Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6877
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_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 '1H15N HSQC' 2 $sample_2 isotropic 6877 1
2 HNCO 2 $sample_2 isotropic 6877 1
3 HNCA 2 $sample_2 isotropic 6877 1
4 HN(CO)CA 2 $sample_2 isotropic 6877 1
5 CBCA(CO)NH 2 $sample_2 isotropic 6877 1
6 '15N NOESY' 2 $sample_2 isotropic 6877 1
7 '13C NOESY' 1 $sample_1 isotropic 6877 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 6877 1
2 $software_2 . . 6877 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 THR H H 1 8.958 0.005 . 1 . . . . 2 THR HN . 6877 1
2 . 1 1 2 2 THR HA H 1 5.068 0.005 . 1 . . . . 2 THR HA . 6877 1
3 . 1 1 2 2 THR HB H 1 4.430 0.005 . 1 . . . . 2 THR HB . 6877 1
4 . 1 1 2 2 THR CA C 13 58.560 0.08 . 1 . . . . 2 THR CA . 6877 1
5 . 1 1 2 2 THR CB C 13 69.770 0.08 . 1 . . . . 2 THR CB . 6877 1
6 . 1 1 2 2 THR N N 15 121.510 0.08 . 1 . . . . 2 THR N . 6877 1
7 . 1 1 3 3 PRO HA H 1 4.590 0.005 . 1 . . . . 3 PRO HA . 6877 1
8 . 1 1 3 3 PRO HG2 H 1 1.920 0.005 . 2 . . . . 3 PRO HG1 . 6877 1
9 . 1 1 3 3 PRO HG3 H 1 2.060 0.005 . 2 . . . . 3 PRO HG2 . 6877 1
10 . 1 1 3 3 PRO HD2 H 1 4.370 0.005 . 2 . . . . 3 PRO HD2 . 6877 1
11 . 1 1 3 3 PRO C C 13 173.790 0.08 . 1 . . . . 3 PRO C . 6877 1
12 . 1 1 3 3 PRO CA C 13 60.620 0.08 . 1 . . . . 3 PRO CA . 6877 1
13 . 1 1 3 3 PRO CG C 13 25.250 0.08 . 1 . . . . 3 PRO CG . 6877 1
14 . 1 1 3 3 PRO CD C 13 48.960 0.08 . 1 . . . . 3 PRO CD . 6877 1
15 . 1 1 4 4 ILE H H 1 8.340 0.005 . 1 . . . . 4 ILE HN . 6877 1
16 . 1 1 4 4 ILE HA H 1 5.970 0.005 . 1 . . . . 4 ILE HA . 6877 1
17 . 1 1 4 4 ILE HG21 H 1 1.070 0.005 . 1 . . . . 4 ILE HG2 . 6877 1
18 . 1 1 4 4 ILE HG22 H 1 1.070 0.005 . 1 . . . . 4 ILE HG2 . 6877 1
19 . 1 1 4 4 ILE HG23 H 1 1.070 0.005 . 1 . . . . 4 ILE HG2 . 6877 1
20 . 1 1 4 4 ILE HD11 H 1 0.547 0.005 . 1 . . . . 4 ILE HD1 . 6877 1
21 . 1 1 4 4 ILE HD12 H 1 0.547 0.005 . 1 . . . . 4 ILE HD1 . 6877 1
22 . 1 1 4 4 ILE HD13 H 1 0.547 0.005 . 1 . . . . 4 ILE HD1 . 6877 1
23 . 1 1 4 4 ILE C C 13 175.290 0.08 . 1 . . . . 4 ILE C . 6877 1
24 . 1 1 4 4 ILE CA C 13 56.580 0.08 . 1 . . . . 4 ILE CA . 6877 1
25 . 1 1 4 4 ILE CG2 C 13 17.310 0.08 . 1 . . . . 4 ILE CG2 . 6877 1
26 . 1 1 4 4 ILE CD1 C 13 12.690 0.08 . 1 . . . . 4 ILE CD1 . 6877 1
27 . 1 1 4 4 ILE N N 15 113.890 0.08 . 1 . . . . 4 ILE N . 6877 1
28 . 1 1 5 5 VAL H H 1 8.723 0.005 . 1 . . . . 5 VAL HN . 6877 1
29 . 1 1 5 5 VAL HA H 1 4.799 0.005 . 1 . . . . 5 VAL HA . 6877 1
30 . 1 1 5 5 VAL HB H 1 2.268 0.005 . 1 . . . . 5 VAL HB . 6877 1
31 . 1 1 5 5 VAL HG11 H 1 1.040 0.005 . 2 . . . . 5 VAL HG1 . 6877 1
32 . 1 1 5 5 VAL HG12 H 1 1.040 0.005 . 2 . . . . 5 VAL HG1 . 6877 1
33 . 1 1 5 5 VAL HG13 H 1 1.040 0.005 . 2 . . . . 5 VAL HG1 . 6877 1
34 . 1 1 5 5 VAL HG21 H 1 1.000 0.005 . 2 . . . . 5 VAL HG2 . 6877 1
35 . 1 1 5 5 VAL HG22 H 1 1.000 0.005 . 2 . . . . 5 VAL HG2 . 6877 1
36 . 1 1 5 5 VAL HG23 H 1 1.000 0.005 . 2 . . . . 5 VAL HG2 . 6877 1
37 . 1 1 5 5 VAL C C 13 173.210 0.08 . 1 . . . . 5 VAL C . 6877 1
38 . 1 1 5 5 VAL CA C 13 58.790 0.08 . 1 . . . . 5 VAL CA . 6877 1
39 . 1 1 5 5 VAL CB C 13 34.485 0.08 . 1 . . . . 5 VAL CB . 6877 1
40 . 1 1 5 5 VAL CG1 C 13 21.850 0.08 . 1 . . . . 5 VAL CG1 . 6877 1
41 . 1 1 5 5 VAL CG2 C 13 20.160 0.08 . 1 . . . . 5 VAL CG2 . 6877 1
42 . 1 1 5 5 VAL N N 15 120.660 0.08 . 1 . . . . 5 VAL N . 6877 1
43 . 1 1 6 6 HIS H H 1 8.880 0.005 . 1 . . . . 6 HIS HN . 6877 1
44 . 1 1 6 6 HIS HA H 1 5.714 0.005 . 1 . . . . 6 HIS HA . 6877 1
45 . 1 1 6 6 HIS C C 13 172.840 0.08 . 1 . . . . 6 HIS C . 6877 1
46 . 1 1 6 6 HIS CA C 13 51.920 0.08 . 1 . . . . 6 HIS CA . 6877 1
47 . 1 1 6 6 HIS N N 15 121.660 0.08 . 1 . . . . 6 HIS N . 6877 1
48 . 1 1 7 7 LEU H H 1 9.490 0.005 . 1 . . . . 7 LEU HN . 6877 1
49 . 1 1 7 7 LEU HA H 1 4.373 0.005 . 1 . . . . 7 LEU HA . 6877 1
50 . 1 1 7 7 LEU C C 13 173.370 0.08 . 1 . . . . 7 LEU C . 6877 1
51 . 1 1 7 7 LEU CA C 13 50.260 0.08 . 1 . . . . 7 LEU CA . 6877 1
52 . 1 1 7 7 LEU N N 15 123.880 0.08 . 1 . . . . 7 LEU N . 6877 1
53 . 1 1 8 8 LYS H H 1 8.770 0.005 . 1 . . . . 8 LYS HN . 6877 1
54 . 1 1 8 8 LYS HA H 1 5.641 0.005 . 1 . . . . 8 LYS HA . 6877 1
55 . 1 1 8 8 LYS C C 13 174.190 0.08 . 1 . . . . 8 LYS C . 6877 1
56 . 1 1 8 8 LYS CA C 13 52.140 0.08 . 1 . . . . 8 LYS CA . 6877 1
57 . 1 1 8 8 LYS N N 15 119.920 0.08 . 1 . . . . 8 LYS N . 6877 1
58 . 1 1 9 9 GLY H H 1 8.450 0.005 . 1 . . . . 9 GLY HN . 6877 1
59 . 1 1 9 9 GLY HA2 H 1 4.365 0.005 . 2 . . . . 9 GLY HA1 . 6877 1
60 . 1 1 9 9 GLY HA3 H 1 3.988 0.005 . 2 . . . . 9 GLY HA2 . 6877 1
61 . 1 1 9 9 GLY C C 13 168.820 0.08 . 1 . . . . 9 GLY C . 6877 1
62 . 1 1 9 9 GLY CA C 13 43.000 0.08 . 1 . . . . 9 GLY CA . 6877 1
63 . 1 1 9 9 GLY N N 15 109.700 0.08 . 1 . . . . 9 GLY N . 6877 1
64 . 1 1 10 10 ASP H H 1 8.550 0.005 . 1 . . . . 10 ASP HN . 6877 1
65 . 1 1 10 10 ASP HA H 1 4.694 0.005 . 1 . . . . 10 ASP HA . 6877 1
66 . 1 1 10 10 ASP HB2 H 1 2.750 0.005 . 2 . . . . 10 ASP HB1 . 6877 1
67 . 1 1 10 10 ASP HB3 H 1 2.870 0.005 . 2 . . . . 10 ASP HB2 . 6877 1
68 . 1 1 10 10 ASP C C 13 174.870 0.08 . 1 . . . . 10 ASP C . 6877 1
69 . 1 1 10 10 ASP CA C 13 52.360 0.08 . 1 . . . . 10 ASP CA . 6877 1
70 . 1 1 10 10 ASP CB C 13 40.660 0.08 . 1 . . . . 10 ASP CB . 6877 1
71 . 1 1 10 10 ASP N N 15 121.990 0.08 . 1 . . . . 10 ASP N . 6877 1
72 . 1 1 11 11 ALA H H 1 8.970 0.005 . 1 . . . . 11 ALA HN . 6877 1
73 . 1 1 11 11 ALA HA H 1 3.947 0.005 . 1 . . . . 11 ALA HA . 6877 1
74 . 1 1 11 11 ALA HB1 H 1 1.516 0.005 . 1 . . . . 11 ALA HB . 6877 1
75 . 1 1 11 11 ALA HB2 H 1 1.516 0.005 . 1 . . . . 11 ALA HB . 6877 1
76 . 1 1 11 11 ALA HB3 H 1 1.516 0.005 . 1 . . . . 11 ALA HB . 6877 1
77 . 1 1 11 11 ALA C C 13 179.360 0.08 . 1 . . . . 11 ALA C . 6877 1
78 . 1 1 11 11 ALA CA C 13 54.280 0.08 . 1 . . . . 11 ALA CA . 6877 1
79 . 1 1 11 11 ALA CB C 13 16.410 0.08 . 1 . . . . 11 ALA CB . 6877 1
80 . 1 1 11 11 ALA N N 15 126.740 0.08 . 1 . . . . 11 ALA N . 6877 1
81 . 1 1 12 12 ASN H H 1 9.180 0.005 . 1 . . . . 12 ASN HN . 6877 1
82 . 1 1 12 12 ASN HA H 1 5.060 0.005 . 1 . . . . 12 ASN HA . 6877 1
83 . 1 1 12 12 ASN HB2 H 1 2.870 0.005 . 2 . . . . 12 ASN HB1 . 6877 1
84 . 1 1 12 12 ASN HB3 H 1 3.006 0.005 . 2 . . . . 12 ASN HB2 . 6877 1
85 . 1 1 12 12 ASN C C 13 174.990 0.08 . 1 . . . . 12 ASN C . 6877 1
86 . 1 1 12 12 ASN CA C 13 56.056 0.08 . 1 . . . . 12 ASN CA . 6877 1
87 . 1 1 12 12 ASN CB C 13 35.640 0.08 . 1 . . . . 12 ASN CB . 6877 1
88 . 1 1 12 12 ASN N N 15 119.497 0.08 . 1 . . . . 12 ASN N . 6877 1
89 . 1 1 13 13 THR H H 1 8.250 0.005 . 1 . . . . 13 THR HN . 6877 1
90 . 1 1 13 13 THR HA H 1 3.974 0.005 . 1 . . . . 13 THR HA . 6877 1
91 . 1 1 13 13 THR HB H 1 4.225 0.005 . 1 . . . . 13 THR HB . 6877 1
92 . 1 1 13 13 THR HG21 H 1 1.250 0.005 . 1 . . . . 13 THR HG2 . 6877 1
93 . 1 1 13 13 THR HG22 H 1 1.250 0.005 . 1 . . . . 13 THR HG2 . 6877 1
94 . 1 1 13 13 THR HG23 H 1 1.250 0.005 . 1 . . . . 13 THR HG2 . 6877 1
95 . 1 1 13 13 THR C C 13 175.820 0.08 . 1 . . . . 13 THR C . 6877 1
96 . 1 1 13 13 THR CA C 13 64.460 0.08 . 1 . . . . 13 THR CA . 6877 1
97 . 1 1 13 13 THR CB C 13 65.510 0.08 . 1 . . . . 13 THR CB . 6877 1
98 . 1 1 13 13 THR CG2 C 13 19.660 0.08 . 1 . . . . 13 THR CG2 . 6877 1
99 . 1 1 13 13 THR N N 15 117.770 0.08 . 1 . . . . 13 THR N . 6877 1
100 . 1 1 14 14 LEU H H 1 8.460 0.005 . 1 . . . . 14 LEU HN . 6877 1
101 . 1 1 14 14 LEU HA H 1 4.214 0.005 . 1 . . . . 14 LEU HA . 6877 1
102 . 1 1 14 14 LEU HD11 H 1 0.629 0.005 . 2 . . . . 14 LEU HD1 . 6877 1
103 . 1 1 14 14 LEU HD12 H 1 0.629 0.005 . 2 . . . . 14 LEU HD1 . 6877 1
104 . 1 1 14 14 LEU HD13 H 1 0.629 0.005 . 2 . . . . 14 LEU HD1 . 6877 1
105 . 1 1 14 14 LEU HD21 H 1 0.634 0.005 . 2 . . . . 14 LEU HD2 . 6877 1
106 . 1 1 14 14 LEU HD22 H 1 0.634 0.005 . 2 . . . . 14 LEU HD2 . 6877 1
107 . 1 1 14 14 LEU HD23 H 1 0.634 0.005 . 2 . . . . 14 LEU HD2 . 6877 1
108 . 1 1 14 14 LEU C C 13 175.870 0.08 . 1 . . . . 14 LEU C . 6877 1
109 . 1 1 14 14 LEU CA C 13 55.670 0.08 . 1 . . . . 14 LEU CA . 6877 1
110 . 1 1 14 14 LEU CD1 C 13 23.970 0.08 . 1 . . . . 14 LEU CD1 . 6877 1
111 . 1 1 14 14 LEU CD2 C 13 21.570 0.08 . 1 . . . . 14 LEU CD2 . 6877 1
112 . 1 1 14 14 LEU N N 15 121.739 0.08 . 1 . . . . 14 LEU N . 6877 1
113 . 1 1 15 15 LYS H H 1 8.010 0.005 . 1 . . . . 15 LYS HN . 6877 1
114 . 1 1 15 15 LYS HA H 1 3.858 0.005 . 1 . . . . 15 LYS HA . 6877 1
115 . 1 1 15 15 LYS HB2 H 1 2.098 0.005 . 2 . . . . 15 LYS HB2 . 6877 1
116 . 1 1 15 15 LYS C C 13 177.940 0.08 . 1 . . . . 15 LYS C . 6877 1
117 . 1 1 15 15 LYS CA C 13 57.100 0.08 . 1 . . . . 15 LYS CA . 6877 1
118 . 1 1 15 15 LYS CB C 13 29.920 0.08 . 1 . . . . 15 LYS CB . 6877 1
119 . 1 1 15 15 LYS N N 15 120.280 0.08 . 1 . . . . 15 LYS N . 6877 1
120 . 1 1 16 16 CYS H H 1 8.190 0.005 . 1 . . . . 16 CYS HN . 6877 1
121 . 1 1 16 16 CYS HA H 1 4.546 0.005 . 1 . . . . 16 CYS HA . 6877 1
122 . 1 1 16 16 CYS HB2 H 1 3.054 0.005 . 2 . . . . 16 CYS HB1 . 6877 1
123 . 1 1 16 16 CYS HB3 H 1 3.165 0.005 . 2 . . . . 16 CYS HB2 . 6877 1
124 . 1 1 16 16 CYS C C 13 174.260 0.08 . 1 . . . . 16 CYS C . 6877 1
125 . 1 1 16 16 CYS CA C 13 59.590 0.08 . 1 . . . . 16 CYS CA . 6877 1
126 . 1 1 16 16 CYS CB C 13 24.229 0.08 . 1 . . . . 16 CYS CB . 6877 1
127 . 1 1 16 16 CYS N N 15 118.870 0.08 . 1 . . . . 16 CYS N . 6877 1
128 . 1 1 17 17 LEU H H 1 8.010 0.005 . 1 . . . . 17 LEU HN . 6877 1
129 . 1 1 17 17 LEU HA H 1 3.836 0.005 . 1 . . . . 17 LEU HA . 6877 1
130 . 1 1 17 17 LEU C C 13 174.860 0.08 . 1 . . . . 17 LEU C . 6877 1
131 . 1 1 17 17 LEU CA C 13 55.720 0.08 . 1 . . . . 17 LEU CA . 6877 1
132 . 1 1 17 17 LEU N N 15 121.730 0.08 . 1 . . . . 17 LEU N . 6877 1
133 . 1 1 18 18 ARG H H 1 8.130 0.005 . 1 . . . . 18 ARG HN . 6877 1
134 . 1 1 18 18 ARG HA H 1 2.679 0.005 . 1 . . . . 18 ARG HA . 6877 1
135 . 1 1 18 18 ARG HD2 H 1 3.307 0.005 . 2 . . . . 18 ARG HD2 . 6877 1
136 . 1 1 18 18 ARG C C 13 175.210 0.08 . 1 . . . . 18 ARG C . 6877 1
137 . 1 1 18 18 ARG CA C 13 56.550 0.08 . 1 . . . . 18 ARG CA . 6877 1
138 . 1 1 18 18 ARG CD C 13 41.865 0.08 . 1 . . . . 18 ARG CD . 6877 1
139 . 1 1 18 18 ARG N N 15 118.100 0.08 . 1 . . . . 18 ARG N . 6877 1
140 . 1 1 19 19 TYR H H 1 7.490 0.005 . 1 . . . . 19 TYR HN . 6877 1
141 . 1 1 19 19 TYR HA H 1 4.268 0.005 . 1 . . . . 19 TYR HA . 6877 1
142 . 1 1 19 19 TYR C C 13 175.640 0.08 . 1 . . . . 19 TYR C . 6877 1
143 . 1 1 19 19 TYR CA C 13 59.400 0.08 . 1 . . . . 19 TYR CA . 6877 1
144 . 1 1 19 19 TYR N N 15 118.190 0.08 . 1 . . . . 19 TYR N . 6877 1
145 . 1 1 20 20 ARG H H 1 7.700 0.005 . 1 . . . . 20 ARG HN . 6877 1
146 . 1 1 20 20 ARG C C 13 177.610 0.08 . 1 . . . . 20 ARG C . 6877 1
147 . 1 1 20 20 ARG CA C 13 57.270 0.08 . 1 . . . . 20 ARG CA . 6877 1
148 . 1 1 20 20 ARG N N 15 116.320 0.08 . 1 . . . . 20 ARG N . 6877 1
149 . 1 1 21 21 PHE H H 1 8.490 0.005 . 1 . . . . 21 PHE HN . 6877 1
150 . 1 1 21 21 PHE HA H 1 5.124 0.005 . 1 . . . . 21 PHE HA . 6877 1
151 . 1 1 21 21 PHE C C 13 176.500 0.08 . 1 . . . . 21 PHE C . 6877 1
152 . 1 1 21 21 PHE CA C 13 54.860 0.08 . 1 . . . . 21 PHE CA . 6877 1
153 . 1 1 21 21 PHE N N 15 116.180 0.08 . 1 . . . . 21 PHE N . 6877 1
154 . 1 1 22 22 LYS H H 1 7.930 0.005 . 1 . . . . 22 LYS HN . 6877 1
155 . 1 1 22 22 LYS HA H 1 4.494 0.005 . 1 . . . . 22 LYS HA . 6877 1
156 . 1 1 22 22 LYS HB2 H 1 2.035 0.005 . 2 . . . . 22 LYS HB2 . 6877 1
157 . 1 1 22 22 LYS C C 13 175.870 0.08 . 1 . . . . 22 LYS C . 6877 1
158 . 1 1 22 22 LYS CA C 13 57.320 0.08 . 1 . . . . 22 LYS CA . 6877 1
159 . 1 1 22 22 LYS CB C 13 29.900 0.08 . 1 . . . . 22 LYS CB . 6877 1
160 . 1 1 22 22 LYS N N 15 122.300 0.08 . 1 . . . . 22 LYS N . 6877 1
161 . 1 1 23 23 LYS H H 1 7.570 0.005 . 1 . . . . 23 LYS HN . 6877 1
162 . 1 1 23 23 LYS HA H 1 4.284 0.005 . 1 . . . . 23 LYS HA . 6877 1
163 . 1 1 23 23 LYS HB2 H 1 1.725 0.005 . 2 . . . . 23 LYS HB1 . 6877 1
164 . 1 1 23 23 LYS HB3 H 1 1.825 0.005 . 2 . . . . 23 LYS HB2 . 6877 1
165 . 1 1 23 23 LYS C C 13 175.330 0.08 . 1 . . . . 23 LYS C . 6877 1
166 . 1 1 23 23 LYS CA C 13 55.240 0.08 . 1 . . . . 23 LYS CA . 6877 1
167 . 1 1 23 23 LYS CB C 13 29.811 0.08 . 1 . . . . 23 LYS CB . 6877 1
168 . 1 1 23 23 LYS N N 15 116.409 0.08 . 1 . . . . 23 LYS N . 6877 1
169 . 1 1 24 24 HIS H H 1 8.210 0.005 . 1 . . . . 24 HIS HN . 6877 1
170 . 1 1 24 24 HIS HA H 1 5.195 0.005 . 1 . . . . 24 HIS HA . 6877 1
171 . 1 1 24 24 HIS C C 13 174.180 0.08 . 1 . . . . 24 HIS C . 6877 1
172 . 1 1 24 24 HIS CA C 13 52.610 0.08 . 1 . . . . 24 HIS CA . 6877 1
173 . 1 1 24 24 HIS N N 15 119.048 0.08 . 1 . . . . 24 HIS N . 6877 1
174 . 1 1 25 25 CYS H H 1 7.740 0.005 . 1 . . . . 25 CYS HN . 6877 1
175 . 1 1 25 25 CYS HA H 1 4.719 0.005 . 1 . . . . 25 CYS HA . 6877 1
176 . 1 1 25 25 CYS HB2 H 1 3.114 0.005 . 2 . . . . 25 CYS HB2 . 6877 1
177 . 1 1 25 25 CYS C C 13 172.310 0.08 . 1 . . . . 25 CYS C . 6877 1
178 . 1 1 25 25 CYS CA C 13 57.530 0.08 . 1 . . . . 25 CYS CA . 6877 1
179 . 1 1 25 25 CYS CB C 13 25.244 0.08 . 1 . . . . 25 CYS CB . 6877 1
180 . 1 1 25 25 CYS N N 15 116.310 0.08 . 1 . . . . 25 CYS N . 6877 1
181 . 1 1 26 26 THR H H 1 7.950 0.005 . 1 . . . . 26 THR HN . 6877 1
182 . 1 1 26 26 THR HA H 1 4.524 0.005 . 1 . . . . 26 THR HA . 6877 1
183 . 1 1 26 26 THR HB H 1 4.755 0.005 . 1 . . . . 26 THR HB . 6877 1
184 . 1 1 26 26 THR HG21 H 1 1.355 0.005 . 1 . . . . 26 THR HG2 . 6877 1
185 . 1 1 26 26 THR HG22 H 1 1.355 0.005 . 1 . . . . 26 THR HG2 . 6877 1
186 . 1 1 26 26 THR HG23 H 1 1.355 0.005 . 1 . . . . 26 THR HG2 . 6877 1
187 . 1 1 26 26 THR C C 13 173.840 0.08 . 1 . . . . 26 THR C . 6877 1
188 . 1 1 26 26 THR CA C 13 60.200 0.08 . 1 . . . . 26 THR CA . 6877 1
189 . 1 1 26 26 THR CB C 13 66.368 0.08 . 1 . . . . 26 THR CB . 6877 1
190 . 1 1 26 26 THR CG2 C 13 19.880 0.08 . 1 . . . . 26 THR CG2 . 6877 1
191 . 1 1 26 26 THR N N 15 110.390 0.08 . 1 . . . . 26 THR N . 6877 1
192 . 1 1 27 27 LEU H H 1 8.110 0.005 . 1 . . . . 27 LEU HN . 6877 1
193 . 1 1 27 27 LEU HA H 1 4.663 0.005 . 1 . . . . 27 LEU HA . 6877 1
194 . 1 1 27 27 LEU C C 13 171.130 0.08 . 1 . . . . 27 LEU C . 6877 1
195 . 1 1 27 27 LEU CA C 13 52.270 0.08 . 1 . . . . 27 LEU CA . 6877 1
196 . 1 1 27 27 LEU N N 15 120.660 0.08 . 1 . . . . 27 LEU N . 6877 1
197 . 1 1 28 28 TYR H H 1 7.030 0.005 . 1 . . . . 28 TYR HN . 6877 1
198 . 1 1 28 28 TYR HA H 1 4.700 0.005 . 1 . . . . 28 TYR HA . 6877 1
199 . 1 1 28 28 TYR C C 13 172.090 0.08 . 1 . . . . 28 TYR C . 6877 1
200 . 1 1 28 28 TYR CA C 13 54.000 0.08 . 1 . . . . 28 TYR CA . 6877 1
201 . 1 1 28 28 TYR N N 15 110.580 0.08 . 1 . . . . 28 TYR N . 6877 1
202 . 1 1 29 29 THR H H 1 8.920 0.005 . 1 . . . . 29 THR HN . 6877 1
203 . 1 1 29 29 THR HA H 1 4.397 0.005 . 1 . . . . 29 THR HA . 6877 1
204 . 1 1 29 29 THR HB H 1 4.037 0.005 . 1 . . . . 29 THR HB . 6877 1
205 . 1 1 29 29 THR HG21 H 1 1.188 0.005 . 1 . . . . 29 THR HG2 . 6877 1
206 . 1 1 29 29 THR HG22 H 1 1.188 0.005 . 1 . . . . 29 THR HG2 . 6877 1
207 . 1 1 29 29 THR HG23 H 1 1.188 0.005 . 1 . . . . 29 THR HG2 . 6877 1
208 . 1 1 29 29 THR C C 13 172.380 0.08 . 1 . . . . 29 THR C . 6877 1
209 . 1 1 29 29 THR CA C 13 61.000 0.08 . 1 . . . . 29 THR CA . 6877 1
210 . 1 1 29 29 THR CB C 13 66.300 0.08 . 1 . . . . 29 THR CB . 6877 1
211 . 1 1 29 29 THR CG2 C 13 20.625 0.08 . 1 . . . . 29 THR CG2 . 6877 1
212 . 1 1 29 29 THR N N 15 112.930 0.08 . 1 . . . . 29 THR N . 6877 1
213 . 1 1 30 30 ALA H H 1 7.440 0.005 . 1 . . . . 30 ALA HN . 6877 1
214 . 1 1 30 30 ALA HA H 1 4.822 0.005 . 1 . . . . 30 ALA HA . 6877 1
215 . 1 1 30 30 ALA HB1 H 1 0.994 0.005 . 1 . . . . 30 ALA HB . 6877 1
216 . 1 1 30 30 ALA HB2 H 1 0.994 0.005 . 1 . . . . 30 ALA HB . 6877 1
217 . 1 1 30 30 ALA HB3 H 1 0.994 0.005 . 1 . . . . 30 ALA HB . 6877 1
218 . 1 1 30 30 ALA C C 13 172.370 0.08 . 1 . . . . 30 ALA C . 6877 1
219 . 1 1 30 30 ALA CA C 13 49.350 0.08 . 1 . . . . 30 ALA CA . 6877 1
220 . 1 1 30 30 ALA CB C 13 20.370 0.08 . 1 . . . . 30 ALA CB . 6877 1
221 . 1 1 30 30 ALA N N 15 123.330 0.08 . 1 . . . . 30 ALA N . 6877 1
222 . 1 1 31 31 VAL H H 1 9.000 0.005 . 1 . . . . 31 VAL HN . 6877 1
223 . 1 1 31 31 VAL HA H 1 5.706 0.005 . 1 . . . . 31 VAL HA . 6877 1
224 . 1 1 31 31 VAL HB H 1 1.830 0.005 . 1 . . . . 31 VAL HB . 6877 1
225 . 1 1 31 31 VAL HG11 H 1 1.136 0.005 . 2 . . . . 31 VAL HG1 . 6877 1
226 . 1 1 31 31 VAL HG12 H 1 1.136 0.005 . 2 . . . . 31 VAL HG1 . 6877 1
227 . 1 1 31 31 VAL HG13 H 1 1.136 0.005 . 2 . . . . 31 VAL HG1 . 6877 1
228 . 1 1 31 31 VAL HG21 H 1 1.068 0.005 . 2 . . . . 31 VAL HG2 . 6877 1
229 . 1 1 31 31 VAL HG22 H 1 1.068 0.005 . 2 . . . . 31 VAL HG2 . 6877 1
230 . 1 1 31 31 VAL HG23 H 1 1.068 0.005 . 2 . . . . 31 VAL HG2 . 6877 1
231 . 1 1 31 31 VAL C C 13 173.090 0.08 . 1 . . . . 31 VAL C . 6877 1
232 . 1 1 31 31 VAL CA C 13 56.900 0.08 . 1 . . . . 31 VAL CA . 6877 1
233 . 1 1 31 31 VAL CB C 13 32.380 0.08 . 1 . . . . 31 VAL CB . 6877 1
234 . 1 1 31 31 VAL CG1 C 13 17.298 0.08 . 1 . . . . 31 VAL CG1 . 6877 1
235 . 1 1 31 31 VAL CG2 C 13 20.160 0.08 . 1 . . . . 31 VAL CG2 . 6877 1
236 . 1 1 31 31 VAL N N 15 116.160 0.08 . 1 . . . . 31 VAL N . 6877 1
237 . 1 1 32 32 SER H H 1 9.955 0.005 . 1 . . . . 32 SER HN . 6877 1
238 . 1 1 32 32 SER HA H 1 5.242 0.005 . 1 . . . . 32 SER HA . 6877 1
239 . 1 1 32 32 SER C C 13 171.730 0.08 . 1 . . . . 32 SER C . 6877 1
240 . 1 1 32 32 SER CA C 13 57.270 0.08 . 1 . . . . 32 SER CA . 6877 1
241 . 1 1 32 32 SER N N 15 128.460 0.08 . 1 . . . . 32 SER N . 6877 1
242 . 1 1 33 33 SER H H 1 8.730 0.005 . 1 . . . . 33 SER HN . 6877 1
243 . 1 1 33 33 SER HA H 1 4.324 0.005 . 1 . . . . 33 SER HA . 6877 1
244 . 1 1 33 33 SER HB2 H 1 3.195 0.005 . 2 . . . . 33 SER HB2 . 6877 1
245 . 1 1 33 33 SER C C 13 170.910 0.08 . 1 . . . . 33 SER C . 6877 1
246 . 1 1 33 33 SER CA C 13 56.860 0.08 . 1 . . . . 33 SER CA . 6877 1
247 . 1 1 33 33 SER CB C 13 61.440 0.08 . 1 . . . . 33 SER CB . 6877 1
248 . 1 1 33 33 SER N N 15 113.070 0.08 . 1 . . . . 33 SER N . 6877 1
249 . 1 1 34 34 THR H H 1 10.010 0.005 . 1 . . . . 34 THR HN . 6877 1
250 . 1 1 34 34 THR HA H 1 4.787 0.005 . 1 . . . . 34 THR HA . 6877 1
251 . 1 1 34 34 THR HB H 1 4.110 0.005 . 1 . . . . 34 THR HB . 6877 1
252 . 1 1 34 34 THR HG21 H 1 1.210 0.005 . 1 . . . . 34 THR HG2 . 6877 1
253 . 1 1 34 34 THR HG22 H 1 1.210 0.005 . 1 . . . . 34 THR HG2 . 6877 1
254 . 1 1 34 34 THR HG23 H 1 1.210 0.005 . 1 . . . . 34 THR HG2 . 6877 1
255 . 1 1 34 34 THR C C 13 173.010 0.08 . 1 . . . . 34 THR C . 6877 1
256 . 1 1 34 34 THR CA C 13 60.970 0.08 . 1 . . . . 34 THR CA . 6877 1
257 . 1 1 34 34 THR CB C 13 65.980 0.08 . 1 . . . . 34 THR CB . 6877 1
258 . 1 1 34 34 THR CG2 C 13 21.600 0.08 . 1 . . . . 34 THR CG2 . 6877 1
259 . 1 1 34 34 THR N N 15 121.560 0.08 . 1 . . . . 34 THR N . 6877 1
260 . 1 1 35 35 TRP H H 1 9.760 0.005 . 1 . . . . 35 TRP HN . 6877 1
261 . 1 1 35 35 TRP HA H 1 5.070 0.005 . 1 . . . . 35 TRP HA . 6877 1
262 . 1 1 35 35 TRP C C 13 170.270 0.08 . 1 . . . . 35 TRP C . 6877 1
263 . 1 1 35 35 TRP CA C 13 52.570 0.08 . 1 . . . . 35 TRP CA . 6877 1
264 . 1 1 35 35 TRP N N 15 131.650 0.08 . 1 . . . . 35 TRP N . 6877 1
265 . 1 1 36 36 HIS H H 1 8.321 0.005 . 1 . . . . 36 HIS HN . 6877 1
266 . 1 1 36 36 HIS HA H 1 4.410 0.005 . 1 . . . . 36 HIS HA . 6877 1
267 . 1 1 36 36 HIS C C 13 171.450 0.08 . 1 . . . . 36 HIS C . 6877 1
268 . 1 1 36 36 HIS CA C 13 52.280 0.08 . 1 . . . . 36 HIS CA . 6877 1
269 . 1 1 36 36 HIS N N 15 109.246 0.08 . 1 . . . . 36 HIS N . 6877 1
270 . 1 1 37 37 TRP H H 1 8.780 0.005 . 1 . . . . 37 TRP HN . 6877 1
271 . 1 1 37 37 TRP HA H 1 5.263 0.005 . 1 . . . . 37 TRP HA . 6877 1
272 . 1 1 37 37 TRP HE1 H 1 10.000 0.005 . 1 . . . . 37 TRP HE1 . 6877 1
273 . 1 1 37 37 TRP C C 13 175.420 0.08 . 1 . . . . 37 TRP C . 6877 1
274 . 1 1 37 37 TRP CA C 13 54.300 0.08 . 1 . . . . 37 TRP CA . 6877 1
275 . 1 1 37 37 TRP N N 15 120.890 0.08 . 1 . . . . 37 TRP N . 6877 1
276 . 1 1 37 37 TRP NE1 N 15 128.620 0.08 . 1 . . . . 37 TRP NE1 . 6877 1
277 . 1 1 38 38 THR H H 1 8.900 0.005 . 1 . . . . 38 THR HN . 6877 1
278 . 1 1 38 38 THR HA H 1 5.013 0.005 . 1 . . . . 38 THR HA . 6877 1
279 . 1 1 38 38 THR HB H 1 4.448 0.005 . 1 . . . . 38 THR HB . 6877 1
280 . 1 1 38 38 THR HG21 H 1 1.430 0.005 . 1 . . . . 38 THR HG2 . 6877 1
281 . 1 1 38 38 THR HG22 H 1 1.430 0.005 . 1 . . . . 38 THR HG2 . 6877 1
282 . 1 1 38 38 THR HG23 H 1 1.430 0.005 . 1 . . . . 38 THR HG2 . 6877 1
283 . 1 1 38 38 THR C C 13 172.920 0.08 . 1 . . . . 38 THR C . 6877 1
284 . 1 1 38 38 THR CA C 13 59.220 0.08 . 1 . . . . 38 THR CA . 6877 1
285 . 1 1 38 38 THR CB C 13 69.026 0.08 . 1 . . . . 38 THR CB . 6877 1
286 . 1 1 38 38 THR CG2 C 13 19.560 0.08 . 1 . . . . 38 THR CG2 . 6877 1
287 . 1 1 38 38 THR N N 15 114.000 0.08 . 1 . . . . 38 THR N . 6877 1
288 . 1 1 39 39 GLY H H 1 8.670 0.005 . 1 . . . . 39 GLY HN . 6877 1
289 . 1 1 39 39 GLY CA C 13 42.980 0.08 . 1 . . . . 39 GLY CA . 6877 1
290 . 1 1 39 39 GLY N N 15 108.750 0.08 . 1 . . . . 39 GLY N . 6877 1
291 . 1 1 40 40 HIS H H 1 8.120 0.005 . 1 . . . . 40 HIS HN . 6877 1
292 . 1 1 40 40 HIS CA C 13 53.240 0.08 . 1 . . . . 40 HIS CA . 6877 1
293 . 1 1 40 40 HIS N N 15 118.038 0.08 . 1 . . . . 40 HIS N . 6877 1
294 . 1 1 41 41 ASN HA H 1 4.772 0.005 . 1 . . . . 41 ASN HA . 6877 1
295 . 1 1 41 41 ASN HB2 H 1 2.916 0.005 . 2 . . . . 41 ASN HB1 . 6877 1
296 . 1 1 41 41 ASN HB3 H 1 2.791 0.005 . 2 . . . . 41 ASN HB2 . 6877 1
297 . 1 1 41 41 ASN C C 13 172.920 0.08 . 1 . . . . 41 ASN C . 6877 1
298 . 1 1 41 41 ASN CA C 13 51.020 0.08 . 1 . . . . 41 ASN CA . 6877 1
299 . 1 1 41 41 ASN CB C 13 36.090 0.08 . 1 . . . . 41 ASN CB . 6877 1
300 . 1 1 42 42 VAL H H 1 7.800 0.005 . 1 . . . . 42 VAL HN . 6877 1
301 . 1 1 42 42 VAL HA H 1 4.198 0.005 . 1 . . . . 42 VAL HA . 6877 1
302 . 1 1 42 42 VAL HB H 1 2.165 0.005 . 1 . . . . 42 VAL HB . 6877 1
303 . 1 1 42 42 VAL HG11 H 1 0.957 0.005 . 2 . . . . 42 VAL HG1 . 6877 1
304 . 1 1 42 42 VAL HG12 H 1 0.957 0.005 . 2 . . . . 42 VAL HG1 . 6877 1
305 . 1 1 42 42 VAL HG13 H 1 0.957 0.005 . 2 . . . . 42 VAL HG1 . 6877 1
306 . 1 1 42 42 VAL HG21 H 1 0.944 0.005 . 2 . . . . 42 VAL HG2 . 6877 1
307 . 1 1 42 42 VAL HG22 H 1 0.944 0.005 . 2 . . . . 42 VAL HG2 . 6877 1
308 . 1 1 42 42 VAL HG23 H 1 0.944 0.005 . 2 . . . . 42 VAL HG2 . 6877 1
309 . 1 1 42 42 VAL C C 13 174.240 0.08 . 1 . . . . 42 VAL C . 6877 1
310 . 1 1 42 42 VAL CA C 13 60.080 0.08 . 1 . . . . 42 VAL CA . 6877 1
311 . 1 1 42 42 VAL CB C 13 30.680 0.08 . 1 . . . . 42 VAL CB . 6877 1
312 . 1 1 42 42 VAL CG1 C 13 18.190 0.08 . 1 . . . . 42 VAL CG1 . 6877 1
313 . 1 1 42 42 VAL CG2 C 13 19.250 0.08 . 1 . . . . 42 VAL CG2 . 6877 1
314 . 1 1 42 42 VAL N N 15 118.590 0.08 . 1 . . . . 42 VAL N . 6877 1
315 . 1 1 43 43 LYS H H 1 8.390 0.005 . 1 . . . . 43 LYS HN . 6877 1
316 . 1 1 43 43 LYS HA H 1 4.359 0.005 . 1 . . . . 43 LYS HA . 6877 1
317 . 1 1 43 43 LYS HB2 H 1 1.708 0.005 . 2 . . . . 43 LYS HB1 . 6877 1
318 . 1 1 43 43 LYS HB3 H 1 1.741 0.005 . 2 . . . . 43 LYS HB2 . 6877 1
319 . 1 1 43 43 LYS CA C 13 54.530 0.08 . 1 . . . . 43 LYS CA . 6877 1
320 . 1 1 43 43 LYS CB C 13 30.460 0.08 . 1 . . . . 43 LYS CB . 6877 1
321 . 1 1 43 43 LYS CG C 13 30.468 0.08 . 1 . . . . 43 LYS CG . 6877 1
322 . 1 1 43 43 LYS N N 15 123.970 0.08 . 1 . . . . 43 LYS N . 6877 1
323 . 1 1 45 45 LYS HA H 1 4.400 0.005 . 1 . . . . 45 LYS HA . 6877 1
324 . 1 1 45 45 LYS HB2 H 1 1.776 0.005 . 2 . . . . 45 LYS HB1 . 6877 1
325 . 1 1 45 45 LYS HB3 H 1 1.974 0.005 . 2 . . . . 45 LYS HB2 . 6877 1
326 . 1 1 45 45 LYS C C 13 174.220 0.08 . 1 . . . . 45 LYS C . 6877 1
327 . 1 1 45 45 LYS CA C 13 54.120 0.08 . 1 . . . . 45 LYS CA . 6877 1
328 . 1 1 45 45 LYS CB C 13 30.450 0.08 . 1 . . . . 45 LYS CB . 6877 1
329 . 1 1 46 46 SER H H 1 7.980 0.005 . 1 . . . . 46 SER HN . 6877 1
330 . 1 1 46 46 SER HA H 1 4.556 0.005 . 1 . . . . 46 SER HA . 6877 1
331 . 1 1 46 46 SER HB2 H 1 3.903 0.005 . 2 . . . . 46 SER HB1 . 6877 1
332 . 1 1 46 46 SER HB3 H 1 3.842 0.005 . 2 . . . . 46 SER HB2 . 6877 1
333 . 1 1 46 46 SER C C 13 170.490 0.08 . 1 . . . . 46 SER C . 6877 1
334 . 1 1 46 46 SER CA C 13 55.850 0.08 . 1 . . . . 46 SER CA . 6877 1
335 . 1 1 46 46 SER CB C 13 62.200 0.08 . 1 . . . . 46 SER CB . 6877 1
336 . 1 1 46 46 SER N N 15 115.510 0.08 . 1 . . . . 46 SER N . 6877 1
337 . 1 1 47 47 ALA H H 1 8.490 0.005 . 1 . . . . 47 ALA HN . 6877 1
338 . 1 1 47 47 ALA HA H 1 4.753 0.005 . 1 . . . . 47 ALA HA . 6877 1
339 . 1 1 47 47 ALA HB1 H 1 1.418 0.005 . 1 . . . . 47 ALA HB . 6877 1
340 . 1 1 47 47 ALA HB2 H 1 1.418 0.005 . 1 . . . . 47 ALA HB . 6877 1
341 . 1 1 47 47 ALA HB3 H 1 1.418 0.005 . 1 . . . . 47 ALA HB . 6877 1
342 . 1 1 47 47 ALA C C 13 173.480 0.08 . 1 . . . . 47 ALA C . 6877 1
343 . 1 1 47 47 ALA CA C 13 48.640 0.08 . 1 . . . . 47 ALA CA . 6877 1
344 . 1 1 47 47 ALA CB C 13 18.100 0.08 . 1 . . . . 47 ALA CB . 6877 1
345 . 1 1 47 47 ALA N N 15 126.720 0.08 . 1 . . . . 47 ALA N . 6877 1
346 . 1 1 48 48 ILE H H 1 8.670 0.005 . 1 . . . . 48 ILE HN . 6877 1
347 . 1 1 48 48 ILE HA H 1 4.802 0.005 . 1 . . . . 48 ILE HA . 6877 1
348 . 1 1 48 48 ILE HG21 H 1 0.113 0.005 . 1 . . . . 48 ILE HG2 . 6877 1
349 . 1 1 48 48 ILE HG22 H 1 0.113 0.005 . 1 . . . . 48 ILE HG2 . 6877 1
350 . 1 1 48 48 ILE HG23 H 1 0.113 0.005 . 1 . . . . 48 ILE HG2 . 6877 1
351 . 1 1 48 48 ILE HD11 H 1 -0.469 0.005 . 1 . . . . 48 ILE HD1 . 6877 1
352 . 1 1 48 48 ILE HD12 H 1 -0.469 0.005 . 1 . . . . 48 ILE HD1 . 6877 1
353 . 1 1 48 48 ILE HD13 H 1 -0.469 0.005 . 1 . . . . 48 ILE HD1 . 6877 1
354 . 1 1 48 48 ILE C C 13 172.560 0.08 . 1 . . . . 48 ILE C . 6877 1
355 . 1 1 48 48 ILE CA C 13 58.200 0.08 . 1 . . . . 48 ILE CA . 6877 1
356 . 1 1 48 48 ILE CG2 C 13 15.790 0.08 . 1 . . . . 48 ILE CG2 . 6877 1
357 . 1 1 48 48 ILE CD1 C 13 10.880 0.08 . 1 . . . . 48 ILE CD1 . 6877 1
358 . 1 1 48 48 ILE N N 15 119.310 0.08 . 1 . . . . 48 ILE N . 6877 1
359 . 1 1 49 49 VAL H H 1 8.640 0.005 . 1 . . . . 49 VAL HN . 6877 1
360 . 1 1 49 49 VAL HB H 1 1.867 0.005 . 1 . . . . 49 VAL HB . 6877 1
361 . 1 1 49 49 VAL HG11 H 1 0.961 0.005 . 2 . . . . 49 VAL HG1 . 6877 1
362 . 1 1 49 49 VAL HG12 H 1 0.961 0.005 . 2 . . . . 49 VAL HG1 . 6877 1
363 . 1 1 49 49 VAL HG13 H 1 0.961 0.005 . 2 . . . . 49 VAL HG1 . 6877 1
364 . 1 1 49 49 VAL HG21 H 1 1.021 0.005 . 2 . . . . 49 VAL HG2 . 6877 1
365 . 1 1 49 49 VAL HG22 H 1 1.021 0.005 . 2 . . . . 49 VAL HG2 . 6877 1
366 . 1 1 49 49 VAL HG23 H 1 1.021 0.005 . 2 . . . . 49 VAL HG2 . 6877 1
367 . 1 1 49 49 VAL C C 13 172.280 0.08 . 1 . . . . 49 VAL C . 6877 1
368 . 1 1 49 49 VAL CA C 13 59.860 0.08 . 1 . . . . 49 VAL CA . 6877 1
369 . 1 1 49 49 VAL CB C 13 34.290 0.08 . 1 . . . . 49 VAL CB . 6877 1
370 . 1 1 49 49 VAL CG1 C 13 23.100 0.08 . 1 . . . . 49 VAL CG1 . 6877 1
371 . 1 1 49 49 VAL CG2 C 13 20.160 0.08 . 1 . . . . 49 VAL CG2 . 6877 1
372 . 1 1 49 49 VAL N N 15 122.200 0.08 . 1 . . . . 49 VAL N . 6877 1
373 . 1 1 50 50 THR H H 1 9.399 0.005 . 1 . . . . 50 THR HN . 6877 1
374 . 1 1 50 50 THR HA H 1 5.622 0.005 . 1 . . . . 50 THR HA . 6877 1
375 . 1 1 50 50 THR HB H 1 3.729 0.005 . 1 . . . . 50 THR HB . 6877 1
376 . 1 1 50 50 THR C C 13 171.920 0.08 . 1 . . . . 50 THR C . 6877 1
377 . 1 1 50 50 THR CA C 13 59.390 0.08 . 1 . . . . 50 THR CA . 6877 1
378 . 1 1 50 50 THR CB C 13 60.795 0.08 . 1 . . . . 50 THR CB . 6877 1
379 . 1 1 50 50 THR N N 15 125.070 0.08 . 1 . . . . 50 THR N . 6877 1
380 . 1 1 51 51 LEU H H 1 9.340 0.005 . 1 . . . . 51 LEU HN . 6877 1
381 . 1 1 51 51 LEU HD11 H 1 0.720 0.005 . 2 . . . . 51 LEU HD1 . 6877 1
382 . 1 1 51 51 LEU HD12 H 1 0.720 0.005 . 2 . . . . 51 LEU HD1 . 6877 1
383 . 1 1 51 51 LEU HD13 H 1 0.720 0.005 . 2 . . . . 51 LEU HD1 . 6877 1
384 . 1 1 51 51 LEU HD21 H 1 0.024 0.005 . 2 . . . . 51 LEU HD2 . 6877 1
385 . 1 1 51 51 LEU HD22 H 1 0.024 0.005 . 2 . . . . 51 LEU HD2 . 6877 1
386 . 1 1 51 51 LEU HD23 H 1 0.024 0.005 . 2 . . . . 51 LEU HD2 . 6877 1
387 . 1 1 51 51 LEU C C 13 173.870 0.08 . 1 . . . . 51 LEU C . 6877 1
388 . 1 1 51 51 LEU CA C 13 53.310 0.08 . 1 . . . . 51 LEU CA . 6877 1
389 . 1 1 51 51 LEU CD1 C 13 23.770 0.08 . 1 . . . . 51 LEU CD1 . 6877 1
390 . 1 1 51 51 LEU CD2 C 13 24.986 0.08 . 1 . . . . 51 LEU CD2 . 6877 1
391 . 1 1 51 51 LEU N N 15 126.670 0.08 . 1 . . . . 51 LEU N . 6877 1
392 . 1 1 52 52 THR H H 1 8.250 0.005 . 1 . . . . 52 THR HN . 6877 1
393 . 1 1 52 52 THR HA H 1 5.077 0.005 . 1 . . . . 52 THR HA . 6877 1
394 . 1 1 52 52 THR HB H 1 4.077 0.005 . 1 . . . . 52 THR HB . 6877 1
395 . 1 1 52 52 THR HG21 H 1 0.902 0.005 . 1 . . . . 52 THR HG2 . 6877 1
396 . 1 1 52 52 THR HG22 H 1 0.902 0.005 . 1 . . . . 52 THR HG2 . 6877 1
397 . 1 1 52 52 THR HG23 H 1 0.902 0.005 . 1 . . . . 52 THR HG2 . 6877 1
398 . 1 1 52 52 THR C C 13 171.070 0.08 . 1 . . . . 52 THR C . 6877 1
399 . 1 1 52 52 THR CA C 13 56.630 0.08 . 1 . . . . 52 THR CA . 6877 1
400 . 1 1 52 52 THR CB C 13 68.660 0.08 . 1 . . . . 52 THR CB . 6877 1
401 . 1 1 52 52 THR CG2 C 13 20.365 0.08 . 1 . . . . 52 THR CG2 . 6877 1
402 . 1 1 52 52 THR N N 15 107.750 0.08 . 1 . . . . 52 THR N . 6877 1
403 . 1 1 53 53 TYR H H 1 7.380 0.005 . 1 . . . . 53 TYR HN . 6877 1
404 . 1 1 53 53 TYR HA H 1 4.985 0.005 . 1 . . . . 53 TYR HA . 6877 1
405 . 1 1 53 53 TYR C C 13 173.750 0.08 . 1 . . . . 53 TYR C . 6877 1
406 . 1 1 53 53 TYR CA C 13 54.800 0.08 . 1 . . . . 53 TYR CA . 6877 1
407 . 1 1 53 53 TYR N N 15 115.410 0.08 . 1 . . . . 53 TYR N . 6877 1
408 . 1 1 54 54 ASP H H 1 9.400 0.005 . 1 . . . . 54 ASP HN . 6877 1
409 . 1 1 54 54 ASP HA H 1 4.687 0.005 . 1 . . . . 54 ASP HA . 6877 1
410 . 1 1 54 54 ASP HB2 H 1 2.763 0.005 . 2 . . . . 54 ASP HB1 . 6877 1
411 . 1 1 54 54 ASP HB3 H 1 2.651 0.005 . 2 . . . . 54 ASP HB2 . 6877 1
412 . 1 1 54 54 ASP C C 13 174.590 0.08 . 1 . . . . 54 ASP C . 6877 1
413 . 1 1 54 54 ASP CA C 13 52.900 0.08 . 1 . . . . 54 ASP CA . 6877 1
414 . 1 1 54 54 ASP CB C 13 39.990 0.08 . 1 . . . . 54 ASP CB . 6877 1
415 . 1 1 54 54 ASP N N 15 119.450 0.08 . 1 . . . . 54 ASP N . 6877 1
416 . 1 1 55 55 SER H H 1 7.550 0.005 . 1 . . . . 55 SER HN . 6877 1
417 . 1 1 55 55 SER HA H 1 4.869 0.005 . 1 . . . . 55 SER HA . 6877 1
418 . 1 1 55 55 SER HB2 H 1 4.339 0.005 . 2 . . . . 55 SER HB1 . 6877 1
419 . 1 1 55 55 SER C C 13 172.620 0.08 . 1 . . . . 55 SER C . 6877 1
420 . 1 1 55 55 SER CA C 13 54.680 0.08 . 1 . . . . 55 SER CA . 6877 1
421 . 1 1 55 55 SER CB C 13 63.365 0.08 . 1 . . . . 55 SER CB . 6877 1
422 . 1 1 55 55 SER N N 15 106.060 0.08 . 1 . . . . 55 SER N . 6877 1
423 . 1 1 56 56 GLU H H 1 9.570 0.005 . 1 . . . . 56 GLU HN . 6877 1
424 . 1 1 56 56 GLU HA H 1 3.816 0.005 . 1 . . . . 56 GLU HA . 6877 1
425 . 1 1 56 56 GLU HB2 H 1 2.360 0.005 . 2 . . . . 56 GLU HB1 . 6877 1
426 . 1 1 56 56 GLU HB3 H 1 2.176 0.005 . 2 . . . . 56 GLU HB2 . 6877 1
427 . 1 1 56 56 GLU HG2 H 1 2.548 0.005 . 2 . . . . 56 GLU HG1 . 6877 1
428 . 1 1 56 56 GLU HG3 H 1 2.347 0.005 . 2 . . . . 56 GLU HG2 . 6877 1
429 . 1 1 56 56 GLU C C 13 175.990 0.08 . 1 . . . . 56 GLU C . 6877 1
430 . 1 1 56 56 GLU CA C 13 58.490 0.08 . 1 . . . . 56 GLU CA . 6877 1
431 . 1 1 56 56 GLU CB C 13 27.210 0.08 . 1 . . . . 56 GLU CB . 6877 1
432 . 1 1 56 56 GLU CG C 13 36.250 0.08 . 1 . . . . 56 GLU CG . 6877 1
433 . 1 1 56 56 GLU N N 15 122.070 0.08 . 1 . . . . 56 GLU N . 6877 1
434 . 1 1 57 57 TRP H H 1 8.340 0.005 . 1 . . . . 57 TRP HN . 6877 1
435 . 1 1 57 57 TRP HA H 1 4.469 0.005 . 1 . . . . 57 TRP HA . 6877 1
436 . 1 1 57 57 TRP C C 13 175.920 0.08 . 1 . . . . 57 TRP C . 6877 1
437 . 1 1 57 57 TRP CA C 13 58.640 0.08 . 1 . . . . 57 TRP CA . 6877 1
438 . 1 1 57 57 TRP N N 15 119.900 0.08 . 1 . . . . 57 TRP N . 6877 1
439 . 1 1 58 58 GLN H H 1 8.260 0.005 . 1 . . . . 58 GLN HN . 6877 1
440 . 1 1 58 58 GLN HA H 1 3.650 0.005 . 1 . . . . 58 GLN HA . 6877 1
441 . 1 1 58 58 GLN C C 13 175.230 0.08 . 1 . . . . 58 GLN C . 6877 1
442 . 1 1 58 58 GLN CA C 13 57.180 0.08 . 1 . . . . 58 GLN CA . 6877 1
443 . 1 1 58 58 GLN N N 15 120.940 0.08 . 1 . . . . 58 GLN N . 6877 1
444 . 1 1 59 59 ARG H H 1 7.320 0.005 . 1 . . . . 59 ARG HN . 6877 1
445 . 1 1 59 59 ARG HA H 1 2.964 0.005 . 1 . . . . 59 ARG HA . 6877 1
446 . 1 1 59 59 ARG HG2 H 1 0.624 0.005 . 2 . . . . 59 ARG HG2 . 6877 1
447 . 1 1 59 59 ARG HD2 H 1 2.983 0.005 . 2 . . . . 59 ARG HD1 . 6877 1
448 . 1 1 59 59 ARG HD3 H 1 2.418 0.005 . 2 . . . . 59 ARG HD2 . 6877 1
449 . 1 1 59 59 ARG C C 13 175.120 0.08 . 1 . . . . 59 ARG C . 6877 1
450 . 1 1 59 59 ARG CA C 13 57.070 0.08 . 1 . . . . 59 ARG CA . 6877 1
451 . 1 1 59 59 ARG CG C 13 22.330 0.08 . 1 . . . . 59 ARG CG . 6877 1
452 . 1 1 59 59 ARG CD C 13 41.970 0.08 . 1 . . . . 59 ARG CD . 6877 1
453 . 1 1 59 59 ARG N N 15 118.010 0.08 . 1 . . . . 59 ARG N . 6877 1
454 . 1 1 60 60 ASP H H 1 8.084 0.005 . 1 . . . . 60 ASP HN . 6877 1
455 . 1 1 60 60 ASP HA H 1 4.372 0.005 . 1 . . . . 60 ASP HA . 6877 1
456 . 1 1 60 60 ASP HB2 H 1 2.800 0.005 . 2 . . . . 60 ASP HB1 . 6877 1
457 . 1 1 60 60 ASP HB3 H 1 2.601 0.005 . 2 . . . . 60 ASP HB2 . 6877 1
458 . 1 1 60 60 ASP C C 13 177.900 0.08 . 1 . . . . 60 ASP C . 6877 1
459 . 1 1 60 60 ASP CA C 13 54.990 0.08 . 1 . . . . 60 ASP CA . 6877 1
460 . 1 1 60 60 ASP CB C 13 37.680 0.08 . 1 . . . . 60 ASP CB . 6877 1
461 . 1 1 60 60 ASP N N 15 118.710 0.08 . 1 . . . . 60 ASP N . 6877 1
462 . 1 1 61 61 GLN H H 1 8.050 0.005 . 1 . . . . 61 GLN HN . 6877 1
463 . 1 1 61 61 GLN HA H 1 3.859 0.005 . 1 . . . . 61 GLN HA . 6877 1
464 . 1 1 61 61 GLN HG2 H 1 1.644 0.005 . 2 . . . . 61 GLN HG1 . 6877 1
465 . 1 1 61 61 GLN HG3 H 1 1.458 0.005 . 2 . . . . 61 GLN HG2 . 6877 1
466 . 1 1 61 61 GLN C C 13 176.420 0.08 . 1 . . . . 61 GLN C . 6877 1
467 . 1 1 61 61 GLN CA C 13 56.130 0.08 . 1 . . . . 61 GLN CA . 6877 1
468 . 1 1 61 61 GLN CG C 13 30.680 0.08 . 1 . . . . 61 GLN CG . 6877 1
469 . 1 1 61 61 GLN N N 15 120.420 0.08 . 1 . . . . 61 GLN N . 6877 1
470 . 1 1 62 62 PHE H H 1 8.680 0.005 . 1 . . . . 62 PHE HN . 6877 1
471 . 1 1 62 62 PHE HA H 1 3.979 0.005 . 1 . . . . 62 PHE HA . 6877 1
472 . 1 1 62 62 PHE C C 13 174.700 0.08 . 1 . . . . 62 PHE C . 6877 1
473 . 1 1 62 62 PHE CA C 13 60.230 0.08 . 1 . . . . 62 PHE CA . 6877 1
474 . 1 1 62 62 PHE N N 15 121.060 0.08 . 1 . . . . 62 PHE N . 6877 1
475 . 1 1 63 63 LEU H H 1 8.380 0.005 . 1 . . . . 63 LEU HN . 6877 1
476 . 1 1 63 63 LEU HA H 1 3.930 0.005 . 1 . . . . 63 LEU HA . 6877 1
477 . 1 1 63 63 LEU HD21 H 1 0.884 0.005 . 2 . . . . 63 LEU HD2 . 6877 1
478 . 1 1 63 63 LEU HD22 H 1 0.884 0.005 . 2 . . . . 63 LEU HD2 . 6877 1
479 . 1 1 63 63 LEU HD23 H 1 0.884 0.005 . 2 . . . . 63 LEU HD2 . 6877 1
480 . 1 1 63 63 LEU C C 13 176.680 0.08 . 1 . . . . 63 LEU C . 6877 1
481 . 1 1 63 63 LEU CA C 13 54.370 0.08 . 1 . . . . 63 LEU CA . 6877 1
482 . 1 1 63 63 LEU CD2 C 13 23.330 0.08 . 1 . . . . 63 LEU CD2 . 6877 1
483 . 1 1 63 63 LEU N N 15 115.650 0.08 . 1 . . . . 63 LEU N . 6877 1
484 . 1 1 64 64 SER H H 1 7.780 0.005 . 1 . . . . 64 SER HN . 6877 1
485 . 1 1 64 64 SER HA H 1 4.465 0.005 . 1 . . . . 64 SER HA . 6877 1
486 . 1 1 64 64 SER HB2 H 1 4.021 0.005 . 2 . . . . 64 SER HB1 . 6877 1
487 . 1 1 64 64 SER HB3 H 1 3.949 0.005 . 2 . . . . 64 SER HB2 . 6877 1
488 . 1 1 64 64 SER C C 13 173.490 0.08 . 1 . . . . 64 SER C . 6877 1
489 . 1 1 64 64 SER CA C 13 57.690 0.08 . 1 . . . . 64 SER CA . 6877 1
490 . 1 1 64 64 SER CB C 13 61.520 0.08 . 1 . . . . 64 SER CB . 6877 1
491 . 1 1 64 64 SER N N 15 112.077 0.08 . 1 . . . . 64 SER N . 6877 1
492 . 1 1 65 65 GLN H H 1 7.640 0.005 . 1 . . . . 65 GLN HN . 6877 1
493 . 1 1 65 65 GLN HA H 1 4.321 0.005 . 1 . . . . 65 GLN HA . 6877 1
494 . 1 1 65 65 GLN HB2 H 1 1.972 0.005 . 2 . . . . 65 GLN HB1 . 6877 1
495 . 1 1 65 65 GLN HB3 H 1 1.746 0.005 . 2 . . . . 65 GLN HB2 . 6877 1
496 . 1 1 65 65 GLN HG2 H 1 2.349 0.005 . 2 . . . . 65 GLN HG1 . 6877 1
497 . 1 1 65 65 GLN HG3 H 1 2.284 0.005 . 2 . . . . 65 GLN HG2 . 6877 1
498 . 1 1 65 65 GLN C C 13 174.010 0.08 . 1 . . . . 65 GLN C . 6877 1
499 . 1 1 65 65 GLN CA C 13 54.770 0.08 . 1 . . . . 65 GLN CA . 6877 1
500 . 1 1 65 65 GLN CB C 13 28.490 0.08 . 1 . . . . 65 GLN CB . 6877 1
501 . 1 1 65 65 GLN CG C 13 31.960 0.08 . 1 . . . . 65 GLN CG . 6877 1
502 . 1 1 65 65 GLN N N 15 118.120 0.08 . 1 . . . . 65 GLN N . 6877 1
503 . 1 1 66 66 VAL H H 1 7.726 0.005 . 1 . . . . 66 VAL HN . 6877 1
504 . 1 1 66 66 VAL HA H 1 3.771 0.005 . 1 . . . . 66 VAL HA . 6877 1
505 . 1 1 66 66 VAL HB H 1 1.320 0.005 . 1 . . . . 66 VAL HB . 6877 1
506 . 1 1 66 66 VAL HG11 H 1 0.514 0.005 . 2 . . . . 66 VAL HG1 . 6877 1
507 . 1 1 66 66 VAL HG12 H 1 0.514 0.005 . 2 . . . . 66 VAL HG1 . 6877 1
508 . 1 1 66 66 VAL HG13 H 1 0.514 0.005 . 2 . . . . 66 VAL HG1 . 6877 1
509 . 1 1 66 66 VAL HG21 H 1 0.110 0.005 . 2 . . . . 66 VAL HG2 . 6877 1
510 . 1 1 66 66 VAL HG22 H 1 0.110 0.005 . 2 . . . . 66 VAL HG2 . 6877 1
511 . 1 1 66 66 VAL HG23 H 1 0.110 0.005 . 2 . . . . 66 VAL HG2 . 6877 1
512 . 1 1 66 66 VAL C C 13 172.560 0.08 . 1 . . . . 66 VAL C . 6877 1
513 . 1 1 66 66 VAL CA C 13 59.880 0.08 . 1 . . . . 66 VAL CA . 6877 1
514 . 1 1 66 66 VAL CB C 13 29.460 0.08 . 1 . . . . 66 VAL CB . 6877 1
515 . 1 1 66 66 VAL CG1 C 13 18.475 0.08 . 1 . . . . 66 VAL CG1 . 6877 1
516 . 1 1 66 66 VAL CG2 C 13 18.165 0.08 . 1 . . . . 66 VAL CG2 . 6877 1
517 . 1 1 66 66 VAL N N 15 119.780 0.08 . 1 . . . . 66 VAL N . 6877 1
518 . 1 1 67 67 LYS H H 1 8.120 0.005 . 1 . . . . 67 LYS HN . 6877 1
519 . 1 1 67 67 LYS HA H 1 4.283 0.005 . 1 . . . . 67 LYS HA . 6877 1
520 . 1 1 67 67 LYS HB2 H 1 1.815 0.005 . 2 . . . . 67 LYS HB1 . 6877 1
521 . 1 1 67 67 LYS HB3 H 1 1.739 0.005 . 2 . . . . 67 LYS HB2 . 6877 1
522 . 1 1 67 67 LYS C C 13 173.610 0.08 . 1 . . . . 67 LYS C . 6877 1
523 . 1 1 67 67 LYS CA C 13 53.430 0.08 . 1 . . . . 67 LYS CA . 6877 1
524 . 1 1 67 67 LYS CB C 13 29.495 0.08 . 1 . . . . 67 LYS CB . 6877 1
525 . 1 1 67 67 LYS N N 15 126.510 0.08 . 1 . . . . 67 LYS N . 6877 1
526 . 1 1 68 68 ILE H H 1 8.423 0.005 . 1 . . . . 68 ILE HN . 6877 1
527 . 1 1 68 68 ILE HA H 1 4.765 0.005 . 1 . . . . 68 ILE HA . 6877 1
528 . 1 1 68 68 ILE HB H 1 1.958 0.005 . 1 . . . . 68 ILE HB . 6877 1
529 . 1 1 68 68 ILE HG12 H 1 1.548 0.005 . 1 . . . . 68 ILE HG11 . 6877 1
530 . 1 1 68 68 ILE HG13 H 1 1.272 0.005 . 1 . . . . 68 ILE HG12 . 6877 1
531 . 1 1 68 68 ILE HG21 H 1 1.043 0.005 . 1 . . . . 68 ILE HG2 . 6877 1
532 . 1 1 68 68 ILE HG22 H 1 1.043 0.005 . 1 . . . . 68 ILE HG2 . 6877 1
533 . 1 1 68 68 ILE HG23 H 1 1.043 0.005 . 1 . . . . 68 ILE HG2 . 6877 1
534 . 1 1 68 68 ILE CA C 13 54.700 0.08 . 1 . . . . 68 ILE CA . 6877 1
535 . 1 1 68 68 ILE CB C 13 36.910 0.08 . 1 . . . . 68 ILE CB . 6877 1
536 . 1 1 68 68 ILE CG1 C 13 24.935 0.08 . 1 . . . . 68 ILE CG1 . 6877 1
537 . 1 1 68 68 ILE CG2 C 13 14.465 0.08 . 1 . . . . 68 ILE CG2 . 6877 1
538 . 1 1 68 68 ILE N N 15 127.590 0.08 . 1 . . . . 68 ILE N . 6877 1
539 . 1 1 69 69 PRO HA H 1 4.643 0.005 . 1 . . . . 69 PRO HA . 6877 1
540 . 1 1 69 69 PRO HB2 H 1 2.619 0.005 . 2 . . . . 69 PRO HB1 . 6877 1
541 . 1 1 69 69 PRO HG2 H 1 2.124 0.005 . 2 . . . . 69 PRO HG1 . 6877 1
542 . 1 1 69 69 PRO HG3 H 1 1.979 0.005 . 2 . . . . 69 PRO HG2 . 6877 1
543 . 1 1 69 69 PRO C C 13 175.440 0.08 . 1 . . . . 69 PRO C . 6877 1
544 . 1 1 69 69 PRO CA C 13 60.630 0.08 . 1 . . . . 69 PRO CA . 6877 1
545 . 1 1 69 69 PRO CB C 13 31.100 0.08 . 1 . . . . 69 PRO CB . 6877 1
546 . 1 1 69 69 PRO CG C 13 24.770 0.08 . 1 . . . . 69 PRO CG . 6877 1
547 . 1 1 70 70 LYS H H 1 8.690 0.005 . 1 . . . . 70 LYS HN . 6877 1
548 . 1 1 70 70 LYS HA H 1 4.364 0.005 . 1 . . . . 70 LYS HA . 6877 1
549 . 1 1 70 70 LYS HB2 H 1 2.052 0.005 . 2 . . . . 70 LYS HB1 . 6877 1
550 . 1 1 70 70 LYS HB3 H 1 1.998 0.005 . 2 . . . . 70 LYS HB2 . 6877 1
551 . 1 1 70 70 LYS C C 13 174.780 0.08 . 1 . . . . 70 LYS C . 6877 1
552 . 1 1 70 70 LYS CA C 13 55.800 0.08 . 1 . . . . 70 LYS CA . 6877 1
553 . 1 1 70 70 LYS CB C 13 29.650 0.08 . 1 . . . . 70 LYS CB . 6877 1
554 . 1 1 70 70 LYS N N 15 118.880 0.08 . 1 . . . . 70 LYS N . 6877 1
555 . 1 1 71 71 THR H H 1 7.290 0.005 . 1 . . . . 71 THR HN . 6877 1
556 . 1 1 71 71 THR HA H 1 4.216 0.005 . 1 . . . . 71 THR HA . 6877 1
557 . 1 1 71 71 THR HB H 1 4.573 0.005 . 1 . . . . 71 THR HB . 6877 1
558 . 1 1 71 71 THR HG21 H 1 1.373 0.005 . 1 . . . . 71 THR HG2 . 6877 1
559 . 1 1 71 71 THR HG22 H 1 1.373 0.005 . 1 . . . . 71 THR HG2 . 6877 1
560 . 1 1 71 71 THR HG23 H 1 1.373 0.005 . 1 . . . . 71 THR HG2 . 6877 1
561 . 1 1 71 71 THR C C 13 172.400 0.08 . 1 . . . . 71 THR C . 6877 1
562 . 1 1 71 71 THR CA C 13 59.300 0.08 . 1 . . . . 71 THR CA . 6877 1
563 . 1 1 71 71 THR CB C 13 66.050 0.08 . 1 . . . . 71 THR CB . 6877 1
564 . 1 1 71 71 THR CG2 C 13 20.560 0.08 . 1 . . . . 71 THR CG2 . 6877 1
565 . 1 1 71 71 THR N N 15 106.120 0.08 . 1 . . . . 71 THR N . 6877 1
566 . 1 1 72 72 ILE H H 1 7.850 0.005 . 1 . . . . 72 ILE HN . 6877 1
567 . 1 1 72 72 ILE HA H 1 4.725 0.005 . 1 . . . . 72 ILE HA . 6877 1
568 . 1 1 72 72 ILE HB H 1 2.208 0.005 . 1 . . . . 72 ILE HB . 6877 1
569 . 1 1 72 72 ILE HD11 H 1 0.727 0.005 . 1 . . . . 72 ILE HD1 . 6877 1
570 . 1 1 72 72 ILE HD12 H 1 0.727 0.005 . 1 . . . . 72 ILE HD1 . 6877 1
571 . 1 1 72 72 ILE HD13 H 1 0.727 0.005 . 1 . . . . 72 ILE HD1 . 6877 1
572 . 1 1 72 72 ILE C C 13 173.040 0.08 . 1 . . . . 72 ILE C . 6877 1
573 . 1 1 72 72 ILE CA C 13 55.310 0.08 . 1 . . . . 72 ILE CA . 6877 1
574 . 1 1 72 72 ILE CB C 13 34.850 0.08 . 1 . . . . 72 ILE CB . 6877 1
575 . 1 1 72 72 ILE CD1 C 13 7.908 0.08 . 1 . . . . 72 ILE CD1 . 6877 1
576 . 1 1 72 72 ILE N N 15 124.820 0.08 . 1 . . . . 72 ILE N . 6877 1
577 . 1 1 73 73 THR H H 1 8.970 0.005 . 1 . . . . 73 THR HN . 6877 1
578 . 1 1 73 73 THR HA H 1 4.642 0.005 . 1 . . . . 73 THR HA . 6877 1
579 . 1 1 73 73 THR HB H 1 4.142 0.005 . 1 . . . . 73 THR HB . 6877 1
580 . 1 1 73 73 THR HG21 H 1 1.334 0.005 . 1 . . . . 73 THR HG2 . 6877 1
581 . 1 1 73 73 THR HG22 H 1 1.334 0.005 . 1 . . . . 73 THR HG2 . 6877 1
582 . 1 1 73 73 THR HG23 H 1 1.334 0.005 . 1 . . . . 73 THR HG2 . 6877 1
583 . 1 1 73 73 THR C C 13 171.590 0.08 . 1 . . . . 73 THR C . 6877 1
584 . 1 1 73 73 THR CA C 13 59.540 0.08 . 1 . . . . 73 THR CA . 6877 1
585 . 1 1 73 73 THR CB C 13 68.000 0.08 . 1 . . . . 73 THR CB . 6877 1
586 . 1 1 73 73 THR CG2 C 13 19.110 0.08 . 1 . . . . 73 THR CG2 . 6877 1
587 . 1 1 73 73 THR N N 15 120.710 0.08 . 1 . . . . 73 THR N . 6877 1
588 . 1 1 74 74 VAL H H 1 8.700 0.005 . 1 . . . . 74 VAL HN . 6877 1
589 . 1 1 74 74 VAL HA H 1 4.779 0.005 . 1 . . . . 74 VAL HA . 6877 1
590 . 1 1 74 74 VAL HB H 1 2.177 0.005 . 1 . . . . 74 VAL HB . 6877 1
591 . 1 1 74 74 VAL HG11 H 1 1.007 0.005 . 2 . . . . 74 VAL HG1 . 6877 1
592 . 1 1 74 74 VAL HG12 H 1 1.007 0.005 . 2 . . . . 74 VAL HG1 . 6877 1
593 . 1 1 74 74 VAL HG13 H 1 1.007 0.005 . 2 . . . . 74 VAL HG1 . 6877 1
594 . 1 1 74 74 VAL HG21 H 1 0.946 0.005 . 2 . . . . 74 VAL HG2 . 6877 1
595 . 1 1 74 74 VAL HG22 H 1 0.946 0.005 . 2 . . . . 74 VAL HG2 . 6877 1
596 . 1 1 74 74 VAL HG23 H 1 0.946 0.005 . 2 . . . . 74 VAL HG2 . 6877 1
597 . 1 1 74 74 VAL C C 13 174.210 0.08 . 1 . . . . 74 VAL C . 6877 1
598 . 1 1 74 74 VAL CA C 13 59.510 0.08 . 1 . . . . 74 VAL CA . 6877 1
599 . 1 1 74 74 VAL CB C 13 31.310 0.08 . 1 . . . . 74 VAL CB . 6877 1
600 . 1 1 74 74 VAL CG1 C 13 19.154 0.08 . 1 . . . . 74 VAL CG1 . 6877 1
601 . 1 1 74 74 VAL CG2 C 13 19.092 0.08 . 1 . . . . 74 VAL CG2 . 6877 1
602 . 1 1 74 74 VAL N N 15 126.050 0.08 . 1 . . . . 74 VAL N . 6877 1
603 . 1 1 75 75 SER H H 1 9.120 0.005 . 1 . . . . 75 SER HN . 6877 1
604 . 1 1 75 75 SER HA H 1 5.171 0.005 . 1 . . . . 75 SER HA . 6877 1
605 . 1 1 75 75 SER HB2 H 1 4.122 0.005 . 2 . . . . 75 SER HB1 . 6877 1
606 . 1 1 75 75 SER HB3 H 1 3.897 0.005 . 2 . . . . 75 SER HB2 . 6877 1
607 . 1 1 75 75 SER C C 13 171.410 0.08 . 1 . . . . 75 SER C . 6877 1
608 . 1 1 75 75 SER CA C 13 54.840 0.08 . 1 . . . . 75 SER CA . 6877 1
609 . 1 1 75 75 SER CB C 13 63.220 0.08 . 1 . . . . 75 SER CB . 6877 1
610 . 1 1 75 75 SER N N 15 122.960 0.08 . 1 . . . . 75 SER N . 6877 1
611 . 1 1 76 76 THR H H 1 8.640 0.005 . 1 . . . . 76 THR HN . 6877 1
612 . 1 1 76 76 THR HA H 1 4.988 0.005 . 1 . . . . 76 THR HA . 6877 1
613 . 1 1 76 76 THR HB H 1 4.184 0.005 . 1 . . . . 76 THR HB . 6877 1
614 . 1 1 76 76 THR HG21 H 1 1.193 0.005 . 1 . . . . 76 THR HG2 . 6877 1
615 . 1 1 76 76 THR HG22 H 1 1.193 0.005 . 1 . . . . 76 THR HG2 . 6877 1
616 . 1 1 76 76 THR HG23 H 1 1.193 0.005 . 1 . . . . 76 THR HG2 . 6877 1
617 . 1 1 76 76 THR C C 13 171.790 0.08 . 1 . . . . 76 THR C . 6877 1
618 . 1 1 76 76 THR CA C 13 57.330 0.08 . 1 . . . . 76 THR CA . 6877 1
619 . 1 1 76 76 THR CB C 13 68.236 0.08 . 1 . . . . 76 THR CB . 6877 1
620 . 1 1 76 76 THR CG2 C 13 19.250 0.08 . 1 . . . . 76 THR CG2 . 6877 1
621 . 1 1 76 76 THR N N 15 113.460 0.08 . 1 . . . . 76 THR N . 6877 1
622 . 1 1 77 77 GLY H H 1 7.450 0.005 . 1 . . . . 77 GLY HN . 6877 1
623 . 1 1 77 77 GLY HA2 H 1 4.367 0.005 . 2 . . . . 77 GLY HA1 . 6877 1
624 . 1 1 77 77 GLY HA3 H 1 4.221 0.005 . 2 . . . . 77 GLY HA2 . 6877 1
625 . 1 1 77 77 GLY C C 13 170.320 0.08 . 1 . . . . 77 GLY C . 6877 1
626 . 1 1 77 77 GLY CA C 13 43.530 0.08 . 1 . . . . 77 GLY CA . 6877 1
627 . 1 1 77 77 GLY N N 15 107.330 0.08 . 1 . . . . 77 GLY N . 6877 1
628 . 1 1 78 78 PHE H H 1 9.060 0.005 . 1 . . . . 78 PHE HN . 6877 1
629 . 1 1 78 78 PHE HA H 1 5.706 0.005 . 1 . . . . 78 PHE HA . 6877 1
630 . 1 1 78 78 PHE C C 13 172.280 0.08 . 1 . . . . 78 PHE C . 6877 1
631 . 1 1 78 78 PHE CA C 13 54.500 0.08 . 1 . . . . 78 PHE CA . 6877 1
632 . 1 1 78 78 PHE N N 15 120.080 0.08 . 1 . . . . 78 PHE N . 6877 1
633 . 1 1 79 79 MET H H 1 9.360 0.005 . 1 . . . . 79 MET HN . 6877 1
634 . 1 1 79 79 MET HE1 H 1 2.401 0.005 . 1 . . . . 79 MET HE . 6877 1
635 . 1 1 79 79 MET HE2 H 1 2.401 0.005 . 1 . . . . 79 MET HE . 6877 1
636 . 1 1 79 79 MET HE3 H 1 2.401 0.005 . 1 . . . . 79 MET HE . 6877 1
637 . 1 1 79 79 MET C C 13 172.390 0.08 . 1 . . . . 79 MET C . 6877 1
638 . 1 1 79 79 MET CA C 13 53.440 0.08 . 1 . . . . 79 MET CA . 6877 1
639 . 1 1 79 79 MET CE C 13 14.540 0.08 . 1 . . . . 79 MET CE . 6877 1
640 . 1 1 79 79 MET N N 15 118.460 0.08 . 1 . . . . 79 MET N . 6877 1
641 . 1 1 80 80 SER H H 1 9.070 0.005 . 1 . . . . 80 SER HN . 6877 1
642 . 1 1 80 80 SER HB2 H 1 4.186 0.005 . 2 . . . . 80 SER HB1 . 6877 1
643 . 1 1 80 80 SER HB3 H 1 3.842 0.005 . 2 . . . . 80 SER HB2 . 6877 1
644 . 1 1 80 80 SER C C 13 170.440 0.08 . 1 . . . . 80 SER C . 6877 1
645 . 1 1 80 80 SER CA C 13 56.040 0.08 . 1 . . . . 80 SER CA . 6877 1
646 . 1 1 80 80 SER CB C 13 61.400 0.08 . 1 . . . . 80 SER CB . 6877 1
647 . 1 1 80 80 SER N N 15 121.350 0.08 . 1 . . . . 80 SER N . 6877 1
648 . 1 1 81 81 ILE H H 1 8.240 0.005 . 1 . . . . 81 ILE HN . 6877 1
649 . 1 1 81 81 ILE HA H 1 4.426 0.005 . 1 . . . . 81 ILE HA . 6877 1
650 . 1 1 81 81 ILE HB H 1 1.960 0.005 . 1 . . . . 81 ILE HB . 6877 1
651 . 1 1 81 81 ILE HG12 H 1 1.309 0.005 . 1 . . . . 81 ILE HG11 . 6877 1
652 . 1 1 81 81 ILE HG13 H 1 1.527 0.005 . 1 . . . . 81 ILE HG12 . 6877 1
653 . 1 1 81 81 ILE HG21 H 1 1.014 0.005 . 1 . . . . 81 ILE HG2 . 6877 1
654 . 1 1 81 81 ILE HG22 H 1 1.014 0.005 . 1 . . . . 81 ILE HG2 . 6877 1
655 . 1 1 81 81 ILE HG23 H 1 1.014 0.005 . 1 . . . . 81 ILE HG2 . 6877 1
656 . 1 1 81 81 ILE HD11 H 1 0.702 0.005 . 1 . . . . 81 ILE HD1 . 6877 1
657 . 1 1 81 81 ILE HD12 H 1 0.702 0.005 . 1 . . . . 81 ILE HD1 . 6877 1
658 . 1 1 81 81 ILE HD13 H 1 0.702 0.005 . 1 . . . . 81 ILE HD1 . 6877 1
659 . 1 1 81 81 ILE CA C 13 60.000 0.08 . 1 . . . . 81 ILE CA . 6877 1
660 . 1 1 81 81 ILE CB C 13 37.730 0.08 . 1 . . . . 81 ILE CB . 6877 1
661 . 1 1 81 81 ILE CG1 C 13 25.730 0.08 . 1 . . . . 81 ILE CG1 . 6877 1
662 . 1 1 81 81 ILE CG2 C 13 15.540 0.08 . 1 . . . . 81 ILE CG2 . 6877 1
663 . 1 1 81 81 ILE CD1 C 13 11.476 0.08 . 1 . . . . 81 ILE CD1 . 6877 1
664 . 1 1 81 81 ILE N N 15 129.890 0.08 . 1 . . . . 81 ILE N . 6877 1
stop_
save_