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 6851
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $400mM_Nacl_10mM_phosphate_pH-5
_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 $13C-15N_label isotropic 6851 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 $xwinnmr . . 6851 1
2 $sparky . . 6851 1
3 $nmrpipe . . 6851 1
4 $cyana . . 6851 1
5 $CNS . . 6851 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 4.199 0.000 . . . . . . 1 M HA . 6851 1
2 . 1 1 1 1 MET HB2 H 1 2.223 0.000 . . . . . . 1 M HB1 . 6851 1
3 . 1 1 1 1 MET HB3 H 1 2.223 0.000 . . . . . . 1 M HB2 . 6851 1
4 . 1 1 1 1 MET HG2 H 1 2.654 0.000 . . . . . . 1 M HG1 . 6851 1
5 . 1 1 1 1 MET HG3 H 1 2.654 0.000 . . . . . . 1 M HG2 . 6851 1
6 . 1 1 1 1 MET CA C 13 56.295 0.000 . . . . . . 1 M CA . 6851 1
7 . 1 1 1 1 MET CB C 13 33.803 0.000 . . . . . . 1 M CB . 6851 1
8 . 1 1 1 1 MET CG C 13 32.024 0.000 . . . . . . 1 M CG . 6851 1
9 . 1 1 2 2 ASP H H 1 8.922 0.004 . . . . . . 2 D HN . 6851 1
10 . 1 1 2 2 ASP HA H 1 4.756 0.003 . . . . . . 2 D HA . 6851 1
11 . 1 1 2 2 ASP HB2 H 1 2.687 0.004 . . . . . . 2 D HB1 . 6851 1
12 . 1 1 2 2 ASP HB3 H 1 2.822 0.004 . . . . . . 2 D HB2 . 6851 1
13 . 1 1 2 2 ASP CA C 13 55.708 0.004 . . . . . . 2 D CA . 6851 1
14 . 1 1 2 2 ASP CB C 13 42.275 0.000 . . . . . . 2 D CB . 6851 1
15 . 1 1 2 2 ASP N N 15 124.576 0.100 . . . . . . 2 D N . 6851 1
16 . 1 1 3 3 SER H H 1 8.502 0.004 . . . . . . 3 S HN . 6851 1
17 . 1 1 3 3 SER HA H 1 4.462 0.002 . . . . . . 3 S HA . 6851 1
18 . 1 1 3 3 SER HB2 H 1 3.939 0.005 . . . . . . 3 S QB . 6851 1
19 . 1 1 3 3 SER HB3 H 1 3.939 0.005 . . . . . . 3 S QB . 6851 1
20 . 1 1 3 3 SER CA C 13 59.619 0.000 . . . . . . 3 S CA . 6851 1
21 . 1 1 3 3 SER CB C 13 64.921 0.000 . . . . . . 3 S CB . 6851 1
22 . 1 1 3 3 SER N N 15 116.515 0.038 . . . . . . 3 S N . 6851 1
23 . 1 1 4 4 GLU H H 1 8.547 0.006 . . . . . . 4 E HN . 6851 1
24 . 1 1 4 4 GLU HA H 1 4.408 0.007 . . . . . . 4 E HA . 6851 1
25 . 1 1 4 4 GLU HB2 H 1 2.068 0.000 . . . . . . 4 E HB1 . 6851 1
26 . 1 1 4 4 GLU HB3 H 1 2.130 0.009 . . . . . . 4 E HB2 . 6851 1
27 . 1 1 4 4 GLU HG2 H 1 2.321 0.004 . . . . . . 4 E QG . 6851 1
28 . 1 1 4 4 GLU HG3 H 1 2.321 0.004 . . . . . . 4 E QG . 6851 1
29 . 1 1 4 4 GLU CA C 13 57.748 0.000 . . . . . . 4 E CA . 6851 1
30 . 1 1 4 4 GLU CB C 13 31.481 0.020 . . . . . . 4 E CB . 6851 1
31 . 1 1 4 4 GLU CG C 13 37.310 0.000 . . . . . . 4 E CG . 6851 1
32 . 1 1 4 4 GLU N N 15 122.479 0.041 . . . . . . 4 E N . 6851 1
33 . 1 1 5 5 THR H H 1 8.226 0.001 . . . . . . 5 T HN . 6851 1
34 . 1 1 5 5 THR HA H 1 4.349 0.006 . . . . . . 5 T HA . 6851 1
35 . 1 1 5 5 THR HB H 1 4.179 0.004 . . . . . . 5 T HB . 6851 1
36 . 1 1 5 5 THR CA C 13 62.939 0.059 . . . . . . 5 T CA . 6851 1
37 . 1 1 5 5 THR CB C 13 70.938 0.042 . . . . . . 5 T CB . 6851 1
38 . 1 1 5 5 THR CG2 C 13 22.906 0.044 . . . . . . 5 T CG2 . 6851 1
39 . 1 1 5 5 THR N N 15 115.867 0.018 . . . . . . 5 T N . 6851 1
40 . 1 1 6 6 LEU H H 1 8.381 0.009 . . . . . . 6 L HN . 6851 1
41 . 1 1 6 6 LEU HA H 1 4.661 0.002 . . . . . . 6 L HA . 6851 1
42 . 1 1 6 6 LEU HB2 H 1 1.585 0.006 . . . . . . 6 L HB1 . 6851 1
43 . 1 1 6 6 LEU HB3 H 1 1.638 0.004 . . . . . . 6 L HB2 . 6851 1
44 . 1 1 6 6 LEU HG H 1 1.708 0.002 . . . . . . 6 L HG . 6851 1
45 . 1 1 6 6 LEU HD11 H 1 0.940 0.001 . . . . . . 6 L HD1 . 6851 1
46 . 1 1 6 6 LEU HD12 H 1 0.940 0.001 . . . . . . 6 L HD1 . 6851 1
47 . 1 1 6 6 LEU HD13 H 1 0.940 0.001 . . . . . . 6 L HD1 . 6851 1
48 . 1 1 6 6 LEU HD21 H 1 0.971 0.000 . . . . . . 6 L HD2 . 6851 1
49 . 1 1 6 6 LEU HD22 H 1 0.971 0.000 . . . . . . 6 L HD2 . 6851 1
50 . 1 1 6 6 LEU HD23 H 1 0.971 0.000 . . . . . . 6 L HD2 . 6851 1
51 . 1 1 6 6 LEU CA C 13 54.317 0.039 . . . . . . 6 L CA . 6851 1
52 . 1 1 6 6 LEU CB C 13 42.902 0.039 . . . . . . 6 L CB . 6851 1
53 . 1 1 6 6 LEU CG C 13 28.184 0.019 . . . . . . 6 L CG . 6851 1
54 . 1 1 6 6 LEU CD1 C 13 24.536 0.024 . . . . . . 6 L CD1 . 6851 1
55 . 1 1 6 6 LEU CD2 C 13 26.272 0.076 . . . . . . 6 L CD2 . 6851 1
56 . 1 1 6 6 LEU N N 15 126.786 0.105 . . . . . . 6 L N . 6851 1
57 . 1 1 7 7 PRO HA H 1 4.445 0.003 . . . . . . 7 P HA . 6851 1
58 . 1 1 7 7 PRO HB2 H 1 1.942 0.004 . . . . . . 7 P HB1 . 6851 1
59 . 1 1 7 7 PRO HB3 H 1 2.348 0.002 . . . . . . 7 P HB2 . 6851 1
60 . 1 1 7 7 PRO HG2 H 1 2.062 0.001 . . . . . . 7 P QG . 6851 1
61 . 1 1 7 7 PRO HG3 H 1 2.062 0.001 . . . . . . 7 P QG . 6851 1
62 . 1 1 7 7 PRO HD2 H 1 3.670 0.006 . . . . . . 7 P HD1 . 6851 1
63 . 1 1 7 7 PRO HD3 H 1 3.888 0.002 . . . . . . 7 P HD2 . 6851 1
64 . 1 1 7 7 PRO CA C 13 64.315 0.009 . . . . . . 7 P CA . 6851 1
65 . 1 1 7 7 PRO CB C 13 33.341 0.075 . . . . . . 7 P CB . 6851 1
66 . 1 1 7 7 PRO CG C 13 28.610 0.000 . . . . . . 7 P CG . 6851 1
67 . 1 1 7 7 PRO CD C 13 51.675 0.013 . . . . . . 7 P CD . 6851 1
68 . 1 1 8 8 GLU H H 1 8.631 0.006 . . . . . . 8 E HN . 6851 1
69 . 1 1 8 8 GLU HA H 1 4.253 0.002 . . . . . . 8 E HA . 6851 1
70 . 1 1 8 8 GLU HB2 H 1 2.031 0.002 . . . . . . 8 E HB1 . 6851 1
71 . 1 1 8 8 GLU HB3 H 1 2.103 0.000 . . . . . . 8 E HB2 . 6851 1
72 . 1 1 8 8 GLU HG2 H 1 2.350 0.000 . . . . . . 8 E QG . 6851 1
73 . 1 1 8 8 GLU HG3 H 1 2.350 0.000 . . . . . . 8 E QG . 6851 1
74 . 1 1 8 8 GLU CA C 13 58.265 0.049 . . . . . . 8 E CA . 6851 1
75 . 1 1 8 8 GLU CB C 13 31.130 0.001 . . . . . . 8 E CB . 6851 1
76 . 1 1 8 8 GLU CG C 13 37.304 0.000 . . . . . . 8 E CG . 6851 1
77 . 1 1 8 8 GLU N N 15 121.069 0.031 . . . . . . 8 E N . 6851 1
78 . 1 1 9 9 SER H H 1 8.328 0.002 . . . . . . 9 S HN . 6851 1
79 . 1 1 9 9 SER HA H 1 4.423 0.002 . . . . . . 9 S HA . 6851 1
80 . 1 1 9 9 SER HB2 H 1 3.943 0.009 . . . . . . 9 S QB . 6851 1
81 . 1 1 9 9 SER HB3 H 1 3.943 0.009 . . . . . . 9 S QB . 6851 1
82 . 1 1 9 9 SER CA C 13 59.844 0.000 . . . . . . 9 S CA . 6851 1
83 . 1 1 9 9 SER CB C 13 64.887 0.000 . . . . . . 9 S CB . 6851 1
84 . 1 1 9 9 SER N N 15 115.909 0.020 . . . . . . 9 S N . 6851 1
85 . 1 1 10 10 GLU H H 1 8.363 0.006 . . . . . . 10 E HN . 6851 1
86 . 1 1 10 10 GLU HA H 1 4.356 0.000 . . . . . . 10 E HA . 6851 1
87 . 1 1 10 10 GLU HB2 H 1 2.103 0.003 . . . . . . 10 E HB1 . 6851 1
88 . 1 1 10 10 GLU HB3 H 1 1.936 0.000 . . . . . . 10 E HB2 . 6851 1
89 . 1 1 10 10 GLU HG2 H 1 2.305 0.008 . . . . . . 10 E QG . 6851 1
90 . 1 1 10 10 GLU HG3 H 1 2.305 0.008 . . . . . . 10 E QG . 6851 1
91 . 1 1 10 10 GLU CA C 13 57.360 0.000 . . . . . . 10 E CA . 6851 1
92 . 1 1 10 10 GLU CB C 13 31.200 0.000 . . . . . . 10 E CB . 6851 1
93 . 1 1 10 10 GLU CG C 13 37.235 0.022 . . . . . . 10 E CG . 6851 1
94 . 1 1 10 10 GLU N N 15 122.552 0.098 . . . . . . 10 E N . 6851 1
95 . 1 1 11 11 LYS H H 1 8.163 0.006 . . . . . . 11 K HN . 6851 1
96 . 1 1 11 11 LYS HA H 1 4.326 0.018 . . . . . . 11 K HA . 6851 1
97 . 1 1 11 11 LYS HB2 H 1 1.758 0.009 . . . . . . 11 K HB1 . 6851 1
98 . 1 1 11 11 LYS HB3 H 1 1.762 0.001 . . . . . . 11 K HB2 . 6851 1
99 . 1 1 11 11 LYS HG2 H 1 1.378 0.000 . . . . . . 11 K HG1 . 6851 1
100 . 1 1 11 11 LYS HD2 H 1 1.696 0.000 . . . . . . 11 K QD . 6851 1
101 . 1 1 11 11 LYS HD3 H 1 1.696 0.000 . . . . . . 11 K QD . 6851 1
102 . 1 1 11 11 LYS CA C 13 57.590 0.000 . . . . . . 11 K CA . 6851 1
103 . 1 1 11 11 LYS CB C 13 34.353 0.034 . . . . . . 11 K CB . 6851 1
104 . 1 1 11 11 LYS CG C 13 25.895 0.039 . . . . . . 11 K CG . 6851 1
105 . 1 1 11 11 LYS CD C 13 30.130 0.000 . . . . . . 11 K CD . 6851 1
106 . 1 1 11 11 LYS N N 15 121.884 0.061 . . . . . . 11 K N . 6851 1
107 . 1 1 12 12 TYR H H 1 8.270 0.005 . . . . . . 12 Y HN . 6851 1
108 . 1 1 12 12 TYR HA H 1 4.650 0.005 . . . . . . 12 Y HA . 6851 1
109 . 1 1 12 12 TYR HB2 H 1 2.998 0.000 . . . . . . 12 Y HB1 . 6851 1
110 . 1 1 12 12 TYR HB3 H 1 3.001 0.000 . . . . . . 12 Y HB2 . 6851 1
111 . 1 1 12 12 TYR HD1 H 1 7.141 0.011 . . . . . . 12 Y QD . 6851 1
112 . 1 1 12 12 TYR HD2 H 1 7.141 0.011 . . . . . . 12 Y QD . 6851 1
113 . 1 1 12 12 TYR HE1 H 1 6.665 0.000 . . . . . . 12 Y HE . 6851 1
114 . 1 1 12 12 TYR HE2 H 1 6.665 0.000 . . . . . . 12 Y HE . 6851 1
115 . 1 1 12 12 TYR CA C 13 58.810 0.010 . . . . . . 12 Y CA . 6851 1
116 . 1 1 12 12 TYR CB C 13 40.186 0.042 . . . . . . 12 Y CB . 6851 1
117 . 1 1 12 12 TYR CD1 C 13 134.491 0.008 . . . . . . 12 Y CD . 6851 1
118 . 1 1 12 12 TYR CD2 C 13 134.491 0.008 . . . . . . 12 Y CD . 6851 1
119 . 1 1 12 12 TYR CE1 C 13 119.463 0.000 . . . . . . 12 Y CE . 6851 1
120 . 1 1 12 12 TYR CE2 C 13 119.463 0.000 . . . . . . 12 Y CE . 6851 1
121 . 1 1 12 12 TYR N N 15 122.134 0.009 . . . . . . 12 Y N . 6851 1
122 . 1 1 13 13 ASN H H 1 8.447 0.004 . . . . . . 13 N HN . 6851 1
123 . 1 1 13 13 ASN HA H 1 5.023 0.001 . . . . . . 13 N HA . 6851 1
124 . 1 1 13 13 ASN HB2 H 1 2.647 0.004 . . . . . . 13 N HB1 . 6851 1
125 . 1 1 13 13 ASN HB3 H 1 2.800 0.005 . . . . . . 13 N HB2 . 6851 1
126 . 1 1 13 13 ASN HD21 H 1 7.704 0.004 . . . . . . 13 N HD21 . 6851 1
127 . 1 1 13 13 ASN HD22 H 1 6.988 0.004 . . . . . . 13 N HD22 . 6851 1
128 . 1 1 13 13 ASN CA C 13 51.883 0.026 . . . . . . 13 N CA . 6851 1
129 . 1 1 13 13 ASN CB C 13 40.450 0.042 . . . . . . 13 N CB . 6851 1
130 . 1 1 13 13 ASN N N 15 123.870 0.064 . . . . . . 13 N N . 6851 1
131 . 1 1 13 13 ASN ND2 N 15 113.419 0.019 . . . . . . 13 N ND2 . 6851 1
132 . 1 1 14 14 PRO HA H 1 4.513 0.002 . . . . . . 14 P HA . 6851 1
133 . 1 1 14 14 PRO HB2 H 1 2.096 0.007 . . . . . . 14 P HB1 . 6851 1
134 . 1 1 14 14 PRO HB3 H 1 2.357 0.001 . . . . . . 14 P HB2 . 6851 1
135 . 1 1 14 14 PRO HG2 H 1 2.049 0.005 . . . . . . 14 P QG . 6851 1
136 . 1 1 14 14 PRO HG3 H 1 2.049 0.005 . . . . . . 14 P QG . 6851 1
137 . 1 1 14 14 PRO HD2 H 1 3.478 0.006 . . . . . . 14 P HD1 . 6851 1
138 . 1 1 14 14 PRO HD3 H 1 3.732 0.006 . . . . . . 14 P HD2 . 6851 1
139 . 1 1 14 14 PRO CA C 13 64.404 0.019 . . . . . . 14 P CA . 6851 1
140 . 1 1 14 14 PRO CB C 13 33.582 0.057 . . . . . . 14 P CB . 6851 1
141 . 1 1 14 14 PRO CG C 13 28.424 0.001 . . . . . . 14 P CG . 6851 1
142 . 1 1 14 14 PRO CD C 13 51.693 0.033 . . . . . . 14 P CD . 6851 1
143 . 1 1 15 15 GLY H H 1 8.931 0.006 . . . . . . 15 G HN . 6851 1
144 . 1 1 15 15 GLY HA2 H 1 4.203 0.004 . . . . . . 15 G HA1 . 6851 1
145 . 1 1 15 15 GLY HA3 H 1 4.670 0.007 . . . . . . 15 G HA2 . 6851 1
146 . 1 1 15 15 GLY CA C 13 46.018 0.040 . . . . . . 15 G CA . 6851 1
147 . 1 1 15 15 GLY N N 15 108.862 0.055 . . . . . . 15 G N . 6851 1
148 . 1 1 16 16 PRO HA H 1 4.178 0.009 . . . . . . 16 P HA . 6851 1
149 . 1 1 16 16 PRO HB2 H 1 1.921 0.000 . . . . . . 16 P QB . 6851 1
150 . 1 1 16 16 PRO HB3 H 1 1.921 0.000 . . . . . . 16 P QB . 6851 1
151 . 1 1 16 16 PRO HG2 H 1 1.616 0.001 . . . . . . 16 P HG1 . 6851 1
152 . 1 1 16 16 PRO HG3 H 1 1.855 0.008 . . . . . . 16 P HG2 . 6851 1
153 . 1 1 16 16 PRO HD2 H 1 3.619 0.004 . . . . . . 16 P HD1 . 6851 1
154 . 1 1 16 16 PRO HD3 H 1 3.938 0.008 . . . . . . 16 P HD2 . 6851 1
155 . 1 1 16 16 PRO CA C 13 66.829 0.000 . . . . . . 16 P CA . 6851 1
156 . 1 1 16 16 PRO CG C 13 28.878 0.044 . . . . . . 16 P CG . 6851 1
157 . 1 1 16 16 PRO CD C 13 50.868 0.036 . . . . . . 16 P CD . 6851 1
158 . 1 1 17 17 GLN H H 1 9.147 0.018 . . . . . . 17 Q HN . 6851 1
159 . 1 1 17 17 GLN HA H 1 3.971 0.005 . . . . . . 17 Q HA . 6851 1
160 . 1 1 17 17 GLN HB2 H 1 2.276 0.009 . . . . . . 17 Q QB . 6851 1
161 . 1 1 17 17 GLN HB3 H 1 2.276 0.009 . . . . . . 17 Q QB . 6851 1
162 . 1 1 17 17 GLN HG2 H 1 2.418 0.011 . . . . . . 17 Q QG . 6851 1
163 . 1 1 17 17 GLN HG3 H 1 2.418 0.011 . . . . . . 17 Q QG . 6851 1
164 . 1 1 17 17 GLN HE21 H 1 7.030 0.005 . . . . . . 17 Q HE21 . 6851 1
165 . 1 1 17 17 GLN HE22 H 1 7.259 0.004 . . . . . . 17 Q HE22 . 6851 1
166 . 1 1 17 17 GLN CA C 13 60.768 0.036 . . . . . . 17 Q CA . 6851 1
167 . 1 1 17 17 GLN CB C 13 29.224 0.040 . . . . . . 17 Q CB . 6851 1
168 . 1 1 17 17 GLN CG C 13 35.388 0.017 . . . . . . 17 Q CG . 6851 1
169 . 1 1 17 17 GLN N N 15 118.073 0.004 . . . . . . 17 Q N . 6851 1
170 . 1 1 17 17 GLN NE2 N 15 111.005 0.026 . . . . . . 17 Q NE2 . 6851 1
171 . 1 1 18 18 ASP H H 1 7.890 0.005 . . . . . . 18 D HN . 6851 1
172 . 1 1 18 18 ASP HA H 1 4.445 0.007 . . . . . . 18 D HA . 6851 1
173 . 1 1 18 18 ASP HB2 H 1 2.788 0.006 . . . . . . 18 D HB1 . 6851 1
174 . 1 1 18 18 ASP HB3 H 1 2.995 0.010 . . . . . . 18 D HB2 . 6851 1
175 . 1 1 18 18 ASP CA C 13 58.428 0.000 . . . . . . 18 D CA . 6851 1
176 . 1 1 18 18 ASP CB C 13 42.373 0.126 . . . . . . 18 D CB . 6851 1
177 . 1 1 18 18 ASP N N 15 118.465 0.028 . . . . . . 18 D N . 6851 1
178 . 1 1 19 19 PHE H H 1 7.718 0.035 . . . . . . 19 F HN . 6851 1
179 . 1 1 19 19 PHE HA H 1 4.238 0.004 . . . . . . 19 F HA . 6851 1
180 . 1 1 19 19 PHE HB2 H 1 3.327 0.002 . . . . . . 19 F HB1 . 6851 1
181 . 1 1 19 19 PHE HB3 H 1 3.528 0.024 . . . . . . 19 F HB2 . 6851 1
182 . 1 1 19 19 PHE HD1 H 1 7.288 0.003 . . . . . . 19 F QD . 6851 1
183 . 1 1 19 19 PHE HD2 H 1 7.288 0.003 . . . . . . 19 F QD . 6851 1
184 . 1 1 19 19 PHE HE1 H 1 6.716 0.001 . . . . . . 19 F QE . 6851 1
185 . 1 1 19 19 PHE HE2 H 1 6.716 0.001 . . . . . . 19 F QE . 6851 1
186 . 1 1 19 19 PHE HZ H 1 6.353 0.003 . . . . . . 19 F HZ . 6851 1
187 . 1 1 19 19 PHE CA C 13 62.068 0.024 . . . . . . 19 F CA . 6851 1
188 . 1 1 19 19 PHE CB C 13 40.637 0.042 . . . . . . 19 F CB . 6851 1
189 . 1 1 19 19 PHE CD1 C 13 132.796 0.000 . . . . . . 19 F CD1 . 6851 1
190 . 1 1 19 19 PHE N N 15 118.534 0.020 . . . . . . 19 F N . 6851 1
191 . 1 1 20 20 LEU H H 1 8.168 0.005 . . . . . . 20 L HN . 6851 1
192 . 1 1 20 20 LEU HA H 1 4.031 0.003 . . . . . . 20 L HA . 6851 1
193 . 1 1 20 20 LEU HB2 H 1 1.507 0.007 . . . . . . 20 L QB . 6851 1
194 . 1 1 20 20 LEU HB3 H 1 1.507 0.007 . . . . . . 20 L QB . 6851 1
195 . 1 1 20 20 LEU HG H 1 1.478 0.004 . . . . . . 20 L HG . 6851 1
196 . 1 1 20 20 LEU CA C 13 59.239 0.026 . . . . . . 20 L CA . 6851 1
197 . 1 1 20 20 LEU CB C 13 43.576 0.006 . . . . . . 20 L CB . 6851 1
198 . 1 1 20 20 LEU CG C 13 27.855 0.026 . . . . . . 20 L CG . 6851 1
199 . 1 1 20 20 LEU CD1 C 13 25.533 0.009 . . . . . . 20 L CD1 . 6851 1
200 . 1 1 20 20 LEU CD2 C 13 25.494 0.004 . . . . . . 20 L CD2 . 6851 1
201 . 1 1 20 20 LEU N N 15 119.883 0.018 . . . . . . 20 L N . 6851 1
202 . 1 1 21 21 LEU H H 1 7.461 0.004 . . . . . . 21 L HN . 6851 1
203 . 1 1 21 21 LEU HA H 1 3.852 0.003 . . . . . . 21 L HA . 6851 1
204 . 1 1 21 21 LEU HB2 H 1 1.609 0.002 . . . . . . 21 L HB1 . 6851 1
205 . 1 1 21 21 LEU HB3 H 1 1.778 0.002 . . . . . . 21 L HB2 . 6851 1
206 . 1 1 21 21 LEU HG H 1 1.817 0.003 . . . . . . 21 L HG . 6851 1
207 . 1 1 21 21 LEU CA C 13 57.549 0.014 . . . . . . 21 L CA . 6851 1
208 . 1 1 21 21 LEU CB C 13 43.066 0.007 . . . . . . 21 L CB . 6851 1
209 . 1 1 21 21 LEU CG C 13 28.836 0.003 . . . . . . 21 L CG . 6851 1
210 . 1 1 21 21 LEU CD1 C 13 23.992 0.090 . . . . . . 21 L CD1 . 6851 1
211 . 1 1 21 21 LEU CD2 C 13 25.976 0.048 . . . . . . 21 L CD2 . 6851 1
212 . 1 1 21 21 LEU N N 15 113.225 0.004 . . . . . . 21 L N . 6851 1
213 . 1 1 22 22 LYS H H 1 7.295 0.005 . . . . . . 22 K HN . 6851 1
214 . 1 1 22 22 LYS HA H 1 4.332 0.002 . . . . . . 22 K HA . 6851 1
215 . 1 1 22 22 LYS HB2 H 1 1.875 0.003 . . . . . . 22 K HB1 . 6851 1
216 . 1 1 22 22 LYS HB3 H 1 2.062 0.010 . . . . . . 22 K HB2 . 6851 1
217 . 1 1 22 22 LYS HG2 H 1 1.443 0.008 . . . . . . 22 K HG1 . 6851 1
218 . 1 1 22 22 LYS HG3 H 1 1.575 0.001 . . . . . . 22 K HG2 . 6851 1
219 . 1 1 22 22 LYS HD2 H 1 1.482 0.003 . . . . . . 22 K HD1 . 6851 1
220 . 1 1 22 22 LYS HD3 H 1 1.594 0.004 . . . . . . 22 K HD2 . 6851 1
221 . 1 1 22 22 LYS HE2 H 1 2.865 0.004 . . . . . . 22 K HE1 . 6851 1
222 . 1 1 22 22 LYS CA C 13 56.810 0.123 . . . . . . 22 K CA . 6851 1
223 . 1 1 22 22 LYS CB C 13 34.154 0.081 . . . . . . 22 K CB . 6851 1
224 . 1 1 22 22 LYS CG C 13 26.289 0.084 . . . . . . 22 K CG . 6851 1
225 . 1 1 22 22 LYS CD C 13 29.861 0.094 . . . . . . 22 K CD . 6851 1
226 . 1 1 22 22 LYS CE C 13 43.367 0.049 . . . . . . 22 K CE . 6851 1
227 . 1 1 22 22 LYS N N 15 115.791 0.012 . . . . . . 22 K N . 6851 1
228 . 1 1 23 23 MET H H 1 7.697 0.003 . . . . . . 23 M HN . 6851 1
229 . 1 1 23 23 MET HA H 1 3.648 0.005 . . . . . . 23 M HA . 6851 1
230 . 1 1 23 23 MET HB2 H 1 1.351 0.008 . . . . . . 23 M HB1 . 6851 1
231 . 1 1 23 23 MET HB3 H 1 2.011 0.008 . . . . . . 23 M HB2 . 6851 1
232 . 1 1 23 23 MET HG2 H 1 1.754 0.005 . . . . . . 23 M HG1 . 6851 1
233 . 1 1 23 23 MET HG3 H 1 3.116 0.010 . . . . . . 23 M HG2 . 6851 1
234 . 1 1 23 23 MET CA C 13 56.127 0.030 . . . . . . 23 M CA . 6851 1
235 . 1 1 23 23 MET CB C 13 32.701 0.049 . . . . . . 23 M CB . 6851 1
236 . 1 1 23 23 MET CG C 13 35.232 0.030 . . . . . . 23 M CG . 6851 1
237 . 1 1 23 23 MET CE C 13 18.901 0.085 . . . . . . 23 M CE . 6851 1
238 . 1 1 23 23 MET N N 15 120.986 0.012 . . . . . . 23 M N . 6851 1
239 . 1 1 24 24 PRO HA H 1 4.096 0.003 . . . . . . 24 P HA . 6851 1
240 . 1 1 24 24 PRO HB2 H 1 1.603 0.006 . . . . . . 24 P HB1 . 6851 1
241 . 1 1 24 24 PRO HB3 H 1 2.159 0.003 . . . . . . 24 P HB2 . 6851 1
242 . 1 1 24 24 PRO HG2 H 1 1.740 0.008 . . . . . . 24 P HG1 . 6851 1
243 . 1 1 24 24 PRO HG3 H 1 1.777 0.001 . . . . . . 24 P HG2 . 6851 1
244 . 1 1 24 24 PRO HD2 H 1 1.931 0.004 . . . . . . 24 P HD1 . 6851 1
245 . 1 1 24 24 PRO HD3 H 1 2.696 0.003 . . . . . . 24 P HD2 . 6851 1
246 . 1 1 24 24 PRO CA C 13 64.800 0.036 . . . . . . 24 P CA . 6851 1
247 . 1 1 24 24 PRO CB C 13 33.301 0.041 . . . . . . 24 P CB . 6851 1
248 . 1 1 24 24 PRO CG C 13 29.245 0.000 . . . . . . 24 P CG . 6851 1
249 . 1 1 24 24 PRO CD C 13 50.448 0.025 . . . . . . 24 P CD . 6851 1
250 . 1 1 25 25 GLY H H 1 7.990 0.002 . . . . . . 25 G HN . 6851 1
251 . 1 1 25 25 GLY HA2 H 1 3.393 0.002 . . . . . . 25 G HA1 . 6851 1
252 . 1 1 25 25 GLY HA3 H 1 4.494 0.007 . . . . . . 25 G HA2 . 6851 1
253 . 1 1 25 25 GLY CA C 13 46.122 0.012 . . . . . . 25 G CA . 6851 1
254 . 1 1 25 25 GLY N N 15 107.072 0.020 . . . . . . 25 G N . 6851 1
255 . 1 1 26 26 VAL H H 1 7.429 0.003 . . . . . . 26 V HN . 6851 1
256 . 1 1 26 26 VAL HA H 1 4.339 0.002 . . . . . . 26 V HA . 6851 1
257 . 1 1 26 26 VAL HB H 1 2.185 0.004 . . . . . . 26 V HB . 6851 1
258 . 1 1 26 26 VAL CA C 13 62.843 0.009 . . . . . . 26 V CA . 6851 1
259 . 1 1 26 26 VAL CB C 13 32.801 0.015 . . . . . . 26 V CB . 6851 1
260 . 1 1 26 26 VAL CG1 C 13 24.423 0.022 . . . . . . 26 V CG1 . 6851 1
261 . 1 1 26 26 VAL CG2 C 13 23.873 0.063 . . . . . . 26 V CG2 . 6851 1
262 . 1 1 26 26 VAL N N 15 119.843 0.015 . . . . . . 26 V N . 6851 1
263 . 1 1 27 27 ASN H H 1 9.215 0.006 . . . . . . 27 N HN . 6851 1
264 . 1 1 27 27 ASN HA H 1 4.890 0.004 . . . . . . 27 N HA . 6851 1
265 . 1 1 27 27 ASN HB2 H 1 2.842 0.006 . . . . . . 27 N HB1 . 6851 1
266 . 1 1 27 27 ASN HB3 H 1 3.157 0.005 . . . . . . 27 N HB2 . 6851 1
267 . 1 1 27 27 ASN HD21 H 1 6.623 0.003 . . . . . . 27 N HD21 . 6851 1
268 . 1 1 27 27 ASN HD22 H 1 7.731 0.004 . . . . . . 27 N HD22 . 6851 1
269 . 1 1 27 27 ASN CA C 13 52.665 0.068 . . . . . . 27 N CA . 6851 1
270 . 1 1 27 27 ASN CB C 13 41.896 0.085 . . . . . . 27 N CB . 6851 1
271 . 1 1 27 27 ASN N N 15 123.610 0.032 . . . . . . 27 N N . 6851 1
272 . 1 1 27 27 ASN ND2 N 15 115.431 0.039 . . . . . . 27 N ND2 . 6851 1
273 . 1 1 28 28 ALA H H 1 8.579 0.002 . . . . . . 28 A HN . 6851 1
274 . 1 1 28 28 ALA HA H 1 4.103 0.004 . . . . . . 28 A HA . 6851 1
275 . 1 1 28 28 ALA CA C 13 56.215 0.007 . . . . . . 28 A CA . 6851 1
276 . 1 1 28 28 ALA CB C 13 19.647 0.010 . . . . . . 28 A CB . 6851 1
277 . 1 1 28 28 ALA N N 15 119.172 0.013 . . . . . . 28 A N . 6851 1
278 . 1 1 29 29 LYS H H 1 8.247 0.005 . . . . . . 29 K HN . 6851 1
279 . 1 1 29 29 LYS HA H 1 4.318 0.003 . . . . . . 29 K HA . 6851 1
280 . 1 1 29 29 LYS HB2 H 1 1.924 0.004 . . . . . . 29 K QB . 6851 1
281 . 1 1 29 29 LYS HB3 H 1 1.924 0.004 . . . . . . 29 K QB . 6851 1
282 . 1 1 29 29 LYS HG2 H 1 1.428 0.002 . . . . . . 29 K HG1 . 6851 1
283 . 1 1 29 29 LYS HG3 H 1 1.539 0.001 . . . . . . 29 K HG2 . 6851 1
284 . 1 1 29 29 LYS HD2 H 1 1.734 0.005 . . . . . . 29 K QD . 6851 1
285 . 1 1 29 29 LYS HD3 H 1 1.734 0.005 . . . . . . 29 K QD . 6851 1
286 . 1 1 29 29 LYS HE2 H 1 3.145 0.000 . . . . . . 29 K HE1 . 6851 1
287 . 1 1 29 29 LYS CA C 13 59.166 0.000 . . . . . . 29 K CA . 6851 1
288 . 1 1 29 29 LYS CB C 13 33.903 0.050 . . . . . . 29 K CB . 6851 1
289 . 1 1 29 29 LYS CG C 13 26.342 0.014 . . . . . . 29 K CG . 6851 1
290 . 1 1 29 29 LYS CD C 13 30.292 0.010 . . . . . . 29 K CD . 6851 1
291 . 1 1 29 29 LYS N N 15 116.581 0.013 . . . . . . 29 K N . 6851 1
292 . 1 1 30 30 ASN H H 1 8.462 0.004 . . . . . . 30 N HN . 6851 1
293 . 1 1 30 30 ASN HA H 1 4.783 0.010 . . . . . . 30 N HA . 6851 1
294 . 1 1 30 30 ASN HB2 H 1 2.921 0.008 . . . . . . 30 N HB1 . 6851 1
295 . 1 1 30 30 ASN HB3 H 1 3.175 0.007 . . . . . . 30 N HB2 . 6851 1
296 . 1 1 30 30 ASN HD21 H 1 6.931 0.001 . . . . . . 30 N HD21 . 6851 1
297 . 1 1 30 30 ASN HD22 H 1 7.702 0.002 . . . . . . 30 N HD22 . 6851 1
298 . 1 1 30 30 ASN CA C 13 54.684 0.011 . . . . . . 30 N CA . 6851 1
299 . 1 1 30 30 ASN CB C 13 40.093 0.048 . . . . . . 30 N CB . 6851 1
300 . 1 1 30 30 ASN N N 15 117.947 0.010 . . . . . . 30 N N . 6851 1
301 . 1 1 30 30 ASN ND2 N 15 112.500 0.023 . . . . . . 30 N ND2 . 6851 1
302 . 1 1 31 31 CYS H H 1 8.372 0.003 . . . . . . 31 C HN . 6851 1
303 . 1 1 31 31 CYS HA H 1 3.961 0.002 . . . . . . 31 C HA . 6851 1
304 . 1 1 31 31 CYS HB2 H 1 2.774 0.001 . . . . . . 31 C HB1 . 6851 1
305 . 1 1 31 31 CYS HB3 H 1 3.020 0.002 . . . . . . 31 C HB2 . 6851 1
306 . 1 1 31 31 CYS CA C 13 63.030 0.020 . . . . . . 31 C CA . 6851 1
307 . 1 1 31 31 CYS CB C 13 27.700 0.008 . . . . . . 31 C CB . 6851 1
308 . 1 1 31 31 CYS N N 15 120.277 0.012 . . . . . . 31 C N . 6851 1
309 . 1 1 32 32 ARG H H 1 7.892 0.005 . . . . . . 32 R HN . 6851 1
310 . 1 1 32 32 ARG HA H 1 3.975 0.001 . . . . . . 32 R HA . 6851 1
311 . 1 1 32 32 ARG HB2 H 1 1.864 0.005 . . . . . . 32 R HB1 . 6851 1
312 . 1 1 32 32 ARG HB3 H 1 1.965 0.002 . . . . . . 32 R HB2 . 6851 1
313 . 1 1 32 32 ARG HG2 H 1 1.617 0.001 . . . . . . 32 R HG1 . 6851 1
314 . 1 1 32 32 ARG HG3 H 1 1.849 0.002 . . . . . . 32 R HG2 . 6851 1
315 . 1 1 32 32 ARG HD2 H 1 3.281 0.001 . . . . . . 32 R QD . 6851 1
316 . 1 1 32 32 ARG HD3 H 1 3.281 0.001 . . . . . . 32 R QD . 6851 1
317 . 1 1 32 32 ARG CA C 13 60.681 0.062 . . . . . . 32 R CA . 6851 1
318 . 1 1 32 32 ARG CB C 13 30.327 0.042 . . . . . . 32 R CB . 6851 1
319 . 1 1 32 32 ARG CG C 13 28.900 0.027 . . . . . . 32 R CG . 6851 1
320 . 1 1 32 32 ARG CD C 13 44.345 0.016 . . . . . . 32 R CD . 6851 1
321 . 1 1 32 32 ARG N N 15 120.481 0.012 . . . . . . 32 R N . 6851 1
322 . 1 1 33 33 SER H H 1 7.802 0.005 . . . . . . 33 S HN . 6851 1
323 . 1 1 33 33 SER HA H 1 4.423 0.004 . . . . . . 33 S HA . 6851 1
324 . 1 1 33 33 SER HB2 H 1 4.092 0.004 . . . . . . 33 S QB . 6851 1
325 . 1 1 33 33 SER HB3 H 1 4.092 0.004 . . . . . . 33 S QB . 6851 1
326 . 1 1 33 33 SER CA C 13 62.347 0.024 . . . . . . 33 S CA . 6851 1
327 . 1 1 33 33 SER CB C 13 63.959 0.034 . . . . . . 33 S CB . 6851 1
328 . 1 1 33 33 SER N N 15 114.802 0.003 . . . . . . 33 S N . 6851 1
329 . 1 1 34 34 LEU H H 1 7.824 0.004 . . . . . . 34 L HN . 6851 1
330 . 1 1 34 34 LEU HA H 1 3.974 0.004 . . . . . . 34 L HA . 6851 1
331 . 1 1 34 34 LEU HB2 H 1 1.681 0.000 . . . . . . 34 L HB1 . 6851 1
332 . 1 1 34 34 LEU HB3 H 1 1.681 0.000 . . . . . . 34 L HB2 . 6851 1
333 . 1 1 34 34 LEU HG H 1 1.497 0.004 . . . . . . 34 L HG . 6851 1
334 . 1 1 34 34 LEU CA C 13 60.382 0.034 . . . . . . 34 L CA . 6851 1
335 . 1 1 34 34 LEU CB C 13 43.257 0.010 . . . . . . 34 L CB . 6851 1
336 . 1 1 34 34 LEU CG C 13 28.107 0.073 . . . . . . 34 L CG . 6851 1
337 . 1 1 34 34 LEU N N 15 121.699 0.020 . . . . . . 34 L N . 6851 1
338 . 1 1 35 35 MET H H 1 8.231 0.005 . . . . . . 35 M HN . 6851 1
339 . 1 1 35 35 MET HA H 1 4.336 0.005 . . . . . . 35 M HA . 6851 1
340 . 1 1 35 35 MET HB2 H 1 2.077 0.003 . . . . . . 35 M QB . 6851 1
341 . 1 1 35 35 MET HB3 H 1 2.077 0.003 . . . . . . 35 M QB . 6851 1
342 . 1 1 35 35 MET HG2 H 1 2.571 0.003 . . . . . . 35 M QG . 6851 1
343 . 1 1 35 35 MET HG3 H 1 2.571 0.003 . . . . . . 35 M QG . 6851 1
344 . 1 1 35 35 MET CA C 13 59.525 0.067 . . . . . . 35 M CA . 6851 1
345 . 1 1 35 35 MET CB C 13 34.360 0.000 . . . . . . 35 M CB . 6851 1
346 . 1 1 35 35 MET CG C 13 33.567 0.065 . . . . . . 35 M CG . 6851 1
347 . 1 1 35 35 MET CE C 13 17.675 0.042 . . . . . . 35 M CE . 6851 1
348 . 1 1 35 35 MET N N 15 115.183 0.032 . . . . . . 35 M N . 6851 1
349 . 1 1 36 36 HIS H H 1 7.819 0.007 . . . . . . 36 H HN . 6851 1
350 . 1 1 36 36 HIS HA H 1 4.656 0.005 . . . . . . 36 H HA . 6851 1
351 . 1 1 36 36 HIS HB2 H 1 3.273 0.004 . . . . . . 36 H QB . 6851 1
352 . 1 1 36 36 HIS HB3 H 1 3.273 0.004 . . . . . . 36 H QB . 6851 1
353 . 1 1 36 36 HIS HD2 H 1 6.959 0.008 . . . . . . 36 H HD2 . 6851 1
354 . 1 1 36 36 HIS HE1 H 1 8.497 0.000 . . . . . . 36 H HE1 . 6851 1
355 . 1 1 36 36 HIS HE2 H 1 7.330 0.003 . . . . . . 36 H HE2 . 6851 1
356 . 1 1 36 36 HIS CA C 13 57.948 0.006 . . . . . . 36 H CA . 6851 1
357 . 1 1 36 36 HIS CB C 13 30.298 0.023 . . . . . . 36 H CB . 6851 1
358 . 1 1 36 36 HIS CD2 C 13 120.496 0.000 . . . . . . 36 H CD2 . 6851 1
359 . 1 1 36 36 HIS N N 15 114.133 0.042 . . . . . . 36 H N . 6851 1
360 . 1 1 37 37 HIS H H 1 7.930 0.009 . . . . . . 37 H HN . 6851 1
361 . 1 1 37 37 HIS HA H 1 4.652 0.002 . . . . . . 37 H HA . 6851 1
362 . 1 1 37 37 HIS HB2 H 1 3.046 0.003 . . . . . . 37 H HB1 . 6851 1
363 . 1 1 37 37 HIS HB3 H 1 3.446 0.005 . . . . . . 37 H HB2 . 6851 1
364 . 1 1 37 37 HIS HD2 H 1 7.708 0.014 . . . . . . 37 H HD2 . 6851 1
365 . 1 1 37 37 HIS HE1 H 1 8.534 0.002 . . . . . . 37 H HE1 . 6851 1
366 . 1 1 37 37 HIS CA C 13 58.809 0.022 . . . . . . 37 H CA . 6851 1
367 . 1 1 37 37 HIS CB C 13 33.201 0.020 . . . . . . 37 H CB . 6851 1
368 . 1 1 37 37 HIS CD2 C 13 122.608 0.000 . . . . . . 37 H CD2 . 6851 1
369 . 1 1 37 37 HIS N N 15 114.698 0.062 . . . . . . 37 H N . 6851 1
370 . 1 1 38 38 VAL H H 1 8.241 0.008 . . . . . . 38 V HN . 6851 1
371 . 1 1 38 38 VAL HA H 1 4.670 0.004 . . . . . . 38 V HA . 6851 1
372 . 1 1 38 38 VAL HB H 1 2.338 0.003 . . . . . . 38 V HB . 6851 1
373 . 1 1 38 38 VAL CA C 13 61.545 0.019 . . . . . . 38 V CA . 6851 1
374 . 1 1 38 38 VAL CB C 13 36.051 0.017 . . . . . . 38 V CB . 6851 1
375 . 1 1 38 38 VAL CG1 C 13 24.964 0.014 . . . . . . 38 V CG1 . 6851 1
376 . 1 1 38 38 VAL CG2 C 13 21.871 0.003 . . . . . . 38 V CG2 . 6851 1
377 . 1 1 38 38 VAL N N 15 116.829 0.117 . . . . . . 38 V N . 6851 1
378 . 1 1 39 39 LYS H H 1 8.701 0.004 . . . . . . 39 K HN . 6851 1
379 . 1 1 39 39 LYS HA H 1 4.301 0.004 . . . . . . 39 K HA . 6851 1
380 . 1 1 39 39 LYS HB2 H 1 1.633 0.003 . . . . . . 39 K HB1 . 6851 1
381 . 1 1 39 39 LYS HB3 H 1 1.738 0.003 . . . . . . 39 K HB2 . 6851 1
382 . 1 1 39 39 LYS HG2 H 1 1.413 0.012 . . . . . . 39 K HG1 . 6851 1
383 . 1 1 39 39 LYS HG3 H 1 1.514 0.008 . . . . . . 39 K HG2 . 6851 1
384 . 1 1 39 39 LYS HD2 H 1 1.725 0.005 . . . . . . 39 K QD . 6851 1
385 . 1 1 39 39 LYS HD3 H 1 1.725 0.005 . . . . . . 39 K QD . 6851 1
386 . 1 1 39 39 LYS HE2 H 1 3.034 0.004 . . . . . . 39 K QE . 6851 1
387 . 1 1 39 39 LYS HE3 H 1 3.034 0.004 . . . . . . 39 K QE . 6851 1
388 . 1 1 39 39 LYS CA C 13 59.221 0.017 . . . . . . 39 K CA . 6851 1
389 . 1 1 39 39 LYS CB C 13 35.834 0.021 . . . . . . 39 K CB . 6851 1
390 . 1 1 39 39 LYS CG C 13 26.035 0.007 . . . . . . 39 K CG . 6851 1
391 . 1 1 39 39 LYS CD C 13 30.299 0.017 . . . . . . 39 K CD . 6851 1
392 . 1 1 39 39 LYS CE C 13 43.322 0.025 . . . . . . 39 K CE . 6851 1
393 . 1 1 39 39 LYS N N 15 119.927 0.025 . . . . . . 39 K N . 6851 1
394 . 1 1 40 40 ASN H H 1 7.004 0.003 . . . . . . 40 N HN . 6851 1
395 . 1 1 40 40 ASN HA H 1 3.037 0.002 . . . . . . 40 N HA . 6851 1
396 . 1 1 40 40 ASN HB2 H 1 2.335 0.003 . . . . . . 40 N HB1 . 6851 1
397 . 1 1 40 40 ASN HB3 H 1 2.616 0.002 . . . . . . 40 N HB2 . 6851 1
398 . 1 1 40 40 ASN CA C 13 52.093 0.014 . . . . . . 40 N CA . 6851 1
399 . 1 1 40 40 ASN CB C 13 41.184 0.036 . . . . . . 40 N CB . 6851 1
400 . 1 1 40 40 ASN N N 15 110.395 0.044 . . . . . . 40 N N . 6851 1
401 . 1 1 41 41 ILE H H 1 8.838 0.005 . . . . . . 41 I HN . 6851 1
402 . 1 1 41 41 ILE HA H 1 3.619 0.006 . . . . . . 41 I HA . 6851 1
403 . 1 1 41 41 ILE HB H 1 1.846 0.003 . . . . . . 41 I HB . 6851 1
404 . 1 1 41 41 ILE HG12 H 1 0.999 0.007 . . . . . . 41 I HG11 . 6851 1
405 . 1 1 41 41 ILE HG13 H 1 2.064 0.004 . . . . . . 41 I HG12 . 6851 1
406 . 1 1 41 41 ILE CA C 13 66.626 0.046 . . . . . . 41 I CA . 6851 1
407 . 1 1 41 41 ILE CB C 13 38.334 0.166 . . . . . . 41 I CB . 6851 1
408 . 1 1 41 41 ILE CG1 C 13 31.857 0.053 . . . . . . 41 I CG1 . 6851 1
409 . 1 1 41 41 ILE CG2 C 13 17.286 0.011 . . . . . . 41 I CG2 . 6851 1
410 . 1 1 41 41 ILE CD1 C 13 14.791 0.022 . . . . . . 41 I CD1 . 6851 1
411 . 1 1 41 41 ILE N N 15 120.071 0.032 . . . . . . 41 I N . 6851 1
412 . 1 1 42 42 ALA H H 1 7.473 0.002 . . . . . . 42 A HN . 6851 1
413 . 1 1 42 42 ALA HA H 1 3.754 0.002 . . . . . . 42 A HA . 6851 1
414 . 1 1 42 42 ALA CA C 13 56.566 0.007 . . . . . . 42 A CA . 6851 1
415 . 1 1 42 42 ALA CB C 13 18.186 0.018 . . . . . . 42 A CB . 6851 1
416 . 1 1 42 42 ALA N N 15 122.441 0.020 . . . . . . 42 A N . 6851 1
417 . 1 1 43 43 GLU H H 1 8.540 0.003 . . . . . . 43 E HN . 6851 1
418 . 1 1 43 43 GLU HA H 1 4.044 0.004 . . . . . . 43 E HA . 6851 1
419 . 1 1 43 43 GLU HB2 H 1 1.969 0.004 . . . . . . 43 E HB1 . 6851 1
420 . 1 1 43 43 GLU HB3 H 1 2.187 0.003 . . . . . . 43 E HB2 . 6851 1
421 . 1 1 43 43 GLU HG2 H 1 2.314 0.010 . . . . . . 43 E HG1 . 6851 1
422 . 1 1 43 43 GLU HG3 H 1 2.731 0.004 . . . . . . 43 E HG2 . 6851 1
423 . 1 1 43 43 GLU CA C 13 60.387 0.000 . . . . . . 43 E CA . 6851 1
424 . 1 1 43 43 GLU CB C 13 31.600 0.042 . . . . . . 43 E CB . 6851 1
425 . 1 1 43 43 GLU CG C 13 38.140 0.057 . . . . . . 43 E CG . 6851 1
426 . 1 1 43 43 GLU N N 15 117.348 0.020 . . . . . . 43 E N . 6851 1
427 . 1 1 44 44 LEU H H 1 7.880 0.002 . . . . . . 44 L HN . 6851 1
428 . 1 1 44 44 LEU HA H 1 4.030 0.006 . . . . . . 44 L HA . 6851 1
429 . 1 1 44 44 LEU HB2 H 1 1.624 0.003 . . . . . . 44 L HB1 . 6851 1
430 . 1 1 44 44 LEU HB3 H 1 2.370 0.005 . . . . . . 44 L HB2 . 6851 1
431 . 1 1 44 44 LEU HG H 1 0.982 0.003 . . . . . . 44 L HG . 6851 1
432 . 1 1 44 44 LEU CA C 13 59.239 0.020 . . . . . . 44 L CA . 6851 1
433 . 1 1 44 44 LEU CB C 13 43.794 0.052 . . . . . . 44 L CB . 6851 1
434 . 1 1 44 44 LEU CG C 13 27.499 0.000 . . . . . . 44 L CG . 6851 1
435 . 1 1 44 44 LEU N N 15 120.880 0.024 . . . . . . 44 L N . 6851 1
436 . 1 1 45 45 ALA H H 1 8.321 0.006 . . . . . . 45 A HN . 6851 1
437 . 1 1 45 45 ALA HA H 1 3.977 0.004 . . . . . . 45 A HA . 6851 1
438 . 1 1 45 45 ALA CA C 13 54.763 0.033 . . . . . . 45 A CA . 6851 1
439 . 1 1 45 45 ALA CB C 13 20.083 0.003 . . . . . . 45 A CB . 6851 1
440 . 1 1 45 45 ALA N N 15 116.153 0.030 . . . . . . 45 A N . 6851 1
441 . 1 1 46 46 ALA H H 1 7.194 0.003 . . . . . . 46 A HN . 6851 1
442 . 1 1 46 46 ALA HA H 1 4.496 0.003 . . . . . . 46 A HA . 6851 1
443 . 1 1 46 46 ALA CA C 13 53.021 0.022 . . . . . . 46 A CA . 6851 1
444 . 1 1 46 46 ALA CB C 13 20.797 0.005 . . . . . . 46 A CB . 6851 1
445 . 1 1 46 46 ALA N N 15 117.836 0.013 . . . . . . 46 A N . 6851 1
446 . 1 1 47 47 LEU H H 1 7.323 0.003 . . . . . . 47 L HN . 6851 1
447 . 1 1 47 47 LEU HA H 1 4.519 0.006 . . . . . . 47 L HA . 6851 1
448 . 1 1 47 47 LEU HB2 H 1 1.533 0.010 . . . . . . 47 L HB1 . 6851 1
449 . 1 1 47 47 LEU HB3 H 1 2.060 0.004 . . . . . . 47 L HB2 . 6851 1
450 . 1 1 47 47 LEU HG H 1 2.269 0.004 . . . . . . 47 L HG . 6851 1
451 . 1 1 47 47 LEU CA C 13 56.594 0.054 . . . . . . 47 L CA . 6851 1
452 . 1 1 47 47 LEU CB C 13 44.535 0.027 . . . . . . 47 L CB . 6851 1
453 . 1 1 47 47 LEU CG C 13 27.175 0.000 . . . . . . 47 L CG . 6851 1
454 . 1 1 47 47 LEU CD1 C 13 23.927 0.008 . . . . . . 47 L CD1 . 6851 1
455 . 1 1 47 47 LEU CD2 C 13 28.884 0.026 . . . . . . 47 L CD2 . 6851 1
456 . 1 1 47 47 LEU N N 15 119.349 0.024 . . . . . . 47 L N . 6851 1
457 . 1 1 48 48 SER H H 1 9.326 0.015 . . . . . . 48 S HN . 6851 1
458 . 1 1 48 48 SER HA H 1 4.695 0.003 . . . . . . 48 S HA . 6851 1
459 . 1 1 48 48 SER HB2 H 1 4.143 0.007 . . . . . . 48 S HB1 . 6851 1
460 . 1 1 48 48 SER HB3 H 1 4.377 0.007 . . . . . . 48 S HB2 . 6851 1
461 . 1 1 48 48 SER CA C 13 58.210 0.022 . . . . . . 48 S CA . 6851 1
462 . 1 1 48 48 SER CB C 13 66.637 0.046 . . . . . . 48 S CB . 6851 1
463 . 1 1 48 48 SER N N 15 118.121 0.106 . . . . . . 48 S N . 6851 1
464 . 1 1 49 49 GLN H H 1 8.631 0.008 . . . . . . 49 Q HN . 6851 1
465 . 1 1 49 49 GLN HA H 1 3.559 0.003 . . . . . . 49 Q HA . 6851 1
466 . 1 1 49 49 GLN HB2 H 1 0.903 0.002 . . . . . . 49 Q HB1 . 6851 1
467 . 1 1 49 49 GLN HB3 H 1 1.491 0.006 . . . . . . 49 Q HB2 . 6851 1
468 . 1 1 49 49 GLN HG2 H 1 1.685 0.003 . . . . . . 49 Q HG1 . 6851 1
469 . 1 1 49 49 GLN HG3 H 1 2.095 0.004 . . . . . . 49 Q HG2 . 6851 1
470 . 1 1 49 49 GLN HE21 H 1 6.615 0.002 . . . . . . 49 Q HE21 . 6851 1
471 . 1 1 49 49 GLN HE22 H 1 7.398 0.002 . . . . . . 49 Q HE22 . 6851 1
472 . 1 1 49 49 GLN CA C 13 61.435 0.018 . . . . . . 49 Q CA . 6851 1
473 . 1 1 49 49 GLN CB C 13 28.968 0.040 . . . . . . 49 Q CB . 6851 1
474 . 1 1 49 49 GLN CG C 13 34.886 0.024 . . . . . . 49 Q CG . 6851 1
475 . 1 1 49 49 GLN N N 15 122.446 0.018 . . . . . . 49 Q N . 6851 1
476 . 1 1 49 49 GLN NE2 N 15 109.983 0.019 . . . . . . 49 Q NE2 . 6851 1
477 . 1 1 50 50 ASP H H 1 8.590 0.005 . . . . . . 50 D HN . 6851 1
478 . 1 1 50 50 ASP HA H 1 4.321 0.001 . . . . . . 50 D HA . 6851 1
479 . 1 1 50 50 ASP HB2 H 1 2.552 0.008 . . . . . . 50 D HB1 . 6851 1
480 . 1 1 50 50 ASP HB3 H 1 2.607 0.006 . . . . . . 50 D HB2 . 6851 1
481 . 1 1 50 50 ASP CA C 13 58.747 0.029 . . . . . . 50 D CA . 6851 1
482 . 1 1 50 50 ASP CB C 13 41.398 0.018 . . . . . . 50 D CB . 6851 1
483 . 1 1 50 50 ASP N N 15 120.041 0.023 . . . . . . 50 D N . 6851 1
484 . 1 1 51 51 GLU H H 1 8.027 0.003 . . . . . . 51 E HN . 6851 1
485 . 1 1 51 51 GLU HA H 1 4.063 0.004 . . . . . . 51 E HA . 6851 1
486 . 1 1 51 51 GLU HB2 H 1 1.984 0.007 . . . . . . 51 E HB1 . 6851 1
487 . 1 1 51 51 GLU HB3 H 1 2.366 0.003 . . . . . . 51 E HB2 . 6851 1
488 . 1 1 51 51 GLU HG2 H 1 2.325 0.000 . . . . . . 51 E HG1 . 6851 1
489 . 1 1 51 51 GLU HG3 H 1 2.381 0.002 . . . . . . 51 E HG2 . 6851 1
490 . 1 1 51 51 GLU CA C 13 60.621 0.056 . . . . . . 51 E CA . 6851 1
491 . 1 1 51 51 GLU CB C 13 31.240 0.050 . . . . . . 51 E CB . 6851 1
492 . 1 1 51 51 GLU CG C 13 38.656 0.006 . . . . . . 51 E CG . 6851 1
493 . 1 1 51 51 GLU N N 15 122.149 0.033 . . . . . . 51 E N . 6851 1
494 . 1 1 52 52 LEU H H 1 8.392 0.005 . . . . . . 52 L HN . 6851 1
495 . 1 1 52 52 LEU HA H 1 3.989 0.004 . . . . . . 52 L HA . 6851 1
496 . 1 1 52 52 LEU HB2 H 1 1.378 0.004 . . . . . . 52 L HB1 . 6851 1
497 . 1 1 52 52 LEU HB3 H 1 2.131 0.003 . . . . . . 52 L HB2 . 6851 1
498 . 1 1 52 52 LEU HG H 1 1.100 0.004 . . . . . . 52 L HG . 6851 1
499 . 1 1 52 52 LEU CA C 13 59.228 0.000 . . . . . . 52 L CA . 6851 1
500 . 1 1 52 52 LEU CB C 13 44.044 0.026 . . . . . . 52 L CB . 6851 1
501 . 1 1 52 52 LEU CG C 13 26.751 0.055 . . . . . . 52 L CG . 6851 1
502 . 1 1 52 52 LEU CD2 C 13 25.778 0.039 . . . . . . 52 L CD2 . 6851 1
503 . 1 1 52 52 LEU N N 15 118.977 0.016 . . . . . . 52 L N . 6851 1
504 . 1 1 53 53 THR H H 1 8.454 0.002 . . . . . . 53 T HN . 6851 1
505 . 1 1 53 53 THR HA H 1 4.426 0.002 . . . . . . 53 T HA . 6851 1
506 . 1 1 53 53 THR HB H 1 3.535 0.003 . . . . . . 53 T HB . 6851 1
507 . 1 1 53 53 THR CA C 13 68.913 0.002 . . . . . . 53 T CA . 6851 1
508 . 1 1 53 53 THR CB C 13 69.169 0.042 . . . . . . 53 T CB . 6851 1
509 . 1 1 53 53 THR CG2 C 13 22.523 0.029 . . . . . . 53 T CG2 . 6851 1
510 . 1 1 53 53 THR N N 15 119.594 0.028 . . . . . . 53 T N . 6851 1
511 . 1 1 54 54 SER H H 1 7.592 0.006 . . . . . . 54 S HN . 6851 1
512 . 1 1 54 54 SER HA H 1 4.163 0.002 . . . . . . 54 S HA . 6851 1
513 . 1 1 54 54 SER HB2 H 1 3.969 0.003 . . . . . . 54 S QB . 6851 1
514 . 1 1 54 54 SER HB3 H 1 3.969 0.003 . . . . . . 54 S QB . 6851 1
515 . 1 1 54 54 SER CA C 13 62.468 0.031 . . . . . . 54 S CA . 6851 1
516 . 1 1 54 54 SER CB C 13 63.859 0.022 . . . . . . 54 S CB . 6851 1
517 . 1 1 54 54 SER N N 15 116.854 0.030 . . . . . . 54 S N . 6851 1
518 . 1 1 55 55 ILE H H 1 7.859 0.004 . . . . . . 55 I HN . 6851 1
519 . 1 1 55 55 ILE HA H 1 3.465 0.003 . . . . . . 55 I HA . 6851 1
520 . 1 1 55 55 ILE HB H 1 1.552 0.006 . . . . . . 55 I HB . 6851 1
521 . 1 1 55 55 ILE HG12 H 1 0.188 0.005 . . . . . . 55 I HG11 . 6851 1
522 . 1 1 55 55 ILE HG13 H 1 1.689 0.004 . . . . . . 55 I HG12 . 6851 1
523 . 1 1 55 55 ILE CA C 13 65.781 0.010 . . . . . . 55 I CA . 6851 1
524 . 1 1 55 55 ILE CB C 13 40.579 0.042 . . . . . . 55 I CB . 6851 1
525 . 1 1 55 55 ILE CG1 C 13 30.033 0.055 . . . . . . 55 I CG1 . 6851 1
526 . 1 1 55 55 ILE CG2 C 13 18.687 0.000 . . . . . . 55 I CG2 . 6851 1
527 . 1 1 55 55 ILE CD1 C 13 16.010 0.017 . . . . . . 55 I CD1 . 6851 1
528 . 1 1 55 55 ILE N N 15 119.936 0.039 . . . . . . 55 I N . 6851 1
529 . 1 1 56 56 LEU H H 1 8.731 0.004 . . . . . . 56 L HN . 6851 1
530 . 1 1 56 56 LEU HA H 1 4.240 0.005 . . . . . . 56 L HA . 6851 1
531 . 1 1 56 56 LEU HB2 H 1 1.608 0.003 . . . . . . 56 L HB1 . 6851 1
532 . 1 1 56 56 LEU HB3 H 1 1.867 0.008 . . . . . . 56 L HB2 . 6851 1
533 . 1 1 56 56 LEU HG H 1 1.856 0.001 . . . . . . 56 L HG . 6851 1
534 . 1 1 56 56 LEU CA C 13 57.302 0.069 . . . . . . 56 L CA . 6851 1
535 . 1 1 56 56 LEU CB C 13 43.226 0.033 . . . . . . 56 L CB . 6851 1
536 . 1 1 56 56 LEU CG C 13 28.285 0.129 . . . . . . 56 L CG . 6851 1
537 . 1 1 56 56 LEU CD1 C 13 23.592 0.088 . . . . . . 56 L CD1 . 6851 1
538 . 1 1 56 56 LEU CD2 C 13 26.252 0.024 . . . . . . 56 L CD2 . 6851 1
539 . 1 1 56 56 LEU N N 15 115.261 0.020 . . . . . . 56 L N . 6851 1
540 . 1 1 57 57 GLY H H 1 8.058 0.003 . . . . . . 57 G HN . 6851 1
541 . 1 1 57 57 GLY HA2 H 1 3.900 0.002 . . . . . . 57 G HA1 . 6851 1
542 . 1 1 57 57 GLY HA3 H 1 4.166 0.004 . . . . . . 57 G HA2 . 6851 1
543 . 1 1 57 57 GLY CA C 13 47.134 0.018 . . . . . . 57 G CA . 6851 1
544 . 1 1 57 57 GLY N N 15 107.709 0.008 . . . . . . 57 G N . 6851 1
545 . 1 1 58 58 ASN H H 1 6.671 0.002 . . . . . . 58 N HN . 6851 1
546 . 1 1 58 58 ASN HA H 1 4.834 0.006 . . . . . . 58 N HA . 6851 1
547 . 1 1 58 58 ASN HB2 H 1 2.751 0.007 . . . . . . 58 N HB1 . 6851 1
548 . 1 1 58 58 ASN HB3 H 1 2.853 0.003 . . . . . . 58 N HB2 . 6851 1
549 . 1 1 58 58 ASN HD21 H 1 7.057 0.002 . . . . . . 58 N HD21 . 6851 1
550 . 1 1 58 58 ASN HD22 H 1 7.848 0.011 . . . . . . 58 N HD22 . 6851 1
551 . 1 1 58 58 ASN CA C 13 54.846 0.017 . . . . . . 58 N CA . 6851 1
552 . 1 1 58 58 ASN CB C 13 42.837 0.015 . . . . . . 58 N CB . 6851 1
553 . 1 1 58 58 ASN N N 15 114.576 0.015 . . . . . . 58 N N . 6851 1
554 . 1 1 58 58 ASN ND2 N 15 114.107 0.025 . . . . . . 58 N ND2 . 6851 1
555 . 1 1 59 59 ALA H H 1 9.210 0.003 . . . . . . 59 A HN . 6851 1
556 . 1 1 59 59 ALA HA H 1 4.290 0.005 . . . . . . 59 A HA . 6851 1
557 . 1 1 59 59 ALA CA C 13 55.926 0.063 . . . . . . 59 A CA . 6851 1
558 . 1 1 59 59 ALA CB C 13 19.660 0.025 . . . . . . 59 A CB . 6851 1
559 . 1 1 59 59 ALA N N 15 130.067 0.022 . . . . . . 59 A N . 6851 1
560 . 1 1 60 60 ALA H H 1 8.469 0.003 . . . . . . 60 A HN . 6851 1
561 . 1 1 60 60 ALA HA H 1 4.247 0.001 . . . . . . 60 A HA . 6851 1
562 . 1 1 60 60 ALA CA C 13 56.413 0.009 . . . . . . 60 A CA . 6851 1
563 . 1 1 60 60 ALA CB C 13 18.770 0.060 . . . . . . 60 A CB . 6851 1
564 . 1 1 60 60 ALA N N 15 123.626 0.071 . . . . . . 60 A N . 6851 1
565 . 1 1 61 61 ASN H H 1 8.535 0.004 . . . . . . 61 N HN . 6851 1
566 . 1 1 61 61 ASN HA H 1 4.524 0.004 . . . . . . 61 N HA . 6851 1
567 . 1 1 61 61 ASN HB2 H 1 2.438 0.006 . . . . . . 61 N HB1 . 6851 1
568 . 1 1 61 61 ASN HB3 H 1 3.395 0.006 . . . . . . 61 N HB2 . 6851 1
569 . 1 1 61 61 ASN HD21 H 1 7.035 0.004 . . . . . . 61 N HD21 . 6851 1
570 . 1 1 61 61 ASN HD22 H 1 7.532 0.002 . . . . . . 61 N HD22 . 6851 1
571 . 1 1 61 61 ASN CA C 13 57.209 0.038 . . . . . . 61 N CA . 6851 1
572 . 1 1 61 61 ASN CB C 13 39.013 0.034 . . . . . . 61 N CB . 6851 1
573 . 1 1 61 61 ASN N N 15 118.492 0.052 . . . . . . 61 N N . 6851 1
574 . 1 1 61 61 ASN ND2 N 15 110.163 0.047 . . . . . . 61 N ND2 . 6851 1
575 . 1 1 62 62 ALA H H 1 7.652 0.003 . . . . . . 62 A HN . 6851 1
576 . 1 1 62 62 ALA HA H 1 3.865 0.004 . . . . . . 62 A HA . 6851 1
577 . 1 1 62 62 ALA CA C 13 56.454 0.035 . . . . . . 62 A CA . 6851 1
578 . 1 1 62 62 ALA CB C 13 21.266 0.012 . . . . . . 62 A CB . 6851 1
579 . 1 1 62 62 ALA N N 15 119.557 0.025 . . . . . . 62 A N . 6851 1
580 . 1 1 63 63 LYS H H 1 8.107 0.005 . . . . . . 63 K HN . 6851 1
581 . 1 1 63 63 LYS HA H 1 3.949 0.002 . . . . . . 63 K HA . 6851 1
582 . 1 1 63 63 LYS HB2 H 1 1.829 0.006 . . . . . . 63 K HB1 . 6851 1
583 . 1 1 63 63 LYS HB3 H 1 2.003 0.003 . . . . . . 63 K HB2 . 6851 1
584 . 1 1 63 63 LYS HG2 H 1 1.391 0.000 . . . . . . 63 K HG1 . 6851 1
585 . 1 1 63 63 LYS HG3 H 1 1.495 0.003 . . . . . . 63 K HG2 . 6851 1
586 . 1 1 63 63 LYS HD2 H 1 1.675 0.000 . . . . . . 63 K QD . 6851 1
587 . 1 1 63 63 LYS HD3 H 1 1.675 0.000 . . . . . . 63 K QD . 6851 1
588 . 1 1 63 63 LYS HE2 H 1 3.136 0.000 . . . . . . 63 K HE1 . 6851 1
589 . 1 1 63 63 LYS HE3 H 1 3.160 0.000 . . . . . . 63 K HE2 . 6851 1
590 . 1 1 63 63 LYS CA C 13 61.047 0.010 . . . . . . 63 K CA . 6851 1
591 . 1 1 63 63 LYS CB C 13 33.540 0.026 . . . . . . 63 K CB . 6851 1
592 . 1 1 63 63 LYS CG C 13 26.208 0.014 . . . . . . 63 K CG . 6851 1
593 . 1 1 63 63 LYS CD C 13 30.164 0.000 . . . . . . 63 K CD . 6851 1
594 . 1 1 63 63 LYS N N 15 118.683 0.023 . . . . . . 63 K N . 6851 1
595 . 1 1 64 64 GLN H H 1 7.786 0.003 . . . . . . 64 Q HN . 6851 1
596 . 1 1 64 64 GLN HA H 1 4.104 0.006 . . . . . . 64 Q HA . 6851 1
597 . 1 1 64 64 GLN HB2 H 1 1.858 0.006 . . . . . . 64 Q HB1 . 6851 1
598 . 1 1 64 64 GLN HB3 H 1 2.179 0.005 . . . . . . 64 Q HB2 . 6851 1
599 . 1 1 64 64 GLN HG2 H 1 2.373 0.004 . . . . . . 64 Q HG1 . 6851 1
600 . 1 1 64 64 GLN HG3 H 1 2.604 0.004 . . . . . . 64 Q HG2 . 6851 1
601 . 1 1 64 64 GLN HE21 H 1 6.805 0.005 . . . . . . 64 Q HE21 . 6851 1
602 . 1 1 64 64 GLN HE22 H 1 7.301 0.002 . . . . . . 64 Q HE22 . 6851 1
603 . 1 1 64 64 GLN CA C 13 60.461 0.012 . . . . . . 64 Q CA . 6851 1
604 . 1 1 64 64 GLN CB C 13 30.288 0.046 . . . . . . 64 Q CB . 6851 1
605 . 1 1 64 64 GLN CG C 13 35.972 0.050 . . . . . . 64 Q CG . 6851 1
606 . 1 1 64 64 GLN N N 15 116.520 0.025 . . . . . . 64 Q N . 6851 1
607 . 1 1 64 64 GLN NE2 N 15 110.398 0.013 . . . . . . 64 Q NE2 . 6851 1
608 . 1 1 65 65 LEU H H 1 7.936 0.005 . . . . . . 65 L HN . 6851 1
609 . 1 1 65 65 LEU HA H 1 4.359 0.006 . . . . . . 65 L HA . 6851 1
610 . 1 1 65 65 LEU HB2 H 1 1.832 0.011 . . . . . . 65 L HB1 . 6851 1
611 . 1 1 65 65 LEU HB3 H 1 1.937 0.005 . . . . . . 65 L HB2 . 6851 1
612 . 1 1 65 65 LEU HG H 1 0.901 0.005 . . . . . . 65 L HG . 6851 1
613 . 1 1 65 65 LEU CA C 13 59.236 0.017 . . . . . . 65 L CA . 6851 1
614 . 1 1 65 65 LEU CB C 13 42.949 0.036 . . . . . . 65 L CB . 6851 1
615 . 1 1 65 65 LEU CG C 13 28.510 0.083 . . . . . . 65 L CG . 6851 1
616 . 1 1 65 65 LEU CD1 C 13 24.757 0.000 . . . . . . 65 L CD1 . 6851 1
617 . 1 1 65 65 LEU CD2 C 13 24.784 0.026 . . . . . . 65 L CD2 . 6851 1
618 . 1 1 65 65 LEU N N 15 122.447 0.022 . . . . . . 65 L N . 6851 1
619 . 1 1 66 66 TYR H H 1 9.022 0.004 . . . . . . 66 Y HN . 6851 1
620 . 1 1 66 66 TYR HA H 1 3.837 0.004 . . . . . . 66 Y HA . 6851 1
621 . 1 1 66 66 TYR HB2 H 1 3.074 0.005 . . . . . . 66 Y QB . 6851 1
622 . 1 1 66 66 TYR HB3 H 1 3.074 0.005 . . . . . . 66 Y QB . 6851 1
623 . 1 1 66 66 TYR HD1 H 1 7.078 0.008 . . . . . . 66 Y QD . 6851 1
624 . 1 1 66 66 TYR HD2 H 1 7.078 0.008 . . . . . . 66 Y QD . 6851 1
625 . 1 1 66 66 TYR HE1 H 1 6.720 0.003 . . . . . . 66 Y QE . 6851 1
626 . 1 1 66 66 TYR HE2 H 1 6.720 0.003 . . . . . . 66 Y QE . 6851 1
627 . 1 1 66 66 TYR CA C 13 64.397 0.067 . . . . . . 66 Y CA . 6851 1
628 . 1 1 66 66 TYR CB C 13 40.686 0.000 . . . . . . 66 Y CB . 6851 1
629 . 1 1 66 66 TYR N N 15 120.136 0.023 . . . . . . 66 Y N . 6851 1
630 . 1 1 67 67 ASP H H 1 9.504 0.005 . . . . . . 67 D HN . 6851 1
631 . 1 1 67 67 ASP HA H 1 4.498 0.001 . . . . . . 67 D HA . 6851 1
632 . 1 1 67 67 ASP HB2 H 1 2.593 0.005 . . . . . . 67 D HB1 . 6851 1
633 . 1 1 67 67 ASP HB3 H 1 2.986 0.008 . . . . . . 67 D HB2 . 6851 1
634 . 1 1 67 67 ASP CA C 13 58.511 0.022 . . . . . . 67 D CA . 6851 1
635 . 1 1 67 67 ASP CB C 13 40.132 0.052 . . . . . . 67 D CB . 6851 1
636 . 1 1 67 67 ASP N N 15 119.972 0.047 . . . . . . 67 D N . 6851 1
637 . 1 1 68 68 PHE H H 1 8.105 0.005 . . . . . . 68 F HN . 6851 1
638 . 1 1 68 68 PHE HA H 1 4.288 0.004 . . . . . . 68 F HA . 6851 1
639 . 1 1 68 68 PHE HB2 H 1 3.362 0.016 . . . . . . 68 F QB . 6851 1
640 . 1 1 68 68 PHE HB3 H 1 3.362 0.016 . . . . . . 68 F QB . 6851 1
641 . 1 1 68 68 PHE HD1 H 1 7.172 0.005 . . . . . . 68 F QD . 6851 1
642 . 1 1 68 68 PHE HD2 H 1 7.172 0.005 . . . . . . 68 F QD . 6851 1
643 . 1 1 68 68 PHE HE1 H 1 6.717 0.004 . . . . . . 68 F QE . 6851 1
644 . 1 1 68 68 PHE HE2 H 1 6.717 0.004 . . . . . . 68 F QE . 6851 1
645 . 1 1 68 68 PHE HZ H 1 6.352 0.005 . . . . . . 68 F HZ . 6851 1
646 . 1 1 68 68 PHE CA C 13 63.230 0.050 . . . . . . 68 F CA . 6851 1
647 . 1 1 68 68 PHE CB C 13 40.377 0.000 . . . . . . 68 F CB . 6851 1
648 . 1 1 68 68 PHE N N 15 124.319 0.026 . . . . . . 68 F N . 6851 1
649 . 1 1 69 69 ILE H H 1 7.937 0.002 . . . . . . 69 I HN . 6851 1
650 . 1 1 69 69 ILE HA H 1 3.405 0.003 . . . . . . 69 I HA . 6851 1
651 . 1 1 69 69 ILE HB H 1 1.847 0.003 . . . . . . 69 I HB . 6851 1
652 . 1 1 69 69 ILE HG12 H 1 1.078 0.004 . . . . . . 69 I HG11 . 6851 1
653 . 1 1 69 69 ILE HG13 H 1 1.908 0.008 . . . . . . 69 I HG12 . 6851 1
654 . 1 1 69 69 ILE CA C 13 64.571 0.037 . . . . . . 69 I CA . 6851 1
655 . 1 1 69 69 ILE CB C 13 39.060 0.069 . . . . . . 69 I CB . 6851 1
656 . 1 1 69 69 ILE CG1 C 13 31.169 0.043 . . . . . . 69 I CG1 . 6851 1
657 . 1 1 69 69 ILE CG2 C 13 19.134 0.017 . . . . . . 69 I CG2 . 6851 1
658 . 1 1 69 69 ILE CD1 C 13 13.963 0.012 . . . . . . 69 I CD1 . 6851 1
659 . 1 1 69 69 ILE N N 15 116.784 0.037 . . . . . . 69 I N . 6851 1
660 . 1 1 70 70 HIS H H 1 7.459 0.004 . . . . . . 70 H HN . 6851 1
661 . 1 1 70 70 HIS HA H 1 4.331 0.003 . . . . . . 70 H HA . 6851 1
662 . 1 1 70 70 HIS HB2 H 1 2.657 0.008 . . . . . . 70 H HB1 . 6851 1
663 . 1 1 70 70 HIS HB3 H 1 3.469 0.005 . . . . . . 70 H HB2 . 6851 1
664 . 1 1 70 70 HIS HD2 H 1 7.083 0.005 . . . . . . 70 H HD2 . 6851 1
665 . 1 1 70 70 HIS HE1 H 1 8.629 0.008 . . . . . . 70 H HE1 . 6851 1
666 . 1 1 70 70 HIS CA C 13 57.302 0.050 . . . . . . 70 H CA . 6851 1
667 . 1 1 70 70 HIS CB C 13 29.550 0.031 . . . . . . 70 H CB . 6851 1
668 . 1 1 70 70 HIS CE1 C 13 137.661 0.021 . . . . . . 70 H CE1 . 6851 1
669 . 1 1 70 70 HIS N N 15 112.181 0.034 . . . . . . 70 H N . 6851 1
670 . 1 1 71 71 THR H H 1 7.555 0.006 . . . . . . 71 T HN . 6851 1
671 . 1 1 71 71 THR HA H 1 4.234 0.004 . . . . . . 71 T HA . 6851 1
672 . 1 1 71 71 THR HB H 1 4.054 0.003 . . . . . . 71 T HB . 6851 1
673 . 1 1 71 71 THR CA C 13 65.458 0.060 . . . . . . 71 T CA . 6851 1
674 . 1 1 71 71 THR CB C 13 70.656 0.039 . . . . . . 71 T CB . 6851 1
675 . 1 1 71 71 THR CG2 C 13 21.829 0.025 . . . . . . 71 T CG2 . 6851 1
676 . 1 1 71 71 THR N N 15 121.414 0.023 . . . . . . 71 T N . 6851 1
677 . 1 1 72 72 SER H H 1 8.831 0.005 . . . . . . 72 S HN . 6851 1
678 . 1 1 72 72 SER HA H 1 4.712 0.004 . . . . . . 72 S HA . 6851 1
679 . 1 1 72 72 SER HB2 H 1 3.966 0.008 . . . . . . 72 S QB . 6851 1
680 . 1 1 72 72 SER HB3 H 1 3.966 0.008 . . . . . . 72 S QB . 6851 1
681 . 1 1 72 72 SER CA C 13 59.039 0.022 . . . . . . 72 S CA . 6851 1
682 . 1 1 72 72 SER CB C 13 64.715 0.057 . . . . . . 72 S CB . 6851 1
683 . 1 1 72 72 SER N N 15 122.574 0.037 . . . . . . 72 S N . 6851 1
684 . 1 1 73 73 PHE H H 1 8.230 0.006 . . . . . . 73 F HN . 6851 1
685 . 1 1 73 73 PHE HA H 1 4.466 0.005 . . . . . . 73 F HA . 6851 1
686 . 1 1 73 73 PHE HB2 H 1 3.133 0.007 . . . . . . 73 F HB1 . 6851 1
687 . 1 1 73 73 PHE HB3 H 1 3.318 0.004 . . . . . . 73 F HB2 . 6851 1
688 . 1 1 73 73 PHE HD1 H 1 7.205 0.007 . . . . . . 73 F QD . 6851 1
689 . 1 1 73 73 PHE HD2 H 1 7.205 0.007 . . . . . . 73 F QD . 6851 1
690 . 1 1 73 73 PHE HE1 H 1 6.987 0.004 . . . . . . 73 F QE . 6851 1
691 . 1 1 73 73 PHE HE2 H 1 6.987 0.004 . . . . . . 73 F QE . 6851 1
692 . 1 1 73 73 PHE HZ H 1 6.714 0.002 . . . . . . 73 F HZ . 6851 1
693 . 1 1 73 73 PHE CA C 13 60.097 0.026 . . . . . . 73 F CA . 6851 1
694 . 1 1 73 73 PHE CB C 13 40.378 0.092 . . . . . . 73 F CB . 6851 1
695 . 1 1 73 73 PHE CD1 C 13 132.424 0.000 . . . . . . 73 F CD1 . 6851 1
696 . 1 1 73 73 PHE N N 15 122.494 0.021 . . . . . . 73 F N . 6851 1
697 . 1 1 74 74 ALA H H 1 8.301 0.006 . . . . . . 74 A HN . 6851 1
698 . 1 1 74 74 ALA HA H 1 4.447 0.003 . . . . . . 74 A HA . 6851 1
699 . 1 1 74 74 ALA CA C 13 53.446 0.043 . . . . . . 74 A CA . 6851 1
700 . 1 1 74 74 ALA CB C 13 21.043 0.028 . . . . . . 74 A CB . 6851 1
701 . 1 1 74 74 ALA N N 15 120.632 0.051 . . . . . . 74 A N . 6851 1
702 . 1 1 75 75 GLU H H 1 8.212 0.005 . . . . . . 75 E HN . 6851 1
703 . 1 1 75 75 GLU HA H 1 4.312 0.002 . . . . . . 75 E HA . 6851 1
704 . 1 1 75 75 GLU HB2 H 1 1.983 0.006 . . . . . . 75 E HB1 . 6851 1
705 . 1 1 75 75 GLU HB3 H 1 2.067 0.004 . . . . . . 75 E HB2 . 6851 1
706 . 1 1 75 75 GLU HG2 H 1 2.271 0.009 . . . . . . 75 E QG . 6851 1
707 . 1 1 75 75 GLU HG3 H 1 2.271 0.009 . . . . . . 75 E QG . 6851 1
708 . 1 1 75 75 GLU CA C 13 57.819 0.000 . . . . . . 75 E CA . 6851 1
709 . 1 1 75 75 GLU CB C 13 31.472 0.003 . . . . . . 75 E CB . 6851 1
710 . 1 1 75 75 GLU CG C 13 37.257 0.028 . . . . . . 75 E CG . 6851 1
711 . 1 1 75 75 GLU N N 15 120.023 0.011 . . . . . . 75 E N . 6851 1
712 . 1 1 76 76 VAL H H 1 8.257 0.003 . . . . . . 76 V HN . 6851 1
713 . 1 1 76 76 VAL HA H 1 4.191 0.003 . . . . . . 76 V HA . 6851 1
714 . 1 1 76 76 VAL HB H 1 2.138 0.006 . . . . . . 76 V HB . 6851 1
715 . 1 1 76 76 VAL CA C 13 63.483 0.033 . . . . . . 76 V CA . 6851 1
716 . 1 1 76 76 VAL CB C 13 33.941 0.022 . . . . . . 76 V CB . 6851 1
717 . 1 1 76 76 VAL N N 15 122.014 0.017 . . . . . . 76 V N . 6851 1
718 . 1 1 77 77 VAL H H 1 8.309 0.004 . . . . . . 77 V HN . 6851 1
719 . 1 1 77 77 VAL HA H 1 4.197 0.001 . . . . . . 77 V HA . 6851 1
720 . 1 1 77 77 VAL HB H 1 2.128 0.004 . . . . . . 77 V HB . 6851 1
721 . 1 1 77 77 VAL CA C 13 63.417 0.000 . . . . . . 77 V CA . 6851 1
722 . 1 1 77 77 VAL CB C 13 33.951 0.010 . . . . . . 77 V CB . 6851 1
723 . 1 1 77 77 VAL N N 15 124.437 0.022 . . . . . . 77 V N . 6851 1
724 . 1 1 78 78 SER H H 1 8.479 0.004 . . . . . . 78 S HN . 6851 1
725 . 1 1 78 78 SER HA H 1 4.509 0.003 . . . . . . 78 S HA . 6851 1
726 . 1 1 78 78 SER HB2 H 1 3.908 0.004 . . . . . . 78 S QB . 6851 1
727 . 1 1 78 78 SER HB3 H 1 3.908 0.004 . . . . . . 78 S QB . 6851 1
728 . 1 1 78 78 SER CA C 13 59.271 0.017 . . . . . . 78 S CA . 6851 1
729 . 1 1 78 78 SER CB C 13 65.030 0.016 . . . . . . 78 S CB . 6851 1
730 . 1 1 78 78 SER N N 15 120.037 0.018 . . . . . . 78 S N . 6851 1
731 . 1 1 79 79 LYS H H 1 8.460 0.001 . . . . . . 79 K HN . 6851 1
732 . 1 1 79 79 LYS HA H 1 4.373 0.000 . . . . . . 79 K HA . 6851 1
733 . 1 1 79 79 LYS HB2 H 1 1.829 0.000 . . . . . . 79 K HB1 . 6851 1
734 . 1 1 79 79 LYS HB3 H 1 1.925 0.000 . . . . . . 79 K HB2 . 6851 1
735 . 1 1 79 79 LYS CB C 13 34.220 0.000 . . . . . . 79 K CB . 6851 1
736 . 1 1 79 79 LYS CD C 13 28.281 2.383 . . . . . . 79 K CD . 6851 1
737 . 1 1 79 79 LYS N N 15 123.795 0.116 . . . . . . 79 K N . 6851 1
738 . 1 1 80 80 GLY H H 1 8.464 0.001 . . . . . . 80 G HN . 6851 1
739 . 1 1 80 80 GLY HA2 H 1 4.019 0.001 . . . . . . 80 G QA . 6851 1
740 . 1 1 80 80 GLY HA3 H 1 4.019 0.001 . . . . . . 80 G QA . 6851 1
741 . 1 1 80 80 GLY CA C 13 46.543 0.000 . . . . . . 80 G CA . 6851 1
742 . 1 1 80 80 GLY N N 15 109.947 0.019 . . . . . . 80 G N . 6851 1
743 . 1 1 81 81 LYS H H 1 8.312 0.006 . . . . . . 81 K HN . 6851 1
744 . 1 1 81 81 LYS HA H 1 4.380 0.005 . . . . . . 81 K HA . 6851 1
745 . 1 1 81 81 LYS HB2 H 1 1.819 0.000 . . . . . . 81 K HB1 . 6851 1
746 . 1 1 81 81 LYS HB3 H 1 1.920 0.000 . . . . . . 81 K HB2 . 6851 1
747 . 1 1 81 81 LYS CA C 13 57.684 0.024 . . . . . . 81 K CA . 6851 1
748 . 1 1 81 81 LYS CB C 13 33.978 0.000 . . . . . . 81 K CB . 6851 1
749 . 1 1 81 81 LYS CG C 13 26.190 0.000 . . . . . . 81 K CG . 6851 1
750 . 1 1 81 81 LYS CD C 13 30.472 0.000 . . . . . . 81 K CD . 6851 1
751 . 1 1 81 81 LYS CE C 13 43.576 0.000 . . . . . . 81 K CE . 6851 1
752 . 1 1 81 81 LYS N N 15 120.937 0.040 . . . . . . 81 K N . 6851 1
753 . 1 1 82 82 GLY H H 1 8.539 0.003 . . . . . . 82 G HN . 6851 1
754 . 1 1 82 82 GLY HA2 H 1 3.999 0.002 . . . . . . 82 G QA . 6851 1
755 . 1 1 82 82 GLY HA3 H 1 3.999 0.002 . . . . . . 82 G QA . 6851 1
756 . 1 1 82 82 GLY CA C 13 46.505 0.062 . . . . . . 82 G CA . 6851 1
757 . 1 1 82 82 GLY N N 15 110.346 0.039 . . . . . . 82 G N . 6851 1
758 . 1 1 83 83 LYS H H 1 8.179 0.004 . . . . . . 83 K HN . 6851 1
759 . 1 1 83 83 LYS HA H 1 4.394 0.002 . . . . . . 83 K HA . 6851 1
760 . 1 1 83 83 LYS HB2 H 1 1.789 0.000 . . . . . . 83 K HB1 . 6851 1
761 . 1 1 83 83 LYS HB3 H 1 1.902 0.000 . . . . . . 83 K HB2 . 6851 1
762 . 1 1 83 83 LYS HG2 H 1 1.448 0.000 . . . . . . 83 K QG . 6851 1
763 . 1 1 83 83 LYS HG3 H 1 1.448 0.000 . . . . . . 83 K QG . 6851 1
764 . 1 1 83 83 LYS CA C 13 57.590 0.000 . . . . . . 83 K CA . 6851 1
765 . 1 1 83 83 LYS CB C 13 34.646 0.000 . . . . . . 83 K CB . 6851 1
766 . 1 1 83 83 LYS CG C 13 26.016 0.000 . . . . . . 83 K CG . 6851 1
767 . 1 1 83 83 LYS CD C 13 30.449 0.000 . . . . . . 83 K CD . 6851 1
768 . 1 1 83 83 LYS CE C 13 43.537 0.038 . . . . . . 83 K CE . 6851 1
769 . 1 1 83 83 LYS N N 15 121.415 0.017 . . . . . . 83 K N . 6851 1
770 . 1 1 84 84 LYS H H 1 8.082 0.007 . . . . . . 84 K HN . 6851 1
771 . 1 1 84 84 LYS HA H 1 4.192 0.000 . . . . . . 84 K HA . 6851 1
772 . 1 1 84 84 LYS CA C 13 59.345 0.000 . . . . . . 84 K CA . 6851 1
773 . 1 1 84 84 LYS CB C 13 34.795 0.000 . . . . . . 84 K CB . 6851 1
774 . 1 1 84 84 LYS N N 15 128.281 0.283 . . . . . . 84 K N . 6851 1
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