . 1 2 2 ASN HD21 H 1 7.051 0.001 . 1 . . . . . 37 Asn HD21 . 17476 1
17 . 1 . 1 2 2 ASN HD22 H 1 7.652 0.001 . 1 . . . . . 37 Asn HD22 . 17476 1
18 . 1 . 1 2 2 ASN C C 13 174.430 0.010 . 1 . . . . . 37 Asn CO . 17476 1
19 . 1 . 1 2 2 ASN CA C 13 53.550 0.010 . 1 . . . . . 37 Asn CA . 17476 1
20 . 1 . 1 2 2 ASN CB C 13 39.460 0.010 . 1 . . . . . 37 Asn CB . 17476 1
21 . 1 . 1 2 2 ASN N N 15 118.220 0.010 . 1 . . . . . 37 Asn N . 17476 1
22 . 1 . 1 3 3 HIS H H 1 8.200 0.001 . 1 . . . . . 38 His HN . 17476 1
23 . 1 . 1 3 3 HIS HA H 1 4.586 0.001 . 1 . . . . . 38 His HA . 17476 1
24 . 1 . 1 3 3 HIS HB2 H 1 3.024 0.001 . 2 . . . . . 38 His HB2 . 17476 1
25 . 1 . 1 3 3 HIS HB3 H 1 3.067 0.001 . 2 . . . . . 38 His HB3 . 17476 1
26 . 1 . 1 3 3 HIS HD2 H 1 7.024 0.001 . 1 . . . . . 38 His HD2 . 17476 1
27 . 1 . 1 3 3 HIS HE1 H 1 8.003 0.001 . 1 . . . . . 38 His HE1 . 17476 1
28 . 1 . 1 3 3 HIS C C 13 175.110 0.010 . 1 . . . . . 38 His CO . 17476 1
29 . 1 . 1 3 3 HIS N N 15 119.040 0.010 . 1 . . . . . 38 His N . 17476 1
30 . 1 . 1 4 4 CYS H H 1 8.051 0.001 . 1 . . . . . 39 Cys HN . 17476 1
31 . 1 . 1 4 4 CYS HA H 1 4.690 0.001 . 1 . . . . . 39 Cys HA . 17476 1
32 . 1 . 1 4 4 CYS HB2 H 1 2.651 0.001 . 1 . . . . . 39 Cys HB2 . 17476 1
33 . 1 . 1 4 4 CYS HB3 H 1 2.922 0.001 . 1 . . . . . 39 Cys HB3 . 17476 1
34 . 1 . 1 5 5 PRO HA H 1 4.484 0.001 . 1 . . . . . 40 Pro HA . 17476 1
35 . 1 . 1 5 5 PRO HB2 H 1 1.670 0.001 . 2 . . . . . 40 Pro HB2 . 17476 1
36 . 1 . 1 5 5 PRO HB3 H 1 1.949 0.001 . 2 . . . . . 40 Pro HB3 . 17476 1
37 . 1 . 1 5 5 PRO HG2 H 1 0.469 0.001 . 2 . . . . . 40 Pro HG2 . 17476 1
38 . 1 . 1 5 5 PRO HG3 H 1 1.709 0.001 . 2 . . . . . 40 Pro HG3 . 17476 1
39 . 1 . 1 5 5 PRO HD2 H 1 3.560 0.001 . 2 . . . . . 40 Pro HD2 . 17476 1
40 . 1 . 1 5 5 PRO HD3 H 1 3.306 0.001 . 2 . . . . . 40 Pro HD3 . 17476 1
41 . 1 . 1 5 5 PRO C C 13 176.800 0.010 . 1 . . . . . 40 Pro CO . 17476 1
42 . 1 . 1 5 5 PRO CA C 13 63.130 0.010 . 1 . . . . . 40 Pro CA . 17476 1
43 . 1 . 1 5 5 PRO CB C 13 31.710 0.010 . 1 . . . . . 40 Pro CB . 17476 1
44 . 1 . 1 6 6 HIS H H 1 9.560 0.001 . 1 . . . . . 41 His HN . 17476 1
45 . 1 . 1 6 6 HIS HA H 1 4.519 0.001 . 1 . . . . . 41 His HA . 17476 1
46 . 1 . 1 6 6 HIS HB2 H 1 3.663 0.001 . 1 . . . . . 41 His HB2 . 17476 1
47 . 1 . 1 6 6 HIS HB3 H 1 2.973 0.001 . 1 . . . . . 41 His HB3 . 17476 1
48 . 1 . 1 6 6 HIS HD2 H 1 7.310 0.001 . 1 . . . . . 41 His HD2 . 17476 1
49 . 1 . 1 6 6 HIS HE1 H 1 7.752 0.001 . 1 . . . . . 41 His HE1 . 17476 1
50 . 1 . 1 6 6 HIS C C 13 176.770 0.010 . 1 . . . . . 41 His CO . 17476 1
51 . 1 . 1 6 6 HIS CA C 13 59.050 0.010 . 1 . . . . . 41 His CA . 17476 1
52 . 1 . 1 6 6 HIS CB C 13 30.280 0.010 . 1 . . . . . 41 His CB . 17476 1
53 . 1 . 1 6 6 HIS N N 15 124.360 0.010 . 1 . . . . . 41 His N . 17476 1
54 . 1 . 1 7 7 LEU H H 1 7.412 0.001 . 1 . . . . . 42 Leu HN . 17476 1
55 . 1 . 1 7 7 LEU HA H 1 4.004 0.001 . 1 . . . . . 42 Leu HA . 17476 1
56 . 1 . 1 7 7 LEU HB2 H 1 1.820 0.001 . 1 . . . . . 42 Leu HB2 . 17476 1
57 . 1 . 1 7 7 LEU HB3 H 1 1.607 0.001 . 1 . . . . . 42 Leu HB3 . 17476 1
58 . 1 . 1 7 7 LEU HG H 1 2.013 0.001 . 1 . . . . . 42 Leu HG . 17476 1
59 . 1 . 1 7 7 LEU HD11 H 1 0.985 0.001 . 2 . . . . . 42 Leu HD1 . 17476 1
60 . 1 . 1 7 7 LEU HD12 H 1 0.985 0.001 . 2 . . . . . 42 Leu HD1 . 17476 1
61 . 1 . 1 7 7 LEU HD13 H 1 0.985 0.001 . 2 . . . . . 42 Leu HD1 . 17476 1
62 . 1 . 1 7 7 LEU HD21 H 1 0.847 0.001 . 2 . . . . . 42 Leu HD2 . 17476 1
63 . 1 . 1 7 7 LEU HD22 H 1 0.847 0.001 . 2 . . . . . 42 Leu HD2 . 17476 1
64 . 1 . 1 7 7 LEU HD23 H 1 0.847 0.001 . 2 . . . . . 42 Leu HD2 . 17476 1
65 . 1 . 1 7 7 LEU C C 13 177.890 0.010 . 1 . . . . . 42 Leu CO . 17476 1
66 . 1 . 1 7 7 LEU CA C 13 57.180 0.010 . 1 . . . . . 42 Leu CA . 17476 1
67 . 1 . 1 7 7 LEU CB C 13 42.150 0.010 . 1 . . . . . 42 Leu CB . 17476 1
68 . 1 . 1 7 7 LEU CD1 C 13 24.890 0.010 . 1 . . . . . 42 Leu CD1 . 17476 1
69 . 1 . 1 7 7 LEU CD2 C 13 23.410 0.010 . 1 . . . . . 42 Leu CD2 . 17476 1
70 . 1 . 1 7 7 LEU N N 15 120.140 0.010 . 1 . . . . . 42 Leu N . 17476 1
71 . 1 . 1 8 8 ASP H H 1 8.006 0.001 . 1 . . . . . 43 Asp HN . 17476 1
72 . 1 . 1 8 8 ASP HA H 1 4.476 0.001 . 1 . . . . . 43 Asp HA . 17476 1
73 . 1 . 1 8 8 ASP HB2 H 1 2.672 0.001 . 2 . . . . . 43 Asp HB2 . 17476 1
74 . 1 . 1 8 8 ASP HB3 H 1 2.721 0.001 . 2 . . . . . 43 Asp HB3 . 17476 1
75 . 1 . 1 8 8 ASP C C 13 176.930 0.010 . 1 . . . . . 43 Asp CO . 17476 1
76 . 1 . 1 8 8 ASP CA C 13 56.510 0.010 . 1 . . . . . 43 Asp CA . 17476 1
77 . 1 . 1 8 8 ASP CB C 13 40.110 0.010 . 1 . . . . . 43 Asp CB . 17476 1
78 . 1 . 1 8 8 ASP N N 15 117.980 0.010 . 1 . . . . . 43 Asp N . 17476 1
79 . 1 . 1 9 9 SER H H 1 7.832 0.001 . 1 . . . . . 44 Ser HN . 17476 1
80 . 1 . 1 9 9 SER HA H 1 4.406 0.001 . 1 . . . . . 44 Ser HA . 17476 1
81 . 1 . 1 9 9 SER HB2 H 1 4.063 0.001 . 2 . . . . . 44 Ser HB . 17476 1
82 . 1 . 1 9 9 SER HB3 H 1 4.063 0.001 . 2 . . . . . 44 Ser HB . 17476 1
83 . 1 . 1 9 9 SER C C 13 174.080 0.010 . 1 . . . . . 44 Ser CO . 17476 1
84 . 1 . 1 9 9 SER CA C 13 59.550 0.010 . 1 . . . . . 44 Ser CA . 17476 1
85 . 1 . 1 9 9 SER CB C 13 63.890 0.010 . 1 . . . . . 44 Ser CB . 17476 1
86 . 1 . 1 9 9 SER N N 15 113.590 0.010 . 1 . . . . . 44 Ser N . 17476 1
87 . 1 . 1 10 10 VAL H H 1 7.225 0.001 . 1 . . . . . 45 Val HN . 17476 1
88 . 1 . 1 10 10 VAL HA H 1 4.267 0.001 . 1 . . . . . 45 Val HA . 17476 1
89 . 1 . 1 10 10 VAL HB H 1 2.214 0.001 . 1 . . . . . 45 Val HB . 17476 1
90 . 1 . 1 10 10 VAL HG11 H 1 1.081 0.001 . 2 . . . . . 45 Val HG1 . 17476 1
91 . 1 . 1 10 10 VAL HG12 H 1 1.081 0.001 . 2 . . . . . 45 Val HG1 . 17476 1
92 . 1 . 1 10 10 VAL HG13 H 1 1.081 0.001 . 2 . . . . . 45 Val HG1 . 17476 1
93 . 1 . 1 10 10 VAL HG21 H 1 1.040 0.001 . 2 . . . . . 45 Val HG2 . 17476 1
94 . 1 . 1 10 10 VAL HG22 H 1 1.040 0.001 . 2 . . . . . 45 Val HG2 . 17476 1
95 . 1 . 1 10 10 VAL HG23 H 1 1.040 0.001 . 2 . . . . . 45 Val HG2 . 17476 1
96 . 1 . 1 10 10 VAL C C 13 176.800 0.010 . 1 . . . . . 45 Val CO . 17476 1
97 . 1 . 1 10 10 VAL CA C 13 62.350 0.010 . 1 . . . . . 45 Val CA . 17476 1
98 . 1 . 1 10 10 VAL CB C 13 32.650 0.010 . 1 . . . . . 45 Val CB . 17476 1
99 . 1 . 1 10 10 VAL CG1 C 13 21.170 0.010 . 1 . . . . . 45 Val CG1 . 17476 1
100 . 1 . 1 10 10 VAL CG2 C 13 21.280 0.010 . 1 . . . . . 45 Val CG2 . 17476 1
101 . 1 . 1 10 10 VAL N N 15 120.140 0.010 . 1 . . . . . 45 Val N . 17476 1
102 . 1 . 1 11 11 GLY H H 1 8.256 0.001 . 1 . . . . . 46 Gly HN . 17476 1
103 . 1 . 1 11 11 GLY HA2 H 1 4.366 0.001 . 2 . . . . . 46 Gly HA2 . 17476 1
104 . 1 . 1 11 11 GLY HA3 H 1 3.713 0.001 . 2 . . . . . 46 Gly HA3 . 17476 1
105 . 1 . 1 11 11 GLY C C 13 172.900 0.010 . 1 . . . . . 46 Gly CO . 17476 1
106 . 1 . 1 11 11 GLY CA C 13 44.380 0.010 . 1 . . . . . 46 Gly CA . 17476 1
107 . 1 . 1 11 11 GLY N N 15 112.990 0.010 . 1 . . . . . 46 Gly N . 17476 1
108 . 1 . 1 12 12 GLU H H 1 8.282 0.001 . 1 . . . . . 47 Glu HN . 17476 1
109 . 1 . 1 12 12 GLU HA H 1 4.295 0.001 . 1 . . . . . 47 Glu HA . 17476 1
110 . 1 . 1 12 12 GLU HB2 H 1 1.878 0.001 . 1 . . . . . 47 Glu HB2 . 17476 1
111 . 1 . 1 12 12 GLU HB3 H 1 1.937 0.001 . 1 . . . . . 47 Glu HB3 . 17476 1
112 . 1 . 1 12 12 GLU HG2 H 1 2.157 0.001 . 2 . . . . . 47 Glu HG2 . 17476 1
113 . 1 . 1 12 12 GLU HG3 H 1 2.221 0.001 . 2 . . . . . 47 Glu HG3 . 17476 1
114 . 1 . 1 12 12 GLU C C 13 176.200 0.010 . 1 . . . . . 47 Glu CO . 17476 1
115 . 1 . 1 12 12 GLU CA C 13 56.240 0.010 . 1 . . . . . 47 Glu CA . 17476 1
116 . 1 . 1 12 12 GLU CB C 13 30.120 0.010 . 1 . . . . . 47 Glu CB . 17476 1
117 . 1 . 1 12 12 GLU N N 15 120.550 0.010 . 1 . . . . . 47 Glu N . 17476 1
118 . 1 . 1 13 13 ILE H H 1 8.221 0.001 . 1 . . . . . 48 Ile HN . 17476 1
119 . 1 . 1 13 13 ILE HA H 1 4.482 0.001 . 1 . . . . . 48 Ile HA . 17476 1
120 . 1 . 1 13 13 ILE HB H 1 1.729 0.001 . 1 . . . . . 48 Ile HB . 17476 1
121 . 1 . 1 13 13 ILE HG12 H 1 1.524 0.001 . 2 . . . . . 48 Ile HG12 . 17476 1
122 . 1 . 1 13 13 ILE HG13 H 1 1.147 0.001 . 2 . . . . . 48 Ile HG13 . 17476 1
123 . 1 . 1 13 13 ILE HG21 H 1 0.820 0.001 . 1 . . . . . 48 Ile HG2 . 17476 1
124 . 1 . 1 13 13 ILE HG22 H 1 0.820 0.001 . 1 . . . . . 48 Ile HG2 . 17476 1
125 . 1 . 1 13 13 ILE HG23 H 1 0.820 0.001 . 1 . . . . . 48 Ile HG2 . 17476 1
126 . 1 . 1 13 13 ILE HD11 H 1 0.767 0.001 . 1 . . . . . 48 Ile HD1 . 17476 1
127 . 1 . 1 13 13 ILE HD12 H 1 0.767 0.001 . 1 . . . . . 48 Ile HD1 . 17476 1
128 . 1 . 1 13 13 ILE HD13 H 1 0.767 0.001 . 1 . . . . . 48 Ile HD1 . 17476 1
129 . 1 . 1 13 13 ILE C C 13 175.340 0.010 . 1 . . . . . 48 Ile CO . 17476 1
130 . 1 . 1 13 13 ILE CA C 13 60.020 0.010 . 1 . . . . . 48 Ile CA . 17476 1
131 . 1 . 1 13 13 ILE CB C 13 40.220 0.010 . 1 . . . . . 48 Ile CB . 17476 1
132 . 1 . 1 13 13 ILE CD1 C 13 13.950 0.010 . 1 . . . . . 48 Ile CD1 . 17476 1
133 . 1 . 1 13 13 ILE N N 15 124.480 0.010 . 1 . . . . . 48 Ile N . 17476 1
134 . 1 . 1 14 14 THR H H 1 8.553 0.001 . 1 . . . . . 49 Thr HN . 17476 1
135 . 1 . 1 14 14 THR HA H 1 4.651 0.001 . 1 . . . . . 49 Thr HA . 17476 1
136 . 1 . 1 14 14 THR HB H 1 4.556 0.001 . 1 . . . . . 49 Thr HB . 17476 1
137 . 1 . 1 14 14 THR HG21 H 1 1.236 0.001 . 1 . . . . . 49 Thr HG2 . 17476 1
138 . 1 . 1 14 14 THR HG22 H 1 1.236 0.001 . 1 . . . . . 49 Thr HG2 . 17476 1
139 . 1 . 1 14 14 THR HG23 H 1 1.236 0.001 . 1 . . . . . 49 Thr HG2 . 17476 1
140 . 1 . 1 14 14 THR C C 13 175.000 0.010 . 1 . . . . . 49 Thr CO . 17476 1
141 . 1 . 1 14 14 THR CA C 13 59.970 0.010 . 1 . . . . . 49 Thr CA . 17476 1
142 . 1 . 1 14 14 THR CB C 13 71.530 0.010 . 1 . . . . . 49 Thr CB . 17476 1
143 . 1 . 1 14 14 THR CG2 C 13 21.200 0.010 . 1 . . . . . 49 Thr CG2 . 17476 1
144 . 1 . 1 14 14 THR N N 15 117.280 0.010 . 1 . . . . . 49 Thr N . 17476 1
145 . 1 . 1 15 15 LYS H H 1 8.976 0.001 . 1 . . . . . 50 Lys HN . 17476 1
146 . 1 . 1 15 15 LYS HA H 1 3.865 0.001 . 1 . . . . . 50 Lys HA . 17476 1
147 . 1 . 1 15 15 LYS HB2 H 1 1.862 0.001 . 2 . . . . . 50 Lys HB2 . 17476 1
148 . 1 . 1 15 15 LYS HB3 H 1 1.778 0.001 . 2 . . . . . 50 Lys HB3 . 17476 1
149 . 1 . 1 15 15 LYS HG2 H 1 1.412 0.001 . 2 . . . . . 50 Lys HG . 17476 1
150 . 1 . 1 15 15 LYS HG3 H 1 1.412 0.001 . 2 . . . . . 50 Lys HG . 17476 1
151 . 1 . 1 15 15 LYS HD2 H 1 1.677 0.001 . 2 . . . . . 50 Lys HD . 17476 1
152 . 1 . 1 15 15 LYS HD3 H 1 1.677 0.001 . 2 . . . . . 50 Lys HD . 17476 1
153 . 1 . 1 15 15 LYS HE2 H 1 2.928 0.001 . 2 . . . . . 50 Lys HE . 17476 1
154 . 1 . 1 15 15 LYS HE3 H 1 2.928 0.001 . 2 . . . . . 50 Lys HE . 17476 1
155 . 1 . 1 15 15 LYS C C 13 178.230 0.010 . 1 . . . . . 50 Lys CO . 17476 1
156 . 1 . 1 15 15 LYS CA C 13 59.820 0.010 . 1 . . . . . 50 Lys CA . 17476 1
157 . 1 . 1 15 15 LYS CB C 13 32.180 0.010 . 1 . . . . . 50 Lys CB . 17476 1
158 . 1 . 1 15 15 LYS N N 15 123.060 0.010 . 1 . . . . . 50 Lys N . 17476 1
159 . 1 . 1 16 16 GLU H H 1 8.817 0.001 . 1 . . . . . 51 Glu HN . 17476 1
160 . 1 . 1 16 16 GLU HA H 1 3.912 0.001 . 1 . . . . . 51 Glu HA . 17476 1
161 . 1 . 1 16 16 GLU HB2 H 1 1.906 0.001 . 2 . . . . . 51 Glu HB2 . 17476 1
162 . 1 . 1 16 16 GLU HB3 H 1 2.017 0.001 . 2 . . . . . 51 Glu HB3 . 17476 1
163 . 1 . 1 16 16 GLU HG2 H 1 2.225 0.001 . 2 . . . . . 51 Glu HG2 . 17476 1
164 . 1 . 1 16 16 GLU HG3 H 1 2.413 0.001 . 2 . . . . . 51 Glu HG3 . 17476 1
165 . 1 . 1 16 16 GLU C C 13 178.940 0.010 . 1 . . . . . 51 Glu CO . 17476 1
166 . 1 . 1 16 16 GLU CA C 13 60.450 0.010 . 1 . . . . . 51 Glu CA . 17476 1
167 . 1 . 1 16 16 GLU CB C 13 28.610 0.010 . 1 . . . . . 51 Glu CB . 17476 1
168 . 1 . 1 16 16 GLU N N 15 117.280 0.010 . 1 . . . . . 51 Glu N . 17476 1
169 . 1 . 1 17 17 ASP H H 1 7.687 0.001 . 1 . . . . . 52 Asp HN . 17476 1
170 . 1 . 1 17 17 ASP HA H 1 4.391 0.001 . 1 . . . . . 52 Asp HA . 17476 1
171 . 1 . 1 17 17 ASP HB2 H 1 2.499 0.001 . 1 . . . . . 52 Asp HB2 . 17476 1
172 . 1 . 1 17 17 ASP HB3 H 1 2.874 0.001 . 1 . . . . . 52 Asp HB3 . 17476 1
173 . 1 . 1 17 17 ASP C C 13 178.430 0.010 . 1 . . . . . 52 Asp CO . 17476 1
174 . 1 . 1 17 17 ASP CA C 13 57.240 0.010 . 1 . . . . . 52 Asp CA . 17476 1
175 . 1 . 1 17 17 ASP CB C 13 41.200 0.010 . 1 . . . . . 52 Asp CB . 17476 1
176 . 1 . 1 17 17 ASP N N 15 120.330 0.010 . 1 . . . . . 52 Asp N . 17476 1
177 . 1 . 1 18 18 LEU H H 1 7.716 0.001 . 1 . . . . . 53 Leu HN . 17476 1
178 . 1 . 1 18 18 LEU HA H 1 3.815 0.001 . 1 . . . . . 53 Leu HA . 17476 1
179 . 1 . 1 18 18 LEU HB2 H 1 1.367 0.001 . 1 . . . . . 53 Leu HB2 . 17476 1
180 . 1 . 1 18 18 LEU HB3 H 1 1.991 0.001 . 1 . . . . . 53 Leu HB3 . 17476 1
181 . 1 . 1 18 18 LEU HG H 1 1.801 0.001 . 1 . . . . . 53 Leu HG . 17476 1
182 . 1 . 1 18 18 LEU HD11 H 1 0.764 0.001 . 2 . . . . . 53 Leu HD1 . 17476 1
183 . 1 . 1 18 18 LEU HD12 H 1 0.764 0.001 . 2 . . . . . 53 Leu HD1 . 17476 1
184 . 1 . 1 18 18 LEU HD13 H 1 0.764 0.001 . 2 . . . . . 53 Leu HD1 . 17476 1
185 . 1 . 1 18 18 LEU HD21 H 1 0.648 0.001 . 2 . . . . . 53 Leu HD2 . 17476 1
186 . 1 . 1 18 18 LEU HD22 H 1 0.648 0.001 . 2 . . . . . 53 Leu HD2 . 17476 1
187 . 1 . 1 18 18 LEU HD23 H 1 0.648 0.001 . 2 . . . . . 53 Leu HD2 . 17476 1
188 . 1 . 1 18 18 LEU C C 13 179.640 0.010 . 1 . . . . . 53 Leu CO . 17476 1
189 . 1 . 1 18 18 LEU CA C 13 58.000 0.010 . 1 . . . . . 53 Leu CA . 17476 1
190 . 1 . 1 18 18 LEU CB C 13 40.730 0.010 . 1 . . . . . 53 Leu CB . 17476 1
191 . 1 . 1 18 18 LEU CD1 C 13 25.020 0.010 . 1 . . . . . 53 Leu CD1 . 17476 1
192 . 1 . 1 18 18 LEU CD2 C 13 22.000 0.010 . 1 . . . . . 53 Leu CD2 . 17476 1
193 . 1 . 1 18 18 LEU N N 15 119.270 0.010 . 1 . . . . . 53 Leu N . 17476 1
194 . 1 . 1 19 19 ILE H H 1 8.198 0.001 . 1 . . . . . 54 Ile HN . 17476 1
195 . 1 . 1 19 19 ILE HA H 1 3.631 0.001 . 1 . . . . . 54 Ile HA . 17476 1
196 . 1 . 1 19 19 ILE HB H 1 1.868 0.001 . 1 . . . . . 54 Ile HB . 17476 1
197 . 1 . 1 19 19 ILE HG12 H 1 1.673 0.001 . 2 . . . . . 54 Ile HG12 . 17476 1
198 . 1 . 1 19 19 ILE HG13 H 1 1.147 0.001 . 2 . . . . . 54 Ile HG13 . 17476 1
199 . 1 . 1 19 19 ILE HG21 H 1 0.835 0.001 . 1 . . . . . 54 Ile HG2 . 17476 1
200 . 1 . 1 19 19 ILE HG22 H 1 0.835 0.001 . 1 . . . . . 54 Ile HG2 . 17476 1
201 . 1 . 1 19 19 ILE HG23 H 1 0.835 0.001 . 1 . . . . . 54 Ile HG2 . 17476 1
202 . 1 . 1 19 19 ILE HD11 H 1 0.800 0.001 . 1 . . . . . 54 Ile HD1 . 17476 1
203 . 1 . 1 19 19 ILE HD12 H 1 0.800 0.001 . 1 . . . . . 54 Ile HD1 . 17476 1
204 . 1 . 1 19 19 ILE HD13 H 1 0.800 0.001 . 1 . . . . . 54 Ile HD1 . 17476 1
205 . 1 . 1 19 19 ILE C C 13 179.850 0.010 . 1 . . . . . 54 Ile CO . 17476 1
206 . 1 . 1 19 19 ILE CA C 13 64.620 0.010 . 1 . . . . . 54 Ile CA . 17476 1
207 . 1 . 1 19 19 ILE CB C 13 37.550 0.010 . 1 . . . . . 54 Ile CB . 17476 1
208 . 1 . 1 19 19 ILE N N 15 119.590 0.010 . 1 . . . . . 54 Ile N . 17476 1
209 . 1 . 1 20 20 GLN H H 1 8.043 0.001 . 1 . . . . . 55 Gln HN . 17476 1
210 . 1 . 1 20 20 GLN HA H 1 3.922 0.001 . 1 . . . . . 55 Gln HA . 17476 1
211 . 1 . 1 20 20 GLN HB2 H 1 2.162 0.001 . 2 . . . . . 55 Gln HB . 17476 1
212 . 1 . 1 20 20 GLN HB3 H 1 2.162 0.001 . 2 . . . . . 55 Gln HB . 17476 1
213 . 1 . 1 20 20 GLN HG2 H 1 2.428 0.001 . 2 . . . . . 55 Gln HG . 17476 1
214 . 1 . 1 20 20 GLN HG3 H 1 2.428 0.001 . 2 . . . . . 55 Gln HG . 17476 1
215 . 1 . 1 20 20 GLN HE21 H 1 6.814 0.001 . 1 . . . . . 55 Gln HE21 . 17476 1
216 . 1 . 1 20 20 GLN HE22 H 1 7.503 0.001 . 1 . . . . . 55 Gln HE22 . 17476 1
217 . 1 . 1 20 20 GLN C C 13 179.770 0.010 . 1 . . . . . 55 Gln CO . 17476 1
218 . 1 . 1 20 20 GLN CA C 13 59.350 0.010 . 1 . . . . . 55 Gln CA . 17476 1
219 . 1 . 1 20 20 GLN CB C 13 28.010 0.010 . 1 . . . . . 55 Gln CB . 17476 1
220 . 1 . 1 20 20 GLN N N 15 119.880 0.010 . 1 . . . . . 55 Gln N . 17476 1
221 . 1 . 1 21 21 LYS H H 1 8.311 0.001 . 1 . . . . . 56 Lys HN . 17476 1
222 . 1 . 1 21 21 LYS HA H 1 3.949 0.001 . 1 . . . . . 56 Lys HA . 17476 1
223 . 1 . 1 21 21 LYS HB2 H 1 1.680 0.001 . 2 . . . . . 56 Lys HB2 . 17476 1
224 . 1 . 1 21 21 LYS HB3 H 1 1.795 0.001 . 2 . . . . . 56 Lys HB3 . 17476 1
225 . 1 . 1 21 21 LYS HG2 H 1 1.434 0.001 . 2 . . . . . 56 Lys HG2 . 17476 1
226 . 1 . 1 21 21 LYS HG3 H 1 1.275 0.001 . 2 . . . . . 56 Lys HG3 . 17476 1
227 . 1 . 1 21 21 LYS HD2 H 1 1.500 0.001 . 2 . . . . . 56 Lys HD2 . 17476 1
228 . 1 . 1 21 21 LYS HD3 H 1 1.371 0.001 . 2 . . . . . 56 Lys HD3 . 17476 1
229 . 1 . 1 21 21 LYS HE2 H 1 2.817 0.001 . 2 . . . . . 56 Lys HE . 17476 1
230 . 1 . 1 21 21 LYS HE3 H 1 2.817 0.001 . 2 . . . . . 56 Lys HE . 17476 1
231 . 1 . 1 21 21 LYS C C 13 179.040 0.010 . 1 . . . . . 56 Lys CO . 17476 1
232 . 1 . 1 21 21 LYS CA C 13 59.560 0.010 . 1 . . . . . 56 Lys CA . 17476 1
233 . 1 . 1 21 21 LYS CB C 13 33.600 0.010 . 1 . . . . . 56 Lys CB . 17476 1
234 . 1 . 1 21 21 LYS N N 15 119.270 0.010 . 1 . . . . . 56 Lys N . 17476 1
235 . 1 . 1 22 22 SER H H 1 7.913 0.001 . 1 . . . . . 57 Ser HN . 17476 1
236 . 1 . 1 22 22 SER HA H 1 3.948 0.001 . 1 . . . . . 57 Ser HA . 17476 1
237 . 1 . 1 22 22 SER HB2 H 1 4.047 0.001 . 2 . . . . . 57 Ser HB2 . 17476 1
238 . 1 . 1 22 22 SER HB3 H 1 3.899 0.001 . 2 . . . . . 57 Ser HB3 . 17476 1
239 . 1 . 1 22 22 SER HG H 1 6.502 0.001 . 1 . . . . . 57 Ser HG . 17476 1
240 . 1 . 1 22 22 SER C C 13 174.200 0.010 . 1 . . . . . 57 Ser CO . 17476 1
241 . 1 . 1 22 22 SER CA C 13 60.880 0.010 . 1 . . . . . 57 Ser CA . 17476 1
242 . 1 . 1 22 22 SER CB C 13 63.280 0.010 . 1 . . . . . 57 Ser CB . 17476 1
243 . 1 . 1 22 22 SER N N 15 115.050 0.010 . 1 . . . . . 57 Ser N . 17476 1
244 . 1 . 1 23 23 LEU H H 1 7.162 0.001 . 1 . . . . . 58 Leu HN . 17476 1
245 . 1 . 1 23 23 LEU HA H 1 4.372 0.001 . 1 . . . . . 58 Leu HA . 17476 1
246 . 1 . 1 23 23 LEU HB2 H 1 1.632 0.001 . 1 . . . . . 58 Leu HB2 . 17476 1
247 . 1 . 1 23 23 LEU HB3 H 1 1.744 0.001 . 1 . . . . . 58 Leu HB3 . 17476 1
248 . 1 . 1 23 23 LEU HG H 1 1.810 0.001 . 1 . . . . . 58 Leu HG . 17476 1
249 . 1 . 1 23 23 LEU HD11 H 1 0.836 0.001 . 2 . . . . . 58 Leu HD1 . 17476 1
250 . 1 . 1 23 23 LEU HD12 H 1 0.836 0.001 . 2 . . . . . 58 Leu HD1 . 17476 1
251 . 1 . 1 23 23 LEU HD13 H 1 0.836 0.001 . 2 . . . . . 58 Leu HD1 . 17476 1
252 . 1 . 1 23 23 LEU HD21 H 1 0.785 0.001 . 2 . . . . . 58 Leu HD2 . 17476 1
253 . 1 . 1 23 23 LEU HD22 H 1 0.785 0.001 . 2 . . . . . 58 Leu HD2 . 17476 1
254 . 1 . 1 23 23 LEU HD23 H 1 0.785 0.001 . 2 . . . . . 58 Leu HD2 . 17476 1
255 . 1 . 1 23 23 LEU C C 13 177.600 0.010 . 1 . . . . . 58 Leu CO . 17476 1
256 . 1 . 1 23 23 LEU CA C 13 55.080 0.010 . 1 . . . . . 58 Leu CA . 17476 1
257 . 1 . 1 23 23 LEU CB C 13 41.810 0.010 . 1 . . . . . 58 Leu CB . 17476 1
258 . 1 . 1 23 23 LEU CD1 C 13 26.540 0.010 . 1 . . . . . 58 Leu CD1 . 17476 1
259 . 1 . 1 23 23 LEU CD2 C 13 21.410 0.010 . 1 . . . . . 58 Leu CD2 . 17476 1
260 . 1 . 1 23 23 LEU N N 15 121.310 0.010 . 1 . . . . . 58 Leu N . 17476 1
261 . 1 . 1 24 24 GLY H H 1 7.301 0.001 . 1 . . . . . 59 Gly HN . 17476 1
262 . 1 . 1 24 24 GLY HA2 H 1 3.794 0.001 . 2 . . . . . 59 Gly HA2 . 17476 1
263 . 1 . 1 24 24 GLY HA3 H 1 4.390 0.001 . 2 . . . . . 59 Gly HA3 . 17476 1
264 . 1 . 1 24 24 GLY C C 13 172.860 0.010 . 1 . . . . . 59 Gly CO . 17476 1
265 . 1 . 1 24 24 GLY CA C 13 44.230 0.010 . 1 . . . . . 59 Gly CA . 17476 1
266 . 1 . 1 24 24 GLY N N 15 107.420 0.010 . 1 . . . . . 59 Gly N . 17476 1
267 . 1 . 1 25 25 THR H H 1 7.413 0.001 . 1 . . . . . 60 Thr HN . 17476 1
268 . 1 . 1 25 25 THR HA H 1 3.822 0.001 . 1 . . . . . 60 Thr HA . 17476 1
269 . 1 . 1 25 25 THR HB H 1 4.874 0.001 . 1 . . . . . 60 Thr HB . 17476 1
270 . 1 . 1 25 25 THR HG21 H 1 0.911 0.001 . 1 . . . . . 60 Thr HG2 . 17476 1
271 . 1 . 1 25 25 THR HG22 H 1 0.911 0.001 . 1 . . . . . 60 Thr HG2 . 17476 1
272 . 1 . 1 25 25 THR HG23 H 1 0.911 0.001 . 1 . . . . . 60 Thr HG2 . 17476 1
273 . 1 . 1 25 25 THR C C 13 174.760 0.010 . 1 . . . . . 60 Thr CO . 17476 1
274 . 1 . 1 25 25 THR CA C 13 59.120 0.010 . 1 . . . . . 60 Thr CA . 17476 1
275 . 1 . 1 25 25 THR CB C 13 73.560 0.010 . 1 . . . . . 60 Thr CB . 17476 1
276 . 1 . 1 25 25 THR CG2 C 13 19.960 0.010 . 1 . . . . . 60 Thr CG2 . 17476 1
277 . 1 . 1 25 25 THR N N 15 107.360 0.010 . 1 . . . . . 60 Thr N . 17476 1
278 . 1 . 1 26 26 CYS H H 1 8.545 0.001 . 1 . . . . . 61 Cys HN . 17476 1
279 . 1 . 1 26 26 CYS HA H 1 3.917 0.001 . 1 . . . . . 61 Cys HA . 17476 1
280 . 1 . 1 26 26 CYS HB2 H 1 3.276 0.001 . 1 . . . . . 61 Cys HB2 . 17476 1
281 . 1 . 1 26 26 CYS HB3 H 1 2.799 0.001 . 1 . . . . . 61 Cys HB3 . 17476 1
282 . 1 . 1 26 26 CYS C C 13 177.490 0.010 . 1 . . . . . 61 Cys CO . 17476 1
283 . 1 . 1 26 26 CYS CA C 13 59.940 0.010 . 1 . . . . . 61 Cys CA . 17476 1
284 . 1 . 1 26 26 CYS CB C 13 30.950 0.010 . 1 . . . . . 61 Cys CB . 17476 1
285 . 1 . 1 26 26 CYS N N 15 121.100 0.010 . 1 . . . . . 61 Cys N . 17476 1
286 . 1 . 1 27 27 GLN H H 1 8.902 0.001 . 1 . . . . . 62 Gln HN . 17476 1
287 . 1 . 1 27 27 GLN HA H 1 4.002 0.001 . 1 . . . . . 62 Gln HA . 17476 1
288 . 1 . 1 27 27 GLN HB2 H 1 1.888 0.001 . 2 . . . . . 62 Gln HB . 17476 1
289 . 1 . 1 27 27 GLN HB3 H 1 1.888 0.001 . 2 . . . . . 62 Gln HB . 17476 1
290 . 1 . 1 27 27 GLN HG2 H 1 2.385 0.001 . 2 . . . . . 62 Gln HG . 17476 1
291 . 1 . 1 27 27 GLN HG3 H 1 2.385 0.001 . 2 . . . . . 62 Gln HG . 17476 1
292 . 1 . 1 27 27 GLN HE21 H 1 6.901 0.001 . 1 . . . . . 62 Gln HE21 . 17476 1
293 . 1 . 1 27 27 GLN HE22 H 1 7.735 0.001 . 1 . . . . . 62 Gln HE22 . 17476 1
294 . 1 . 1 27 27 GLN C C 13 176.530 0.010 . 1 . . . . . 62 Gln CO . 17476 1
295 . 1 . 1 27 27 GLN CA C 13 58.680 0.010 . 1 . . . . . 62 Gln CA . 17476 1
296 . 1 . 1 27 27 GLN CB C 13 28.810 0.010 . 1 . . . . . 62 Gln CB . 17476 1
297 . 1 . 1 27 27 GLN N N 15 130.580 0.010 . 1 . . . . . 62 Gln N . 17476 1
298 . 1 . 1 28 28 ASP H H 1 8.780 0.001 . 1 . . . . . 63 Asp HN . 17476 1
299 . 1 . 1 28 28 ASP HA H 1 4.797 0.001 . 1 . . . . . 63 Asp HA . 17476 1
300 . 1 . 1 28 28 ASP HB2 H 1 2.484 0.001 . 2 . . . . . 63 Asp HB . 17476 1
301 . 1 . 1 28 28 ASP HB3 H 1 2.484 0.001 . 2 . . . . . 63 Asp HB . 17476 1
302 . 1 . 1 28 28 ASP C C 13 176.240 0.010 . 1 . . . . . 63 Asp CO . 17476 1
303 . 1 . 1 28 28 ASP CA C 13 56.600 0.010 . 1 . . . . . 63 Asp CA . 17476 1
304 . 1 . 1 28 28 ASP CB C 13 42.270 0.010 . 1 . . . . . 63 Asp CB . 17476 1
305 . 1 . 1 28 28 ASP N N 15 119.380 0.010 . 1 . . . . . 63 Asp N . 17476 1
306 . 1 . 1 29 29 CYS H H 1 7.999 0.001 . 1 . . . . . 64 Cys HN . 17476 1
307 . 1 . 1 29 29 CYS HA H 1 5.016 0.001 . 1 . . . . . 64 Cys HA . 17476 1
308 . 1 . 1 29 29 CYS HB2 H 1 3.062 0.001 . 1 . . . . . 64 Cys HB2 . 17476 1
309 . 1 . 1 29 29 CYS HB3 H 1 3.363 0.001 . 1 . . . . . 64 Cys HB3 . 17476 1
310 . 1 . 1 29 29 CYS C C 13 175.340 0.010 . 1 . . . . . 64 Cys CO . 17476 1
311 . 1 . 1 29 29 CYS CA C 13 59.170 0.010 . 1 . . . . . 64 Cys CA . 17476 1
312 . 1 . 1 29 29 CYS CB C 13 31.480 0.010 . 1 . . . . . 64 Cys CB . 17476 1
313 . 1 . 1 29 29 CYS N N 15 118.150 0.010 . 1 . . . . . 64 Cys N . 17476 1
314 . 1 . 1 30 30 LYS H H 1 7.967 0.001 . 1 . . . . . 65 Lys HN . 17476 1
315 . 1 . 1 30 30 LYS HA H 1 4.230 0.001 . 1 . . . . . 65 Lys HA . 17476 1
316 . 1 . 1 30 30 LYS HB2 H 1 2.039 0.001 . 2 . . . . . 65 Lys HB2 . 17476 1
317 . 1 . 1 30 30 LYS HB3 H 1 1.619 0.001 . 2 . . . . . 65 Lys HB3 . 17476 1
318 . 1 . 1 30 30 LYS HG2 H 1 1.350 0.001 . 2 . . . . . 65 Lys HG2 . 17476 1
319 . 1 . 1 30 30 LYS HG3 H 1 1.210 0.001 . 2 . . . . . 65 Lys HG3 . 17476 1
320 . 1 . 1 30 30 LYS HD2 H 1 1.519 0.001 . 2 . . . . . 65 Lys HD . 17476 1
321 . 1 . 1 30 30 LYS HD3 H 1 1.519 0.001 . 2 . . . . . 65 Lys HD . 17476 1
322 . 1 . 1 30 30 LYS HE2 H 1 2.888 0.001 . 2 . . . . . 65 Lys HE . 17476 1
323 . 1 . 1 30 30 LYS HE3 H 1 2.888 0.001 . 2 . . . . . 65 Lys HE . 17476 1
324 . 1 . 1 30 30 LYS CA C 13 56.950 0.010 . 1 . . . . . 65 Lys CA . 17476 1
325 . 1 . 1 30 30 LYS CB C 13 29.370 0.010 . 1 . . . . . 65 Lys CB . 17476 1
326 . 1 . 1 30 30 LYS N N 15 115.930 0.010 . 1 . . . . . 65 Lys N . 17476 1
327 . 1 . 1 31 31 VAL H H 1 7.731 0.001 . 1 . . . . . 66 Val HN . 17476 1
328 . 1 . 1 31 31 VAL HA H 1 4.219 0.001 . 1 . . . . . 66 Val HA . 17476 1
329 . 1 . 1 31 31 VAL HB H 1 2.292 0.001 . 1 . . . . . 66 Val HB . 17476 1
330 . 1 . 1 31 31 VAL HG11 H 1 1.029 0.001 . 2 . . . . . 66 Val HG1 . 17476 1
331 . 1 . 1 31 31 VAL HG12 H 1 1.029 0.001 . 2 . . . . . 66 Val HG1 . 17476 1
332 . 1 . 1 31 31 VAL HG13 H 1 1.029 0.001 . 2 . . . . . 66 Val HG1 . 17476 1
333 . 1 . 1 31 31 VAL HG21 H 1 1.135 0.001 . 2 . . . . . 66 Val HG2 . 17476 1
334 . 1 . 1 31 31 VAL HG22 H 1 1.135 0.001 . 2 . . . . . 66 Val HG2 . 17476 1
335 . 1 . 1 31 31 VAL HG23 H 1 1.135 0.001 . 2 . . . . . 66 Val HG2 . 17476 1
336 . 1 . 1 31 31 VAL C C 13 175.000 0.010 . 1 . . . . . 66 Val CO . 17476 1
337 . 1 . 1 31 31 VAL CA C 13 62.950 0.010 . 1 . . . . . 66 Val CA . 17476 1
338 . 1 . 1 31 31 VAL CB C 13 32.580 0.010 . 1 . . . . . 66 Val CB . 17476 1
339 . 1 . 1 31 31 VAL CG1 C 13 21.220 0.010 . 1 . . . . . 66 Val CG1 . 17476 1
340 . 1 . 1 31 31 VAL CG2 C 13 21.020 0.010 . 1 . . . . . 66 Val CG2 . 17476 1
341 . 1 . 1 32 32 GLN H H 1 8.072 0.001 . 1 . . . . . 67 Gln HN . 17476 1
342 . 1 . 1 32 32 GLN HA H 1 4.483 0.001 . 1 . . . . . 67 Gln HA . 17476 1
343 . 1 . 1 32 32 GLN HB2 H 1 2.273 0.001 . 2 . . . . . 67 Gln HB2 . 17476 1
344 . 1 . 1 32 32 GLN HB3 H 1 2.049 0.001 . 2 . . . . . 67 Gln HB3 . 17476 1
345 . 1 . 1 32 32 GLN HG2 H 1 2.544 0.001 . 2 . . . . . 67 Gln HG2 . 17476 1
346 . 1 . 1 32 32 GLN HG3 H 1 2.415 0.001 . 2 . . . . . 67 Gln HG3 . 17476 1
347 . 1 . 1 32 32 GLN HE21 H 1 6.815 0.001 . 1 . . . . . 67 Gln HE21 . 17476 1
348 . 1 . 1 32 32 GLN HE22 H 1 7.562 0.001 . 1 . . . . . 67 Gln HE22 . 17476 1
349 . 1 . 1 32 32 GLN C C 13 176.110 0.010 . 1 . . . . . 67 Gln CO . 17476 1
350 . 1 . 1 32 32 GLN CA C 13 55.400 0.010 . 1 . . . . . 67 Gln CA . 17476 1
351 . 1 . 1 32 32 GLN CB C 13 31.060 0.010 . 1 . . . . . 67 Gln CB . 17476 1
352 . 1 . 1 32 32 GLN N N 15 121.100 0.010 . 1 . . . . . 67 Gln N . 17476 1
353 . 1 . 1 33 33 GLY H H 1 8.301 0.001 . 1 . . . . . 68 Gly HN . 17476 1
354 . 1 . 1 33 33 GLY HA2 H 1 3.909 0.001 . 2 . . . . . 68 Gly HA2 . 17476 1
355 . 1 . 1 33 33 GLY HA3 H 1 3.789 0.001 . 2 . . . . . 68 Gly HA3 . 17476 1
356 . 1 . 1 33 33 GLY C C 13 171.980 0.010 . 1 . . . . . 68 Gly CO . 17476 1
357 . 1 . 1 33 33 GLY CA C 13 44.530 0.010 . 1 . . . . . 68 Gly CA . 17476 1
358 . 1 . 1 33 33 GLY N N 15 104.480 0.010 . 1 . . . . . 68 Gly N . 17476 1
359 . 1 . 1 34 34 PRO HA H 1 4.426 0.001 . 1 . . . . . 69 Pro HA . 17476 1
360 . 1 . 1 34 34 PRO HB2 H 1 2.121 0.001 . 2 . . . . . 69 Pro HB2 . 17476 1
361 . 1 . 1 34 34 PRO HB3 H 1 2.319 0.001 . 2 . . . . . 69 Pro HB3 . 17476 1
362 . 1 . 1 34 34 PRO HG2 H 1 1.659 0.001 . 2 . . . . . 69 Pro HG2 . 17476 1
363 . 1 . 1 34 34 PRO HG3 H 1 1.891 0.001 . 2 . . . . . 69 Pro HG3 . 17476 1
364 . 1 . 1 34 34 PRO HD2 H 1 3.427 0.001 . 2 . . . . . 69 Pro HD2 . 17476 1
365 . 1 . 1 34 34 PRO HD3 H 1 3.485 0.001 . 2 . . . . . 69 Pro HD3 . 17476 1
366 . 1 . 1 35 35 ASN H H 1 8.812 0.001 . 1 . . . . . 70 Asn HN . 17476 1
367 . 1 . 1 35 35 ASN HA H 1 4.123 0.001 . 1 . . . . . 70 Asn HA . 17476 1
368 . 1 . 1 35 35 ASN HB2 H 1 3.090 0.001 . 2 . . . . . 70 Asn HB2 . 17476 1
369 . 1 . 1 35 35 ASN HB3 H 1 2.973 0.001 . 2 . . . . . 70 Asn HB3 . 17476 1
370 . 1 . 1 35 35 ASN HD21 H 1 6.811 0.001 . 1 . . . . . 70 Asn HD21 . 17476 1
371 . 1 . 1 35 35 ASN HD22 H 1 7.668 0.001 . 1 . . . . . 70 Asn HD22 . 17476 1
372 . 1 . 1 35 35 ASN C C 13 175.730 0.010 . 1 . . . . . 70 Asn CO . 17476 1
373 . 1 . 1 35 35 ASN CA C 13 55.180 0.010 . 1 . . . . . 70 Asn CA . 17476 1
374 . 1 . 1 35 35 ASN CB C 13 36.970 0.010 . 1 . . . . . 70 Asn CB . 17476 1
375 . 1 . 1 36 36 LEU H H 1 8.157 0.001 . 1 . . . . . 71 Leu HN . 17476 1
376 . 1 . 1 36 36 LEU HA H 1 4.629 0.001 . 1 . . . . . 71 Leu HA . 17476 1
377 . 1 . 1 36 36 LEU HB2 H 1 0.959 0.001 . 1 . . . . . 71 Leu HB2 . 17476 1
378 . 1 . 1 36 36 LEU HB3 H 1 1.525 0.001 . 1 . . . . . 71 Leu HB3 . 17476 1
379 . 1 . 1 36 36 LEU HG H 1 1.207 0.001 . 1 . . . . . 71 Leu HG . 17476 1
380 . 1 . 1 36 36 LEU HD11 H 1 0.503 0.001 . 2 . . . . . 71 Leu HD1 . 17476 1
381 . 1 . 1 36 36 LEU HD12 H 1 0.503 0.001 . 2 . . . . . 71 Leu HD1 . 17476 1
382 . 1 . 1 36 36 LEU HD13 H 1 0.503 0.001 . 2 . . . . . 71 Leu HD1 . 17476 1
383 . 1 . 1 36 36 LEU HD21 H 1 0.514 0.001 . 2 . . . . . 71 Leu HD2 . 17476 1
384 . 1 . 1 36 36 LEU HD22 H 1 0.514 0.001 . 2 . . . . . 71 Leu HD2 . 17476 1
385 . 1 . 1 36 36 LEU HD23 H 1 0.514 0.001 . 2 . . . . . 71 Leu HD2 . 17476 1
386 . 1 . 1 36 36 LEU C C 13 175.420 0.010 . 1 . . . . . 71 Leu CO . 17476 1
387 . 1 . 1 36 36 LEU CA C 13 54.670 0.010 . 1 . . . . . 71 Leu CA . 17476 1
388 . 1 . 1 36 36 LEU CB C 13 44.220 0.010 . 1 . . . . . 71 Leu CB . 17476 1
389 . 1 . 1 36 36 LEU CD1 C 13 24.830 0.010 . 1 . . . . . 71 Leu CD1 . 17476 1
390 . 1 . 1 36 36 LEU CD2 C 13 21.000 0.010 . 1 . . . . . 71 Leu CD2 . 17476 1
391 . 1 . 1 36 36 LEU N N 15 116.930 0.010 . 1 . . . . . 71 Leu N . 17476 1
392 . 1 . 1 37 37 TRP H H 1 9.110 0.001 . 1 . . . . . 72 Trp HN . 17476 1
393 . 1 . 1 37 37 TRP HA H 1 5.261 0.001 . 1 . . . . . 72 Trp HA . 17476 1
394 . 1 . 1 37 37 TRP HB2 H 1 3.577 0.001 . 1 . . . . . 72 Trp HB2 . 17476 1
395 . 1 . 1 37 37 TRP HB3 H 1 2.921 0.001 . 1 . . . . . 72 Trp HB3 . 17476 1
396 . 1 . 1 37 37 TRP HD1 H 1 7.094 0.001 . 1 . . . . . 72 Trp HD1 . 17476 1
397 . 1 . 1 37 37 TRP HE1 H 1 10.016 0.001 . 1 . . . . . 72 Trp HE1 . 17476 1
398 . 1 . 1 37 37 TRP HE3 H 1 7.655 0.001 . 1 . . . . . 72 Trp HE3 . 17476 1
399 . 1 . 1 37 37 TRP HZ2 H 1 7.293 0.001 . 1 . . . . . 72 Trp HZ2 . 17476 1
400 . 1 . 1 37 37 TRP HZ3 H 1 6.993 0.001 . 1 . . . . . 72 Trp HZ3 . 17476 1
401 . 1 . 1 37 37 TRP HH2 H 1 6.908 0.001 . 1 . . . . . 72 Trp HH2 . 17476 1
402 . 1 . 1 37 37 TRP C C 13 175.860 0.010 . 1 . . . . . 72 Trp CO . 17476 1
403 . 1 . 1 37 37 TRP CA C 13 55.840 0.010 . 1 . . . . . 72 Trp CA . 17476 1
404 . 1 . 1 37 37 TRP CB C 13 29.730 0.010 . 1 . . . . . 72 Trp CB . 17476 1
405 . 1 . 1 37 37 TRP N N 15 119.900 0.010 . 1 . . . . . 72 Trp N . 17476 1
406 . 1 . 1 38 38 ALA H H 1 9.523 0.001 . 1 . . . . . 73 Ala HN . 17476 1
407 . 1 . 1 38 38 ALA HA H 1 5.128 0.001 . 1 . . . . . 73 Ala HA . 17476 1
408 . 1 . 1 38 38 ALA HB1 H 1 1.363 0.001 . 1 . . . . . 73 Ala HB . 17476 1
409 . 1 . 1 38 38 ALA HB2 H 1 1.363 0.001 . 1 . . . . . 73 Ala HB . 17476 1
410 . 1 . 1 38 38 ALA HB3 H 1 1.363 0.001 . 1 . . . . . 73 Ala HB . 17476 1
411 . 1 . 1 38 38 ALA C C 13 175.350 0.010 . 1 . . . . . 73 Ala CO . 17476 1
412 . 1 . 1 38 38 ALA CA C 13 49.800 0.010 . 1 . . . . . 73 Ala CA . 17476 1
413 . 1 . 1 38 38 ALA CB C 13 21.100 0.010 . 1 . . . . . 73 Ala CB . 17476 1
414 . 1 . 1 38 38 ALA N N 15 126.190 0.010 . 1 . . . . . 73 Ala N . 17476 1
415 . 1 . 1 39 39 CYS H H 1 8.323 0.001 . 1 . . . . . 74 Cys HN . 17476 1
416 . 1 . 1 39 39 CYS HA H 1 4.504 0.001 . 1 . . . . . 74 Cys HA . 17476 1
417 . 1 . 1 39 39 CYS HB2 H 1 3.196 0.001 . 1 . . . . . 74 Cys HB2 . 17476 1
418 . 1 . 1 39 39 CYS HB3 H 1 3.032 0.001 . 1 . . . . . 74 Cys HB3 . 17476 1
419 . 1 . 1 39 39 CYS C C 13 176.910 0.010 . 1 . . . . . 74 Cys CO . 17476 1
420 . 1 . 1 39 39 CYS CA C 13 61.420 0.010 . 1 . . . . . 74 Cys CA . 17476 1
421 . 1 . 1 39 39 CYS CB C 13 31.320 0.010 . 1 . . . . . 74 Cys CB . 17476 1
422 . 1 . 1 39 39 CYS N N 15 126.160 0.010 . 1 . . . . . 74 Cys N . 17476 1
423 . 1 . 1 40 40 LEU H H 1 8.825 0.001 . 1 . . . . . 75 Leu HN . 17476 1
424 . 1 . 1 40 40 LEU HA H 1 4.531 0.001 . 1 . . . . . 75 Leu HA . 17476 1
425 . 1 . 1 40 40 LEU HB2 H 1 1.515 0.001 . 1 . . . . . 75 Leu HB2 . 17476 1
426 . 1 . 1 40 40 LEU HB3 H 1 1.790 0.001 . 1 . . . . . 75 Leu HB3 . 17476 1
427 . 1 . 1 40 40 LEU HG H 1 1.794 0.001 . 1 . . . . . 75 Leu HG . 17476 1
428 . 1 . 1 40 40 LEU HD11 H 1 0.814 0.001 . 2 . . . . . 75 Leu HD1 . 17476 1
429 . 1 . 1 40 40 LEU HD12 H 1 0.814 0.001 . 2 . . . . . 75 Leu HD1 . 17476 1
430 . 1 . 1 40 40 LEU HD13 H 1 0.814 0.001 . 2 . . . . . 75 Leu HD1 . 17476 1
431 . 1 . 1 40 40 LEU HD21 H 1 0.821 0.001 . 2 . . . . . 75 Leu HD2 . 17476 1
432 . 1 . 1 40 40 LEU HD22 H 1 0.821 0.001 . 2 . . . . . 75 Leu HD2 . 17476 1
433 . 1 . 1 40 40 LEU HD23 H 1 0.821 0.001 . 2 . . . . . 75 Leu HD2 . 17476 1
434 . 1 . 1 40 40 LEU C C 13 176.410 0.010 . 1 . . . . . 75 Leu CO . 17476 1
435 . 1 . 1 40 40 LEU CA C 13 54.370 0.010 . 1 . . . . . 75 Leu CA . 17476 1
436 . 1 . 1 40 40 LEU CB C 13 43.460 0.010 . 1 . . . . . 75 Leu CB . 17476 1
437 . 1 . 1 40 40 LEU CD2 C 13 22.450 0.010 . 1 . . . . . 75 Leu CD2 . 17476 1
438 . 1 . 1 40 40 LEU N N 15 127.390 0.010 . 1 . . . . . 75 Leu N . 17476 1
439 . 1 . 1 41 41 GLU H H 1 8.869 0.001 . 1 . . . . . 76 Glu HN . 17476 1
440 . 1 . 1 41 41 GLU HA H 1 3.714 0.001 . 1 . . . . . 76 Glu HA . 17476 1
441 . 1 . 1 41 41 GLU HB2 H 1 1.159 0.001 . 2 . . . . . 76 Glu HB2 . 17476 1
442 . 1 . 1 41 41 GLU HB3 H 1 1.528 0.001 . 2 . . . . . 76 Glu HB3 . 17476 1
443 . 1 . 1 41 41 GLU HG2 H 1 2.034 0.001 . 2 . . . . . 76 Glu HG2 . 17476 1
444 . 1 . 1 41 41 GLU HG3 H 1 0.698 0.001 . 2 . . . . . 76 Glu HG3 . 17476 1
445 . 1 . 1 41 41 GLU C C 13 177.200 0.010 . 1 . . . . . 76 Glu CO . 17476 1
446 . 1 . 1 41 41 GLU CA C 13 57.820 0.010 . 1 . . . . . 76 Glu CA . 17476 1
447 . 1 . 1 41 41 GLU CB C 13 29.080 0.010 . 1 . . . . . 76 Glu CB . 17476 1
448 . 1 . 1 41 41 GLU N N 15 125.330 0.010 . 1 . . . . . 76 Glu N . 17476 1
449 . 1 . 1 42 42 ASN H H 1 8.480 0.001 . 1 . . . . . 77 Asn HN . 17476 1
450 . 1 . 1 42 42 ASN HA H 1 4.363 0.001 . 1 . . . . . 77 Asn HA . 17476 1
451 . 1 . 1 42 42 ASN HB2 H 1 2.691 0.001 . 1 . . . . . 77 Asn HB2 . 17476 1
452 . 1 . 1 42 42 ASN HB3 H 1 2.608 0.001 . 1 . . . . . 77 Asn HB3 . 17476 1
453 . 1 . 1 42 42 ASN HD21 H 1 6.923 0.001 . 1 . . . . . 77 Asn HD21 . 17476 1
454 . 1 . 1 42 42 ASN HD22 H 1 7.679 0.001 . 1 . . . . . 77 Asn HD22 . 17476 1
455 . 1 . 1 42 42 ASN C C 13 175.880 0.010 . 1 . . . . . 77 Asn CO . 17476 1
456 . 1 . 1 42 42 ASN CA C 13 55.800 0.010 . 1 . . . . . 77 Asn CA . 17476 1
457 . 1 . 1 42 42 ASN CB C 13 38.420 0.010 . 1 . . . . . 77 Asn CB . 17476 1
458 . 1 . 1 42 42 ASN N N 15 126.570 0.010 . 1 . . . . . 77 Asn N . 17476 1
459 . 1 . 1 43 43 ARG H H 1 8.814 0.001 . 1 . . . . . 78 Arg HN . 17476 1
460 . 1 . 1 43 43 ARG HA H 1 3.786 0.001 . 1 . . . . . 78 Arg HA . 17476 1
461 . 1 . 1 43 43 ARG HB2 H 1 1.523 0.001 . 2 . . . . . 78 Arg HB2 . 17476 1
462 . 1 . 1 43 43 ARG HB3 H 1 2.038 0.001 . 2 . . . . . 78 Arg HB3 . 17476 1
463 . 1 . 1 43 43 ARG HG2 H 1 1.528 0.001 . 2 . . . . . 78 Arg HG2 . 17476 1
464 . 1 . 1 43 43 ARG HG3 H 1 2.140 0.001 . 2 . . . . . 78 Arg HG3 . 17476 1
465 . 1 . 1 43 43 ARG HD2 H 1 3.146 0.001 . 2 . . . . . 78 Arg HD2 . 17476 1
466 . 1 . 1 43 43 ARG HD3 H 1 3.193 0.001 . 2 . . . . . 78 Arg HD3 . 17476 1
467 . 1 . 1 43 43 ARG HE H 1 6.922 0.001 . 1 . . . . . 78 Arg HE . 17476 1
468 . 1 . 1 43 43 ARG C C 13 174.550 0.010 . 1 . . . . . 78 Arg CO . 17476 1
469 . 1 . 1 43 43 ARG CA C 13 58.400 0.010 . 1 . . . . . 78 Arg CA . 17476 1
470 . 1 . 1 43 43 ARG CB C 13 27.680 0.010 . 1 . . . . . 78 Arg CB . 17476 1
471 . 1 . 1 43 43 ARG N N 15 117.890 0.010 . 1 . . . . . 78 Arg N . 17476 1
472 . 1 . 1 44 44 CYS H H 1 8.304 0.001 . 1 . . . . . 79 Cys HN . 17476 1
473 . 1 . 1 44 44 CYS HA H 1 4.581 0.001 . 1 . . . . . 79 Cys HA . 17476 1
474 . 1 . 1 44 44 CYS HB2 H 1 3.146 0.001 . 1 . . . . . 79 Cys HB2 . 17476 1
475 . 1 . 1 44 44 CYS HB3 H 1 2.490 0.001 . 1 . . . . . 79 Cys HB3 . 17476 1
476 . 1 . 1 44 44 CYS C C 13 175.090 0.010 . 1 . . . . . 79 Cys CO . 17476 1
477 . 1 . 1 44 44 CYS CA C 13 59.960 0.010 . 1 . . . . . 79 Cys CA . 17476 1
478 . 1 . 1 44 44 CYS CB C 13 31.870 0.010 . 1 . . . . . 79 Cys CB . 17476 1
479 . 1 . 1 44 44 CYS N N 15 124.410 0.010 . 1 . . . . . 79 Cys N . 17476 1
480 . 1 . 1 45 45 SER H H 1 8.678 0.001 . 1 . . . . . 80 Ser HN . 17476 1
481 . 1 . 1 45 45 SER HA H 1 4.811 0.001 . 1 . . . . . 80 Ser HA . 17476 1
482 . 1 . 1 45 45 SER HB2 H 1 3.879 0.001 . 2 . . . . . 80 Ser HB2 . 17476 1
483 . 1 . 1 45 45 SER HB3 H 1 3.996 0.001 . 2 . . . . . 80 Ser HB3 . 17476 1
484 . 1 . 1 45 45 SER C C 13 174.530 0.010 . 1 . . . . . 80 Ser CO . 17476 1
485 . 1 . 1 45 45 SER CA C 13 57.490 0.010 . 1 . . . . . 80 Ser CA . 17476 1
486 . 1 . 1 45 45 SER CB C 13 64.150 0.010 . 1 . . . . . 80 Ser CB . 17476 1
487 . 1 . 1 45 45 SER N N 15 120.600 0.010 . 1 . . . . . 80 Ser N . 17476 1
488 . 1 . 1 46 46 TYR H H 1 9.018 0.001 . 1 . . . . . 81 Tyr HN . 17476 1
489 . 1 . 1 46 46 TYR HA H 1 3.956 0.001 . 1 . . . . . 81 Tyr HA . 17476 1
490 . 1 . 1 46 46 TYR HB2 H 1 2.647 0.001 . 2 . . . . . 81 Tyr HB2 . 17476 1
491 . 1 . 1 46 46 TYR HB3 H 1 2.162 0.001 . 2 . . . . . 81 Tyr HB3 . 17476 1
492 . 1 . 1 46 46 TYR C C 13 175.290 0.010 . 1 . . . . . 81 Tyr CO . 17476 1
493 . 1 . 1 46 46 TYR CA C 13 62.330 0.010 . 1 . . . . . 81 Tyr CA . 17476 1
494 . 1 . 1 46 46 TYR CB C 13 40.100 0.010 . 1 . . . . . 81 Tyr CB . 17476 1
495 . 1 . 1 46 46 TYR N N 15 126.120 0.010 . 1 . . . . . 81 Tyr N . 17476 1
496 . 1 . 1 47 47 VAL H H 1 5.796 0.001 . 1 . . . . . 82 Val HN . 17476 1
497 . 1 . 1 47 47 VAL HA H 1 4.654 0.001 . 1 . . . . . 82 Val HA . 17476 1
498 . 1 . 1 47 47 VAL HB H 1 1.731 0.001 . 1 . . . . . 82 Val HB . 17476 1
499 . 1 . 1 47 47 VAL HG11 H 1 0.573 0.001 . 2 . . . . . 82 Val HG1 . 17476 1
500 . 1 . 1 47 47 VAL HG12 H 1 0.573 0.001 . 2 . . . . . 82 Val HG1 . 17476 1
501 . 1 . 1 47 47 VAL HG13 H 1 0.573 0.001 . 2 . . . . . 82 Val HG1 . 17476 1
502 . 1 . 1 47 47 VAL HG21 H 1 0.869 0.001 . 2 . . . . . 82 Val HG2 . 17476 1
503 . 1 . 1 47 47 VAL HG22 H 1 0.869 0.001 . 2 . . . . . 82 Val HG2 . 17476 1
504 . 1 . 1 47 47 VAL HG23 H 1 0.869 0.001 . 2 . . . . . 82 Val HG2 . 17476 1
505 . 1 . 1 47 47 VAL C C 13 173.130 0.010 . 1 . . . . . 82 Val CO . 17476 1
506 . 1 . 1 47 47 VAL CA C 13 61.240 0.010 . 1 . . . . . 82 Val CA . 17476 1
507 . 1 . 1 47 47 VAL CB C 13 35.260 0.010 . 1 . . . . . 82 Val CB . 17476 1
508 . 1 . 1 47 47 VAL CG1 C 13 21.790 0.010 . 1 . . . . . 82 Val CG1 . 17476 1
509 . 1 . 1 47 47 VAL CG2 C 13 21.110 0.010 . 1 . . . . . 82 Val CG2 . 17476 1
510 . 1 . 1 47 47 VAL N N 15 130.330 0.010 . 1 . . . . . 82 Val N . 17476 1
511 . 1 . 1 48 48 GLY H H 1 9.080 0.001 . 1 . . . . . 83 Gly HN . 17476 1
512 . 1 . 1 48 48 GLY HA2 H 1 6.071 0.001 . 2 . . . . . 83 Gly HA2 . 17476 1
513 . 1 . 1 48 48 GLY HA3 H 1 3.781 0.001 . 2 . . . . . 83 Gly HA3 . 17476 1
514 . 1 . 1 48 48 GLY C C 13 172.610 0.010 . 1 . . . . . 83 Gly CO . 17476 1
515 . 1 . 1 48 48 GLY CA C 13 44.760 0.010 . 1 . . . . . 83 Gly CA . 17476 1
516 . 1 . 1 48 48 GLY N N 15 112.010 0.010 . 1 . . . . . 83 Gly N . 17476 1
517 . 1 . 1 49 49 CYS H H 1 9.178 0.001 . 1 . . . . . 84 Cys HN . 17476 1
518 . 1 . 1 49 49 CYS HA H 1 5.031 0.001 . 1 . . . . . 84 Cys HA . 17476 1
519 . 1 . 1 49 49 CYS HB2 H 1 2.896 0.001 . 1 . . . . . 84 Cys HB2 . 17476 1
520 . 1 . 1 49 49 CYS HB3 H 1 3.241 0.001 . 1 . . . . . 84 Cys HB3 . 17476 1
521 . 1 . 1 49 49 CYS C C 13 174.860 0.010 . 1 . . . . . 84 Cys CO . 17476 1
522 . 1 . 1 49 49 CYS CA C 13 57.650 0.010 . 1 . . . . . 84 Cys CA . 17476 1
523 . 1 . 1 49 49 CYS CB C 13 31.750 0.010 . 1 . . . . . 84 Cys CB . 17476 1
524 . 1 . 1 49 49 CYS N N 15 117.990 0.010 . 1 . . . . . 84 Cys N . 17476 1
525 . 1 . 1 50 50 GLY H H 1 8.761 0.001 . 1 . . . . . 85 Gly HN . 17476 1
526 . 1 . 1 50 50 GLY HA2 H 1 3.956 0.001 . 2 . . . . . 85 Gly HA2 . 17476 1
527 . 1 . 1 50 50 GLY HA3 H 1 4.903 0.001 . 2 . . . . . 85 Gly HA3 . 17476 1
528 . 1 . 1 50 50 GLY C C 13 176.600 0.010 . 1 . . . . . 85 Gly CO . 17476 1
529 . 1 . 1 50 50 GLY CA C 13 44.400 0.010 . 1 . . . . . 85 Gly CA . 17476 1
530 . 1 . 1 50 50 GLY N N 15 106.200 0.010 . 1 . . . . . 85 Gly N . 17476 1
531 . 1 . 1 51 51 GLU H H 1 8.684 0.001 . 1 . . . . . 86 Glu HN . 17476 1
532 . 1 . 1 51 51 GLU HA H 1 3.781 0.001 . 1 . . . . . 86 Glu HA . 17476 1
533 . 1 . 1 51 51 GLU HB2 H 1 1.913 0.001 . 2 . . . . . 86 Glu HB2 . 17476 1
534 . 1 . 1 51 51 GLU HB3 H 1 2.004 0.001 . 2 . . . . . 86 Glu HB3 . 17476 1
535 . 1 . 1 51 51 GLU HG2 H 1 2.172 0.001 . 2 . . . . . 86 Glu HG . 17476 1
536 . 1 . 1 51 51 GLU HG3 H 1 2.172 0.001 . 2 . . . . . 86 Glu HG . 17476 1
537 . 1 . 1 51 51 GLU C C 13 176.480 0.010 . 1 . . . . . 86 Glu CO . 17476 1
538 . 1 . 1 51 51 GLU CA C 13 58.800 0.010 . 1 . . . . . 86 Glu CA . 17476 1
539 . 1 . 1 51 51 GLU CB C 13 29.450 0.010 . 1 . . . . . 86 Glu CB . 17476 1
540 . 1 . 1 51 51 GLU N N 15 120.670 0.010 . 1 . . . . . 86 Glu N . 17476 1
541 . 1 . 1 52 52 SER H H 1 8.384 0.001 . 1 . . . . . 87 Ser HN . 17476 1
542 . 1 . 1 52 52 SER HA H 1 4.398 0.001 . 1 . . . . . 87 Ser HA . 17476 1
543 . 1 . 1 52 52 SER HB2 H 1 3.925 0.001 . 2 . . . . . 87 Ser HB2 . 17476 1
544 . 1 . 1 52 52 SER HB3 H 1 4.054 0.001 . 2 . . . . . 87 Ser HB3 . 17476 1
545 . 1 . 1 52 52 SER C C 13 174.380 0.010 . 1 . . . . . 87 Ser CO . 17476 1
546 . 1 . 1 52 52 SER CA C 13 59.810 0.010 . 1 . . . . . 87 Ser CA . 17476 1
547 . 1 . 1 52 52 SER CB C 13 63.000 0.010 . 1 . . . . . 87 Ser CB . 17476 1
548 . 1 . 1 52 52 SER N N 15 113.910 0.010 . 1 . . . . . 87 Ser N . 17476 1
549 . 1 . 1 53 53 GLN H H 1 7.824 0.001 . 1 . . . . . 88 Gln HN . 17476 1
550 . 1 . 1 53 53 GLN HA H 1 4.692 0.001 . 1 . . . . . 88 Gln HA . 17476 1
551 . 1 . 1 53 53 GLN HB2 H 1 2.430 0.001 . 1 . . . . . 88 Gln HB2 . 17476 1
552 . 1 . 1 53 53 GLN HB3 H 1 2.167 0.001 . 1 . . . . . 88 Gln HB3 . 17476 1
553 . 1 . 1 53 53 GLN HG2 H 1 2.491 0.001 . 2 . . . . . 88 Gln HG . 17476 1
554 . 1 . 1 53 53 GLN HG3 H 1 2.491 0.001 . 2 . . . . . 88 Gln HG . 17476 1
555 . 1 . 1 53 53 GLN HE21 H 1 6.848 0.001 . 1 . . . . . 88 Gln HE21 . 17476 1
556 . 1 . 1 53 53 GLN HE22 H 1 7.525 0.001 . 1 . . . . . 88 Gln HE22 . 17476 1
557 . 1 . 1 53 53 GLN C C 13 174.610 0.010 . 1 . . . . . 88 Gln CO . 17476 1
558 . 1 . 1 53 53 GLN CA C 13 54.810 0.010 . 1 . . . . . 88 Gln CA . 17476 1
559 . 1 . 1 53 53 GLN CB C 13 27.570 0.010 . 1 . . . . . 88 Gln CB . 17476 1
560 . 1 . 1 53 53 GLN N N 15 123.100 0.010 . 1 . . . . . 88 Gln N . 17476 1
561 . 1 . 1 54 54 VAL H H 1 7.974 0.001 . 1 . . . . . 89 Val HN . 17476 1
562 . 1 . 1 54 54 VAL HA H 1 4.111 0.001 . 1 . . . . . 89 Val HA . 17476 1
563 . 1 . 1 54 54 VAL HB H 1 1.483 0.001 . 1 . . . . . 89 Val HB . 17476 1
564 . 1 . 1 54 54 VAL HG11 H 1 0.660 0.001 . 2 . . . . . 89 Val HG1 . 17476 1
565 . 1 . 1 54 54 VAL HG12 H 1 0.660 0.001 . 2 . . . . . 89 Val HG1 . 17476 1
566 . 1 . 1 54 54 VAL HG13 H 1 0.660 0.001 . 2 . . . . . 89 Val HG1 . 17476 1
567 . 1 . 1 54 54 VAL HG21 H 1 0.663 0.001 . 2 . . . . . 89 Val HG2 . 17476 1
568 . 1 . 1 54 54 VAL HG22 H 1 0.663 0.001 . 2 . . . . . 89 Val HG2 . 17476 1
569 . 1 . 1 54 54 VAL HG23 H 1 0.663 0.001 . 2 . . . . . 89 Val HG2 . 17476 1
570 . 1 . 1 54 54 VAL C C 13 174.160 0.010 . 1 . . . . . 89 Val CO . 17476 1
571 . 1 . 1 54 54 VAL CA C 13 61.410 0.010 . 1 . . . . . 89 Val CA . 17476 1
572 . 1 . 1 54 54 VAL CB C 13 32.290 0.010 . 1 . . . . . 89 Val CB . 17476 1
573 . 1 . 1 54 54 VAL CG1 C 13 21.360 0.010 . 1 . . . . . 89 Val CG1 . 17476 1
574 . 1 . 1 54 54 VAL CG2 C 13 21.050 0.010 . 1 . . . . . 89 Val CG2 . 17476 1
575 . 1 . 1 54 54 VAL N N 15 120.330 0.010 . 1 . . . . . 89 Val N . 17476 1
576 . 1 . 1 55 55 ASP H H 1 7.933 0.001 . 1 . . . . . 90 Asp HN . 17476 1
577 . 1 . 1 55 55 ASP HA H 1 4.183 0.001 . 1 . . . . . 90 Asp HA . 17476 1
578 . 1 . 1 55 55 ASP HB2 H 1 1.874 0.001 . 2 . . . . . 90 Asp HB2 . 17476 1
579 . 1 . 1 55 55 ASP HB3 H 1 3.256 0.001 . 2 . . . . . 90 Asp HB3 . 17476 1
580 . 1 . 1 55 55 ASP C C 13 176.500 0.010 . 1 . . . . . 90 Asp CO . 17476 1
581 . 1 . 1 55 55 ASP CA C 13 53.540 0.010 . 1 . . . . . 90 Asp CA . 17476 1
582 . 1 . 1 55 55 ASP CB C 13 38.950 0.010 . 1 . . . . . 90 Asp CB . 17476 1
583 . 1 . 1 55 55 ASP N N 15 121.130 0.010 . 1 . . . . . 90 Asp N . 17476 1
584 . 1 . 1 56 56 HIS H H 1 8.604 0.001 . 1 . . . . . 91 His HN . 17476 1
585 . 1 . 1 56 56 HIS HA H 1 4.277 0.001 . 1 . . . . . 91 His HA . 17476 1
586 . 1 . 1 56 56 HIS HB2 H 1 4.082 0.001 . 1 . . . . . 91 His HB2 . 17476 1
587 . 1 . 1 56 56 HIS HB3 H 1 3.686 0.001 . 1 . . . . . 91 His HB3 . 17476 1
588 . 1 . 1 56 56 HIS HD2 H 1 7.115 0.001 . 1 . . . . . 91 His HD2 . 17476 1
589 . 1 . 1 56 56 HIS HE1 H 1 7.775 0.001 . 1 . . . . . 91 His HE1 . 17476 1
590 . 1 . 1 56 56 HIS C C 13 178.390 0.010 . 1 . . . . . 91 His CO . 17476 1
591 . 1 . 1 56 56 HIS CA C 13 63.210 0.010 . 1 . . . . . 91 His CA . 17476 1
592 . 1 . 1 56 56 HIS CB C 13 29.300 0.010 . 1 . . . . . 91 His CB . 17476 1
593 . 1 . 1 56 56 HIS N N 15 119.620 0.010 . 1 . . . . . 91 His N . 17476 1
594 . 1 . 1 57 57 SER H H 1 9.472 0.001 . 1 . . . . . 92 Ser HN . 17476 1
595 . 1 . 1 57 57 SER HA H 1 4.344 0.001 . 1 . . . . . 92 Ser HA . 17476 1
596 . 1 . 1 57 57 SER HB2 H 1 3.807 0.001 . 2 . . . . . 92 Ser HB2 . 17476 1
597 . 1 . 1 57 57 SER HB3 H 1 4.719 0.001 . 2 . . . . . 92 Ser HB3 . 17476 1
598 . 1 . 1 57 57 SER C C 13 177.330 0.010 . 1 . . . . . 92 Ser CO . 17476 1
599 . 1 . 1 57 57 SER CA C 13 62.750 0.010 . 1 . . . . . 92 Ser CA . 17476 1
600 . 1 . 1 57 57 SER CB C 13 63.410 0.010 . 1 . . . . . 92 Ser CB . 17476 1
601 . 1 . 1 57 57 SER N N 15 114.450 0.010 . 1 . . . . . 92 Ser N . 17476 1
602 . 1 . 1 58 58 THR H H 1 7.382 0.001 . 1 . . . . . 93 Thr HN . 17476 1
603 . 1 . 1 58 58 THR HA H 1 3.835 0.001 . 1 . . . . . 93 Thr HA . 17476 1
604 . 1 . 1 58 58 THR HB H 1 3.351 0.001 . 1 . . . . . 93 Thr HB . 17476 1
605 . 1 . 1 58 58 THR HG21 H 1 0.968 0.001 . 1 . . . . . 93 Thr HG2 . 17476 1
606 . 1 . 1 58 58 THR HG22 H 1 0.968 0.001 . 1 . . . . . 93 Thr HG2 . 17476 1
607 . 1 . 1 58 58 THR HG23 H 1 0.968 0.001 . 1 . . . . . 93 Thr HG2 . 17476 1
608 . 1 . 1 58 58 THR C C 13 176.340 0.010 . 1 . . . . . 93 Thr CO . 17476 1
609 . 1 . 1 58 58 THR CA C 13 66.540 0.010 . 1 . . . . . 93 Thr CA . 17476 1
610 . 1 . 1 58 58 THR CB C 13 67.460 0.010 . 1 . . . . . 93 Thr CB . 17476 1
611 . 1 . 1 58 58 THR CG2 C 13 21.230 0.010 . 1 . . . . . 93 Thr CG2 . 17476 1
612 . 1 . 1 58 58 THR N N 15 121.860 0.010 . 1 . . . . . 93 Thr N . 17476 1
613 . 1 . 1 59 59 ILE H H 1 7.383 0.001 . 1 . . . . . 94 Ile HN . 17476 1
614 . 1 . 1 59 59 ILE HA H 1 3.508 0.001 . 1 . . . . . 94 Ile HA . 17476 1
615 . 1 . 1 59 59 ILE HB H 1 1.850 0.001 . 1 . . . . . 94 Ile HB . 17476 1
616 . 1 . 1 59 59 ILE HG12 H 1 1.061 0.001 . 2 . . . . . 94 Ile HG12 . 17476 1
617 . 1 . 1 59 59 ILE HG13 H 1 1.614 0.001 . 2 . . . . . 94 Ile HG13 . 17476 1
618 . 1 . 1 59 59 ILE HG21 H 1 0.888 0.001 . 1 . . . . . 94 Ile HG2 . 17476 1
619 . 1 . 1 59 59 ILE HG22 H 1 0.888 0.001 . 1 . . . . . 94 Ile HG2 . 17476 1
620 . 1 . 1 59 59 ILE HG23 H 1 0.888 0.001 . 1 . . . . . 94 Ile HG2 . 17476 1
621 . 1 . 1 59 59 ILE HD11 H 1 0.754 0.001 . 1 . . . . . 94 Ile HD1 . 17476 1
622 . 1 . 1 59 59 ILE HD12 H 1 0.754 0.001 . 1 . . . . . 94 Ile HD1 . 17476 1
623 . 1 . 1 59 59 ILE HD13 H 1 0.754 0.001 . 1 . . . . . 94 Ile HD1 . 17476 1
624 . 1 . 1 59 59 ILE C C 13 177.780 0.010 . 1 . . . . . 94 Ile CO . 17476 1
625 . 1 . 1 59 59 ILE CA C 13 65.040 0.010 . 1 . . . . . 94 Ile CA . 17476 1
626 . 1 . 1 59 59 ILE CB C 13 37.640 0.010 . 1 . . . . . 94 Ile CB . 17476 1
627 . 1 . 1 59 59 ILE CD1 C 13 12.870 0.010 . 1 . . . . . 94 Ile CD1 . 17476 1
628 . 1 . 1 59 59 ILE N N 15 122.680 0.010 . 1 . . . . . 94 Ile N . 17476 1
629 . 1 . 1 60 60 HIS H H 1 8.397 0.001 . 1 . . . . . 95 His HN . 17476 1
630 . 1 . 1 60 60 HIS HA H 1 3.950 0.001 . 1 . . . . . 95 His HA . 17476 1
631 . 1 . 1 60 60 HIS HB2 H 1 3.024 0.001 . 1 . . . . . 95 His HB2 . 17476 1
632 . 1 . 1 60 60 HIS HB3 H 1 2.292 0.001 . 1 . . . . . 95 His HB3 . 17476 1
633 . 1 . 1 60 60 HIS HD1 H 1 11.859 0.001 . 1 . . . . . 95 His HD1 . 17476 1
634 . 1 . 1 60 60 HIS HD2 H 1 7.304 0.001 . 1 . . . . . 95 His HD2 . 17476 1
635 . 1 . 1 60 60 HIS HE1 H 1 7.621 0.001 . 1 . . . . . 95 His HE1 . 17476 1
636 . 1 . 1 60 60 HIS C C 13 179.040 0.010 . 1 . . . . . 95 His CO . 17476 1
637 . 1 . 1 60 60 HIS CA C 13 59.870 0.010 . 1 . . . . . 95 His CA . 17476 1
638 . 1 . 1 60 60 HIS CB C 13 28.190 0.010 . 1 . . . . . 95 His CB . 17476 1
639 . 1 . 1 60 60 HIS N N 15 117.880 0.010 . 1 . . . . . 95 His N . 17476 1
640 . 1 . 1 61 61 SER H H 1 7.453 0.001 . 1 . . . . . 96 Ser HN . 17476 1
641 . 1 . 1 61 61 SER HA H 1 3.856 0.001 . 1 . . . . . 96 Ser HA . 17476 1
642 . 1 . 1 61 61 SER HB2 H 1 3.204 0.001 . 2 . . . . . 96 Ser HB2 . 17476 1
643 . 1 . 1 61 61 SER HB3 H 1 3.558 0.001 . 2 . . . . . 96 Ser HB3 . 17476 1
644 . 1 . 1 61 61 SER HG H 1 4.392 0.001 . 1 . . . . . 96 Ser HG . 17476 1
645 . 1 . 1 61 61 SER C C 13 176.810 0.010 . 1 . . . . . 96 Ser CO . 17476 1
646 . 1 . 1 61 61 SER CA C 13 61.500 0.010 . 1 . . . . . 96 Ser CA . 17476 1
647 . 1 . 1 61 61 SER CB C 13 63.620 0.010 . 1 . . . . . 96 Ser CB . 17476 1
648 . 1 . 1 61 61 SER N N 15 114.760 0.010 . 1 . . . . . 96 Ser N . 17476 1
649 . 1 . 1 62 62 GLN H H 1 7.980 0.001 . 1 . . . . . 97 Gln HN . 17476 1
650 . 1 . 1 62 62 GLN HA H 1 3.840 0.001 . 1 . . . . . 97 Gln HA . 17476 1
651 . 1 . 1 62 62 GLN HB2 H 1 1.937 0.001 . 2 . . . . . 97 Gln HB2 . 17476 1
652 . 1 . 1 62 62 GLN HB3 H 1 2.111 0.001 . 2 . . . . . 97 Gln HB3 . 17476 1
653 . 1 . 1 62 62 GLN HG2 H 1 2.382 0.001 . 2 . . . . . 97 Gln HG2 . 17476 1
654 . 1 . 1 62 62 GLN HG3 H 1 2.259 0.001 . 2 . . . . . 97 Gln HG3 . 17476 1
655 . 1 . 1 62 62 GLN HE21 H 1 6.668 0.001 . 1 . . . . . 97 Gln HE21 . 17476 1
656 . 1 . 1 62 62 GLN HE22 H 1 7.309 0.001 . 1 . . . . . 97 Gln HE22 . 17476 1
657 . 1 . 1 62 62 GLN C C 13 178.600 0.010 . 1 . . . . . 97 Gln CO . 17476 1
658 . 1 . 1 62 62 GLN CA C 13 58.420 0.010 . 1 . . . . . 97 Gln CA . 17476 1
659 . 1 . 1 62 62 GLN CB C 13 28.250 0.010 . 1 . . . . . 97 Gln CB . 17476 1
660 . 1 . 1 62 62 GLN N N 15 118.360 0.010 . 1 . . . . . 97 Gln N . 17476 1
661 . 1 . 1 63 63 GLU H H 1 8.048 0.001 . 1 . . . . . 98 Glu HN . 17476 1
662 . 1 . 1 63 63 GLU HA H 1 3.950 0.001 . 1 . . . . . 98 Glu HA . 17476 1
663 . 1 . 1 63 63 GLU HB2 H 1 1.832 0.001 . 2 . . . . . 98 Glu HB2 . 17476 1
664 . 1 . 1 63 63 GLU HB3 H 1 1.895 0.001 . 2 . . . . . 98 Glu HB3 . 17476 1
665 . 1 . 1 63 63 GLU HG2 H 1 2.323 0.001 . 2 . . . . . 98 Glu HG2 . 17476 1
666 . 1 . 1 63 63 GLU HG3 H 1 2.096 0.001 . 2 . . . . . 98 Glu HG3 . 17476 1
667 . 1 . 1 63 63 GLU C C 13 178.350 0.010 . 1 . . . . . 98 Glu CO . 17476 1
668 . 1 . 1 63 63 GLU CA C 13 58.470 0.010 . 1 . . . . . 98 Glu CA . 17476 1
669 . 1 . 1 63 63 GLU CB C 13 30.330 0.010 . 1 . . . . . 98 Glu CB . 17476 1
670 . 1 . 1 63 63 GLU N N 15 116.340 0.010 . 1 . . . . . 98 Glu N . 17476 1
671 . 1 . 1 64 64 THR H H 1 7.304 0.001 . 1 . . . . . 99 Thr HN . 17476 1
672 . 1 . 1 64 64 THR HA H 1 2.885 0.001 . 1 . . . . . 99 Thr HA . 17476 1
673 . 1 . 1 64 64 THR HB H 1 2.438 0.001 . 1 . . . . . 99 Thr HB . 17476 1
674 . 1 . 1 64 64 THR HG1 H 1 3.839 0.001 . 1 . . . . . 99 Thr HG1 . 17476 1
675 . 1 . 1 64 64 THR HG21 H 1 0.445 0.001 . 1 . . . . . 99 Thr HG2 . 17476 1
676 . 1 . 1 64 64 THR HG22 H 1 0.445 0.001 . 1 . . . . . 99 Thr HG2 . 17476 1
677 . 1 . 1 64 64 THR HG23 H 1 0.445 0.001 . 1 . . . . . 99 Thr HG2 . 17476 1
678 . 1 . 1 64 64 THR C C 13 175.460 0.010 . 1 . . . . . 99 Thr CO . 17476 1
679 . 1 . 1 64 64 THR CA C 13 62.190 0.010 . 1 . . . . . 99 Thr CA . 17476 1
680 . 1 . 1 64 64 THR CB C 13 71.020 0.010 . 1 . . . . . 99 Thr CB . 17476 1
681 . 1 . 1 64 64 THR CG2 C 13 20.330 0.010 . 1 . . . . . 99 Thr CG2 . 17476 1
682 . 1 . 1 64 64 THR N N 15 105.970 0.010 . 1 . . . . . 99 Thr N . 17476 1
683 . 1 . 1 65 65 LYS H H 1 7.878 0.001 . 1 . . . . . 100 Lys HN . 17476 1
684 . 1 . 1 65 65 LYS HA H 1 3.191 0.001 . 1 . . . . . 100 Lys HA . 17476 1
685 . 1 . 1 65 65 LYS HB2 H 1 1.887 0.001 . 2 . . . . . 100 Lys HB2 . 17476 1
686 . 1 . 1 65 65 LYS HB3 H 1 1.611 0.001 . 2 . . . . . 100 Lys HB3 . 17476 1
687 . 1 . 1 65 65 LYS HG2 H 1 1.230 0.001 . 2 . . . . . 100 Lys HG2 . 17476 1
688 . 1 . 1 65 65 LYS HG3 H 1 1.161 0.001 . 2 . . . . . 100 Lys HG3 . 17476 1
689 . 1 . 1 65 65 LYS HD2 H 1 1.574 0.001 . 2 . . . . . 100 Lys HD2 . 17476 1
690 . 1 . 1 65 65 LYS HD3 H 1 1.629 0.001 . 2 . . . . . 100 Lys HD3 . 17476 1
691 . 1 . 1 65 65 LYS HE2 H 1 2.961 0.001 . 2 . . . . . 100 Lys HE2 . 17476 1
692 . 1 . 1 65 65 LYS HE3 H 1 2.921 0.001 . 2 . . . . . 100 Lys HE3 . 17476 1
693 . 1 . 1 65 65 LYS C C 13 174.340 0.010 . 1 . . . . . 100 Lys CO . 17476 1
694 . 1 . 1 65 65 LYS CA C 13 57.630 0.010 . 1 . . . . . 100 Lys CA . 17476 1
695 . 1 . 1 65 65 LYS CB C 13 27.960 0.010 . 1 . . . . . 100 Lys CB . 17476 1
696 . 1 . 1 65 65 LYS N N 15 115.710 0.010 . 1 . . . . . 100 Lys N . 17476 1
697 . 1 . 1 66 66 HIS H H 1 7.173 0.001 . 1 . . . . . 101 His HN . 17476 1
698 . 1 . 1 66 66 HIS HA H 1 4.598 0.001 . 1 . . . . . 101 His HA . 17476 1
699 . 1 . 1 66 66 HIS HB2 H 1 3.169 0.001 . 1 . . . . . 101 His HB2 . 17476 1
700 . 1 . 1 66 66 HIS HB3 H 1 2.885 0.001 . 1 . . . . . 101 His HB3 . 17476 1
701 . 1 . 1 66 66 HIS HD2 H 1 6.359 0.001 . 1 . . . . . 101 His HD2 . 17476 1
702 . 1 . 1 66 66 HIS HE1 H 1 8.088 0.001 . 1 . . . . . 101 His HE1 . 17476 1
703 . 1 . 1 66 66 HIS C C 13 177.090 0.010 . 1 . . . . . 101 His CO . 17476 1
704 . 1 . 1 66 66 HIS CA C 13 52.640 0.010 . 1 . . . . . 101 His CA . 17476 1
705 . 1 . 1 66 66 HIS CB C 13 31.910 0.010 . 1 . . . . . 101 His CB . 17476 1
706 . 1 . 1 66 66 HIS N N 15 116.930 0.010 . 1 . . . . . 101 His N . 17476 1
707 . 1 . 1 67 67 TYR H H 1 9.096 0.001 . 1 . . . . . 102 Tyr HN . 17476 1
708 . 1 . 1 67 67 TYR HA H 1 4.730 0.001 . 1 . . . . . 102 Tyr HA . 17476 1
709 . 1 . 1 67 67 TYR HB2 H 1 3.482 0.001 . 1 . . . . . 102 Tyr HB2 . 17476 1
710 . 1 . 1 67 67 TYR HB3 H 1 2.638 0.001 . 1 . . . . . 102 Tyr HB3 . 17476 1
711 . 1 . 1 67 67 TYR HD1 H 1 6.786 0.001 . 3 . . . . . 102 Tyr HD . 17476 1
712 . 1 . 1 67 67 TYR HD2 H 1 6.786 0.001 . 3 . . . . . 102 Tyr HD . 17476 1
713 . 1 . 1 67 67 TYR HE1 H 1 6.679 0.001 . 3 . . . . . 102 Tyr HE . 17476 1
714 . 1 . 1 67 67 TYR HE2 H 1 6.679 0.001 . 3 . . . . . 102 Tyr HE . 17476 1
715 . 1 . 1 67 67 TYR C C 13 173.830 0.010 . 1 . . . . . 102 Tyr CO . 17476 1
716 . 1 . 1 67 67 TYR CA C 13 59.520 0.010 . 1 . . . . . 102 Tyr CA . 17476 1
717 . 1 . 1 67 67 TYR CB C 13 39.780 0.010 . 1 . . . . . 102 Tyr CB . 17476 1
718 . 1 . 1 67 67 TYR N N 15 127.590 0.010 . 1 . . . . . 102 Tyr N . 17476 1
719 . 1 . 1 68 68 LEU H H 1 9.370 0.001 . 1 . . . . . 103 Leu HN . 17476 1
720 . 1 . 1 68 68 LEU HA H 1 5.645 0.001 . 1 . . . . . 103 Leu HA . 17476 1
721 . 1 . 1 68 68 LEU HB2 H 1 1.273 0.001 . 1 . . . . . 103 Leu HB2 . 17476 1
722 . 1 . 1 68 68 LEU HB3 H 1 1.880 0.001 . 1 . . . . . 103 Leu HB3 . 17476 1
723 . 1 . 1 68 68 LEU HG H 1 1.658 0.001 . 1 . . . . . 103 Leu HG . 17476 1
724 . 1 . 1 68 68 LEU HD11 H 1 0.858 0.001 . 2 . . . . . 103 Leu HD1 . 17476 1
725 . 1 . 1 68 68 LEU HD12 H 1 0.858 0.001 . 2 . . . . . 103 Leu HD1 . 17476 1
726 . 1 . 1 68 68 LEU HD13 H 1 0.858 0.001 . 2 . . . . . 103 Leu HD1 . 17476 1
727 . 1 . 1 68 68 LEU HD21 H 1 0.894 0.001 . 2 . . . . . 103 Leu HD2 . 17476 1
728 . 1 . 1 68 68 LEU HD22 H 1 0.894 0.001 . 2 . . . . . 103 Leu HD2 . 17476 1
729 . 1 . 1 68 68 LEU HD23 H 1 0.894 0.001 . 2 . . . . . 103 Leu HD2 . 17476 1
730 . 1 . 1 68 68 LEU C C 13 176.130 0.010 . 1 . . . . . 103 Leu CO . 17476 1
731 . 1 . 1 68 68 LEU CA C 13 53.740 0.010 . 1 . . . . . 103 Leu CA . 17476 1
732 . 1 . 1 68 68 LEU CB C 13 44.210 0.010 . 1 . . . . . 103 Leu CB . 17476 1
733 . 1 . 1 68 68 LEU CD1 C 13 25.590 0.010 . 1 . . . . . 103 Leu CD1 . 17476 1
734 . 1 . 1 68 68 LEU CD2 C 13 25.000 0.010 . 1 . . . . . 103 Leu CD2 . 17476 1
735 . 1 . 1 68 68 LEU N N 15 121.580 0.010 . 1 . . . . . 103 Leu N . 17476 1
736 . 1 . 1 69 69 THR H H 1 8.737 0.001 . 1 . . . . . 104 Thr HN . 17476 1
737 . 1 . 1 69 69 THR HA H 1 5.432 0.001 . 1 . . . . . 104 Thr HA . 17476 1
738 . 1 . 1 69 69 THR HB H 1 4.403 0.001 . 1 . . . . . 104 Thr HB . 17476 1
739 . 1 . 1 69 69 THR HG1 H 1 4.663 0.001 . 1 . . . . . 104 Thr HG1 . 17476 1
740 . 1 . 1 69 69 THR HG21 H 1 1.314 0.001 . 1 . . . . . 104 Thr HG2 . 17476 1
741 . 1 . 1 69 69 THR HG22 H 1 1.314 0.001 . 1 . . . . . 104 Thr HG2 . 17476 1
742 . 1 . 1 69 69 THR HG23 H 1 1.314 0.001 . 1 . . . . . 104 Thr HG2 . 17476 1
743 . 1 . 1 69 69 THR C C 13 171.430 0.010 . 1 . . . . . 104 Thr CO . 17476 1
744 . 1 . 1 69 69 THR CA C 13 59.350 0.010 . 1 . . . . . 104 Thr CA . 17476 1
745 . 1 . 1 69 69 THR CB C 13 70.270 0.010 . 1 . . . . . 104 Thr CB . 17476 1
746 . 1 . 1 69 69 THR CG2 C 13 21.710 0.010 . 1 . . . . . 104 Thr CG2 . 17476 1
747 . 1 . 1 69 69 THR N N 15 117.300 0.010 . 1 . . . . . 104 Thr N . 17476 1
748 . 1 . 1 70 70 VAL H H 1 9.047 0.001 . 1 . . . . . 105 Val HN . 17476 1
749 . 1 . 1 70 70 VAL HA H 1 5.514 0.001 . 1 . . . . . 105 Val HA . 17476 1
750 . 1 . 1 70 70 VAL HB H 1 1.934 0.001 . 1 . . . . . 105 Val HB . 17476 1
751 . 1 . 1 70 70 VAL HG11 H 1 1.047 0.001 . 2 . . . . . 105 Val HG1 . 17476 1
752 . 1 . 1 70 70 VAL HG12 H 1 1.047 0.001 . 2 . . . . . 105 Val HG1 . 17476 1
753 . 1 . 1 70 70 VAL HG13 H 1 1.047 0.001 . 2 . . . . . 105 Val HG1 . 17476 1
754 . 1 . 1 70 70 VAL HG21 H 1 0.683 0.001 . 2 . . . . . 105 Val HG2 . 17476 1
755 . 1 . 1 70 70 VAL HG22 H 1 0.683 0.001 . 2 . . . . . 105 Val HG2 . 17476 1
756 . 1 . 1 70 70 VAL HG23 H 1 0.683 0.001 . 2 . . . . . 105 Val HG2 . 17476 1
757 . 1 . 1 70 70 VAL C C 13 172.240 0.010 . 1 . . . . . 105 Val CO . 17476 1
758 . 1 . 1 70 70 VAL CA C 13 57.480 0.010 . 1 . . . . . 105 Val CA . 17476 1
759 . 1 . 1 70 70 VAL CB C 13 35.970 0.010 . 1 . . . . . 105 Val CB . 17476 1
760 . 1 . 1 70 70 VAL CG1 C 13 20.090 0.010 . 1 . . . . . 105 Val CG1 . 17476 1
761 . 1 . 1 70 70 VAL CG2 C 13 21.250 0.010 . 1 . . . . . 105 Val CG2 . 17476 1
762 . 1 . 1 70 70 VAL N N 15 123.880 0.010 . 1 . . . . . 105 Val N . 17476 1
763 . 1 . 1 71 71 ASN H H 1 8.288 0.001 . 1 . . . . . 106 Asn HN . 17476 1
764 . 1 . 1 71 71 ASN HA H 1 3.534 0.001 . 1 . . . . . 106 Asn HA . 17476 1
765 . 1 . 1 71 71 ASN HB2 H 1 2.338 0.001 . 2 . . . . . 106 Asn HB2 . 17476 1
766 . 1 . 1 71 71 ASN HB3 H 1 0.267 0.001 . 2 . . . . . 106 Asn HB3 . 17476 1
767 . 1 . 1 71 71 ASN HD21 H 1 7.293 0.001 . 1 . . . . . 106 Asn HD21 . 17476 1
768 . 1 . 1 71 71 ASN HD22 H 1 7.438 0.001 . 1 . . . . . 106 Asn HD22 . 17476 1
769 . 1 . 1 71 71 ASN C C 13 176.940 0.010 . 1 . . . . . 106 Asn CO . 17476 1
770 . 1 . 1 71 71 ASN CA C 13 52.960 0.010 . 1 . . . . . 106 Asn CA . 17476 1
771 . 1 . 1 71 71 ASN CB C 13 37.400 0.010 . 1 . . . . . 106 Asn CB . 17476 1
772 . 1 . 1 71 71 ASN N N 15 129.690 0.010 . 1 . . . . . 106 Asn N . 17476 1
773 . 1 . 1 72 72 LEU H H 1 8.979 0.001 . 1 . . . . . 107 Leu HN . 17476 1
774 . 1 . 1 72 72 LEU HA H 1 3.853 0.001 . 1 . . . . . 107 Leu HA . 17476 1
775 . 1 . 1 72 72 LEU HB2 H 1 1.167 0.001 . 1 . . . . . 107 Leu HB2 . 17476 1
776 . 1 . 1 72 72 LEU HB3 H 1 1.873 0.001 . 1 . . . . . 107 Leu HB3 . 17476 1
777 . 1 . 1 72 72 LEU HG H 1 1.592 0.001 . 1 . . . . . 107 Leu HG . 17476 1
778 . 1 . 1 72 72 LEU HD11 H 1 0.565 0.001 . 2 . . . . . 107 Leu HD1 . 17476 1
779 . 1 . 1 72 72 LEU HD12 H 1 0.565 0.001 . 2 . . . . . 107 Leu HD1 . 17476 1
780 . 1 . 1 72 72 LEU HD13 H 1 0.565 0.001 . 2 . . . . . 107 Leu HD1 . 17476 1
781 . 1 . 1 72 72 LEU HD21 H 1 0.820 0.001 . 2 . . . . . 107 Leu HD2 . 17476 1
782 . 1 . 1 72 72 LEU HD22 H 1 0.820 0.001 . 2 . . . . . 107 Leu HD2 . 17476 1
783 . 1 . 1 72 72 LEU HD23 H 1 0.820 0.001 . 2 . . . . . 107 Leu HD2 . 17476 1
784 . 1 . 1 72 72 LEU C C 13 176.700 0.010 . 1 . . . . . 107 Leu CO . 17476 1
785 . 1 . 1 72 72 LEU CA C 13 56.570 0.010 . 1 . . . . . 107 Leu CA . 17476 1
786 . 1 . 1 72 72 LEU CB C 13 41.160 0.010 . 1 . . . . . 107 Leu CB . 17476 1
787 . 1 . 1 72 72 LEU CD1 C 13 25.430 0.010 . 1 . . . . . 107 Leu CD1 . 17476 1
788 . 1 . 1 72 72 LEU CD2 C 13 22.950 0.010 . 1 . . . . . 107 Leu CD2 . 17476 1
789 . 1 . 1 72 72 LEU N N 15 127.400 0.010 . 1 . . . . . 107 Leu N . 17476 1
790 . 1 . 1 73 73 THR H H 1 8.913 0.001 . 1 . . . . . 108 Thr HN . 17476 1
791 . 1 . 1 73 73 THR HA H 1 4.232 0.001 . 1 . . . . . 108 Thr HA . 17476 1
792 . 1 . 1 73 73 THR HB H 1 4.230 0.001 . 1 . . . . . 108 Thr HB . 17476 1
793 . 1 . 1 73 73 THR HG21 H 1 1.190 0.001 . 1 . . . . . 108 Thr HG2 . 17476 1
794 . 1 . 1 73 73 THR HG22 H 1 1.190 0.001 . 1 . . . . . 108 Thr HG2 . 17476 1
795 . 1 . 1 73 73 THR HG23 H 1 1.190 0.001 . 1 . . . . . 108 Thr HG2 . 17476 1
796 . 1 . 1 73 73 THR C C 13 175.410 0.010 . 1 . . . . . 108 Thr CO . 17476 1
797 . 1 . 1 73 73 THR CA C 13 65.280 0.010 . 1 . . . . . 108 Thr CA . 17476 1
798 . 1 . 1 73 73 THR CB C 13 69.730 0.010 . 1 . . . . . 108 Thr CB . 17476 1
799 . 1 . 1 73 73 THR CG2 C 13 21.070 0.010 . 1 . . . . . 108 Thr CG2 . 17476 1
800 . 1 . 1 73 73 THR N N 15 115.150 0.010 . 1 . . . . . 108 Thr N . 17476 1
801 . 1 . 1 74 74 THR H H 1 7.846 0.001 . 1 . . . . . 109 Thr HN . 17476 1
802 . 1 . 1 74 74 THR HA H 1 4.085 0.001 . 1 . . . . . 109 Thr HA . 17476 1
803 . 1 . 1 74 74 THR HB H 1 4.234 0.001 . 1 . . . . . 109 Thr HB . 17476 1
804 . 1 . 1 74 74 THR HG1 H 1 5.278 0.001 . 1 . . . . . 109 Thr HG1 . 17476 1
805 . 1 . 1 74 74 THR HG21 H 1 1.087 0.001 . 1 . . . . . 109 Thr HG2 . 17476 1
806 . 1 . 1 74 74 THR HG22 H 1 1.087 0.001 . 1 . . . . . 109 Thr HG2 . 17476 1
807 . 1 . 1 74 74 THR HG23 H 1 1.087 0.001 . 1 . . . . . 109 Thr HG2 . 17476 1
808 . 1 . 1 74 74 THR C C 13 177.820 0.010 . 1 . . . . . 109 Thr CO . 17476 1
809 . 1 . 1 74 74 THR CA C 13 62.160 0.010 . 1 . . . . . 109 Thr CA . 17476 1
810 . 1 . 1 74 74 THR CB C 13 70.230 0.010 . 1 . . . . . 109 Thr CB . 17476 1
811 . 1 . 1 74 74 THR CG2 C 13 20.860 0.010 . 1 . . . . . 109 Thr CG2 . 17476 1
812 . 1 . 1 74 74 THR N N 15 110.770 0.010 . 1 . . . . . 109 Thr N . 17476 1
813 . 1 . 1 75 75 LEU H H 1 8.392 0.001 . 1 . . . . . 110 Leu HN . 17476 1
814 . 1 . 1 75 75 LEU HA H 1 3.907 0.001 . 1 . . . . . 110 Leu HA . 17476 1
815 . 1 . 1 75 75 LEU HB2 H 1 1.606 0.001 . 1 . . . . . 110 Leu HB2 . 17476 1
816 . 1 . 1 75 75 LEU HB3 H 1 1.992 0.001 . 1 . . . . . 110 Leu HB3 . 17476 1
817 . 1 . 1 75 75 LEU HG H 1 1.379 0.001 . 1 . . . . . 110 Leu HG . 17476 1
818 . 1 . 1 75 75 LEU HD11 H 1 0.814 0.001 . 2 . . . . . 110 Leu HD1 . 17476 1
819 . 1 . 1 75 75 LEU HD12 H 1 0.814 0.001 . 2 . . . . . 110 Leu HD1 . 17476 1
820 . 1 . 1 75 75 LEU HD13 H 1 0.814 0.001 . 2 . . . . . 110 Leu HD1 . 17476 1
821 . 1 . 1 75 75 LEU HD21 H 1 0.732 0.001 . 2 . . . . . 110 Leu HD2 . 17476 1
822 . 1 . 1 75 75 LEU HD22 H 1 0.732 0.001 . 2 . . . . . 110 Leu HD2 . 17476 1
823 . 1 . 1 75 75 LEU HD23 H 1 0.732 0.001 . 2 . . . . . 110 Leu HD2 . 17476 1
824 . 1 . 1 75 75 LEU C C 13 175.050 0.010 . 1 . . . . . 110 Leu CO . 17476 1
825 . 1 . 1 75 75 LEU CA C 13 55.960 0.010 . 1 . . . . . 110 Leu CA . 17476 1
826 . 1 . 1 75 75 LEU CB C 13 37.880 0.010 . 1 . . . . . 110 Leu CB . 17476 1
827 . 1 . 1 75 75 LEU CD1 C 13 24.260 0.010 . 1 . . . . . 110 Leu CD1 . 17476 1
828 . 1 . 1 75 75 LEU CD2 C 13 22.200 0.010 . 1 . . . . . 110 Leu CD2 . 17476 1
829 . 1 . 1 75 75 LEU N N 15 118.300 0.010 . 1 . . . . . 110 Leu N . 17476 1
830 . 1 . 1 76 76 ARG H H 1 7.132 0.001 . 1 . . . . . 111 Arg HN . 17476 1
831 . 1 . 1 76 76 ARG HA H 1 4.311 0.001 . 1 . . . . . 111 Arg HA . 17476 1
832 . 1 . 1 76 76 ARG HB2 H 1 1.775 0.001 . 2 . . . . . 111 Arg HB2 . 17476 1
833 . 1 . 1 76 76 ARG HB3 H 1 1.581 0.001 . 2 . . . . . 111 Arg HB3 . 17476 1
834 . 1 . 1 76 76 ARG HG2 H 1 1.587 0.001 . 2 . . . . . 111 Arg HG2 . 17476 1
835 . 1 . 1 76 76 ARG HG3 H 1 1.692 0.001 . 2 . . . . . 111 Arg HG3 . 17476 1
836 . 1 . 1 76 76 ARG HD2 H 1 3.215 0.001 . 2 . . . . . 111 Arg HD2 . 17476 1
837 . 1 . 1 76 76 ARG HD3 H 1 3.286 0.001 . 2 . . . . . 111 Arg HD3 . 17476 1
838 . 1 . 1 76 76 ARG HE H 1 7.471 0.001 . 1 . . . . . 111 Arg HE . 17476 1
839 . 1 . 1 76 76 ARG C C 13 174.730 0.010 . 1 . . . . . 111 Arg CO . 17476 1
840 . 1 . 1 76 76 ARG CA C 13 56.370 0.010 . 1 . . . . . 111 Arg CA . 17476 1
841 . 1 . 1 76 76 ARG CB C 13 31.670 0.010 . 1 . . . . . 111 Arg CB . 17476 1
842 . 1 . 1 76 76 ARG N N 15 117.010 0.010 . 1 . . . . . 111 Arg N . 17476 1
843 . 1 . 1 77 77 VAL H H 1 9.062 0.001 . 1 . . . . . 112 Val HN . 17476 1
844 . 1 . 1 77 77 VAL HA H 1 4.904 0.001 . 1 . . . . . 112 Val HA . 17476 1
845 . 1 . 1 77 77 VAL HB H 1 2.173 0.001 . 1 . . . . . 112 Val HB . 17476 1
846 . 1 . 1 77 77 VAL HG11 H 1 0.733 0.001 . 2 . . . . . 112 Val HG1 . 17476 1
847 . 1 . 1 77 77 VAL HG12 H 1 0.733 0.001 . 2 . . . . . 112 Val HG1 . 17476 1
848 . 1 . 1 77 77 VAL HG13 H 1 0.733 0.001 . 2 . . . . . 112 Val HG1 . 17476 1
849 . 1 . 1 77 77 VAL HG21 H 1 0.907 0.001 . 2 . . . . . 112 Val HG2 . 17476 1
850 . 1 . 1 77 77 VAL HG22 H 1 0.907 0.001 . 2 . . . . . 112 Val HG2 . 17476 1
851 . 1 . 1 77 77 VAL HG23 H 1 0.907 0.001 . 2 . . . . . 112 Val HG2 . 17476 1
852 . 1 . 1 77 77 VAL C C 13 174.540 0.010 . 1 . . . . . 112 Val CO . 17476 1
853 . 1 . 1 77 77 VAL CA C 13 61.600 0.010 . 1 . . . . . 112 Val CA . 17476 1
854 . 1 . 1 77 77 VAL CB C 13 31.970 0.010 . 1 . . . . . 112 Val CB . 17476 1
855 . 1 . 1 77 77 VAL CG1 C 13 21.810 0.010 . 1 . . . . . 112 Val CG1 . 17476 1
856 . 1 . 1 77 77 VAL CG2 C 13 21.280 0.010 . 1 . . . . . 112 Val CG2 . 17476 1
857 . 1 . 1 77 77 VAL N N 15 125.790 0.010 . 1 . . . . . 112 Val N . 17476 1
858 . 1 . 1 78 78 TRP H H 1 9.443 0.001 . 1 . . . . . 113 Trp HN . 17476 1
859 . 1 . 1 78 78 TRP HA H 1 4.845 0.001 . 1 . . . . . 113 Trp HA . 17476 1
860 . 1 . 1 78 78 TRP HB2 H 1 2.739 0.001 . 1 . . . . . 113 Trp HB2 . 17476 1
861 . 1 . 1 78 78 TRP HB3 H 1 2.844 0.001 . 1 . . . . . 113 Trp HB3 . 17476 1
862 . 1 . 1 78 78 TRP HD1 H 1 5.124 0.001 . 1 . . . . . 113 Trp HD1 . 17476 1
863 . 1 . 1 78 78 TRP HE1 H 1 9.224 0.001 . 1 . . . . . 113 Trp HE1 . 17476 1
864 . 1 . 1 78 78 TRP HE3 H 1 7.231 0.001 . 1 . . . . . 113 Trp HE3 . 17476 1
865 . 1 . 1 78 78 TRP HZ2 H 1 7.137 0.001 . 1 . . . . . 113 Trp HZ2 . 17476 1
866 . 1 . 1 78 78 TRP HZ3 H 1 7.229 0.001 . 1 . . . . . 113 Trp HZ3 . 17476 1
867 . 1 . 1 78 78 TRP HH2 H 1 6.983 0.001 . 1 . . . . . 113 Trp HH2 . 17476 1
868 . 1 . 1 78 78 TRP C C 13 172.920 0.010 . 1 . . . . . 113 Trp CO . 17476 1
869 . 1 . 1 78 78 TRP CA C 13 55.170 0.010 . 1 . . . . . 113 Trp CA . 17476 1
870 . 1 . 1 78 78 TRP CB C 13 33.910 0.010 . 1 . . . . . 113 Trp CB . 17476 1
871 . 1 . 1 78 78 TRP N N 15 129.310 0.010 . 1 . . . . . 113 Trp N . 17476 1
872 . 1 . 1 79 79 CYS H H 1 7.159 0.001 . 1 . . . . . 114 Cys HN . 17476 1
873 . 1 . 1 79 79 CYS HA H 1 5.169 0.001 . 1 . . . . . 114 Cys HA . 17476 1
874 . 1 . 1 79 79 CYS HB2 H 1 2.476 0.001 . 1 . . . . . 114 Cys HB2 . 17476 1
875 . 1 . 1 79 79 CYS HB3 H 1 2.603 0.001 . 1 . . . . . 114 Cys HB3 . 17476 1
876 . 1 . 1 79 79 CYS C C 13 177.670 0.010 . 1 . . . . . 114 Cys CO . 17476 1
877 . 1 . 1 79 79 CYS CA C 13 56.450 0.010 . 1 . . . . . 114 Cys CA . 17476 1
878 . 1 . 1 79 79 CYS CB C 13 31.400 0.010 . 1 . . . . . 114 Cys CB . 17476 1
879 . 1 . 1 79 79 CYS N N 15 124.710 0.010 . 1 . . . . . 114 Cys N . 17476 1
880 . 1 . 1 80 80 TYR H H 1 10.164 0.001 . 1 . . . . . 115 Tyr HN . 17476 1
881 . 1 . 1 80 80 TYR HA H 1 4.263 0.001 . 1 . . . . . 115 Tyr HA . 17476 1
882 . 1 . 1 80 80 TYR HB2 H 1 3.219 0.001 . 1 . . . . . 115 Tyr HB2 . 17476 1
883 . 1 . 1 80 80 TYR HB3 H 1 2.945 0.001 . 1 . . . . . 115 Tyr HB3 . 17476 1
884 . 1 . 1 80 80 TYR HD1 H 1 7.387 0.001 . 3 . . . . . 115 Tyr HD . 17476 1
885 . 1 . 1 80 80 TYR HD2 H 1 7.387 0.001 . 3 . . . . . 115 Tyr HD . 17476 1
886 . 1 . 1 80 80 TYR HE1 H 1 6.713 0.001 . 3 . . . . . 115 Tyr HE . 17476 1
887 . 1 . 1 80 80 TYR HE2 H 1 6.713 0.001 . 3 . . . . . 115 Tyr HE . 17476 1
888 . 1 . 1 80 80 TYR C C 13 177.470 0.010 . 1 . . . . . 115 Tyr CO . 17476 1
889 . 1 . 1 80 80 TYR CA C 13 61.880 0.010 . 1 . . . . . 115 Tyr CA . 17476 1
890 . 1 . 1 80 80 TYR CB C 13 40.240 0.010 . 1 . . . . . 115 Tyr CB . 17476 1
891 . 1 . 1 80 80 TYR N N 15 125.840 0.010 . 1 . . . . . 115 Tyr N . 17476 1
892 . 1 . 1 81 81 ALA H H 1 7.994 0.001 . 1 . . . . . 116 Ala HN . 17476 1
893 . 1 . 1 81 81 ALA HA H 1 3.789 0.001 . 1 . . . . . 116 Ala HA . 17476 1
894 . 1 . 1 81 81 ALA HB1 H 1 -0.333 0.001 . 1 . . . . . 116 Ala HB . 17476 1
895 . 1 . 1 81 81 ALA HB2 H 1 -0.333 0.001 . 1 . . . . . 116 Ala HB . 17476 1
896 . 1 . 1 81 81 ALA HB3 H 1 -0.333 0.001 . 1 . . . . . 116 Ala HB . 17476 1
897 . 1 . 1 81 81 ALA C C 13 179.590 0.010 . 1 . . . . . 116 Ala CO . 17476 1
898 . 1 . 1 81 81 ALA CA C 13 54.260 0.010 . 1 . . . . . 116 Ala CA . 17476 1
899 . 1 . 1 81 81 ALA CB C 13 16.970 0.010 . 1 . . . . . 116 Ala CB . 17476 1
900 . 1 . 1 81 81 ALA N N 15 123.960 0.010 . 1 . . . . . 116 Ala N . 17476 1
901 . 1 . 1 82 82 CYS H H 1 9.757 0.001 . 1 . . . . . 117 Cys HN . 17476 1
902 . 1 . 1 82 82 CYS HA H 1 3.858 0.001 . 1 . . . . . 117 Cys HA . 17476 1
903 . 1 . 1 82 82 CYS HB2 H 1 2.410 0.001 . 1 . . . . . 117 Cys HB2 . 17476 1
904 . 1 . 1 82 82 CYS HB3 H 1 2.675 0.001 . 1 . . . . . 117 Cys HB3 . 17476 1
905 . 1 . 1 82 82 CYS C C 13 175.510 0.010 . 1 . . . . . 117 Cys CO . 17476 1
906 . 1 . 1 82 82 CYS CA C 13 62.480 0.010 . 1 . . . . . 117 Cys CA . 17476 1
907 . 1 . 1 82 82 CYS CB C 13 30.060 0.010 . 1 . . . . . 117 Cys CB . 17476 1
908 . 1 . 1 82 82 CYS N N 15 123.730 0.010 . 1 . . . . . 117 Cys N . 17476 1
909 . 1 . 1 83 83 SER H H 1 7.776 0.001 . 1 . . . . . 118 Ser HN . 17476 1
910 . 1 . 1 83 83 SER HA H 1 3.569 0.001 . 1 . . . . . 118 Ser HA . 17476 1
911 . 1 . 1 83 83 SER HB2 H 1 3.677 0.001 . 2 . . . . . 118 Ser HB2 . 17476 1
912 . 1 . 1 83 83 SER HB3 H 1 4.161 0.001 . 2 . . . . . 118 Ser HB3 . 17476 1
913 . 1 . 1 83 83 SER C C 13 173.100 0.010 . 1 . . . . . 118 Ser CO . 17476 1
914 . 1 . 1 83 83 SER CA C 13 57.940 0.010 . 1 . . . . . 118 Ser CA . 17476 1
915 . 1 . 1 83 83 SER CB C 13 61.700 0.010 . 1 . . . . . 118 Ser CB . 17476 1
916 . 1 . 1 83 83 SER N N 15 115.730 0.010 . 1 . . . . . 118 Ser N . 17476 1
917 . 1 . 1 84 84 LYS H H 1 6.366 0.001 . 1 . . . . . 119 Lys HN . 17476 1
918 . 1 . 1 84 84 LYS HA H 1 3.840 0.001 . 1 . . . . . 119 Lys HA . 17476 1
919 . 1 . 1 84 84 LYS HB2 H 1 1.541 0.001 . 2 . . . . . 119 Lys HB2 . 17476 1
920 . 1 . 1 84 84 LYS HB3 H 1 1.387 0.001 . 2 . . . . . 119 Lys HB3 . 17476 1
921 . 1 . 1 84 84 LYS HG2 H 1 0.935 0.001 . 2 . . . . . 119 Lys HG2 . 17476 1
922 . 1 . 1 84 84 LYS HG3 H 1 0.843 0.001 . 2 . . . . . 119 Lys HG3 . 17476 1
923 . 1 . 1 84 84 LYS HD2 H 1 1.503 0.001 . 2 . . . . . 119 Lys HD . 17476 1
924 . 1 . 1 84 84 LYS HD3 H 1 1.503 0.001 . 2 . . . . . 119 Lys HD . 17476 1
925 . 1 . 1 84 84 LYS HE2 H 1 2.824 0.001 . 2 . . . . . 119 Lys HE2 . 17476 1
926 . 1 . 1 84 84 LYS HE3 H 1 2.892 0.001 . 2 . . . . . 119 Lys HE3 . 17476 1
927 . 1 . 1 84 84 LYS C C 13 172.590 0.010 . 1 . . . . . 119 Lys CO . 17476 1
928 . 1 . 1 84 84 LYS CA C 13 54.130 0.010 . 1 . . . . . 119 Lys CA . 17476 1
929 . 1 . 1 84 84 LYS CB C 13 35.780 0.010 . 1 . . . . . 119 Lys CB . 17476 1
930 . 1 . 1 84 84 LYS N N 15 114.350 0.010 . 1 . . . . . 119 Lys N . 17476 1
931 . 1 . 1 85 85 GLU H H 1 7.998 0.001 . 1 . . . . . 120 Glu HN . 17476 1
932 . 1 . 1 85 85 GLU HA H 1 4.718 0.001 . 1 . . . . . 120 Glu HA . 17476 1
933 . 1 . 1 85 85 GLU HB2 H 1 1.814 0.001 . 2 . . . . . 120 Glu HB2 . 17476 1
934 . 1 . 1 85 85 GLU HB3 H 1 1.766 0.001 . 2 . . . . . 120 Glu HB3 . 17476 1
935 . 1 . 1 85 85 GLU HG2 H 1 1.992 0.001 . 2 . . . . . 120 Glu HG2 . 17476 1
936 . 1 . 1 85 85 GLU HG3 H 1 2.718 0.001 . 2 . . . . . 120 Glu HG3 . 17476 1
937 . 1 . 1 85 85 GLU C C 13 176.120 0.010 . 1 . . . . . 120 Glu CO . 17476 1
938 . 1 . 1 85 85 GLU CA C 13 55.610 0.010 . 1 . . . . . 120 Glu CA . 17476 1
939 . 1 . 1 85 85 GLU CB C 13 29.900 0.010 . 1 . . . . . 120 Glu CB . 17476 1
940 . 1 . 1 85 85 GLU N N 15 120.500 0.010 . 1 . . . . . 120 Glu N . 17476 1
941 . 1 . 1 86 86 VAL H H 1 7.920 0.001 . 1 . . . . . 121 Val HN . 17476 1
942 . 1 . 1 86 86 VAL HA H 1 4.349 0.001 . 1 . . . . . 121 Val HA . 17476 1
943 . 1 . 1 86 86 VAL HB H 1 1.937 0.001 . 1 . . . . . 121 Val HB . 17476 1
944 . 1 . 1 86 86 VAL HG11 H 1 0.801 0.001 . 2 . . . . . 121 Val HG1 . 17476 1
945 . 1 . 1 86 86 VAL HG12 H 1 0.801 0.001 . 2 . . . . . 121 Val HG1 . 17476 1
946 . 1 . 1 86 86 VAL HG13 H 1 0.801 0.001 . 2 . . . . . 121 Val HG1 . 17476 1
947 . 1 . 1 86 86 VAL HG21 H 1 0.577 0.001 . 2 . . . . . 121 Val HG2 . 17476 1
948 . 1 . 1 86 86 VAL HG22 H 1 0.577 0.001 . 2 . . . . . 121 Val HG2 . 17476 1
949 . 1 . 1 86 86 VAL HG23 H 1 0.577 0.001 . 2 . . . . . 121 Val HG2 . 17476 1
950 . 1 . 1 86 86 VAL C C 13 173.260 0.010 . 1 . . . . . 121 Val CO . 17476 1
951 . 1 . 1 86 86 VAL CA C 13 59.380 0.010 . 1 . . . . . 121 Val CA . 17476 1
952 . 1 . 1 86 86 VAL CB C 13 34.670 0.010 . 1 . . . . . 121 Val CB . 17476 1
953 . 1 . 1 86 86 VAL CG1 C 13 20.800 0.010 . 1 . . . . . 121 Val CG1 . 17476 1
954 . 1 . 1 86 86 VAL CG2 C 13 19.360 0.010 . 1 . . . . . 121 Val CG2 . 17476 1
955 . 1 . 1 86 86 VAL N N 15 120.290 0.010 . 1 . . . . . 121 Val N . 17476 1
956 . 1 . 1 87 87 PHE H H 1 8.166 0.001 . 1 . . . . . 122 Phe HN . 17476 1
957 . 1 . 1 87 87 PHE HA H 1 4.839 0.001 . 1 . . . . . 122 Phe HA . 17476 1
958 . 1 . 1 87 87 PHE HB2 H 1 2.778 0.001 . 1 . . . . . 122 Phe HB2 . 17476 1
959 . 1 . 1 87 87 PHE HB3 H 1 3.146 0.001 . 1 . . . . . 122 Phe HB3 . 17476 1
960 . 1 . 1 87 87 PHE HD1 H 1 7.259 0.001 . 3 . . . . . 122 Phe HD . 17476 1
961 . 1 . 1 87 87 PHE HD2 H 1 7.259 0.001 . 3 . . . . . 122 Phe HD . 17476 1
962 . 1 . 1 87 87 PHE HE1 H 1 7.268 0.001 . 3 . . . . . 122 Phe HE . 17476 1
963 . 1 . 1 87 87 PHE HE2 H 1 7.268 0.001 . 3 . . . . . 122 Phe HE . 17476 1
964 . 1 . 1 87 87 PHE HZ H 1 7.179 0.001 . 1 . . . . . 122 Phe HZ . 17476 1
965 . 1 . 1 87 87 PHE C C 13 175.530 0.010 . 1 . . . . . 122 Phe CO . 17476 1
966 . 1 . 1 87 87 PHE CA C 13 56.980 0.010 . 1 . . . . . 122 Phe CA . 17476 1
967 . 1 . 1 87 87 PHE CB C 13 40.650 0.010 . 1 . . . . . 122 Phe CB . 17476 1
968 . 1 . 1 87 87 PHE N N 15 119.000 0.010 . 1 . . . . . 122 Phe N . 17476 1
969 . 1 . 1 88 88 LEU H H 1 8.803 0.001 . 1 . . . . . 123 Leu HN . 17476 1
970 . 1 . 1 88 88 LEU HA H 1 4.411 0.001 . 1 . . . . . 123 Leu HA . 17476 1
971 . 1 . 1 88 88 LEU HB2 H 1 1.693 0.001 . 2 . . . . . 123 Leu HB2 . 17476 1
972 . 1 . 1 88 88 LEU HB3 H 1 1.637 0.001 . 2 . . . . . 123 Leu HB3 . 17476 1
973 . 1 . 1 88 88 LEU HG H 1 1.694 0.001 . 1 . . . . . 123 Leu HG . 17476 1
974 . 1 . 1 88 88 LEU HD11 H 1 0.919 0.001 . 2 . . . . . 123 Leu HD1 . 17476 1
975 . 1 . 1 88 88 LEU HD12 H 1 0.919 0.001 . 2 . . . . . 123 Leu HD1 . 17476 1
976 . 1 . 1 88 88 LEU HD13 H 1 0.919 0.001 . 2 . . . . . 123 Leu HD1 . 17476 1
977 . 1 . 1 88 88 LEU HD21 H 1 0.870 0.001 . 2 . . . . . 123 Leu HD2 . 17476 1
978 . 1 . 1 88 88 LEU HD22 H 1 0.870 0.001 . 2 . . . . . 123 Leu HD2 . 17476 1
979 . 1 . 1 88 88 LEU HD23 H 1 0.870 0.001 . 2 . . . . . 123 Leu HD2 . 17476 1
980 . 1 . 1 88 88 LEU C C 13 176.920 0.010 . 1 . . . . . 123 Leu CO . 17476 1
981 . 1 . 1 88 88 LEU CA C 13 54.310 0.010 . 1 . . . . . 123 Leu CA . 17476 1
982 . 1 . 1 88 88 LEU CB C 13 42.620 0.010 . 1 . . . . . 123 Leu CB . 17476 1
983 . 1 . 1 88 88 LEU CD1 C 13 24.750 0.010 . 1 . . . . . 123 Leu CD1 . 17476 1
984 . 1 . 1 88 88 LEU CD2 C 13 23.030 0.010 . 1 . . . . . 123 Leu CD2 . 17476 1
985 . 1 . 1 88 88 LEU N N 15 123.960 0.010 . 1 . . . . . 123 Leu N . 17476 1
986 . 1 . 1 89 89 ASP H H 1 8.436 0.001 . 1 . . . . . 124 Asp HN . 17476 1
987 . 1 . 1 89 89 ASP HA H 1 4.462 0.001 . 1 . . . . . 124 Asp HA . 17476 1
988 . 1 . 1 89 89 ASP HB2 H 1 2.619 0.001 . 2 . . . . . 124 Asp HB2 . 17476 1
989 . 1 . 1 89 89 ASP HB3 H 1 2.700 0.001 . 2 . . . . . 124 Asp HB3 . 17476 1
990 . 1 . 1 89 89 ASP C C 13 176.430 0.010 . 1 . . . . . 124 Asp CO . 17476 1
991 . 1 . 1 89 89 ASP CA C 13 55.180 0.010 . 1 . . . . . 124 Asp CA . 17476 1
992 . 1 . 1 89 89 ASP CB C 13 40.880 0.010 . 1 . . . . . 124 Asp CB . 17476 1
993 . 1 . 1 89 89 ASP N N 15 120.740 0.010 . 1 . . . . . 124 Asp N . 17476 1
994 . 1 . 1 90 90 ARG H H 1 8.015 0.001 . 1 . . . . . 125 Arg HN . 17476 1
995 . 1 . 1 90 90 ARG HA H 1 4.360 0.001 . 1 . . . . . 125 Arg HA . 17476 1
996 . 1 . 1 90 90 ARG HB2 H 1 1.861 0.001 . 2 . . . . . 125 Arg HB2 . 17476 1
997 . 1 . 1 90 90 ARG HB3 H 1 1.717 0.001 . 2 . . . . . 125 Arg HB3 . 17476 1
998 . 1 . 1 90 90 ARG HG2 H 1 1.563 0.001 . 2 . . . . . 125 Arg HG . 17476 1
999 . 1 . 1 90 90 ARG HG3 H 1 1.563 0.001 . 2 . . . . . 125 Arg HG . 17476 1
1000 . 1 . 1 90 90 ARG HD2 H 1 3.154 0.001 . 2 . . . . . 125 Arg HD . 17476 1
1001 . 1 . 1 90 90 ARG HD3 H 1 3.154 0.001 . 2 . . . . . 125 Arg HD . 17476 1
1002 . 1 . 1 90 90 ARG HE H 1 7.257 0.001 . 1 . . . . . 125 Arg HE . 17476 1
1003 . 1 . 1 90 90 ARG C C 13 176.120 0.010 . 1 . . . . . 125 Arg CO . 17476 1
1004 . 1 . 1 90 90 ARG CA C 13 56.050 0.010 . 1 . . . . . 125 Arg CA . 17476 1
1005 . 1 . 1 90 90 ARG CB C 13 30.680 0.010 . 1 . . . . . 125 Arg CB . 17476 1
1006 . 1 . 1 90 90 ARG N N 15 119.320 0.010 . 1 . . . . . 125 Arg N . 17476 1
1007 . 1 . 1 91 91 LYS H H 1 8.310 0.001 . 1 . . . . . 126 Lys HN . 17476 1
1008 . 1 . 1 91 91 LYS HA H 1 4.236 0.001 . 1 . . . . . 126 Lys HA . 17476 1
1009 . 1 . 1 91 91 LYS HB2 H 1 1.751 0.001 . 2 . . . . . 126 Lys HB2 . 17476 1
1010 . 1 . 1 91 91 LYS HB3 H 1 1.808 0.001 . 2 . . . . . 126 Lys HB3 . 17476 1
1011 . 1 . 1 91 91 LYS HG2 H 1 1.460 0.001 . 2 . . . . . 126 Lys HG2 . 17476 1
1012 . 1 . 1 91 91 LYS HG3 H 1 1.419 0.001 . 2 . . . . . 126 Lys HG3 . 17476 1
1013 . 1 . 1 91 91 LYS HD2 H 1 1.655 0.001 . 2 . . . . . 126 Lys HD . 17476 1
1014 . 1 . 1 91 91 LYS HD3 H 1 1.655 0.001 . 2 . . . . . 126 Lys HD . 17476 1
1015 . 1 . 1 91 91 LYS HE2 H 1 2.978 0.001 . 2 . . . . . 126 Lys HE . 17476 1
1016 . 1 . 1 91 91 LYS HE3 H 1 2.978 0.001 . 2 . . . . . 126 Lys HE . 17476 1
1017 . 1 . 1 91 91 LYS C C 13 176.750 0.010 . 1 . . . . . 126 Lys CO . 17476 1
1018 . 1 . 1 91 91 LYS CA C 13 56.720 0.010 . 1 . . . . . 126 Lys CA . 17476 1
1019 . 1 . 1 91 91 LYS CB C 13 32.790 0.010 . 1 . . . . . 126 Lys CB . 17476 1
1020 . 1 . 1 91 91 LYS N N 15 120.600 0.010 . 1 . . . . . 126 Lys N . 17476 1
1021 . 1 . 1 92 92 LEU H H 1 8.310 0.001 . 1 . . . . . 127 Leu HN . 17476 1
1022 . 1 . 1 92 92 LEU HA H 1 4.343 0.001 . 1 . . . . . 127 Leu HA . 17476 1
1023 . 1 . 1 92 92 LEU HB2 H 1 1.513 0.001 . 2 . . . . . 127 Leu HB2 . 17476 1
1024 . 1 . 1 92 92 LEU HB3 H 1 1.677 0.001 . 2 . . . . . 127 Leu HB3 . 17476 1
1025 . 1 . 1 92 92 LEU HG H 1 1.630 0.001 . 1 . . . . . 127 Leu HG . 17476 1
1026 . 1 . 1 92 92 LEU HD11 H 1 0.856 0.001 . 2 . . . . . 127 Leu HD1 . 17476 1
1027 . 1 . 1 92 92 LEU HD12 H 1 0.856 0.001 . 2 . . . . . 127 Leu HD1 . 17476 1
1028 . 1 . 1 92 92 LEU HD13 H 1 0.856 0.001 . 2 . . . . . 127 Leu HD1 . 17476 1
1029 . 1 . 1 92 92 LEU HD21 H 1 0.806 0.001 . 2 . . . . . 127 Leu HD2 . 17476 1
1030 . 1 . 1 92 92 LEU HD22 H 1 0.806 0.001 . 2 . . . . . 127 Leu HD2 . 17476 1
1031 . 1 . 1 92 92 LEU HD23 H 1 0.806 0.001 . 2 . . . . . 127 Leu HD2 . 17476 1
1032 . 1 . 1 92 92 LEU C C 13 177.240 0.010 . 1 . . . . . 127 Leu CO . 17476 1
1033 . 1 . 1 92 92 LEU CA C 13 55.270 0.010 . 1 . . . . . 127 Leu CA . 17476 1
1034 . 1 . 1 92 92 LEU CB C 13 42.570 0.010 . 1 . . . . . 127 Leu CB . 17476 1
1035 . 1 . 1 92 92 LEU CD1 C 13 24.450 0.010 . 1 . . . . . 127 Leu CD1 . 17476 1
1036 . 1 . 1 92 92 LEU CD2 C 13 22.950 0.010 . 1 . . . . . 127 Leu CD2 . 17476 1
1037 . 1 . 1 92 92 LEU N N 15 121.730 0.010 . 1 . . . . . 127 Leu N . 17476 1
1038 . 1 . 1 93 93 GLY H H 1 8.323 0.001 . 1 . . . . . 128 Gly HN . 17476 1
1039 . 1 . 1 93 93 GLY HA2 H 1 3.926 0.001 . 2 . . . . . 128 Gly HA2 . 17476 1
1040 . 1 . 1 93 93 GLY HA3 H 1 3.982 0.001 . 2 . . . . . 128 Gly HA3 . 17476 1
1041 . 1 . 1 93 93 GLY C C 13 174.160 0.010 . 1 . . . . . 128 Gly CO . 17476 1
1042 . 1 . 1 93 93 GLY CA C 13 45.400 0.010 . 1 . . . . . 128 Gly CA . 17476 1
1043 . 1 . 1 93 93 GLY N N 15 109.190 0.010 . 1 . . . . . 128 Gly N . 17476 1
1044 . 1 . 1 94 94 THR H H 1 8.018 0.001 . 1 . . . . . 129 Thr HN . 17476 1
1045 . 1 . 1 94 94 THR HA H 1 4.341 0.001 . 1 . . . . . 129 Thr HA . 17476 1
1046 . 1 . 1 94 94 THR HB H 1 4.261 0.001 . 1 . . . . . 129 Thr HB . 17476 1
1047 . 1 . 1 94 94 THR HG21 H 1 1.161 0.001 . 1 . . . . . 129 Thr HG2 . 17476 1
1048 . 1 . 1 94 94 THR HG22 H 1 1.161 0.001 . 1 . . . . . 129 Thr HG2 . 17476 1
1049 . 1 . 1 94 94 THR HG23 H 1 1.161 0.001 . 1 . . . . . 129 Thr HG2 . 17476 1
1050 . 1 . 1 94 94 THR C C 13 174.430 0.010 . 1 . . . . . 129 Thr CO . 17476 1
1051 . 1 . 1 94 94 THR CA C 13 61.760 0.010 . 1 . . . . . 129 Thr CA . 17476 1
1052 . 1 . 1 94 94 THR CB C 13 69.980 0.010 . 1 . . . . . 129 Thr CB . 17476 1
1053 . 1 . 1 94 94 THR CG2 C 13 21.140 0.010 . 1 . . . . . 129 Thr CG2 . 17476 1
1054 . 1 . 1 94 94 THR N N 15 112.930 0.010 . 1 . . . . . 129 Thr N . 17476 1
1055 . 1 . 1 95 95 GLN H H 1 8.234 0.001 . 1 . . . . . 130 Gln HN . 17476 1
1056 . 1 . 1 95 95 GLN HA H 1 4.148 0.001 . 1 . . . . . 130 Gln HA . 17476 1
1057 . 1 . 1 95 95 GLN HB2 H 1 1.922 0.001 . 2 . . . . . 130 Gln HB2 . 17476 1
1058 . 1 . 1 95 95 GLN HB3 H 1 2.088 0.001 . 2 . . . . . 130 Gln HB3 . 17476 1
1059 . 1 . 1 95 95 GLN HG2 H 1 2.284 0.001 . 2 . . . . . 130 Gln HG . 17476 1
1060 . 1 . 1 95 95 GLN HG3 H 1 2.284 0.001 . 2 . . . . . 130 Gln HG . 17476 1
1061 . 1 . 1 95 95 GLN HE21 H 1 6.822 0.001 . 1 . . . . . 130 Gln HE21 . 17476 1
1062 . 1 . 1 95 95 GLN HE22 H 1 7.532 0.001 . 1 . . . . . 130 Gln HE22 . 17476 1
1063 . 1 . 1 95 95 GLN C C 13 173.910 0.010 . 1 . . . . . 130 Gln CO . 17476 1
1064 . 1 . 1 95 95 GLN CA C 13 53.830 0.010 . 1 . . . . . 130 Gln CA . 17476 1
1065 . 1 . 1 95 95 GLN CB C 13 29.080 0.010 . 1 . . . . . 130 Gln CB . 17476 1
1066 . 1 . 1 95 95 GLN N N 15 123.280 0.010 . 1 . . . . . 130 Gln N . 17476 1
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