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 18390
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Fr822A-NMR
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 18390 1
2 '2D 1H-13C HSQC aliphatic' . . . 18390 1
3 '2D 1H-13C HSQC aromatic' . . . 18390 1
4 '3D CBCA(CO)NH' . . . 18390 1
5 '3D C(CO)NH' . . . 18390 1
6 '3D HNCO' . . . 18390 1
7 '3D HNCA' . . . 18390 1
8 '3D HNCACB' . . . 18390 1
9 '3D HBHA(CO)NH' . . . 18390 1
10 '3D HCCH-TOCSY' . . . 18390 1
11 '3D 1H-15N NOESY' . . . 18390 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 1 1 MET HA H 1 4.355 0.034 . 1 . . . A 1 MET HA . 18390 1
2 . 1 1 1 1 MET HB2 H 1 2.365 0.034 . 2 . . . A 1 MET HB2 . 18390 1
3 . 1 1 1 1 MET HB3 H 1 2.365 0.034 . 2 . . . A 1 MET HB3 . 18390 1
4 . 1 1 1 1 MET H H 1 8.302 0.034 . 1 . . . A 1 MET H1 . 18390 1
5 . 1 1 1 1 MET C C 13 176.559 0.100 . 1 . . . A 1 MET C . 18390 1
6 . 1 1 1 1 MET CA C 13 55.344 0.035 . 1 . . . A 1 MET CA . 18390 1
7 . 1 1 1 1 MET CB C 13 39.480 0.035 . 1 . . . A 1 MET CB . 18390 1
8 . 1 1 1 1 MET N N 15 121.584 0.014 . 1 . . . A 1 MET N . 18390 1
9 . 1 1 2 2 ASN H H 1 8.437 0.003 . 1 . . . A 2 ASN H . 18390 1
10 . 1 1 2 2 ASN HB2 H 1 2.712 0.034 . 2 . . . A 2 ASN HB2 . 18390 1
11 . 1 1 2 2 ASN HB3 H 1 2.712 0.034 . 2 . . . A 2 ASN HB3 . 18390 1
12 . 1 1 2 2 ASN C C 13 175.868 0.100 . 1 . . . A 2 ASN C . 18390 1
13 . 1 1 2 2 ASN CA C 13 53.057 0.035 . 1 . . . A 2 ASN CA . 18390 1
14 . 1 1 2 2 ASN CB C 13 39.102 0.035 . 1 . . . A 2 ASN CB . 18390 1
15 . 1 1 2 2 ASN N N 15 120.125 0.023 . 1 . . . A 2 ASN N . 18390 1
16 . 1 1 3 3 TYR H H 1 8.139 0.003 . 1 . . . A 3 TYR H . 18390 1
17 . 1 1 3 3 TYR HA H 1 4.584 0.007 . 1 . . . A 3 TYR HA . 18390 1
18 . 1 1 3 3 TYR HB2 H 1 2.916 0.003 . 2 . . . A 3 TYR HB2 . 18390 1
19 . 1 1 3 3 TYR HB3 H 1 3.088 0.005 . 2 . . . A 3 TYR HB3 . 18390 1
20 . 1 1 3 3 TYR C C 13 176.950 0.100 . 1 . . . A 3 TYR C . 18390 1
21 . 1 1 3 3 TYR CA C 13 58.017 0.128 . 1 . . . A 3 TYR CA . 18390 1
22 . 1 1 3 3 TYR CB C 13 39.087 0.080 . 1 . . . A 3 TYR CB . 18390 1
23 . 1 1 3 3 TYR N N 15 120.873 0.016 . 1 . . . A 3 TYR N . 18390 1
24 . 1 1 4 4 SER H H 1 8.298 0.004 . 1 . . . A 4 SER H . 18390 1
25 . 1 1 4 4 SER HA H 1 4.515 0.034 . 1 . . . A 4 SER HA . 18390 1
26 . 1 1 4 4 SER HB2 H 1 3.847 0.003 . 2 . . . A 4 SER HB2 . 18390 1
27 . 1 1 4 4 SER HB3 H 1 3.847 0.003 . 2 . . . A 4 SER HB3 . 18390 1
28 . 1 1 4 4 SER C C 13 175.812 0.100 . 1 . . . A 4 SER C . 18390 1
29 . 1 1 4 4 SER CA C 13 58.305 0.035 . 1 . . . A 4 SER CA . 18390 1
30 . 1 1 4 4 SER CB C 13 64.336 0.102 . 1 . . . A 4 SER CB . 18390 1
31 . 1 1 4 4 SER N N 15 117.320 0.043 . 1 . . . A 4 SER N . 18390 1
32 . 1 1 5 5 THR H H 1 8.213 0.003 . 1 . . . A 5 THR H . 18390 1
33 . 1 1 5 5 THR HA H 1 4.379 0.034 . 1 . . . A 5 THR HA . 18390 1
34 . 1 1 5 5 THR HB H 1 4.298 0.003 . 1 . . . A 5 THR HB . 18390 1
35 . 1 1 5 5 THR HG21 H 1 1.214 0.004 . 1 . . . A 5 THR HG21 . 18390 1
36 . 1 1 5 5 THR HG22 H 1 1.214 0.004 . 1 . . . A 5 THR HG22 . 18390 1
37 . 1 1 5 5 THR HG23 H 1 1.214 0.004 . 1 . . . A 5 THR HG23 . 18390 1
38 . 1 1 5 5 THR C C 13 176.355 0.100 . 1 . . . A 5 THR C . 18390 1
39 . 1 1 5 5 THR CA C 13 62.094 0.010 . 1 . . . A 5 THR CA . 18390 1
40 . 1 1 5 5 THR CB C 13 70.114 0.113 . 1 . . . A 5 THR CB . 18390 1
41 . 1 1 5 5 THR CG2 C 13 21.745 0.064 . 1 . . . A 5 THR CG2 . 18390 1
42 . 1 1 5 5 THR N N 15 115.184 0.015 . 1 . . . A 5 THR N . 18390 1
43 . 1 1 6 6 GLY H H 1 8.410 0.003 . 1 . . . A 6 GLY H . 18390 1
44 . 1 1 6 6 GLY HA2 H 1 3.996 0.034 . 2 . . . A 6 GLY HA2 . 18390 1
45 . 1 1 6 6 GLY HA3 H 1 3.996 0.034 . 2 . . . A 6 GLY HA3 . 18390 1
46 . 1 1 6 6 GLY C C 13 175.537 0.100 . 1 . . . A 6 GLY C . 18390 1
47 . 1 1 6 6 GLY CA C 13 45.467 0.035 . 1 . . . A 6 GLY CA . 18390 1
48 . 1 1 6 6 GLY N N 15 111.050 0.019 . 1 . . . A 6 GLY N . 18390 1
49 . 1 1 7 7 THR H H 1 8.080 0.003 . 1 . . . A 7 THR H . 18390 1
50 . 1 1 7 7 THR HA H 1 4.312 0.062 . 1 . . . A 7 THR HA . 18390 1
51 . 1 1 7 7 THR HB H 1 4.252 0.003 . 1 . . . A 7 THR HB . 18390 1
52 . 1 1 7 7 THR HG21 H 1 1.166 0.004 . 1 . . . A 7 THR HG21 . 18390 1
53 . 1 1 7 7 THR HG22 H 1 1.166 0.004 . 1 . . . A 7 THR HG22 . 18390 1
54 . 1 1 7 7 THR HG23 H 1 1.166 0.004 . 1 . . . A 7 THR HG23 . 18390 1
55 . 1 1 7 7 THR C C 13 175.440 0.100 . 1 . . . A 7 THR C . 18390 1
56 . 1 1 7 7 THR CA C 13 61.878 0.011 . 1 . . . A 7 THR CA . 18390 1
57 . 1 1 7 7 THR CB C 13 70.150 0.108 . 1 . . . A 7 THR CB . 18390 1
58 . 1 1 7 7 THR CG2 C 13 21.614 0.046 . 1 . . . A 7 THR CG2 . 18390 1
59 . 1 1 7 7 THR N N 15 113.255 0.058 . 1 . . . A 7 THR N . 18390 1
60 . 1 1 8 8 ASP H H 1 8.369 0.003 . 1 . . . A 8 ASP H . 18390 1
61 . 1 1 8 8 ASP HA H 1 4.599 0.008 . 1 . . . A 8 ASP HA . 18390 1
62 . 1 1 8 8 ASP HB2 H 1 2.613 0.034 . 2 . . . A 8 ASP HB2 . 18390 1
63 . 1 1 8 8 ASP HB3 H 1 2.689 0.001 . 2 . . . A 8 ASP HB3 . 18390 1
64 . 1 1 8 8 ASP C C 13 176.828 0.100 . 1 . . . A 8 ASP C . 18390 1
65 . 1 1 8 8 ASP CA C 13 54.525 0.102 . 1 . . . A 8 ASP CA . 18390 1
66 . 1 1 8 8 ASP CB C 13 41.441 0.016 . 1 . . . A 8 ASP CB . 18390 1
67 . 1 1 8 8 ASP N N 15 122.616 0.014 . 1 . . . A 8 ASP N . 18390 1
68 . 1 1 9 9 ALA H H 1 8.185 0.003 . 1 . . . A 9 ALA H . 18390 1
69 . 1 1 9 9 ALA HA H 1 4.331 0.003 . 1 . . . A 9 ALA HA . 18390 1
70 . 1 1 9 9 ALA HB1 H 1 1.385 0.006 . 1 . . . A 9 ALA HB1 . 18390 1
71 . 1 1 9 9 ALA HB2 H 1 1.385 0.006 . 1 . . . A 9 ALA HB2 . 18390 1
72 . 1 1 9 9 ALA HB3 H 1 1.385 0.006 . 1 . . . A 9 ALA HB3 . 18390 1
73 . 1 1 9 9 ALA C C 13 178.412 0.100 . 1 . . . A 9 ALA C . 18390 1
74 . 1 1 9 9 ALA CA C 13 52.445 0.111 . 1 . . . A 9 ALA CA . 18390 1
75 . 1 1 9 9 ALA CB C 13 19.869 0.018 . 1 . . . A 9 ALA CB . 18390 1
76 . 1 1 9 9 ALA N N 15 123.931 0.015 . 1 . . . A 9 ALA N . 18390 1
77 . 1 1 10 10 ASN H H 1 8.487 0.009 . 1 . . . A 10 ASN H . 18390 1
78 . 1 1 10 10 ASN HA H 1 4.781 0.016 . 1 . . . A 10 ASN HA . 18390 1
79 . 1 1 10 10 ASN HB2 H 1 2.834 0.001 . 2 . . . A 10 ASN HB2 . 18390 1
80 . 1 1 10 10 ASN HB3 H 1 2.834 0.001 . 2 . . . A 10 ASN HB3 . 18390 1
81 . 1 1 10 10 ASN C C 13 176.383 0.100 . 1 . . . A 10 ASN C . 18390 1
82 . 1 1 10 10 ASN CA C 13 53.350 0.121 . 1 . . . A 10 ASN CA . 18390 1
83 . 1 1 10 10 ASN CB C 13 39.319 0.023 . 1 . . . A 10 ASN CB . 18390 1
84 . 1 1 10 10 ASN N N 15 118.378 0.018 . 1 . . . A 10 ASN N . 18390 1
85 . 1 1 11 11 THR H H 1 7.678 0.011 . 1 . . . A 11 THR H . 18390 1
86 . 1 1 11 11 THR HA H 1 4.583 0.002 . 1 . . . A 11 THR HA . 18390 1
87 . 1 1 11 11 THR HB H 1 5.050 0.004 . 1 . . . A 11 THR HB . 18390 1
88 . 1 1 11 11 THR HG21 H 1 1.280 0.005 . 1 . . . A 11 THR HG21 . 18390 1
89 . 1 1 11 11 THR HG22 H 1 1.280 0.005 . 1 . . . A 11 THR HG22 . 18390 1
90 . 1 1 11 11 THR HG23 H 1 1.280 0.005 . 1 . . . A 11 THR HG23 . 18390 1
91 . 1 1 11 11 THR C C 13 175.684 0.100 . 1 . . . A 11 THR C . 18390 1
92 . 1 1 11 11 THR CA C 13 60.530 0.101 . 1 . . . A 11 THR CA . 18390 1
93 . 1 1 11 11 THR CB C 13 70.622 0.085 . 1 . . . A 11 THR CB . 18390 1
94 . 1 1 11 11 THR CG2 C 13 22.703 0.054 . 1 . . . A 11 THR CG2 . 18390 1
95 . 1 1 11 11 THR N N 15 110.937 0.010 . 1 . . . A 11 THR N . 18390 1
96 . 1 1 12 12 LEU H H 1 8.671 0.009 . 1 . . . A 12 LEU H . 18390 1
97 . 1 1 12 12 LEU HA H 1 3.831 0.003 . 1 . . . A 12 LEU HA . 18390 1
98 . 1 1 12 12 LEU HB2 H 1 1.262 0.001 . 2 . . . A 12 LEU HB2 . 18390 1
99 . 1 1 12 12 LEU HB3 H 1 1.402 0.003 . 2 . . . A 12 LEU HB3 . 18390 1
100 . 1 1 12 12 LEU HD11 H 1 0.720 0.010 . 1 . . . A 12 LEU HD11 . 18390 1
101 . 1 1 12 12 LEU HD12 H 1 0.720 0.010 . 1 . . . A 12 LEU HD12 . 18390 1
102 . 1 1 12 12 LEU HD13 H 1 0.720 0.010 . 1 . . . A 12 LEU HD13 . 18390 1
103 . 1 1 12 12 LEU HD21 H 1 0.710 0.007 . 1 . . . A 12 LEU HD21 . 18390 1
104 . 1 1 12 12 LEU HD22 H 1 0.710 0.007 . 1 . . . A 12 LEU HD22 . 18390 1
105 . 1 1 12 12 LEU HD23 H 1 0.710 0.007 . 1 . . . A 12 LEU HD23 . 18390 1
106 . 1 1 12 12 LEU C C 13 177.582 0.100 . 1 . . . A 12 LEU C . 18390 1
107 . 1 1 12 12 LEU CA C 13 57.409 0.126 . 1 . . . A 12 LEU CA . 18390 1
108 . 1 1 12 12 LEU CB C 13 42.819 0.146 . 1 . . . A 12 LEU CB . 18390 1
109 . 1 1 12 12 LEU CD1 C 13 23.353 0.036 . 2 . . . A 12 LEU CD1 . 18390 1
110 . 1 1 12 12 LEU CD2 C 13 25.426 0.078 . 2 . . . A 12 LEU CD2 . 18390 1
111 . 1 1 12 12 LEU N N 15 122.990 0.031 . 1 . . . A 12 LEU N . 18390 1
112 . 1 1 13 13 PHE H H 1 7.488 0.006 . 1 . . . A 13 PHE H . 18390 1
113 . 1 1 13 13 PHE HA H 1 5.100 0.001 . 1 . . . A 13 PHE HA . 18390 1
114 . 1 1 13 13 PHE HB2 H 1 2.098 0.004 . 2 . . . A 13 PHE HB2 . 18390 1
115 . 1 1 13 13 PHE HB3 H 1 2.444 0.004 . 2 . . . A 13 PHE HB3 . 18390 1
116 . 1 1 13 13 PHE HD1 H 1 6.843 0.006 . 3 . . . A 13 PHE HD1 . 18390 1
117 . 1 1 13 13 PHE HD2 H 1 6.843 0.006 . 3 . . . A 13 PHE HD2 . 18390 1
118 . 1 1 13 13 PHE HE1 H 1 6.985 0.003 . 3 . . . A 13 PHE HE1 . 18390 1
119 . 1 1 13 13 PHE HE2 H 1 6.985 0.003 . 3 . . . A 13 PHE HE2 . 18390 1
120 . 1 1 13 13 PHE C C 13 175.816 0.100 . 1 . . . A 13 PHE C . 18390 1
121 . 1 1 13 13 PHE CA C 13 55.102 0.114 . 1 . . . A 13 PHE CA . 18390 1
122 . 1 1 13 13 PHE CB C 13 40.671 0.112 . 1 . . . A 13 PHE CB . 18390 1
123 . 1 1 13 13 PHE CD1 C 13 132.080 0.004 . 3 . . . A 13 PHE CD1 . 18390 1
124 . 1 1 13 13 PHE CE1 C 13 130.968 0.094 . 3 . . . A 13 PHE CE1 . 18390 1
125 . 1 1 13 13 PHE N N 15 114.740 0.021 . 1 . . . A 13 PHE N . 18390 1
126 . 1 1 14 14 VAL H H 1 8.372 0.003 . 1 . . . A 14 VAL H . 18390 1
127 . 1 1 14 14 VAL HA H 1 4.910 0.004 . 1 . . . A 14 VAL HA . 18390 1
128 . 1 1 14 14 VAL HB H 1 2.257 0.005 . 1 . . . A 14 VAL HB . 18390 1
129 . 1 1 14 14 VAL HG11 H 1 0.863 0.008 . 1 . . . A 14 VAL HG11 . 18390 1
130 . 1 1 14 14 VAL HG12 H 1 0.863 0.008 . 1 . . . A 14 VAL HG12 . 18390 1
131 . 1 1 14 14 VAL HG13 H 1 0.863 0.008 . 1 . . . A 14 VAL HG13 . 18390 1
132 . 1 1 14 14 VAL HG21 H 1 0.853 0.005 . 1 . . . A 14 VAL HG21 . 18390 1
133 . 1 1 14 14 VAL HG22 H 1 0.853 0.005 . 1 . . . A 14 VAL HG22 . 18390 1
134 . 1 1 14 14 VAL HG23 H 1 0.853 0.005 . 1 . . . A 14 VAL HG23 . 18390 1
135 . 1 1 14 14 VAL C C 13 176.083 0.100 . 1 . . . A 14 VAL C . 18390 1
136 . 1 1 14 14 VAL CA C 13 58.834 0.060 . 1 . . . A 14 VAL CA . 18390 1
137 . 1 1 14 14 VAL CB C 13 36.149 0.058 . 1 . . . A 14 VAL CB . 18390 1
138 . 1 1 14 14 VAL CG1 C 13 21.626 0.026 . 2 . . . A 14 VAL CG1 . 18390 1
139 . 1 1 14 14 VAL CG2 C 13 18.521 0.042 . 2 . . . A 14 VAL CG2 . 18390 1
140 . 1 1 14 14 VAL N N 15 113.431 0.052 . 1 . . . A 14 VAL N . 18390 1
141 . 1 1 15 15 ASP H H 1 8.068 0.007 . 1 . . . A 15 ASP H . 18390 1
142 . 1 1 15 15 ASP HA H 1 3.941 0.003 . 1 . . . A 15 ASP HA . 18390 1
143 . 1 1 15 15 ASP HB2 H 1 2.474 0.004 . 2 . . . A 15 ASP HB2 . 18390 1
144 . 1 1 15 15 ASP HB3 H 1 2.474 0.004 . 2 . . . A 15 ASP HB3 . 18390 1
145 . 1 1 15 15 ASP C C 13 178.825 0.100 . 1 . . . A 15 ASP C . 18390 1
146 . 1 1 15 15 ASP CA C 13 56.493 0.100 . 1 . . . A 15 ASP CA . 18390 1
147 . 1 1 15 15 ASP CB C 13 40.066 0.075 . 1 . . . A 15 ASP CB . 18390 1
148 . 1 1 15 15 ASP N N 15 120.209 0.026 . 1 . . . A 15 ASP N . 18390 1
149 . 1 1 16 16 GLY H H 1 9.158 0.003 . 1 . . . A 16 GLY H . 18390 1
150 . 1 1 16 16 GLY HA2 H 1 3.576 0.008 . 2 . . . A 16 GLY HA2 . 18390 1
151 . 1 1 16 16 GLY HA3 H 1 4.277 0.003 . 2 . . . A 16 GLY HA3 . 18390 1
152 . 1 1 16 16 GLY C C 13 174.928 0.100 . 1 . . . A 16 GLY C . 18390 1
153 . 1 1 16 16 GLY CA C 13 45.060 0.011 . 1 . . . A 16 GLY CA . 18390 1
154 . 1 1 16 16 GLY N N 15 112.740 0.024 . 1 . . . A 16 GLY N . 18390 1
155 . 1 1 17 17 GLU H H 1 8.234 0.003 . 1 . . . A 17 GLU H . 18390 1
156 . 1 1 17 17 GLU HA H 1 3.995 0.010 . 1 . . . A 17 GLU HA . 18390 1
157 . 1 1 17 17 GLU HG2 H 1 2.350 0.034 . 2 . . . A 17 GLU HG2 . 18390 1
158 . 1 1 17 17 GLU HG3 H 1 2.350 0.034 . 2 . . . A 17 GLU HG3 . 18390 1
159 . 1 1 17 17 GLU C C 13 176.895 0.100 . 1 . . . A 17 GLU C . 18390 1
160 . 1 1 17 17 GLU CA C 13 57.773 0.035 . 1 . . . A 17 GLU CA . 18390 1
161 . 1 1 17 17 GLU CB C 13 31.588 0.035 . 1 . . . A 17 GLU CB . 18390 1
162 . 1 1 17 17 GLU CG C 13 35.648 0.108 . 1 . . . A 17 GLU CG . 18390 1
163 . 1 1 17 17 GLU N N 15 124.150 0.018 . 1 . . . A 17 GLU N . 18390 1
164 . 1 1 18 18 ARG H H 1 8.447 0.011 . 1 . . . A 18 ARG H . 18390 1
165 . 1 1 18 18 ARG HA H 1 4.648 0.011 . 1 . . . A 18 ARG HA . 18390 1
166 . 1 1 18 18 ARG HB2 H 1 1.736 0.017 . 2 . . . A 18 ARG HB2 . 18390 1
167 . 1 1 18 18 ARG HB3 H 1 1.736 0.017 . 2 . . . A 18 ARG HB3 . 18390 1
168 . 1 1 18 18 ARG HG2 H 1 1.184 0.007 . 2 . . . A 18 ARG HG2 . 18390 1
169 . 1 1 18 18 ARG HG3 H 1 1.636 0.022 . 2 . . . A 18 ARG HG3 . 18390 1
170 . 1 1 18 18 ARG HD2 H 1 2.610 0.001 . 2 . . . A 18 ARG HD2 . 18390 1
171 . 1 1 18 18 ARG HD3 H 1 2.610 0.001 . 2 . . . A 18 ARG HD3 . 18390 1
172 . 1 1 18 18 ARG C C 13 176.233 0.100 . 1 . . . A 18 ARG C . 18390 1
173 . 1 1 18 18 ARG CA C 13 56.400 0.003 . 1 . . . A 18 ARG CA . 18390 1
174 . 1 1 18 18 ARG CB C 13 30.400 0.037 . 1 . . . A 18 ARG CB . 18390 1
175 . 1 1 18 18 ARG CG C 13 26.677 0.152 . 1 . . . A 18 ARG CG . 18390 1
176 . 1 1 18 18 ARG CD C 13 43.667 0.056 . 1 . . . A 18 ARG CD . 18390 1
177 . 1 1 18 18 ARG N N 15 127.394 0.045 . 1 . . . A 18 ARG N . 18390 1
178 . 1 1 19 19 VAL H H 1 8.633 0.002 . 1 . . . A 19 VAL H . 18390 1
179 . 1 1 19 19 VAL HA H 1 4.889 0.003 . 1 . . . A 19 VAL HA . 18390 1
180 . 1 1 19 19 VAL HB H 1 2.176 0.004 . 1 . . . A 19 VAL HB . 18390 1
181 . 1 1 19 19 VAL HG11 H 1 0.503 0.006 . 1 . . . A 19 VAL HG11 . 18390 1
182 . 1 1 19 19 VAL HG12 H 1 0.503 0.006 . 1 . . . A 19 VAL HG12 . 18390 1
183 . 1 1 19 19 VAL HG13 H 1 0.503 0.006 . 1 . . . A 19 VAL HG13 . 18390 1
184 . 1 1 19 19 VAL HG21 H 1 0.112 0.011 . 1 . . . A 19 VAL HG21 . 18390 1
185 . 1 1 19 19 VAL HG22 H 1 0.112 0.011 . 1 . . . A 19 VAL HG22 . 18390 1
186 . 1 1 19 19 VAL HG23 H 1 0.112 0.011 . 1 . . . A 19 VAL HG23 . 18390 1
187 . 1 1 19 19 VAL C C 13 175.112 0.100 . 1 . . . A 19 VAL C . 18390 1
188 . 1 1 19 19 VAL CA C 13 59.728 0.075 . 1 . . . A 19 VAL CA . 18390 1
189 . 1 1 19 19 VAL CB C 13 35.971 0.086 . 1 . . . A 19 VAL CB . 18390 1
190 . 1 1 19 19 VAL CG1 C 13 23.176 0.025 . 2 . . . A 19 VAL CG1 . 18390 1
191 . 1 1 19 19 VAL CG2 C 13 17.743 0.045 . 2 . . . A 19 VAL CG2 . 18390 1
192 . 1 1 19 19 VAL N N 15 120.632 0.034 . 1 . . . A 19 VAL N . 18390 1
193 . 1 1 20 20 LEU H H 1 8.417 0.003 . 1 . . . A 20 LEU H . 18390 1
194 . 1 1 20 20 LEU HA H 1 5.016 0.006 . 1 . . . A 20 LEU HA . 18390 1
195 . 1 1 20 20 LEU HB2 H 1 0.968 0.008 . 2 . . . A 20 LEU HB2 . 18390 1
196 . 1 1 20 20 LEU HB3 H 1 1.265 0.005 . 2 . . . A 20 LEU HB3 . 18390 1
197 . 1 1 20 20 LEU HG H 1 1.348 0.034 . 1 . . . A 20 LEU HG . 18390 1
198 . 1 1 20 20 LEU HD11 H 1 0.484 0.011 . 1 . . . A 20 LEU HD11 . 18390 1
199 . 1 1 20 20 LEU HD12 H 1 0.484 0.011 . 1 . . . A 20 LEU HD12 . 18390 1
200 . 1 1 20 20 LEU HD13 H 1 0.484 0.011 . 1 . . . A 20 LEU HD13 . 18390 1
201 . 1 1 20 20 LEU HD21 H 1 0.631 0.003 . 1 . . . A 20 LEU HD21 . 18390 1
202 . 1 1 20 20 LEU HD22 H 1 0.631 0.003 . 1 . . . A 20 LEU HD22 . 18390 1
203 . 1 1 20 20 LEU HD23 H 1 0.631 0.003 . 1 . . . A 20 LEU HD23 . 18390 1
204 . 1 1 20 20 LEU C C 13 176.297 0.100 . 1 . . . A 20 LEU C . 18390 1
205 . 1 1 20 20 LEU CA C 13 53.232 0.102 . 1 . . . A 20 LEU CA . 18390 1
206 . 1 1 20 20 LEU CB C 13 43.991 0.021 . 1 . . . A 20 LEU CB . 18390 1
207 . 1 1 20 20 LEU CG C 13 26.921 0.004 . 1 . . . A 20 LEU CG . 18390 1
208 . 1 1 20 20 LEU CD1 C 13 26.764 0.086 . 2 . . . A 20 LEU CD1 . 18390 1
209 . 1 1 20 20 LEU CD2 C 13 23.573 0.174 . 2 . . . A 20 LEU CD2 . 18390 1
210 . 1 1 20 20 LEU N N 15 119.290 0.034 . 1 . . . A 20 LEU N . 18390 1
211 . 1 1 21 21 CYS H H 1 9.277 0.006 . 1 . . . A 21 CYS H . 18390 1
212 . 1 1 21 21 CYS HA H 1 5.329 0.004 . 1 . . . A 21 CYS HA . 18390 1
213 . 1 1 21 21 CYS HB2 H 1 2.011 0.013 . 2 . . . A 21 CYS HB2 . 18390 1
214 . 1 1 21 21 CYS HB3 H 1 2.552 0.005 . 2 . . . A 21 CYS HB3 . 18390 1
215 . 1 1 21 21 CYS C C 13 175.768 0.100 . 1 . . . A 21 CYS C . 18390 1
216 . 1 1 21 21 CYS CA C 13 57.557 0.047 . 1 . . . A 21 CYS CA . 18390 1
217 . 1 1 21 21 CYS CB C 13 30.621 0.097 . 1 . . . A 21 CYS CB . 18390 1
218 . 1 1 21 21 CYS N N 15 121.012 0.030 . 1 . . . A 21 CYS N . 18390 1
219 . 1 1 22 22 PHE H H 1 9.132 0.003 . 1 . . . A 22 PHE H . 18390 1
220 . 1 1 22 22 PHE HA H 1 5.062 0.006 . 1 . . . A 22 PHE HA . 18390 1
221 . 1 1 22 22 PHE HB2 H 1 2.816 0.010 . 2 . . . A 22 PHE HB2 . 18390 1
222 . 1 1 22 22 PHE HB3 H 1 3.286 0.005 . 2 . . . A 22 PHE HB3 . 18390 1
223 . 1 1 22 22 PHE HE1 H 1 7.210 0.007 . 3 . . . A 22 PHE HE1 . 18390 1
224 . 1 1 22 22 PHE HE2 H 1 7.210 0.007 . 3 . . . A 22 PHE HE2 . 18390 1
225 . 1 1 22 22 PHE C C 13 178.470 0.100 . 1 . . . A 22 PHE C . 18390 1
226 . 1 1 22 22 PHE CA C 13 59.627 0.016 . 1 . . . A 22 PHE CA . 18390 1
227 . 1 1 22 22 PHE CB C 13 41.220 0.134 . 1 . . . A 22 PHE CB . 18390 1
228 . 1 1 22 22 PHE CE2 C 13 132.207 0.042 . 3 . . . A 22 PHE CE2 . 18390 1
229 . 1 1 22 22 PHE N N 15 128.509 0.018 . 1 . . . A 22 PHE N . 18390 1
230 . 1 1 23 23 HIS H H 1 9.025 0.002 . 1 . . . A 23 HIS H . 18390 1
231 . 1 1 23 23 HIS N N 15 123.679 0.011 . 1 . . . A 23 HIS N . 18390 1
232 . 1 1 25 25 PRO C C 13 176.332 0.100 . 1 . . . A 25 PRO C . 18390 1
233 . 1 1 26 26 LEU H H 1 6.785 0.002 . 1 . . . A 26 LEU H . 18390 1
234 . 1 1 26 26 LEU HA H 1 4.524 0.009 . 1 . . . A 26 LEU HA . 18390 1
235 . 1 1 26 26 LEU HB2 H 1 1.089 0.007 . 2 . . . A 26 LEU HB2 . 18390 1
236 . 1 1 26 26 LEU HB3 H 1 1.685 0.006 . 2 . . . A 26 LEU HB3 . 18390 1
237 . 1 1 26 26 LEU HG H 1 1.369 0.034 . 1 . . . A 26 LEU HG . 18390 1
238 . 1 1 26 26 LEU HD11 H 1 0.906 0.003 . 1 . . . A 26 LEU HD11 . 18390 1
239 . 1 1 26 26 LEU HD12 H 1 0.906 0.003 . 1 . . . A 26 LEU HD12 . 18390 1
240 . 1 1 26 26 LEU HD13 H 1 0.906 0.003 . 1 . . . A 26 LEU HD13 . 18390 1
241 . 1 1 26 26 LEU HD21 H 1 0.761 0.008 . 1 . . . A 26 LEU HD21 . 18390 1
242 . 1 1 26 26 LEU HD22 H 1 0.761 0.008 . 1 . . . A 26 LEU HD22 . 18390 1
243 . 1 1 26 26 LEU HD23 H 1 0.761 0.008 . 1 . . . A 26 LEU HD23 . 18390 1
244 . 1 1 26 26 LEU C C 13 174.816 0.100 . 1 . . . A 26 LEU C . 18390 1
245 . 1 1 26 26 LEU CA C 13 53.718 0.089 . 1 . . . A 26 LEU CA . 18390 1
246 . 1 1 26 26 LEU CB C 13 44.861 0.054 . 1 . . . A 26 LEU CB . 18390 1
247 . 1 1 26 26 LEU CG C 13 27.873 0.019 . 1 . . . A 26 LEU CG . 18390 1
248 . 1 1 26 26 LEU CD1 C 13 25.827 0.064 . 2 . . . A 26 LEU CD1 . 18390 1
249 . 1 1 26 26 LEU CD2 C 13 23.681 0.119 . 2 . . . A 26 LEU CD2 . 18390 1
250 . 1 1 26 26 LEU N N 15 117.460 0.001 . 1 . . . A 26 LEU N . 18390 1
251 . 1 1 27 27 ILE H H 1 7.404 0.004 . 1 . . . A 27 ILE H . 18390 1
252 . 1 1 27 27 ILE HA H 1 3.887 0.007 . 1 . . . A 27 ILE HA . 18390 1
253 . 1 1 27 27 ILE HB H 1 0.898 0.006 . 1 . . . A 27 ILE HB . 18390 1
254 . 1 1 27 27 ILE HG12 H 1 -0.844 0.009 . 2 . . . A 27 ILE HG12 . 18390 1
255 . 1 1 27 27 ILE HG13 H 1 0.753 0.007 . 2 . . . A 27 ILE HG13 . 18390 1
256 . 1 1 27 27 ILE HG21 H 1 0.278 0.007 . 1 . . . A 27 ILE HG21 . 18390 1
257 . 1 1 27 27 ILE HG22 H 1 0.278 0.007 . 1 . . . A 27 ILE HG22 . 18390 1
258 . 1 1 27 27 ILE HG23 H 1 0.278 0.007 . 1 . . . A 27 ILE HG23 . 18390 1
259 . 1 1 27 27 ILE HD11 H 1 0.197 0.015 . 1 . . . A 27 ILE HD11 . 18390 1
260 . 1 1 27 27 ILE HD12 H 1 0.197 0.015 . 1 . . . A 27 ILE HD12 . 18390 1
261 . 1 1 27 27 ILE HD13 H 1 0.197 0.015 . 1 . . . A 27 ILE HD13 . 18390 1
262 . 1 1 27 27 ILE C C 13 175.799 0.100 . 1 . . . A 27 ILE C . 18390 1
263 . 1 1 27 27 ILE CA C 13 60.413 0.057 . 1 . . . A 27 ILE CA . 18390 1
264 . 1 1 27 27 ILE CB C 13 40.357 0.078 . 1 . . . A 27 ILE CB . 18390 1
265 . 1 1 27 27 ILE CG1 C 13 26.751 0.064 . 1 . . . A 27 ILE CG1 . 18390 1
266 . 1 1 27 27 ILE CG2 C 13 21.014 0.036 . 1 . . . A 27 ILE CG2 . 18390 1
267 . 1 1 27 27 ILE CD1 C 13 14.155 0.056 . 1 . . . A 27 ILE CD1 . 18390 1
268 . 1 1 27 27 ILE N N 15 116.195 0.034 . 1 . . . A 27 ILE N . 18390 1
269 . 1 1 28 28 TYR H H 1 8.608 0.008 . 1 . . . A 28 TYR H . 18390 1
270 . 1 1 28 28 TYR HA H 1 4.609 0.007 . 1 . . . A 28 TYR HA . 18390 1
271 . 1 1 28 28 TYR HB2 H 1 2.420 0.007 . 2 . . . A 28 TYR HB2 . 18390 1
272 . 1 1 28 28 TYR HB3 H 1 3.235 0.008 . 2 . . . A 28 TYR HB3 . 18390 1
273 . 1 1 28 28 TYR HD1 H 1 7.094 0.006 . 3 . . . A 28 TYR HD1 . 18390 1
274 . 1 1 28 28 TYR HD2 H 1 7.094 0.006 . 3 . . . A 28 TYR HD2 . 18390 1
275 . 1 1 28 28 TYR HE1 H 1 6.991 0.034 . 3 . . . A 28 TYR HE1 . 18390 1
276 . 1 1 28 28 TYR HE2 H 1 6.991 0.034 . 3 . . . A 28 TYR HE2 . 18390 1
277 . 1 1 28 28 TYR C C 13 176.620 0.100 . 1 . . . A 28 TYR C . 18390 1
278 . 1 1 28 28 TYR CA C 13 56.903 0.035 . 1 . . . A 28 TYR CA . 18390 1
279 . 1 1 28 28 TYR CB C 13 42.782 0.080 . 1 . . . A 28 TYR CB . 18390 1
280 . 1 1 28 28 TYR CD1 C 13 133.303 0.080 . 3 . . . A 28 TYR CD1 . 18390 1
281 . 1 1 28 28 TYR CE1 C 13 118.352 0.035 . 3 . . . A 28 TYR CE1 . 18390 1
282 . 1 1 28 28 TYR N N 15 124.078 0.039 . 1 . . . A 28 TYR N . 18390 1
283 . 1 1 29 29 GLU H H 1 8.779 0.005 . 1 . . . A 29 GLU H . 18390 1
284 . 1 1 29 29 GLU HA H 1 4.495 0.004 . 1 . . . A 29 GLU HA . 18390 1
285 . 1 1 29 29 GLU HG2 H 1 2.310 0.034 . 2 . . . A 29 GLU HG2 . 18390 1
286 . 1 1 29 29 GLU HG3 H 1 2.310 0.034 . 2 . . . A 29 GLU HG3 . 18390 1
287 . 1 1 29 29 GLU C C 13 176.879 0.100 . 1 . . . A 29 GLU C . 18390 1
288 . 1 1 29 29 GLU CA C 13 57.703 0.051 . 1 . . . A 29 GLU CA . 18390 1
289 . 1 1 29 29 GLU CB C 13 29.591 0.035 . 1 . . . A 29 GLU CB . 18390 1
290 . 1 1 29 29 GLU CG C 13 37.118 0.123 . 1 . . . A 29 GLU CG . 18390 1
291 . 1 1 29 29 GLU N N 15 121.988 0.013 . 1 . . . A 29 GLU N . 18390 1
292 . 1 1 30 30 ALA H H 1 9.039 0.006 . 1 . . . A 30 ALA H . 18390 1
293 . 1 1 30 30 ALA HA H 1 4.888 0.005 . 1 . . . A 30 ALA HA . 18390 1
294 . 1 1 30 30 ALA HB1 H 1 0.779 0.006 . 1 . . . A 30 ALA HB1 . 18390 1
295 . 1 1 30 30 ALA HB2 H 1 0.779 0.006 . 1 . . . A 30 ALA HB2 . 18390 1
296 . 1 1 30 30 ALA HB3 H 1 0.779 0.006 . 1 . . . A 30 ALA HB3 . 18390 1
297 . 1 1 30 30 ALA C C 13 176.487 0.100 . 1 . . . A 30 ALA C . 18390 1
298 . 1 1 30 30 ALA CA C 13 51.500 0.091 . 1 . . . A 30 ALA CA . 18390 1
299 . 1 1 30 30 ALA CB C 13 24.679 0.043 . 1 . . . A 30 ALA CB . 18390 1
300 . 1 1 30 30 ALA N N 15 128.879 0.016 . 1 . . . A 30 ALA N . 18390 1
301 . 1 1 31 31 LYS H H 1 8.654 0.003 . 1 . . . A 31 LYS H . 18390 1
302 . 1 1 31 31 LYS HA H 1 5.108 0.005 . 1 . . . A 31 LYS HA . 18390 1
303 . 1 1 31 31 LYS HB2 H 1 1.568 0.034 . 2 . . . A 31 LYS HB2 . 18390 1
304 . 1 1 31 31 LYS HB3 H 1 1.568 0.034 . 2 . . . A 31 LYS HB3 . 18390 1
305 . 1 1 31 31 LYS HG2 H 1 1.554 0.001 . 2 . . . A 31 LYS HG2 . 18390 1
306 . 1 1 31 31 LYS HG3 H 1 1.554 0.001 . 2 . . . A 31 LYS HG3 . 18390 1
307 . 1 1 31 31 LYS HD2 H 1 1.127 0.003 . 2 . . . A 31 LYS HD2 . 18390 1
308 . 1 1 31 31 LYS HD3 H 1 1.127 0.003 . 2 . . . A 31 LYS HD3 . 18390 1
309 . 1 1 31 31 LYS HE2 H 1 2.859 0.001 . 2 . . . A 31 LYS HE2 . 18390 1
310 . 1 1 31 31 LYS HE3 H 1 2.859 0.001 . 2 . . . A 31 LYS HE3 . 18390 1
311 . 1 1 31 31 LYS C C 13 176.028 0.100 . 1 . . . A 31 LYS C . 18390 1
312 . 1 1 31 31 LYS CA C 13 54.700 0.035 . 1 . . . A 31 LYS CA . 18390 1
313 . 1 1 31 31 LYS CB C 13 37.188 0.086 . 1 . . . A 31 LYS CB . 18390 1
314 . 1 1 31 31 LYS CG C 13 29.517 0.144 . 1 . . . A 31 LYS CG . 18390 1
315 . 1 1 31 31 LYS CD C 13 24.771 0.071 . 1 . . . A 31 LYS CD . 18390 1
316 . 1 1 31 31 LYS CE C 13 42.044 0.032 . 1 . . . A 31 LYS CE . 18390 1
317 . 1 1 31 31 LYS N N 15 121.450 0.042 . 1 . . . A 31 LYS N . 18390 1
318 . 1 1 32 32 VAL H H 1 8.133 0.004 . 1 . . . A 32 VAL H . 18390 1
319 . 1 1 32 32 VAL HA H 1 3.807 0.003 . 1 . . . A 32 VAL HA . 18390 1
320 . 1 1 32 32 VAL HB H 1 2.296 0.007 . 1 . . . A 32 VAL HB . 18390 1
321 . 1 1 32 32 VAL HG11 H 1 0.914 0.005 . 1 . . . A 32 VAL HG11 . 18390 1
322 . 1 1 32 32 VAL HG12 H 1 0.914 0.005 . 1 . . . A 32 VAL HG12 . 18390 1
323 . 1 1 32 32 VAL HG13 H 1 0.914 0.005 . 1 . . . A 32 VAL HG13 . 18390 1
324 . 1 1 32 32 VAL HG21 H 1 0.544 0.006 . 1 . . . A 32 VAL HG21 . 18390 1
325 . 1 1 32 32 VAL HG22 H 1 0.544 0.006 . 1 . . . A 32 VAL HG22 . 18390 1
326 . 1 1 32 32 VAL HG23 H 1 0.544 0.006 . 1 . . . A 32 VAL HG23 . 18390 1
327 . 1 1 32 32 VAL C C 13 177.671 0.100 . 1 . . . A 32 VAL C . 18390 1
328 . 1 1 32 32 VAL CA C 13 63.257 0.059 . 1 . . . A 32 VAL CA . 18390 1
329 . 1 1 32 32 VAL CB C 13 32.545 0.093 . 1 . . . A 32 VAL CB . 18390 1
330 . 1 1 32 32 VAL CG1 C 13 23.460 0.049 . 2 . . . A 32 VAL CG1 . 18390 1
331 . 1 1 32 32 VAL CG2 C 13 21.656 0.032 . 2 . . . A 32 VAL CG2 . 18390 1
332 . 1 1 32 32 VAL N N 15 124.316 0.055 . 1 . . . A 32 VAL N . 18390 1
333 . 1 1 33 33 LEU H H 1 9.819 0.008 . 1 . . . A 33 LEU H . 18390 1
334 . 1 1 33 33 LEU HA H 1 4.553 0.002 . 1 . . . A 33 LEU HA . 18390 1
335 . 1 1 33 33 LEU HB2 H 1 1.540 0.005 . 2 . . . A 33 LEU HB2 . 18390 1
336 . 1 1 33 33 LEU HB3 H 1 1.816 0.004 . 2 . . . A 33 LEU HB3 . 18390 1
337 . 1 1 33 33 LEU HG H 1 1.571 0.005 . 1 . . . A 33 LEU HG . 18390 1
338 . 1 1 33 33 LEU HD11 H 1 0.700 0.007 . 1 . . . A 33 LEU HD11 . 18390 1
339 . 1 1 33 33 LEU HD12 H 1 0.700 0.007 . 1 . . . A 33 LEU HD12 . 18390 1
340 . 1 1 33 33 LEU HD13 H 1 0.700 0.007 . 1 . . . A 33 LEU HD13 . 18390 1
341 . 1 1 33 33 LEU HD21 H 1 0.712 0.006 . 1 . . . A 33 LEU HD21 . 18390 1
342 . 1 1 33 33 LEU HD22 H 1 0.712 0.006 . 1 . . . A 33 LEU HD22 . 18390 1
343 . 1 1 33 33 LEU HD23 H 1 0.712 0.006 . 1 . . . A 33 LEU HD23 . 18390 1
344 . 1 1 33 33 LEU C C 13 178.378 0.100 . 1 . . . A 33 LEU C . 18390 1
345 . 1 1 33 33 LEU CA C 13 55.903 0.129 . 1 . . . A 33 LEU CA . 18390 1
346 . 1 1 33 33 LEU CB C 13 43.831 0.082 . 1 . . . A 33 LEU CB . 18390 1
347 . 1 1 33 33 LEU CG C 13 27.169 0.021 . 1 . . . A 33 LEU CG . 18390 1
348 . 1 1 33 33 LEU CD1 C 13 25.757 0.057 . 2 . . . A 33 LEU CD1 . 18390 1
349 . 1 1 33 33 LEU CD2 C 13 22.446 0.164 . 2 . . . A 33 LEU CD2 . 18390 1
350 . 1 1 33 33 LEU N N 15 128.950 0.036 . 1 . . . A 33 LEU N . 18390 1
351 . 1 1 34 34 LYS H H 1 7.568 0.002 . 1 . . . A 34 LYS H . 18390 1
352 . 1 1 34 34 LYS HA H 1 4.841 0.003 . 1 . . . A 34 LYS HA . 18390 1
353 . 1 1 34 34 LYS HB2 H 1 1.643 0.004 . 2 . . . A 34 LYS HB2 . 18390 1
354 . 1 1 34 34 LYS HB3 H 1 1.968 0.004 . 2 . . . A 34 LYS HB3 . 18390 1
355 . 1 1 34 34 LYS HG2 H 1 1.567 0.034 . 2 . . . A 34 LYS HG2 . 18390 1
356 . 1 1 34 34 LYS HD2 H 1 1.415 0.006 . 2 . . . A 34 LYS HD2 . 18390 1
357 . 1 1 34 34 LYS HD3 H 1 1.581 0.013 . 2 . . . A 34 LYS HD3 . 18390 1
358 . 1 1 34 34 LYS HE2 H 1 2.865 0.005 . 2 . . . A 34 LYS HE2 . 18390 1
359 . 1 1 34 34 LYS HE3 H 1 2.865 0.005 . 2 . . . A 34 LYS HE3 . 18390 1
360 . 1 1 34 34 LYS C C 13 175.986 0.100 . 1 . . . A 34 LYS C . 18390 1
361 . 1 1 34 34 LYS CA C 13 55.223 0.035 . 1 . . . A 34 LYS CA . 18390 1
362 . 1 1 34 34 LYS CB C 13 37.545 0.097 . 1 . . . A 34 LYS CB . 18390 1
363 . 1 1 34 34 LYS CG C 13 29.455 0.150 . 1 . . . A 34 LYS CG . 18390 1
364 . 1 1 34 34 LYS CD C 13 25.272 0.087 . 1 . . . A 34 LYS CD . 18390 1
365 . 1 1 34 34 LYS CE C 13 42.156 0.139 . 1 . . . A 34 LYS CE . 18390 1
366 . 1 1 34 34 LYS N N 15 115.715 0.026 . 1 . . . A 34 LYS N . 18390 1
367 . 1 1 35 35 THR H H 1 9.155 0.004 . 1 . . . A 35 THR H . 18390 1
368 . 1 1 35 35 THR HA H 1 5.080 0.005 . 1 . . . A 35 THR HA . 18390 1
369 . 1 1 35 35 THR HB H 1 3.990 0.005 . 1 . . . A 35 THR HB . 18390 1
370 . 1 1 35 35 THR HG21 H 1 1.253 0.005 . 1 . . . A 35 THR HG21 . 18390 1
371 . 1 1 35 35 THR HG22 H 1 1.253 0.005 . 1 . . . A 35 THR HG22 . 18390 1
372 . 1 1 35 35 THR HG23 H 1 1.253 0.005 . 1 . . . A 35 THR HG23 . 18390 1
373 . 1 1 35 35 THR C C 13 174.731 0.100 . 1 . . . A 35 THR C . 18390 1
374 . 1 1 35 35 THR CA C 13 62.383 0.112 . 1 . . . A 35 THR CA . 18390 1
375 . 1 1 35 35 THR CB C 13 72.197 0.071 . 1 . . . A 35 THR CB . 18390 1
376 . 1 1 35 35 THR CG2 C 13 21.948 0.011 . 1 . . . A 35 THR CG2 . 18390 1
377 . 1 1 35 35 THR N N 15 117.005 0.023 . 1 . . . A 35 THR N . 18390 1
378 . 1 1 36 36 LYS H H 1 8.846 0.003 . 1 . . . A 36 LYS H . 18390 1
379 . 1 1 36 36 LYS HA H 1 4.907 0.004 . 1 . . . A 36 LYS HA . 18390 1
380 . 1 1 36 36 LYS HB2 H 1 1.379 0.004 . 2 . . . A 36 LYS HB2 . 18390 1
381 . 1 1 36 36 LYS HB3 H 1 1.706 0.005 . 2 . . . A 36 LYS HB3 . 18390 1
382 . 1 1 36 36 LYS HG2 H 1 0.803 0.003 . 2 . . . A 36 LYS HG2 . 18390 1
383 . 1 1 36 36 LYS HG3 H 1 1.156 0.004 . 2 . . . A 36 LYS HG3 . 18390 1
384 . 1 1 36 36 LYS HD2 H 1 1.120 0.002 . 2 . . . A 36 LYS HD2 . 18390 1
385 . 1 1 36 36 LYS HD3 H 1 1.120 0.002 . 2 . . . A 36 LYS HD3 . 18390 1
386 . 1 1 36 36 LYS HE2 H 1 1.652 0.009 . 2 . . . A 36 LYS HE2 . 18390 1
387 . 1 1 36 36 LYS HE3 H 1 2.073 0.006 . 2 . . . A 36 LYS HE3 . 18390 1
388 . 1 1 36 36 LYS CA C 13 53.862 0.010 . 1 . . . A 36 LYS CA . 18390 1
389 . 1 1 36 36 LYS CB C 13 34.232 0.061 . 1 . . . A 36 LYS CB . 18390 1
390 . 1 1 36 36 LYS CG C 13 29.514 0.005 . 1 . . . A 36 LYS CG . 18390 1
391 . 1 1 36 36 LYS CD C 13 25.093 0.035 . 1 . . . A 36 LYS CD . 18390 1
392 . 1 1 36 36 LYS CE C 13 41.219 0.067 . 1 . . . A 36 LYS CE . 18390 1
393 . 1 1 36 36 LYS N N 15 125.603 0.024 . 1 . . . A 36 LYS N . 18390 1
394 . 1 1 37 37 PRO HA H 1 4.416 0.007 . 1 . . . A 37 PRO HA . 18390 1
395 . 1 1 37 37 PRO HB2 H 1 2.147 0.012 . 2 . . . A 37 PRO HB2 . 18390 1
396 . 1 1 37 37 PRO HB3 H 1 2.147 0.012 . 2 . . . A 37 PRO HB3 . 18390 1
397 . 1 1 37 37 PRO HG2 H 1 1.972 0.009 . 2 . . . A 37 PRO HG2 . 18390 1
398 . 1 1 37 37 PRO HG3 H 1 1.972 0.009 . 2 . . . A 37 PRO HG3 . 18390 1
399 . 1 1 37 37 PRO HD2 H 1 3.859 0.003 . 2 . . . A 37 PRO HD2 . 18390 1
400 . 1 1 37 37 PRO HD3 H 1 3.633 0.004 . 2 . . . A 37 PRO HD3 . 18390 1
401 . 1 1 37 37 PRO C C 13 176.959 0.100 . 1 . . . A 37 PRO C . 18390 1
402 . 1 1 37 37 PRO CA C 13 64.125 0.039 . 1 . . . A 37 PRO CA . 18390 1
403 . 1 1 37 37 PRO CB C 13 32.664 0.082 . 1 . . . A 37 PRO CB . 18390 1
404 . 1 1 37 37 PRO CG C 13 26.833 0.096 . 1 . . . A 37 PRO CG . 18390 1
405 . 1 1 37 37 PRO CD C 13 50.906 0.082 . 1 . . . A 37 PRO CD . 18390 1
406 . 1 1 38 38 ASP H H 1 8.551 0.010 . 1 . . . A 38 ASP H . 18390 1
407 . 1 1 38 38 ASP HA H 1 4.567 0.004 . 1 . . . A 38 ASP HA . 18390 1
408 . 1 1 38 38 ASP HB2 H 1 2.619 0.003 . 2 . . . A 38 ASP HB2 . 18390 1
409 . 1 1 38 38 ASP HB3 H 1 2.619 0.003 . 2 . . . A 38 ASP HB3 . 18390 1
410 . 1 1 38 38 ASP C C 13 176.646 0.100 . 1 . . . A 38 ASP C . 18390 1
411 . 1 1 38 38 ASP CA C 13 53.325 0.068 . 1 . . . A 38 ASP CA . 18390 1
412 . 1 1 38 38 ASP CB C 13 40.258 0.067 . 1 . . . A 38 ASP CB . 18390 1
413 . 1 1 38 38 ASP N N 15 115.739 0.029 . 1 . . . A 38 ASP N . 18390 1
414 . 1 1 39 39 ALA H H 1 7.046 0.011 . 1 . . . A 39 ALA H . 18390 1
415 . 1 1 39 39 ALA HA H 1 4.316 0.002 . 1 . . . A 39 ALA HA . 18390 1
416 . 1 1 39 39 ALA HB1 H 1 1.298 0.003 . 1 . . . A 39 ALA HB1 . 18390 1
417 . 1 1 39 39 ALA HB2 H 1 1.298 0.003 . 1 . . . A 39 ALA HB2 . 18390 1
418 . 1 1 39 39 ALA HB3 H 1 1.298 0.003 . 1 . . . A 39 ALA HB3 . 18390 1
419 . 1 1 39 39 ALA C C 13 176.657 0.100 . 1 . . . A 39 ALA C . 18390 1
420 . 1 1 39 39 ALA CA C 13 51.618 0.119 . 1 . . . A 39 ALA CA . 18390 1
421 . 1 1 39 39 ALA CB C 13 21.131 0.050 . 1 . . . A 39 ALA CB . 18390 1
422 . 1 1 39 39 ALA N N 15 124.181 0.017 . 1 . . . A 39 ALA N . 18390 1
423 . 1 1 40 40 THR H H 1 8.078 0.008 . 1 . . . A 40 THR H . 18390 1
424 . 1 1 40 40 THR HA H 1 4.482 0.003 . 1 . . . A 40 THR HA . 18390 1
425 . 1 1 40 40 THR HB H 1 3.971 0.002 . 1 . . . A 40 THR HB . 18390 1
426 . 1 1 40 40 THR HG21 H 1 1.110 0.006 . 1 . . . A 40 THR HG21 . 18390 1
427 . 1 1 40 40 THR HG22 H 1 1.110 0.006 . 1 . . . A 40 THR HG22 . 18390 1
428 . 1 1 40 40 THR HG23 H 1 1.110 0.006 . 1 . . . A 40 THR HG23 . 18390 1
429 . 1 1 40 40 THR CA C 13 58.212 0.046 . 1 . . . A 40 THR CA . 18390 1
430 . 1 1 40 40 THR CB C 13 71.489 0.053 . 1 . . . A 40 THR CB . 18390 1
431 . 1 1 40 40 THR CG2 C 13 20.547 0.137 . 1 . . . A 40 THR CG2 . 18390 1
432 . 1 1 40 40 THR N N 15 113.038 0.018 . 1 . . . A 40 THR N . 18390 1
433 . 1 1 41 41 PRO HA H 1 4.022 0.034 . 1 . . . A 41 PRO HA . 18390 1
434 . 1 1 41 41 PRO HB2 H 1 2.578 0.012 . 2 . . . A 41 PRO HB2 . 18390 1
435 . 1 1 41 41 PRO C C 13 175.099 0.100 . 1 . . . A 41 PRO C . 18390 1
436 . 1 1 41 41 PRO CA C 13 63.246 0.035 . 1 . . . A 41 PRO CA . 18390 1
437 . 1 1 41 41 PRO CB C 13 35.560 0.045 . 1 . . . A 41 PRO CB . 18390 1
438 . 1 1 41 41 PRO CG C 13 25.396 0.035 . 1 . . . A 41 PRO CG . 18390 1
439 . 1 1 42 42 VAL H H 1 8.174 0.005 . 1 . . . A 42 VAL H . 18390 1
440 . 1 1 42 42 VAL HA H 1 3.523 0.005 . 1 . . . A 42 VAL HA . 18390 1
441 . 1 1 42 42 VAL HB H 1 1.885 0.004 . 1 . . . A 42 VAL HB . 18390 1
442 . 1 1 42 42 VAL HG11 H 1 0.622 0.007 . 1 . . . A 42 VAL HG11 . 18390 1
443 . 1 1 42 42 VAL HG12 H 1 0.622 0.007 . 1 . . . A 42 VAL HG12 . 18390 1
444 . 1 1 42 42 VAL HG13 H 1 0.622 0.007 . 1 . . . A 42 VAL HG13 . 18390 1
445 . 1 1 42 42 VAL HG21 H 1 1.224 0.005 . 1 . . . A 42 VAL HG21 . 18390 1
446 . 1 1 42 42 VAL HG22 H 1 1.224 0.005 . 1 . . . A 42 VAL HG22 . 18390 1
447 . 1 1 42 42 VAL HG23 H 1 1.224 0.005 . 1 . . . A 42 VAL HG23 . 18390 1
448 . 1 1 42 42 VAL C C 13 175.843 0.100 . 1 . . . A 42 VAL C . 18390 1
449 . 1 1 42 42 VAL CA C 13 64.893 0.028 . 1 . . . A 42 VAL CA . 18390 1
450 . 1 1 42 42 VAL CB C 13 32.586 0.042 . 1 . . . A 42 VAL CB . 18390 1
451 . 1 1 42 42 VAL CG1 C 13 21.489 0.031 . 2 . . . A 42 VAL CG1 . 18390 1
452 . 1 1 42 42 VAL CG2 C 13 23.422 0.066 . 2 . . . A 42 VAL CG2 . 18390 1
453 . 1 1 42 42 VAL N N 15 120.912 0.070 . 1 . . . A 42 VAL N . 18390 1
454 . 1 1 43 43 GLU H H 1 6.519 0.008 . 1 . . . A 43 GLU H . 18390 1
455 . 1 1 43 43 GLU HA H 1 5.393 0.011 . 1 . . . A 43 GLU HA . 18390 1
456 . 1 1 43 43 GLU HB2 H 1 1.661 0.008 . 2 . . . A 43 GLU HB2 . 18390 1
457 . 1 1 43 43 GLU HB3 H 1 2.172 0.015 . 2 . . . A 43 GLU HB3 . 18390 1
458 . 1 1 43 43 GLU HG2 H 1 1.928 0.009 . 2 . . . A 43 GLU HG2 . 18390 1
459 . 1 1 43 43 GLU HG3 H 1 2.319 0.008 . 2 . . . A 43 GLU HG3 . 18390 1
460 . 1 1 43 43 GLU C C 13 175.529 0.100 . 1 . . . A 43 GLU C . 18390 1
461 . 1 1 43 43 GLU CA C 13 53.700 0.110 . 1 . . . A 43 GLU CA . 18390 1
462 . 1 1 43 43 GLU CB C 13 35.351 0.090 . 1 . . . A 43 GLU CB . 18390 1
463 . 1 1 43 43 GLU CG C 13 36.289 0.092 . 1 . . . A 43 GLU CG . 18390 1
464 . 1 1 43 43 GLU N N 15 120.415 0.028 . 1 . . . A 43 GLU N . 18390 1
465 . 1 1 44 44 TYR H H 1 9.280 0.011 . 1 . . . A 44 TYR H . 18390 1
466 . 1 1 44 44 TYR HA H 1 5.269 0.008 . 1 . . . A 44 TYR HA . 18390 1
467 . 1 1 44 44 TYR HB2 H 1 2.452 0.006 . 2 . . . A 44 TYR HB2 . 18390 1
468 . 1 1 44 44 TYR HB3 H 1 2.878 0.003 . 2 . . . A 44 TYR HB3 . 18390 1
469 . 1 1 44 44 TYR HD1 H 1 7.043 0.011 . 3 . . . A 44 TYR HD1 . 18390 1
470 . 1 1 44 44 TYR HD2 H 1 7.043 0.011 . 3 . . . A 44 TYR HD2 . 18390 1
471 . 1 1 44 44 TYR HE1 H 1 6.924 0.034 . 3 . . . A 44 TYR HE1 . 18390 1
472 . 1 1 44 44 TYR HE2 H 1 6.924 0.034 . 3 . . . A 44 TYR HE2 . 18390 1
473 . 1 1 44 44 TYR C C 13 174.575 0.100 . 1 . . . A 44 TYR C . 18390 1
474 . 1 1 44 44 TYR CA C 13 56.891 0.080 . 1 . . . A 44 TYR CA . 18390 1
475 . 1 1 44 44 TYR CB C 13 42.731 0.107 . 1 . . . A 44 TYR CB . 18390 1
476 . 1 1 44 44 TYR CD2 C 13 133.417 0.098 . 3 . . . A 44 TYR CD2 . 18390 1
477 . 1 1 44 44 TYR CE2 C 13 118.739 0.035 . 3 . . . A 44 TYR CE2 . 18390 1
478 . 1 1 44 44 TYR N N 15 118.015 0.048 . 1 . . . A 44 TYR N . 18390 1
479 . 1 1 45 45 TYR H H 1 8.957 0.005 . 1 . . . A 45 TYR H . 18390 1
480 . 1 1 45 45 TYR HA H 1 4.232 0.006 . 1 . . . A 45 TYR HA . 18390 1
481 . 1 1 45 45 TYR HB2 H 1 0.089 0.007 . 2 . . . A 45 TYR HB2 . 18390 1
482 . 1 1 45 45 TYR HB3 H 1 2.061 0.007 . 2 . . . A 45 TYR HB3 . 18390 1
483 . 1 1 45 45 TYR HD1 H 1 5.677 0.006 . 3 . . . A 45 TYR HD1 . 18390 1
484 . 1 1 45 45 TYR HD2 H 1 5.677 0.006 . 3 . . . A 45 TYR HD2 . 18390 1
485 . 1 1 45 45 TYR HE1 H 1 6.475 0.008 . 3 . . . A 45 TYR HE1 . 18390 1
486 . 1 1 45 45 TYR HE2 H 1 6.475 0.008 . 3 . . . A 45 TYR HE2 . 18390 1
487 . 1 1 45 45 TYR C C 13 174.947 0.100 . 1 . . . A 45 TYR C . 18390 1
488 . 1 1 45 45 TYR CA C 13 56.737 0.114 . 1 . . . A 45 TYR CA . 18390 1
489 . 1 1 45 45 TYR CB C 13 37.601 0.068 . 1 . . . A 45 TYR CB . 18390 1
490 . 1 1 45 45 TYR CD2 C 13 132.190 0.016 . 3 . . . A 45 TYR CD2 . 18390 1
491 . 1 1 45 45 TYR CE2 C 13 117.046 0.006 . 3 . . . A 45 TYR CE2 . 18390 1
492 . 1 1 45 45 TYR N N 15 129.018 0.043 . 1 . . . A 45 TYR N . 18390 1
493 . 1 1 46 46 ILE H H 1 8.515 0.006 . 1 . . . A 46 ILE H . 18390 1
494 . 1 1 46 46 ILE HA H 1 4.426 0.008 . 1 . . . A 46 ILE HA . 18390 1
495 . 1 1 46 46 ILE HB H 1 1.536 0.006 . 1 . . . A 46 ILE HB . 18390 1
496 . 1 1 46 46 ILE HG12 H 1 1.143 0.002 . 2 . . . A 46 ILE HG12 . 18390 1
497 . 1 1 46 46 ILE HG13 H 1 1.277 0.005 . 2 . . . A 46 ILE HG13 . 18390 1
498 . 1 1 46 46 ILE HG21 H 1 -0.082 0.009 . 1 . . . A 46 ILE HG21 . 18390 1
499 . 1 1 46 46 ILE HG22 H 1 -0.082 0.009 . 1 . . . A 46 ILE HG22 . 18390 1
500 . 1 1 46 46 ILE HG23 H 1 -0.082 0.009 . 1 . . . A 46 ILE HG23 . 18390 1
501 . 1 1 46 46 ILE HD11 H 1 0.193 0.008 . 1 . . . A 46 ILE HD11 . 18390 1
502 . 1 1 46 46 ILE HD12 H 1 0.193 0.008 . 1 . . . A 46 ILE HD12 . 18390 1
503 . 1 1 46 46 ILE HD13 H 1 0.193 0.008 . 1 . . . A 46 ILE HD13 . 18390 1
504 . 1 1 46 46 ILE C C 13 174.931 0.100 . 1 . . . A 46 ILE C . 18390 1
505 . 1 1 46 46 ILE CA C 13 57.489 0.031 . 1 . . . A 46 ILE CA . 18390 1
506 . 1 1 46 46 ILE CB C 13 40.021 0.044 . 1 . . . A 46 ILE CB . 18390 1
507 . 1 1 46 46 ILE CG1 C 13 26.495 0.019 . 1 . . . A 46 ILE CG1 . 18390 1
508 . 1 1 46 46 ILE CG2 C 13 17.292 0.171 . 1 . . . A 46 ILE CG2 . 18390 1
509 . 1 1 46 46 ILE CD1 C 13 11.569 0.059 . 1 . . . A 46 ILE CD1 . 18390 1
510 . 1 1 46 46 ILE N N 15 129.061 0.041 . 1 . . . A 46 ILE N . 18390 1
511 . 1 1 47 47 HIS H H 1 7.801 0.004 . 1 . . . A 47 HIS H . 18390 1
512 . 1 1 47 47 HIS HA H 1 4.875 0.034 . 1 . . . A 47 HIS HA . 18390 1
513 . 1 1 47 47 HIS HD2 H 1 6.916 0.004 . 1 . . . A 47 HIS HD2 . 18390 1
514 . 1 1 47 47 HIS C C 13 175.289 0.100 . 1 . . . A 47 HIS C . 18390 1
515 . 1 1 47 47 HIS CA C 13 53.359 0.035 . 1 . . . A 47 HIS CA . 18390 1
516 . 1 1 47 47 HIS CB C 13 31.601 0.054 . 1 . . . A 47 HIS CB . 18390 1
517 . 1 1 47 47 HIS CD2 C 13 119.496 0.014 . 1 . . . A 47 HIS CD2 . 18390 1
518 . 1 1 47 47 HIS N N 15 118.453 0.051 . 1 . . . A 47 HIS N . 18390 1
519 . 1 1 48 48 TYR H H 1 7.993 0.006 . 1 . . . A 48 TYR H . 18390 1
520 . 1 1 48 48 TYR HA H 1 3.771 0.004 . 1 . . . A 48 TYR HA . 18390 1
521 . 1 1 48 48 TYR HD1 H 1 6.482 0.001 . 3 . . . A 48 TYR HD1 . 18390 1
522 . 1 1 48 48 TYR HD2 H 1 6.482 0.001 . 3 . . . A 48 TYR HD2 . 18390 1
523 . 1 1 48 48 TYR HE1 H 1 6.416 0.034 . 3 . . . A 48 TYR HE1 . 18390 1
524 . 1 1 48 48 TYR HE2 H 1 6.416 0.034 . 3 . . . A 48 TYR HE2 . 18390 1
525 . 1 1 48 48 TYR C C 13 176.065 0.100 . 1 . . . A 48 TYR C . 18390 1
526 . 1 1 48 48 TYR CB C 13 37.242 0.035 . 1 . . . A 48 TYR CB . 18390 1
527 . 1 1 48 48 TYR CD1 C 13 132.921 0.020 . 3 . . . A 48 TYR CD1 . 18390 1
528 . 1 1 48 48 TYR CE1 C 13 116.840 0.035 . 3 . . . A 48 TYR CE1 . 18390 1
529 . 1 1 48 48 TYR N N 15 128.932 0.027 . 1 . . . A 48 TYR N . 18390 1
530 . 1 1 49 49 ALA H H 1 7.840 0.003 . 1 . . . A 49 ALA H . 18390 1
531 . 1 1 49 49 ALA HA H 1 3.938 0.007 . 1 . . . A 49 ALA HA . 18390 1
532 . 1 1 49 49 ALA HB1 H 1 1.147 0.002 . 1 . . . A 49 ALA HB1 . 18390 1
533 . 1 1 49 49 ALA HB2 H 1 1.147 0.002 . 1 . . . A 49 ALA HB2 . 18390 1
534 . 1 1 49 49 ALA HB3 H 1 1.147 0.002 . 1 . . . A 49 ALA HB3 . 18390 1
535 . 1 1 49 49 ALA CA C 13 53.492 0.047 . 1 . . . A 49 ALA CA . 18390 1
536 . 1 1 49 49 ALA CB C 13 18.361 0.075 . 1 . . . A 49 ALA CB . 18390 1
537 . 1 1 49 49 ALA N N 15 125.452 0.033 . 1 . . . A 49 ALA N . 18390 1
538 . 1 1 50 50 GLY HA3 H 1 4.199 0.001 . 2 . . . A 50 GLY HA3 . 18390 1
539 . 1 1 50 50 GLY C C 13 175.551 0.100 . 1 . . . A 50 GLY C . 18390 1
540 . 1 1 50 50 GLY CA C 13 45.555 0.035 . 1 . . . A 50 GLY CA . 18390 1
541 . 1 1 51 51 TRP H H 1 8.068 0.003 . 1 . . . A 51 TRP H . 18390 1
542 . 1 1 51 51 TRP HA H 1 4.961 0.005 . 1 . . . A 51 TRP HA . 18390 1
543 . 1 1 51 51 TRP HB2 H 1 3.058 0.002 . 2 . . . A 51 TRP HB2 . 18390 1
544 . 1 1 51 51 TRP HB3 H 1 3.161 0.015 . 2 . . . A 51 TRP HB3 . 18390 1
545 . 1 1 51 51 TRP HD1 H 1 6.761 0.002 . 1 . . . A 51 TRP HD1 . 18390 1
546 . 1 1 51 51 TRP HE1 H 1 9.172 0.002 . 1 . . . A 51 TRP HE1 . 18390 1
547 . 1 1 51 51 TRP CA C 13 55.104 0.005 . 1 . . . A 51 TRP CA . 18390 1
548 . 1 1 51 51 TRP CB C 13 31.237 0.035 . 1 . . . A 51 TRP CB . 18390 1
549 . 1 1 51 51 TRP CD1 C 13 124.332 0.035 . 1 . . . A 51 TRP CD1 . 18390 1
550 . 1 1 51 51 TRP N N 15 122.122 0.018 . 1 . . . A 51 TRP N . 18390 1
551 . 1 1 51 51 TRP NE1 N 15 126.052 0.006 . 1 . . . A 51 TRP NE1 . 18390 1
552 . 1 1 53 53 LYS HA H 1 4.539 0.001 . 1 . . . A 53 LYS HA . 18390 1
553 . 1 1 53 53 LYS HB2 H 1 1.918 0.001 . 2 . . . A 53 LYS HB2 . 18390 1
554 . 1 1 53 53 LYS HB3 H 1 1.918 0.001 . 2 . . . A 53 LYS HB3 . 18390 1
555 . 1 1 53 53 LYS HG2 H 1 1.665 0.034 . 2 . . . A 53 LYS HG2 . 18390 1
556 . 1 1 53 53 LYS HG3 H 1 1.665 0.034 . 2 . . . A 53 LYS HG3 . 18390 1
557 . 1 1 53 53 LYS HD2 H 1 1.507 0.005 . 2 . . . A 53 LYS HD2 . 18390 1
558 . 1 1 53 53 LYS HD3 H 1 1.507 0.005 . 2 . . . A 53 LYS HD3 . 18390 1
559 . 1 1 53 53 LYS HE2 H 1 2.974 0.034 . 2 . . . A 53 LYS HE2 . 18390 1
560 . 1 1 53 53 LYS HE3 H 1 2.974 0.034 . 2 . . . A 53 LYS HE3 . 18390 1
561 . 1 1 53 53 LYS C C 13 178.701 0.100 . 1 . . . A 53 LYS C . 18390 1
562 . 1 1 53 53 LYS CA C 13 58.133 0.035 . 1 . . . A 53 LYS CA . 18390 1
563 . 1 1 53 53 LYS CB C 13 32.367 0.071 . 1 . . . A 53 LYS CB . 18390 1
564 . 1 1 53 53 LYS CG C 13 29.393 0.136 . 1 . . . A 53 LYS CG . 18390 1
565 . 1 1 53 53 LYS CD C 13 24.571 0.112 . 1 . . . A 53 LYS CD . 18390 1
566 . 1 1 53 53 LYS CE C 13 41.899 0.035 . 1 . . . A 53 LYS CE . 18390 1
567 . 1 1 54 54 ASN H H 1 8.436 0.004 . 1 . . . A 54 ASN H . 18390 1
568 . 1 1 54 54 ASN HA H 1 4.358 0.006 . 1 . . . A 54 ASN HA . 18390 1
569 . 1 1 54 54 ASN HB2 H 1 1.848 0.034 . 2 . . . A 54 ASN HB2 . 18390 1
570 . 1 1 54 54 ASN HB3 H 1 2.362 0.034 . 2 . . . A 54 ASN HB3 . 18390 1
571 . 1 1 54 54 ASN C C 13 176.691 0.100 . 1 . . . A 54 ASN C . 18390 1
572 . 1 1 54 54 ASN CA C 13 55.481 0.118 . 1 . . . A 54 ASN CA . 18390 1
573 . 1 1 54 54 ASN CB C 13 37.442 0.035 . 1 . . . A 54 ASN CB . 18390 1
574 . 1 1 54 54 ASN N N 15 117.944 0.045 . 1 . . . A 54 ASN N . 18390 1
575 . 1 1 55 55 TRP H H 1 7.625 0.007 . 1 . . . A 55 TRP H . 18390 1
576 . 1 1 55 55 TRP HA H 1 4.736 0.021 . 1 . . . A 55 TRP HA . 18390 1
577 . 1 1 55 55 TRP HB2 H 1 3.447 0.004 . 2 . . . A 55 TRP HB2 . 18390 1
578 . 1 1 55 55 TRP HB3 H 1 3.624 0.005 . 2 . . . A 55 TRP HB3 . 18390 1
579 . 1 1 55 55 TRP HD1 H 1 7.366 0.006 . 1 . . . A 55 TRP HD1 . 18390 1
580 . 1 1 55 55 TRP HE1 H 1 9.912 0.003 . 1 . . . A 55 TRP HE1 . 18390 1
581 . 1 1 55 55 TRP C C 13 176.142 0.100 . 1 . . . A 55 TRP C . 18390 1
582 . 1 1 55 55 TRP CB C 13 30.414 0.078 . 1 . . . A 55 TRP CB . 18390 1
583 . 1 1 55 55 TRP CD1 C 13 127.502 0.011 . 1 . . . A 55 TRP CD1 . 18390 1
584 . 1 1 55 55 TRP N N 15 118.384 0.050 . 1 . . . A 55 TRP N . 18390 1
585 . 1 1 55 55 TRP NE1 N 15 127.765 0.014 . 1 . . . A 55 TRP NE1 . 18390 1
586 . 1 1 56 56 ASP H H 1 7.554 0.005 . 1 . . . A 56 ASP H . 18390 1
587 . 1 1 56 56 ASP HA H 1 4.857 0.005 . 1 . . . A 56 ASP HA . 18390 1
588 . 1 1 56 56 ASP HB2 H 1 2.055 0.003 . 2 . . . A 56 ASP HB2 . 18390 1
589 . 1 1 56 56 ASP HB3 H 1 2.675 0.006 . 2 . . . A 56 ASP HB3 . 18390 1
590 . 1 1 56 56 ASP C C 13 178.016 0.100 . 1 . . . A 56 ASP C . 18390 1
591 . 1 1 56 56 ASP CA C 13 55.569 0.124 . 1 . . . A 56 ASP CA . 18390 1
592 . 1 1 56 56 ASP CB C 13 38.656 0.005 . 1 . . . A 56 ASP CB . 18390 1
593 . 1 1 56 56 ASP N N 15 121.933 0.034 . 1 . . . A 56 ASP N . 18390 1
594 . 1 1 57 57 GLU H H 1 7.735 0.005 . 1 . . . A 57 GLU H . 18390 1
595 . 1 1 57 57 GLU HA H 1 4.833 0.016 . 1 . . . A 57 GLU HA . 18390 1
596 . 1 1 57 57 GLU HB2 H 1 2.159 0.007 . 2 . . . A 57 GLU HB2 . 18390 1
597 . 1 1 57 57 GLU HB3 H 1 2.159 0.007 . 2 . . . A 57 GLU HB3 . 18390 1
598 . 1 1 57 57 GLU HG2 H 1 2.264 0.010 . 2 . . . A 57 GLU HG2 . 18390 1
599 . 1 1 57 57 GLU HG3 H 1 2.696 0.009 . 2 . . . A 57 GLU HG3 . 18390 1
600 . 1 1 57 57 GLU C C 13 175.753 0.100 . 1 . . . A 57 GLU C . 18390 1
601 . 1 1 57 57 GLU CA C 13 54.857 0.061 . 1 . . . A 57 GLU CA . 18390 1
602 . 1 1 57 57 GLU CG C 13 34.174 0.076 . 1 . . . A 57 GLU CG . 18390 1
603 . 1 1 57 57 GLU N N 15 117.357 0.034 . 1 . . . A 57 GLU N . 18390 1
604 . 1 1 58 58 TRP H H 1 8.842 0.003 . 1 . . . A 58 TRP H . 18390 1
605 . 1 1 58 58 TRP HA H 1 5.326 0.009 . 1 . . . A 58 TRP HA . 18390 1
606 . 1 1 58 58 TRP HB2 H 1 3.229 0.006 . 2 . . . A 58 TRP HB2 . 18390 1
607 . 1 1 58 58 TRP HB3 H 1 3.229 0.006 . 2 . . . A 58 TRP HB3 . 18390 1
608 . 1 1 58 58 TRP HD1 H 1 7.490 0.007 . 1 . . . A 58 TRP HD1 . 18390 1
609 . 1 1 58 58 TRP HE1 H 1 9.954 0.011 . 1 . . . A 58 TRP HE1 . 18390 1
610 . 1 1 58 58 TRP HZ2 H 1 7.197 0.002 . 1 . . . A 58 TRP HZ2 . 18390 1
611 . 1 1 58 58 TRP C C 13 178.360 0.100 . 1 . . . A 58 TRP C . 18390 1
612 . 1 1 58 58 TRP CA C 13 57.439 0.035 . 1 . . . A 58 TRP CA . 18390 1
613 . 1 1 58 58 TRP CB C 13 29.922 0.136 . 1 . . . A 58 TRP CB . 18390 1
614 . 1 1 58 58 TRP CD1 C 13 127.975 0.041 . 1 . . . A 58 TRP CD1 . 18390 1
615 . 1 1 58 58 TRP CZ2 C 13 114.632 0.021 . 1 . . . A 58 TRP CZ2 . 18390 1
616 . 1 1 58 58 TRP N N 15 122.189 0.030 . 1 . . . A 58 TRP N . 18390 1
617 . 1 1 58 58 TRP NE1 N 15 130.327 0.014 . 1 . . . A 58 TRP NE1 . 18390 1
618 . 1 1 59 59 VAL H H 1 10.069 0.009 . 1 . . . A 59 VAL H . 18390 1
619 . 1 1 59 59 VAL HA H 1 4.952 0.008 . 1 . . . A 59 VAL HA . 18390 1
620 . 1 1 59 59 VAL HB H 1 2.058 0.004 . 1 . . . A 59 VAL HB . 18390 1
621 . 1 1 59 59 VAL HG11 H 1 1.032 0.004 . 1 . . . A 59 VAL HG11 . 18390 1
622 . 1 1 59 59 VAL HG12 H 1 1.032 0.004 . 1 . . . A 59 VAL HG12 . 18390 1
623 . 1 1 59 59 VAL HG13 H 1 1.032 0.004 . 1 . . . A 59 VAL HG13 . 18390 1
624 . 1 1 59 59 VAL HG21 H 1 0.956 0.003 . 1 . . . A 59 VAL HG21 . 18390 1
625 . 1 1 59 59 VAL HG22 H 1 0.956 0.003 . 1 . . . A 59 VAL HG22 . 18390 1
626 . 1 1 59 59 VAL HG23 H 1 0.956 0.003 . 1 . . . A 59 VAL HG23 . 18390 1
627 . 1 1 59 59 VAL CA C 13 58.253 0.088 . 1 . . . A 59 VAL CA . 18390 1
628 . 1 1 59 59 VAL CB C 13 35.141 0.057 . 1 . . . A 59 VAL CB . 18390 1
629 . 1 1 59 59 VAL CG1 C 13 21.941 0.067 . 2 . . . A 59 VAL CG1 . 18390 1
630 . 1 1 59 59 VAL CG2 C 13 21.165 0.050 . 2 . . . A 59 VAL CG2 . 18390 1
631 . 1 1 59 59 VAL N N 15 122.442 0.041 . 1 . . . A 59 VAL N . 18390 1
632 . 1 1 60 60 PRO HA H 1 5.031 0.008 . 1 . . . A 60 PRO HA . 18390 1
633 . 1 1 60 60 PRO HB2 H 1 2.320 0.034 . 2 . . . A 60 PRO HB2 . 18390 1
634 . 1 1 60 60 PRO HB3 H 1 2.320 0.034 . 2 . . . A 60 PRO HB3 . 18390 1
635 . 1 1 60 60 PRO C C 13 179.825 0.100 . 1 . . . A 60 PRO C . 18390 1
636 . 1 1 60 60 PRO CA C 13 62.170 0.029 . 1 . . . A 60 PRO CA . 18390 1
637 . 1 1 60 60 PRO CB C 13 33.050 0.147 . 1 . . . A 60 PRO CB . 18390 1
638 . 1 1 60 60 PRO CG C 13 27.412 0.035 . 1 . . . A 60 PRO CG . 18390 1
639 . 1 1 61 61 GLU H H 1 8.645 0.006 . 1 . . . A 61 GLU H . 18390 1
640 . 1 1 61 61 GLU HA H 1 4.052 0.016 . 1 . . . A 61 GLU HA . 18390 1
641 . 1 1 61 61 GLU C C 13 177.060 0.100 . 1 . . . A 61 GLU C . 18390 1
642 . 1 1 61 61 GLU CA C 13 60.602 0.071 . 1 . . . A 61 GLU CA . 18390 1
643 . 1 1 61 61 GLU N N 15 118.470 0.014 . 1 . . . A 61 GLU N . 18390 1
644 . 1 1 62 62 ASN H H 1 8.065 0.012 . 1 . . . A 62 ASN H . 18390 1
645 . 1 1 62 62 ASN HA H 1 4.685 0.001 . 1 . . . A 62 ASN HA . 18390 1
646 . 1 1 62 62 ASN HB2 H 1 2.886 0.007 . 2 . . . A 62 ASN HB2 . 18390 1
647 . 1 1 62 62 ASN HB3 H 1 2.982 0.002 . 2 . . . A 62 ASN HB3 . 18390 1
648 . 1 1 62 62 ASN C C 13 177.720 0.100 . 1 . . . A 62 ASN C . 18390 1
649 . 1 1 62 62 ASN CA C 13 55.397 0.072 . 1 . . . A 62 ASN CA . 18390 1
650 . 1 1 62 62 ASN CB C 13 37.544 0.004 . 1 . . . A 62 ASN CB . 18390 1
651 . 1 1 62 62 ASN N N 15 109.601 0.076 . 1 . . . A 62 ASN N . 18390 1
652 . 1 1 63 63 ARG H H 1 8.186 0.004 . 1 . . . A 63 ARG H . 18390 1
653 . 1 1 63 63 ARG HA H 1 4.458 0.001 . 1 . . . A 63 ARG HA . 18390 1
654 . 1 1 63 63 ARG HB2 H 1 2.579 0.008 . 2 . . . A 63 ARG HB2 . 18390 1
655 . 1 1 63 63 ARG HB3 H 1 2.579 0.008 . 2 . . . A 63 ARG HB3 . 18390 1
656 . 1 1 63 63 ARG HG2 H 1 1.799 0.016 . 2 . . . A 63 ARG HG2 . 18390 1
657 . 1 1 63 63 ARG HG3 H 1 1.799 0.016 . 2 . . . A 63 ARG HG3 . 18390 1
658 . 1 1 63 63 ARG HD2 H 1 3.307 0.015 . 2 . . . A 63 ARG HD2 . 18390 1
659 . 1 1 63 63 ARG HD3 H 1 3.307 0.015 . 2 . . . A 63 ARG HD3 . 18390 1
660 . 1 1 63 63 ARG C C 13 174.172 0.100 . 1 . . . A 63 ARG C . 18390 1
661 . 1 1 63 63 ARG CA C 13 56.806 0.035 . 1 . . . A 63 ARG CA . 18390 1
662 . 1 1 63 63 ARG CB C 13 31.957 0.084 . 1 . . . A 63 ARG CB . 18390 1
663 . 1 1 63 63 ARG CG C 13 28.043 0.148 . 1 . . . A 63 ARG CG . 18390 1
664 . 1 1 63 63 ARG CD C 13 44.340 0.160 . 1 . . . A 63 ARG CD . 18390 1
665 . 1 1 63 63 ARG N N 15 119.388 0.044 . 1 . . . A 63 ARG N . 18390 1
666 . 1 1 64 64 VAL H H 1 7.736 0.004 . 1 . . . A 64 VAL H . 18390 1
667 . 1 1 64 64 VAL HA H 1 4.130 0.004 . 1 . . . A 64 VAL HA . 18390 1
668 . 1 1 64 64 VAL HB H 1 1.518 0.006 . 1 . . . A 64 VAL HB . 18390 1
669 . 1 1 64 64 VAL HG11 H 1 -0.499 0.007 . 1 . . . A 64 VAL HG11 . 18390 1
670 . 1 1 64 64 VAL HG12 H 1 -0.499 0.007 . 1 . . . A 64 VAL HG12 . 18390 1
671 . 1 1 64 64 VAL HG13 H 1 -0.499 0.007 . 1 . . . A 64 VAL HG13 . 18390 1
672 . 1 1 64 64 VAL HG21 H 1 0.593 0.009 . 1 . . . A 64 VAL HG21 . 18390 1
673 . 1 1 64 64 VAL HG22 H 1 0.593 0.009 . 1 . . . A 64 VAL HG22 . 18390 1
674 . 1 1 64 64 VAL HG23 H 1 0.593 0.009 . 1 . . . A 64 VAL HG23 . 18390 1
675 . 1 1 64 64 VAL C C 13 174.373 0.100 . 1 . . . A 64 VAL C . 18390 1
676 . 1 1 64 64 VAL CA C 13 62.217 0.030 . 1 . . . A 64 VAL CA . 18390 1
677 . 1 1 64 64 VAL CB C 13 32.526 0.072 . 1 . . . A 64 VAL CB . 18390 1
678 . 1 1 64 64 VAL CG1 C 13 20.920 0.031 . 2 . . . A 64 VAL CG1 . 18390 1
679 . 1 1 64 64 VAL CG2 C 13 22.640 0.043 . 2 . . . A 64 VAL CG2 . 18390 1
680 . 1 1 64 64 VAL N N 15 120.468 0.039 . 1 . . . A 64 VAL N . 18390 1
681 . 1 1 65 65 LEU H H 1 8.858 0.003 . 1 . . . A 65 LEU H . 18390 1
682 . 1 1 65 65 LEU HA H 1 4.860 0.034 . 1 . . . A 65 LEU HA . 18390 1
683 . 1 1 65 65 LEU HB2 H 1 1.383 0.013 . 2 . . . A 65 LEU HB2 . 18390 1
684 . 1 1 65 65 LEU HB3 H 1 1.534 0.034 . 2 . . . A 65 LEU HB3 . 18390 1
685 . 1 1 65 65 LEU HG H 1 1.499 0.004 . 1 . . . A 65 LEU HG . 18390 1
686 . 1 1 65 65 LEU HD11 H 1 0.559 0.017 . 1 . . . A 65 LEU HD11 . 18390 1
687 . 1 1 65 65 LEU HD12 H 1 0.559 0.017 . 1 . . . A 65 LEU HD12 . 18390 1
688 . 1 1 65 65 LEU HD13 H 1 0.559 0.017 . 1 . . . A 65 LEU HD13 . 18390 1
689 . 1 1 65 65 LEU HD21 H 1 0.863 0.004 . 1 . . . A 65 LEU HD21 . 18390 1
690 . 1 1 65 65 LEU HD22 H 1 0.863 0.004 . 1 . . . A 65 LEU HD22 . 18390 1
691 . 1 1 65 65 LEU HD23 H 1 0.863 0.004 . 1 . . . A 65 LEU HD23 . 18390 1
692 . 1 1 65 65 LEU C C 13 177.573 0.100 . 1 . . . A 65 LEU C . 18390 1
693 . 1 1 65 65 LEU CA C 13 52.867 0.035 . 1 . . . A 65 LEU CA . 18390 1
694 . 1 1 65 65 LEU CB C 13 45.882 0.057 . 1 . . . A 65 LEU CB . 18390 1
695 . 1 1 65 65 LEU CG C 13 26.904 0.086 . 1 . . . A 65 LEU CG . 18390 1
696 . 1 1 65 65 LEU CD1 C 13 26.135 0.107 . 2 . . . A 65 LEU CD1 . 18390 1
697 . 1 1 65 65 LEU CD2 C 13 24.025 0.038 . 2 . . . A 65 LEU CD2 . 18390 1
698 . 1 1 65 65 LEU N N 15 124.312 0.028 . 1 . . . A 65 LEU N . 18390 1
699 . 1 1 66 66 LYS H H 1 8.577 0.003 . 1 . . . A 66 LYS H . 18390 1
700 . 1 1 66 66 LYS HA H 1 4.565 0.002 . 1 . . . A 66 LYS HA . 18390 1
701 . 1 1 66 66 LYS C C 13 178.208 0.100 . 1 . . . A 66 LYS C . 18390 1
702 . 1 1 66 66 LYS CA C 13 54.712 0.035 . 1 . . . A 66 LYS CA . 18390 1
703 . 1 1 66 66 LYS CB C 13 33.354 0.035 . 1 . . . A 66 LYS CB . 18390 1
704 . 1 1 66 66 LYS CG C 13 23.945 0.035 . 1 . . . A 66 LYS CG . 18390 1
705 . 1 1 66 66 LYS CD C 13 28.700 0.035 . 1 . . . A 66 LYS CD . 18390 1
706 . 1 1 66 66 LYS N N 15 119.103 0.019 . 1 . . . A 66 LYS N . 18390 1
707 . 1 1 67 67 TYR H H 1 8.953 0.009 . 1 . . . A 67 TYR H . 18390 1
708 . 1 1 67 67 TYR HA H 1 3.988 0.005 . 1 . . . A 67 TYR HA . 18390 1
709 . 1 1 67 67 TYR HB2 H 1 2.398 0.034 . 2 . . . A 67 TYR HB2 . 18390 1
710 . 1 1 67 67 TYR HB3 H 1 3.366 0.007 . 2 . . . A 67 TYR HB3 . 18390 1
711 . 1 1 67 67 TYR HD1 H 1 6.706 0.004 . 3 . . . A 67 TYR HD1 . 18390 1
712 . 1 1 67 67 TYR HD2 H 1 6.706 0.004 . 3 . . . A 67 TYR HD2 . 18390 1
713 . 1 1 67 67 TYR HE1 H 1 6.561 0.002 . 3 . . . A 67 TYR HE1 . 18390 1
714 . 1 1 67 67 TYR HE2 H 1 6.561 0.002 . 3 . . . A 67 TYR HE2 . 18390 1
715 . 1 1 67 67 TYR C C 13 174.986 0.100 . 1 . . . A 67 TYR C . 18390 1
716 . 1 1 67 67 TYR CA C 13 59.137 0.100 . 1 . . . A 67 TYR CA . 18390 1
717 . 1 1 67 67 TYR CB C 13 38.365 0.088 . 1 . . . A 67 TYR CB . 18390 1
718 . 1 1 67 67 TYR CD2 C 13 131.887 0.035 . 3 . . . A 67 TYR CD2 . 18390 1
719 . 1 1 67 67 TYR CE2 C 13 118.142 0.015 . 3 . . . A 67 TYR CE2 . 18390 1
720 . 1 1 67 67 TYR N N 15 123.006 0.026 . 1 . . . A 67 TYR N . 18390 1
721 . 1 1 68 68 ASN H H 1 7.058 0.003 . 1 . . . A 68 ASN H . 18390 1
722 . 1 1 68 68 ASN HA H 1 4.696 0.005 . 1 . . . A 68 ASN HA . 18390 1
723 . 1 1 68 68 ASN HB2 H 1 2.973 0.034 . 2 . . . A 68 ASN HB2 . 18390 1
724 . 1 1 68 68 ASN HB3 H 1 3.140 0.034 . 2 . . . A 68 ASN HB3 . 18390 1
725 . 1 1 68 68 ASN C C 13 175.523 0.100 . 1 . . . A 68 ASN C . 18390 1
726 . 1 1 68 68 ASN CA C 13 51.472 0.110 . 1 . . . A 68 ASN CA . 18390 1
727 . 1 1 68 68 ASN CB C 13 39.299 0.035 . 1 . . . A 68 ASN CB . 18390 1
728 . 1 1 68 68 ASN N N 15 124.241 0.018 . 1 . . . A 68 ASN N . 18390 1
729 . 1 1 69 69 ASP H H 1 8.531 0.004 . 1 . . . A 69 ASP H . 18390 1
730 . 1 1 69 69 ASP HA H 1 4.202 0.008 . 1 . . . A 69 ASP HA . 18390 1
731 . 1 1 69 69 ASP HB2 H 1 2.598 0.005 . 2 . . . A 69 ASP HB2 . 18390 1
732 . 1 1 69 69 ASP HB3 H 1 2.598 0.005 . 2 . . . A 69 ASP HB3 . 18390 1
733 . 1 1 69 69 ASP C C 13 179.461 0.100 . 1 . . . A 69 ASP C . 18390 1
734 . 1 1 69 69 ASP CA C 13 57.880 0.112 . 1 . . . A 69 ASP CA . 18390 1
735 . 1 1 69 69 ASP CB C 13 40.983 0.089 . 1 . . . A 69 ASP CB . 18390 1
736 . 1 1 69 69 ASP N N 15 118.358 0.027 . 1 . . . A 69 ASP N . 18390 1
737 . 1 1 70 70 ASP H H 1 8.169 0.004 . 1 . . . A 70 ASP H . 18390 1
738 . 1 1 70 70 ASP HA H 1 4.308 0.005 . 1 . . . A 70 ASP HA . 18390 1
739 . 1 1 70 70 ASP HB2 H 1 2.519 0.005 . 2 . . . A 70 ASP HB2 . 18390 1
740 . 1 1 70 70 ASP HB3 H 1 2.519 0.005 . 2 . . . A 70 ASP HB3 . 18390 1
741 . 1 1 70 70 ASP C C 13 179.983 0.100 . 1 . . . A 70 ASP C . 18390 1
742 . 1 1 70 70 ASP CA C 13 57.543 0.095 . 1 . . . A 70 ASP CA . 18390 1
743 . 1 1 70 70 ASP CB C 13 40.539 0.095 . 1 . . . A 70 ASP CB . 18390 1
744 . 1 1 70 70 ASP N N 15 119.894 0.022 . 1 . . . A 70 ASP N . 18390 1
745 . 1 1 71 71 ASN H H 1 8.651 0.003 . 1 . . . A 71 ASN H . 18390 1
746 . 1 1 71 71 ASN HA H 1 4.620 0.002 . 1 . . . A 71 ASN HA . 18390 1
747 . 1 1 71 71 ASN HB2 H 1 2.334 0.034 . 2 . . . A 71 ASN HB2 . 18390 1
748 . 1 1 71 71 ASN HB3 H 1 2.721 0.034 . 2 . . . A 71 ASN HB3 . 18390 1
749 . 1 1 71 71 ASN C C 13 178.683 0.100 . 1 . . . A 71 ASN C . 18390 1
750 . 1 1 71 71 ASN CA C 13 54.994 0.035 . 1 . . . A 71 ASN CA . 18390 1
751 . 1 1 71 71 ASN CB C 13 38.329 0.092 . 1 . . . A 71 ASN CB . 18390 1
752 . 1 1 71 71 ASN N N 15 119.689 0.024 . 1 . . . A 71 ASN N . 18390 1
753 . 1 1 72 72 VAL H H 1 8.263 0.006 . 1 . . . A 72 VAL H . 18390 1
754 . 1 1 72 72 VAL HA H 1 3.352 0.005 . 1 . . . A 72 VAL HA . 18390 1
755 . 1 1 72 72 VAL HB H 1 1.998 0.004 . 1 . . . A 72 VAL HB . 18390 1
756 . 1 1 72 72 VAL HG11 H 1 0.817 0.002 . 1 . . . A 72 VAL HG11 . 18390 1
757 . 1 1 72 72 VAL HG12 H 1 0.817 0.002 . 1 . . . A 72 VAL HG12 . 18390 1
758 . 1 1 72 72 VAL HG13 H 1 0.817 0.002 . 1 . . . A 72 VAL HG13 . 18390 1
759 . 1 1 72 72 VAL HG21 H 1 0.635 0.002 . 1 . . . A 72 VAL HG21 . 18390 1
760 . 1 1 72 72 VAL HG22 H 1 0.635 0.002 . 1 . . . A 72 VAL HG22 . 18390 1
761 . 1 1 72 72 VAL HG23 H 1 0.635 0.002 . 1 . . . A 72 VAL HG23 . 18390 1
762 . 1 1 72 72 VAL C C 13 179.626 0.100 . 1 . . . A 72 VAL C . 18390 1
763 . 1 1 72 72 VAL CA C 13 67.294 0.113 . 1 . . . A 72 VAL CA . 18390 1
764 . 1 1 72 72 VAL CB C 13 31.853 0.063 . 1 . . . A 72 VAL CB . 18390 1
765 . 1 1 72 72 VAL CG1 C 13 21.288 0.028 . 2 . . . A 72 VAL CG1 . 18390 1
766 . 1 1 72 72 VAL CG2 C 13 23.871 0.098 . 2 . . . A 72 VAL CG2 . 18390 1
767 . 1 1 72 72 VAL N N 15 123.638 0.022 . 1 . . . A 72 VAL N . 18390 1
768 . 1 1 73 73 LYS H H 1 7.765 0.003 . 1 . . . A 73 LYS H . 18390 1
769 . 1 1 73 73 LYS HA H 1 4.047 0.006 . 1 . . . A 73 LYS HA . 18390 1
770 . 1 1 73 73 LYS HB2 H 1 1.924 0.007 . 2 . . . A 73 LYS HB2 . 18390 1
771 . 1 1 73 73 LYS HB3 H 1 1.924 0.007 . 2 . . . A 73 LYS HB3 . 18390 1
772 . 1 1 73 73 LYS HG2 H 1 1.400 0.011 . 2 . . . A 73 LYS HG2 . 18390 1
773 . 1 1 73 73 LYS HG3 H 1 1.551 0.004 . 2 . . . A 73 LYS HG3 . 18390 1
774 . 1 1 73 73 LYS HD2 H 1 1.675 0.004 . 2 . . . A 73 LYS HD2 . 18390 1
775 . 1 1 73 73 LYS HD3 H 1 1.675 0.004 . 2 . . . A 73 LYS HD3 . 18390 1
776 . 1 1 73 73 LYS HE2 H 1 2.955 0.007 . 2 . . . A 73 LYS HE2 . 18390 1
777 . 1 1 73 73 LYS HE3 H 1 2.955 0.007 . 2 . . . A 73 LYS HE3 . 18390 1
778 . 1 1 73 73 LYS C C 13 180.154 0.100 . 1 . . . A 73 LYS C . 18390 1
779 . 1 1 73 73 LYS CA C 13 59.880 0.107 . 1 . . . A 73 LYS CA . 18390 1
780 . 1 1 73 73 LYS CB C 13 32.059 0.125 . 1 . . . A 73 LYS CB . 18390 1
781 . 1 1 73 73 LYS CG C 13 25.441 0.108 . 1 . . . A 73 LYS CG . 18390 1
782 . 1 1 73 73 LYS CD C 13 29.475 0.142 . 1 . . . A 73 LYS CD . 18390 1
783 . 1 1 73 73 LYS CE C 13 42.219 0.191 . 1 . . . A 73 LYS CE . 18390 1
784 . 1 1 73 73 LYS N N 15 121.004 0.032 . 1 . . . A 73 LYS N . 18390 1
785 . 1 1 74 74 ARG H H 1 7.674 0.005 . 1 . . . A 74 ARG H . 18390 1
786 . 1 1 74 74 ARG HA H 1 4.080 0.003 . 1 . . . A 74 ARG HA . 18390 1
787 . 1 1 74 74 ARG HB2 H 1 1.904 0.034 . 2 . . . A 74 ARG HB2 . 18390 1
788 . 1 1 74 74 ARG HB3 H 1 1.904 0.034 . 2 . . . A 74 ARG HB3 . 18390 1
789 . 1 1 74 74 ARG HG2 H 1 1.531 0.013 . 2 . . . A 74 ARG HG2 . 18390 1
790 . 1 1 74 74 ARG HG3 H 1 1.531 0.013 . 2 . . . A 74 ARG HG3 . 18390 1
791 . 1 1 74 74 ARG HD2 H 1 3.052 0.002 . 2 . . . A 74 ARG HD2 . 18390 1
792 . 1 1 74 74 ARG HD3 H 1 3.052 0.002 . 2 . . . A 74 ARG HD3 . 18390 1
793 . 1 1 74 74 ARG C C 13 179.025 0.100 . 1 . . . A 74 ARG C . 18390 1
794 . 1 1 74 74 ARG CA C 13 58.979 0.035 . 1 . . . A 74 ARG CA . 18390 1
795 . 1 1 74 74 ARG CB C 13 30.396 0.045 . 1 . . . A 74 ARG CB . 18390 1
796 . 1 1 74 74 ARG CG C 13 26.764 0.013 . 1 . . . A 74 ARG CG . 18390 1
797 . 1 1 74 74 ARG CD C 13 44.050 0.131 . 1 . . . A 74 ARG CD . 18390 1
798 . 1 1 74 74 ARG N N 15 119.703 0.018 . 1 . . . A 74 ARG N . 18390 1
799 . 1 1 75 75 ARG H H 1 7.940 0.008 . 1 . . . A 75 ARG H . 18390 1
800 . 1 1 75 75 ARG HA H 1 3.733 0.006 . 1 . . . A 75 ARG HA . 18390 1
801 . 1 1 75 75 ARG HB2 H 1 1.396 0.010 . 2 . . . A 75 ARG HB2 . 18390 1
802 . 1 1 75 75 ARG HB3 H 1 1.396 0.010 . 2 . . . A 75 ARG HB3 . 18390 1
803 . 1 1 75 75 ARG HG2 H 1 1.702 0.012 . 2 . . . A 75 ARG HG2 . 18390 1
804 . 1 1 75 75 ARG HG3 H 1 1.702 0.012 . 2 . . . A 75 ARG HG3 . 18390 1
805 . 1 1 75 75 ARG HD2 H 1 2.902 0.004 . 2 . . . A 75 ARG HD2 . 18390 1
806 . 1 1 75 75 ARG HD3 H 1 2.902 0.004 . 2 . . . A 75 ARG HD3 . 18390 1
807 . 1 1 75 75 ARG C C 13 179.431 0.100 . 1 . . . A 75 ARG C . 18390 1
808 . 1 1 75 75 ARG CA C 13 59.682 0.135 . 1 . . . A 75 ARG CA . 18390 1
809 . 1 1 75 75 ARG CB C 13 29.737 0.035 . 1 . . . A 75 ARG CB . 18390 1
810 . 1 1 75 75 ARG CG C 13 26.508 0.079 . 1 . . . A 75 ARG CG . 18390 1
811 . 1 1 75 75 ARG CD C 13 43.876 0.077 . 1 . . . A 75 ARG CD . 18390 1
812 . 1 1 75 75 ARG N N 15 119.121 0.028 . 1 . . . A 75 ARG N . 18390 1
813 . 1 1 76 76 GLN H H 1 8.017 0.009 . 1 . . . A 76 GLN H . 18390 1
814 . 1 1 76 76 GLN HA H 1 4.025 0.005 . 1 . . . A 76 GLN HA . 18390 1
815 . 1 1 76 76 GLN HB2 H 1 2.093 0.003 . 2 . . . A 76 GLN HB2 . 18390 1
816 . 1 1 76 76 GLN HB3 H 1 2.093 0.003 . 2 . . . A 76 GLN HB3 . 18390 1
817 . 1 1 76 76 GLN HG2 H 1 2.394 0.034 . 2 . . . A 76 GLN HG2 . 18390 1
818 . 1 1 76 76 GLN HG3 H 1 2.499 0.009 . 2 . . . A 76 GLN HG3 . 18390 1
819 . 1 1 76 76 GLN C C 13 179.529 0.100 . 1 . . . A 76 GLN C . 18390 1
820 . 1 1 76 76 GLN CA C 13 58.707 0.117 . 1 . . . A 76 GLN CA . 18390 1
821 . 1 1 76 76 GLN CB C 13 28.812 0.035 . 1 . . . A 76 GLN CB . 18390 1
822 . 1 1 76 76 GLN CG C 13 34.049 0.120 . 1 . . . A 76 GLN CG . 18390 1
823 . 1 1 76 76 GLN N N 15 118.873 0.020 . 1 . . . A 76 GLN N . 18390 1
824 . 1 1 77 77 GLU H H 1 8.316 0.003 . 1 . . . A 77 GLU H . 18390 1
825 . 1 1 77 77 GLU HB2 H 1 2.058 0.034 . 2 . . . A 77 GLU HB2 . 18390 1
826 . 1 1 77 77 GLU HB3 H 1 2.058 0.034 . 2 . . . A 77 GLU HB3 . 18390 1
827 . 1 1 77 77 GLU C C 13 180.403 0.100 . 1 . . . A 77 GLU C . 18390 1
828 . 1 1 77 77 GLU CA C 13 59.043 0.035 . 1 . . . A 77 GLU CA . 18390 1
829 . 1 1 77 77 GLU CB C 13 29.802 0.035 . 1 . . . A 77 GLU CB . 18390 1
830 . 1 1 77 77 GLU CG C 13 36.151 0.035 . 1 . . . A 77 GLU CG . 18390 1
831 . 1 1 77 77 GLU N N 15 120.708 0.013 . 1 . . . A 77 GLU N . 18390 1
832 . 1 1 78 78 LEU H H 1 8.208 0.009 . 1 . . . A 78 LEU H . 18390 1
833 . 1 1 78 78 LEU HA H 1 4.106 0.002 . 1 . . . A 78 LEU HA . 18390 1
834 . 1 1 78 78 LEU HB2 H 1 1.529 0.008 . 2 . . . A 78 LEU HB2 . 18390 1
835 . 1 1 78 78 LEU HB3 H 1 1.780 0.005 . 2 . . . A 78 LEU HB3 . 18390 1
836 . 1 1 78 78 LEU HG H 1 1.786 0.010 . 1 . . . A 78 LEU HG . 18390 1
837 . 1 1 78 78 LEU HD11 H 1 0.970 0.008 . 1 . . . A 78 LEU HD11 . 18390 1
838 . 1 1 78 78 LEU HD12 H 1 0.970 0.008 . 1 . . . A 78 LEU HD12 . 18390 1
839 . 1 1 78 78 LEU HD13 H 1 0.970 0.008 . 1 . . . A 78 LEU HD13 . 18390 1
840 . 1 1 78 78 LEU HD21 H 1 0.954 0.006 . 1 . . . A 78 LEU HD21 . 18390 1
841 . 1 1 78 78 LEU HD22 H 1 0.954 0.006 . 1 . . . A 78 LEU HD22 . 18390 1
842 . 1 1 78 78 LEU HD23 H 1 0.954 0.006 . 1 . . . A 78 LEU HD23 . 18390 1
843 . 1 1 78 78 LEU C C 13 180.119 0.100 . 1 . . . A 78 LEU C . 18390 1
844 . 1 1 78 78 LEU CA C 13 57.698 0.140 . 1 . . . A 78 LEU CA . 18390 1
845 . 1 1 78 78 LEU CB C 13 42.333 0.051 . 1 . . . A 78 LEU CB . 18390 1
846 . 1 1 78 78 LEU CG C 13 27.411 0.018 . 1 . . . A 78 LEU CG . 18390 1
847 . 1 1 78 78 LEU CD1 C 13 25.443 0.073 . 2 . . . A 78 LEU CD1 . 18390 1
848 . 1 1 78 78 LEU CD2 C 13 23.328 0.043 . 2 . . . A 78 LEU CD2 . 18390 1
849 . 1 1 78 78 LEU N N 15 120.223 0.015 . 1 . . . A 78 LEU N . 18390 1
850 . 1 1 79 79 ALA H H 1 7.799 0.004 . 1 . . . A 79 ALA H . 18390 1
851 . 1 1 79 79 ALA HA H 1 4.060 0.001 . 1 . . . A 79 ALA HA . 18390 1
852 . 1 1 79 79 ALA HB1 H 1 1.447 0.005 . 1 . . . A 79 ALA HB1 . 18390 1
853 . 1 1 79 79 ALA HB2 H 1 1.447 0.005 . 1 . . . A 79 ALA HB2 . 18390 1
854 . 1 1 79 79 ALA HB3 H 1 1.447 0.005 . 1 . . . A 79 ALA HB3 . 18390 1
855 . 1 1 79 79 ALA C C 13 180.866 0.100 . 1 . . . A 79 ALA C . 18390 1
856 . 1 1 79 79 ALA CA C 13 54.592 0.127 . 1 . . . A 79 ALA CA . 18390 1
857 . 1 1 79 79 ALA CB C 13 18.249 0.047 . 1 . . . A 79 ALA CB . 18390 1
858 . 1 1 79 79 ALA N N 15 120.746 0.020 . 1 . . . A 79 ALA N . 18390 1
859 . 1 1 80 80 ARG H H 1 7.735 0.003 . 1 . . . A 80 ARG H . 18390 1
860 . 1 1 80 80 ARG HA H 1 4.191 0.004 . 1 . . . A 80 ARG HA . 18390 1
861 . 1 1 80 80 ARG HB2 H 1 1.939 0.006 . 2 . . . A 80 ARG HB2 . 18390 1
862 . 1 1 80 80 ARG HB3 H 1 1.939 0.006 . 2 . . . A 80 ARG HB3 . 18390 1
863 . 1 1 80 80 ARG HG2 H 1 1.682 0.034 . 2 . . . A 80 ARG HG2 . 18390 1
864 . 1 1 80 80 ARG HG3 H 1 1.682 0.034 . 2 . . . A 80 ARG HG3 . 18390 1
865 . 1 1 80 80 ARG HD2 H 1 3.208 0.005 . 2 . . . A 80 ARG HD2 . 18390 1
866 . 1 1 80 80 ARG HD3 H 1 3.208 0.005 . 2 . . . A 80 ARG HD3 . 18390 1
867 . 1 1 80 80 ARG C C 13 179.491 0.100 . 1 . . . A 80 ARG C . 18390 1
868 . 1 1 80 80 ARG CA C 13 58.248 0.092 . 1 . . . A 80 ARG CA . 18390 1
869 . 1 1 80 80 ARG CB C 13 30.509 0.179 . 1 . . . A 80 ARG CB . 18390 1
870 . 1 1 80 80 ARG CG C 13 27.398 0.064 . 1 . . . A 80 ARG CG . 18390 1
871 . 1 1 80 80 ARG CD C 13 43.610 0.035 . 1 . . . A 80 ARG CD . 18390 1
872 . 1 1 80 80 ARG N N 15 117.793 0.030 . 1 . . . A 80 ARG N . 18390 1
873 . 1 1 81 81 GLN H H 1 8.019 0.003 . 1 . . . A 81 GLN H . 18390 1
874 . 1 1 81 81 GLN HA H 1 4.218 0.034 . 1 . . . A 81 GLN HA . 18390 1
875 . 1 1 81 81 GLN HB2 H 1 2.223 0.003 . 2 . . . A 81 GLN HB2 . 18390 1
876 . 1 1 81 81 GLN HB3 H 1 2.223 0.003 . 2 . . . A 81 GLN HB3 . 18390 1
877 . 1 1 81 81 GLN HG2 H 1 2.497 0.001 . 2 . . . A 81 GLN HG2 . 18390 1
878 . 1 1 81 81 GLN HG3 H 1 2.497 0.001 . 2 . . . A 81 GLN HG3 . 18390 1
879 . 1 1 81 81 GLN C C 13 178.306 0.100 . 1 . . . A 81 GLN C . 18390 1
880 . 1 1 81 81 GLN CA C 13 57.577 0.035 . 1 . . . A 81 GLN CA . 18390 1
881 . 1 1 81 81 GLN CB C 13 29.209 0.035 . 1 . . . A 81 GLN CB . 18390 1
882 . 1 1 81 81 GLN CG C 13 34.113 0.093 . 1 . . . A 81 GLN CG . 18390 1
883 . 1 1 81 81 GLN N N 15 118.900 0.020 . 1 . . . A 81 GLN N . 18390 1
884 . 1 1 82 82 CYS H H 1 8.059 0.005 . 1 . . . A 82 CYS H . 18390 1
885 . 1 1 82 82 CYS HA H 1 4.548 0.004 . 1 . . . A 82 CYS HA . 18390 1
886 . 1 1 82 82 CYS HB2 H 1 2.930 0.002 . 2 . . . A 82 CYS HB2 . 18390 1
887 . 1 1 82 82 CYS HB3 H 1 3.038 0.001 . 2 . . . A 82 CYS HB3 . 18390 1
888 . 1 1 82 82 CYS C C 13 176.106 0.100 . 1 . . . A 82 CYS C . 18390 1
889 . 1 1 82 82 CYS CA C 13 59.732 0.011 . 1 . . . A 82 CYS CA . 18390 1
890 . 1 1 82 82 CYS CB C 13 28.405 0.015 . 1 . . . A 82 CYS CB . 18390 1
891 . 1 1 82 82 CYS N N 15 116.462 0.035 . 1 . . . A 82 CYS N . 18390 1
892 . 1 1 83 83 GLY H H 1 8.000 0.004 . 1 . . . A 83 GLY H . 18390 1
893 . 1 1 83 83 GLY N N 15 109.160 0.001 . 1 . . . A 83 GLY N . 18390 1
stop_
save_