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 19646
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D HNCO' . . . 19646 1
2 '3D HNCA' . . . 19646 1
3 '3D HN(CO)CA' . . . 19646 1
4 '3D HNCACB' . . . 19646 1
5 '3D 15N HSQC-NOESY-15N HSQC' . . . 19646 1
6 '3D HN(CACO)NH' . . . 19646 1
7 '3D (H)CC(CO)NH' . . . 19646 1
8 '3D H(CCCO)NH' . . . 19646 1
9 '3D H(C)CH-TOCSY' . . . 19646 1
10 '2D constant-time 1H-13C HSQC' . . . 19646 1
11 '3D 1H-15N NOESY' . . . 19646 1
12 '3D 1H-13C NOESY' . . . 19646 1
29 '2D 1H-15N HSQC' . . . 19646 1
30 '2D 1H-13C HSQC' . . . 19646 1
31 '2D constant-time 1H-13C HSQC' . . . 19646 1
32 '2D 1H-13C HSQC' . . . 19646 1
33 '2D constant-time 1H-13C HSQC' . . . 19646 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 2 2 ALA HA H 1 4.314 0.003 . 1 . . . A 2 ALA HA . 19646 1
2 . 1 1 2 2 ALA HB1 H 1 1.369 0.003 . 1 . . . A 2 ALA HB1 . 19646 1
3 . 1 1 2 2 ALA HB2 H 1 1.369 0.003 . 1 . . . A 2 ALA HB2 . 19646 1
4 . 1 1 2 2 ALA HB3 H 1 1.369 0.003 . 1 . . . A 2 ALA HB3 . 19646 1
5 . 1 1 2 2 ALA CA C 13 52.571 0.037 . 1 . . . A 2 ALA CA . 19646 1
6 . 1 1 2 2 ALA CB C 13 19.315 0.000 . 1 . . . A 2 ALA CB . 19646 1
7 . 1 1 3 3 MET HA H 1 4.438 0.003 . 1 . . . A 3 MET HA . 19646 1
8 . 1 1 3 3 MET HB2 H 1 2.072 0.001 . 2 . . . A 3 MET HB2 . 19646 1
9 . 1 1 3 3 MET HB3 H 1 2.021 0.001 . 2 . . . A 3 MET HB3 . 19646 1
10 . 1 1 3 3 MET HG2 H 1 2.602 0.004 . 2 . . . A 3 MET HG2 . 19646 1
11 . 1 1 3 3 MET HG3 H 1 2.535 0.004 . 2 . . . A 3 MET HG3 . 19646 1
12 . 1 1 3 3 MET HE1 H 1 2.061 0.000 . 1 . . . A 3 MET HE1 . 19646 1
13 . 1 1 3 3 MET HE2 H 1 2.061 0.000 . 1 . . . A 3 MET HE2 . 19646 1
14 . 1 1 3 3 MET HE3 H 1 2.061 0.000 . 1 . . . A 3 MET HE3 . 19646 1
15 . 1 1 3 3 MET CA C 13 55.752 0.019 . 1 . . . A 3 MET CA . 19646 1
16 . 1 1 3 3 MET CB C 13 32.785 0.045 . 1 . . . A 3 MET CB . 19646 1
17 . 1 1 3 3 MET CG C 13 32.024 0.032 . 1 . . . A 3 MET CG . 19646 1
18 . 1 1 3 3 MET CE C 13 16.977 0.000 . 1 . . . A 3 MET CE . 19646 1
19 . 1 1 6 6 CYS H H 1 8.184 0.000 . 1 . . . A 6 CYS H . 19646 1
20 . 1 1 6 6 CYS N N 15 123.547 0.000 . 1 . . . A 6 CYS N . 19646 1
21 . 1 1 8 8 PRO HA H 1 4.565 0.000 . 1 . . . A 8 PRO HA . 19646 1
22 . 1 1 8 8 PRO HB2 H 1 2.323 0.000 . 2 . . . A 8 PRO HB2 . 19646 1
23 . 1 1 8 8 PRO HB3 H 1 1.922 0.000 . 2 . . . A 8 PRO HB3 . 19646 1
24 . 1 1 8 8 PRO HD2 H 1 3.791 0.003 . 2 . . . A 8 PRO HD2 . 19646 1
25 . 1 1 8 8 PRO HD3 H 1 3.555 0.008 . 2 . . . A 8 PRO HD3 . 19646 1
26 . 1 1 8 8 PRO CA C 13 62.078 0.000 . 1 . . . A 8 PRO CA . 19646 1
27 . 1 1 8 8 PRO CB C 13 30.636 0.004 . 1 . . . A 8 PRO CB . 19646 1
28 . 1 1 8 8 PRO CD C 13 50.454 0.002 . 1 . . . A 8 PRO CD . 19646 1
29 . 1 1 9 9 PRO HA H 1 4.564 0.005 . 1 . . . A 9 PRO HA . 19646 1
30 . 1 1 9 9 PRO HB2 H 1 2.305 0.007 . 2 . . . A 9 PRO HB2 . 19646 1
31 . 1 1 9 9 PRO HB3 H 1 2.152 0.005 . 2 . . . A 9 PRO HB3 . 19646 1
32 . 1 1 9 9 PRO HG2 H 1 2.008 0.002 . 2 . . . A 9 PRO HG2 . 19646 1
33 . 1 1 9 9 PRO HG3 H 1 1.437 0.009 . 2 . . . A 9 PRO HG3 . 19646 1
34 . 1 1 9 9 PRO HD2 H 1 3.524 0.004 . 2 . . . A 9 PRO HD2 . 19646 1
35 . 1 1 9 9 PRO HD3 H 1 3.480 0.003 . 2 . . . A 9 PRO HD3 . 19646 1
36 . 1 1 9 9 PRO CA C 13 64.007 0.019 . 1 . . . A 9 PRO CA . 19646 1
37 . 1 1 9 9 PRO CB C 13 33.632 0.063 . 1 . . . A 9 PRO CB . 19646 1
38 . 1 1 9 9 PRO CG C 13 24.545 0.037 . 1 . . . A 9 PRO CG . 19646 1
39 . 1 1 9 9 PRO CD C 13 49.539 0.037 . 1 . . . A 9 PRO CD . 19646 1
40 . 1 1 10 10 MET H H 1 8.759 0.003 . 1 . . . A 10 MET H . 19646 1
41 . 1 1 10 10 MET HA H 1 4.346 0.005 . 1 . . . A 10 MET HA . 19646 1
42 . 1 1 10 10 MET HB2 H 1 2.056 0.004 . 2 . . . A 10 MET HB2 . 19646 1
43 . 1 1 10 10 MET HB3 H 1 1.782 0.004 . 2 . . . A 10 MET HB3 . 19646 1
44 . 1 1 10 10 MET HG2 H 1 2.725 0.005 . 2 . . . A 10 MET HG2 . 19646 1
45 . 1 1 10 10 MET HG3 H 1 2.271 0.004 . 2 . . . A 10 MET HG3 . 19646 1
46 . 1 1 10 10 MET HE1 H 1 1.928 0.001 . 1 . . . A 10 MET HE1 . 19646 1
47 . 1 1 10 10 MET HE2 H 1 1.928 0.001 . 1 . . . A 10 MET HE2 . 19646 1
48 . 1 1 10 10 MET HE3 H 1 1.928 0.001 . 1 . . . A 10 MET HE3 . 19646 1
49 . 1 1 10 10 MET CA C 13 57.932 0.046 . 1 . . . A 10 MET CA . 19646 1
50 . 1 1 10 10 MET CB C 13 33.859 0.055 . 1 . . . A 10 MET CB . 19646 1
51 . 1 1 10 10 MET CG C 13 34.256 0.059 . 1 . . . A 10 MET CG . 19646 1
52 . 1 1 10 10 MET CE C 13 18.044 0.031 . 1 . . . A 10 MET CE . 19646 1
53 . 1 1 10 10 MET N N 15 123.176 0.055 . 1 . . . A 10 MET N . 19646 1
54 . 1 1 11 11 VAL H H 1 8.855 0.008 . 1 . . . A 11 VAL H . 19646 1
55 . 1 1 11 11 VAL HA H 1 4.301 0.003 . 1 . . . A 11 VAL HA . 19646 1
56 . 1 1 11 11 VAL HB H 1 1.974 0.004 . 1 . . . A 11 VAL HB . 19646 1
57 . 1 1 11 11 VAL HG11 H 1 0.887 0.003 . 2 . . . A 11 VAL HG11 . 19646 1
58 . 1 1 11 11 VAL HG12 H 1 0.887 0.003 . 2 . . . A 11 VAL HG12 . 19646 1
59 . 1 1 11 11 VAL HG13 H 1 0.887 0.003 . 2 . . . A 11 VAL HG13 . 19646 1
60 . 1 1 11 11 VAL HG21 H 1 0.825 0.007 . 2 . . . A 11 VAL HG21 . 19646 1
61 . 1 1 11 11 VAL HG22 H 1 0.825 0.007 . 2 . . . A 11 VAL HG22 . 19646 1
62 . 1 1 11 11 VAL HG23 H 1 0.825 0.007 . 2 . . . A 11 VAL HG23 . 19646 1
63 . 1 1 11 11 VAL CA C 13 59.732 0.009 . 1 . . . A 11 VAL CA . 19646 1
64 . 1 1 11 11 VAL CB C 13 35.145 0.041 . 1 . . . A 11 VAL CB . 19646 1
65 . 1 1 11 11 VAL CG1 C 13 21.357 0.035 . 2 . . . A 11 VAL CG1 . 19646 1
66 . 1 1 11 11 VAL CG2 C 13 19.573 0.105 . 2 . . . A 11 VAL CG2 . 19646 1
67 . 1 1 11 11 VAL N N 15 116.266 0.041 . 1 . . . A 11 VAL N . 19646 1
68 . 1 1 12 12 LYS H H 1 8.448 0.004 . 1 . . . A 12 LYS H . 19646 1
69 . 1 1 12 12 LYS HA H 1 4.371 0.007 . 1 . . . A 12 LYS HA . 19646 1
70 . 1 1 12 12 LYS HB2 H 1 1.770 0.006 . 2 . . . A 12 LYS HB2 . 19646 1
71 . 1 1 12 12 LYS HB3 H 1 1.605 0.005 . 2 . . . A 12 LYS HB3 . 19646 1
72 . 1 1 12 12 LYS HG2 H 1 1.242 0.006 . 2 . . . A 12 LYS HG2 . 19646 1
73 . 1 1 12 12 LYS HG3 H 1 1.210 0.003 . 2 . . . A 12 LYS HG3 . 19646 1
74 . 1 1 12 12 LYS CA C 13 56.715 0.031 . 1 . . . A 12 LYS CA . 19646 1
75 . 1 1 12 12 LYS CB C 13 33.170 0.042 . 1 . . . A 12 LYS CB . 19646 1
76 . 1 1 12 12 LYS CG C 13 25.207 0.045 . 1 . . . A 12 LYS CG . 19646 1
77 . 1 1 12 12 LYS N N 15 125.383 0.034 . 1 . . . A 12 LYS N . 19646 1
78 . 1 1 13 13 LEU H H 1 9.145 0.006 . 1 . . . A 13 LEU H . 19646 1
79 . 1 1 13 13 LEU HA H 1 4.549 0.005 . 1 . . . A 13 LEU HA . 19646 1
80 . 1 1 13 13 LEU HB2 H 1 1.919 0.007 . 2 . . . A 13 LEU HB2 . 19646 1
81 . 1 1 13 13 LEU HB3 H 1 1.498 0.006 . 2 . . . A 13 LEU HB3 . 19646 1
82 . 1 1 13 13 LEU HG H 1 1.592 0.004 . 1 . . . A 13 LEU HG . 19646 1
83 . 1 1 13 13 LEU HD11 H 1 0.865 0.003 . 2 . . . A 13 LEU HD11 . 19646 1
84 . 1 1 13 13 LEU HD12 H 1 0.865 0.003 . 2 . . . A 13 LEU HD12 . 19646 1
85 . 1 1 13 13 LEU HD13 H 1 0.865 0.003 . 2 . . . A 13 LEU HD13 . 19646 1
86 . 1 1 13 13 LEU HD21 H 1 0.901 0.002 . 2 . . . A 13 LEU HD21 . 19646 1
87 . 1 1 13 13 LEU HD22 H 1 0.901 0.002 . 2 . . . A 13 LEU HD22 . 19646 1
88 . 1 1 13 13 LEU HD23 H 1 0.901 0.002 . 2 . . . A 13 LEU HD23 . 19646 1
89 . 1 1 13 13 LEU CA C 13 54.112 0.019 . 1 . . . A 13 LEU CA . 19646 1
90 . 1 1 13 13 LEU CB C 13 43.288 0.034 . 1 . . . A 13 LEU CB . 19646 1
91 . 1 1 13 13 LEU CG C 13 28.227 0.037 . 1 . . . A 13 LEU CG . 19646 1
92 . 1 1 13 13 LEU CD1 C 13 24.974 0.043 . 2 . . . A 13 LEU CD1 . 19646 1
93 . 1 1 13 13 LEU CD2 C 13 25.383 0.035 . 2 . . . A 13 LEU CD2 . 19646 1
94 . 1 1 13 13 LEU N N 15 132.136 0.042 . 1 . . . A 13 LEU N . 19646 1
95 . 1 1 14 14 VAL H H 1 8.578 0.006 . 1 . . . A 14 VAL H . 19646 1
96 . 1 1 14 14 VAL HA H 1 4.149 0.008 . 1 . . . A 14 VAL HA . 19646 1
97 . 1 1 14 14 VAL HB H 1 1.931 0.003 . 1 . . . A 14 VAL HB . 19646 1
98 . 1 1 14 14 VAL HG11 H 1 0.860 0.004 . 2 . . . A 14 VAL HG11 . 19646 1
99 . 1 1 14 14 VAL HG12 H 1 0.860 0.004 . 2 . . . A 14 VAL HG12 . 19646 1
100 . 1 1 14 14 VAL HG13 H 1 0.860 0.004 . 2 . . . A 14 VAL HG13 . 19646 1
101 . 1 1 14 14 VAL HG21 H 1 0.864 0.005 . 2 . . . A 14 VAL HG21 . 19646 1
102 . 1 1 14 14 VAL HG22 H 1 0.864 0.005 . 2 . . . A 14 VAL HG22 . 19646 1
103 . 1 1 14 14 VAL HG23 H 1 0.864 0.005 . 2 . . . A 14 VAL HG23 . 19646 1
104 . 1 1 14 14 VAL CA C 13 61.132 0.036 . 1 . . . A 14 VAL CA . 19646 1
105 . 1 1 14 14 VAL CB C 13 32.365 0.006 . 1 . . . A 14 VAL CB . 19646 1
106 . 1 1 14 14 VAL CG1 C 13 20.987 0.039 . 2 . . . A 14 VAL CG1 . 19646 1
107 . 1 1 14 14 VAL CG2 C 13 20.981 0.008 . 2 . . . A 14 VAL CG2 . 19646 1
108 . 1 1 14 14 VAL N N 15 127.590 0.038 . 1 . . . A 14 VAL N . 19646 1
109 . 1 1 15 15 CYS H H 1 8.643 0.004 . 1 . . . A 15 CYS H . 19646 1
110 . 1 1 15 15 CYS HA H 1 4.291 0.005 . 1 . . . A 15 CYS HA . 19646 1
111 . 1 1 15 15 CYS HB2 H 1 2.962 0.006 . 2 . . . A 15 CYS HB2 . 19646 1
112 . 1 1 15 15 CYS HB3 H 1 2.691 0.007 . 2 . . . A 15 CYS HB3 . 19646 1
113 . 1 1 15 15 CYS CA C 13 56.014 0.000 . 1 . . . A 15 CYS CA . 19646 1
114 . 1 1 15 15 CYS CB C 13 40.082 0.029 . 1 . . . A 15 CYS CB . 19646 1
115 . 1 1 15 15 CYS N N 15 129.201 0.025 . 1 . . . A 15 CYS N . 19646 1
116 . 1 1 16 16 PRO HA H 1 4.497 0.003 . 1 . . . A 16 PRO HA . 19646 1
117 . 1 1 16 16 PRO HB2 H 1 2.290 0.011 . 2 . . . A 16 PRO HB2 . 19646 1
118 . 1 1 16 16 PRO HB3 H 1 2.100 0.005 . 2 . . . A 16 PRO HB3 . 19646 1
119 . 1 1 16 16 PRO HG2 H 1 2.154 0.012 . 2 . . . A 16 PRO HG2 . 19646 1
120 . 1 1 16 16 PRO HG3 H 1 2.062 0.013 . 2 . . . A 16 PRO HG3 . 19646 1
121 . 1 1 16 16 PRO HD2 H 1 3.801 0.008 . 2 . . . A 16 PRO HD2 . 19646 1
122 . 1 1 16 16 PRO HD3 H 1 3.613 0.007 . 2 . . . A 16 PRO HD3 . 19646 1
123 . 1 1 16 16 PRO CA C 13 62.350 0.034 . 1 . . . A 16 PRO CA . 19646 1
124 . 1 1 16 16 PRO CB C 13 32.151 0.045 . 1 . . . A 16 PRO CB . 19646 1
125 . 1 1 16 16 PRO CG C 13 27.459 0.041 . 1 . . . A 16 PRO CG . 19646 1
126 . 1 1 16 16 PRO CD C 13 50.442 0.012 . 1 . . . A 16 PRO CD . 19646 1
127 . 1 1 17 17 ALA H H 1 8.553 0.015 . 1 . . . A 17 ALA H . 19646 1
128 . 1 1 17 17 ALA HA H 1 4.120 0.004 . 1 . . . A 17 ALA HA . 19646 1
129 . 1 1 17 17 ALA HB1 H 1 1.376 0.004 . 1 . . . A 17 ALA HB1 . 19646 1
130 . 1 1 17 17 ALA HB2 H 1 1.376 0.004 . 1 . . . A 17 ALA HB2 . 19646 1
131 . 1 1 17 17 ALA HB3 H 1 1.376 0.004 . 1 . . . A 17 ALA HB3 . 19646 1
132 . 1 1 17 17 ALA CA C 13 53.417 0.060 . 1 . . . A 17 ALA CA . 19646 1
133 . 1 1 17 17 ALA CB C 13 18.882 0.151 . 1 . . . A 17 ALA CB . 19646 1
134 . 1 1 17 17 ALA N N 15 124.507 0.052 . 1 . . . A 17 ALA N . 19646 1
135 . 1 1 18 18 ASP H H 1 8.116 0.005 . 1 . . . A 18 ASP H . 19646 1
136 . 1 1 18 18 ASP HA H 1 4.505 0.004 . 1 . . . A 18 ASP HA . 19646 1
137 . 1 1 18 18 ASP HB2 H 1 2.748 0.005 . 2 . . . A 18 ASP HB2 . 19646 1
138 . 1 1 18 18 ASP HB3 H 1 2.635 0.004 . 2 . . . A 18 ASP HB3 . 19646 1
139 . 1 1 18 18 ASP CA C 13 53.654 0.012 . 1 . . . A 18 ASP CA . 19646 1
140 . 1 1 18 18 ASP CB C 13 40.387 0.050 . 1 . . . A 18 ASP CB . 19646 1
141 . 1 1 18 18 ASP N N 15 114.322 0.035 . 1 . . . A 18 ASP N . 19646 1
142 . 1 1 19 19 ASN H H 1 7.669 0.005 . 1 . . . A 19 ASN H . 19646 1
143 . 1 1 19 19 ASN HA H 1 4.656 0.007 . 1 . . . A 19 ASN HA . 19646 1
144 . 1 1 19 19 ASN HB2 H 1 2.809 0.004 . 2 . . . A 19 ASN HB2 . 19646 1
145 . 1 1 19 19 ASN HB3 H 1 2.813 0.000 . 2 . . . A 19 ASN HB3 . 19646 1
146 . 1 1 19 19 ASN HD21 H 1 7.623 0.005 . 1 . . . A 19 ASN HD21 . 19646 1
147 . 1 1 19 19 ASN HD22 H 1 6.892 0.002 . 1 . . . A 19 ASN HD22 . 19646 1
148 . 1 1 19 19 ASN CA C 13 53.230 0.034 . 1 . . . A 19 ASN CA . 19646 1
149 . 1 1 19 19 ASN CB C 13 38.076 0.028 . 1 . . . A 19 ASN CB . 19646 1
150 . 1 1 19 19 ASN N N 15 115.834 0.004 . 1 . . . A 19 ASN N . 19646 1
151 . 1 1 19 19 ASN ND2 N 15 111.505 0.026 . 1 . . . A 19 ASN ND2 . 19646 1
152 . 1 1 20 20 LEU HA H 1 4.287 0.005 . 1 . . . A 20 LEU HA . 19646 1
153 . 1 1 20 20 LEU HB2 H 1 1.659 0.002 . 2 . . . A 20 LEU HB2 . 19646 1
154 . 1 1 20 20 LEU HB3 H 1 1.596 0.003 . 2 . . . A 20 LEU HB3 . 19646 1
155 . 1 1 20 20 LEU HD11 H 1 0.918 0.008 . 2 . . . A 20 LEU HD11 . 19646 1
156 . 1 1 20 20 LEU HD12 H 1 0.918 0.008 . 2 . . . A 20 LEU HD12 . 19646 1
157 . 1 1 20 20 LEU HD13 H 1 0.918 0.008 . 2 . . . A 20 LEU HD13 . 19646 1
158 . 1 1 20 20 LEU HD21 H 1 0.847 0.006 . 2 . . . A 20 LEU HD21 . 19646 1
159 . 1 1 20 20 LEU HD22 H 1 0.847 0.006 . 2 . . . A 20 LEU HD22 . 19646 1
160 . 1 1 20 20 LEU HD23 H 1 0.847 0.006 . 2 . . . A 20 LEU HD23 . 19646 1
161 . 1 1 20 20 LEU CA C 13 55.807 0.021 . 1 . . . A 20 LEU CA . 19646 1
162 . 1 1 20 20 LEU CB C 13 41.758 0.035 . 1 . . . A 20 LEU CB . 19646 1
163 . 1 1 20 20 LEU CD1 C 13 25.022 0.002 . 2 . . . A 20 LEU CD1 . 19646 1
164 . 1 1 20 20 LEU CD2 C 13 23.143 0.040 . 2 . . . A 20 LEU CD2 . 19646 1
165 . 1 1 21 21 ARG H H 1 7.897 0.002 . 1 . . . A 21 ARG H . 19646 1
166 . 1 1 21 21 ARG HA H 1 4.303 0.004 . 1 . . . A 21 ARG HA . 19646 1
167 . 1 1 21 21 ARG HB2 H 1 1.946 0.004 . 2 . . . A 21 ARG HB2 . 19646 1
168 . 1 1 21 21 ARG HB3 H 1 1.736 0.004 . 2 . . . A 21 ARG HB3 . 19646 1
169 . 1 1 21 21 ARG HG2 H 1 1.642 0.003 . 2 . . . A 21 ARG HG2 . 19646 1
170 . 1 1 21 21 ARG HG3 H 1 1.540 0.005 . 2 . . . A 21 ARG HG3 . 19646 1
171 . 1 1 21 21 ARG HD2 H 1 3.180 0.003 . 2 . . . A 21 ARG HD2 . 19646 1
172 . 1 1 21 21 ARG HD3 H 1 3.182 0.000 . 2 . . . A 21 ARG HD3 . 19646 1
173 . 1 1 21 21 ARG CA C 13 55.632 0.020 . 1 . . . A 21 ARG CA . 19646 1
174 . 1 1 21 21 ARG CB C 13 29.732 0.032 . 1 . . . A 21 ARG CB . 19646 1
175 . 1 1 21 21 ARG CG C 13 27.129 0.031 . 1 . . . A 21 ARG CG . 19646 1
176 . 1 1 21 21 ARG CD C 13 43.128 0.046 . 1 . . . A 21 ARG CD . 19646 1
177 . 1 1 21 21 ARG N N 15 117.867 0.042 . 1 . . . A 21 ARG N . 19646 1
178 . 1 1 22 22 ALA H H 1 7.345 0.012 . 1 . . . A 22 ALA H . 19646 1
179 . 1 1 22 22 ALA HA H 1 4.215 0.003 . 1 . . . A 22 ALA HA . 19646 1
180 . 1 1 22 22 ALA HB1 H 1 1.349 0.006 . 1 . . . A 22 ALA HB1 . 19646 1
181 . 1 1 22 22 ALA HB2 H 1 1.349 0.006 . 1 . . . A 22 ALA HB2 . 19646 1
182 . 1 1 22 22 ALA HB3 H 1 1.349 0.006 . 1 . . . A 22 ALA HB3 . 19646 1
183 . 1 1 22 22 ALA CA C 13 52.261 0.046 . 1 . . . A 22 ALA CA . 19646 1
184 . 1 1 22 22 ALA CB C 13 20.466 0.035 . 1 . . . A 22 ALA CB . 19646 1
185 . 1 1 22 22 ALA N N 15 123.746 0.007 . 1 . . . A 22 ALA N . 19646 1
186 . 1 1 23 23 GLU H H 1 8.061 0.008 . 1 . . . A 23 GLU H . 19646 1
187 . 1 1 23 23 GLU HA H 1 4.542 0.009 . 1 . . . A 23 GLU HA . 19646 1
188 . 1 1 23 23 GLU HB2 H 1 2.273 0.001 . 2 . . . A 23 GLU HB2 . 19646 1
189 . 1 1 23 23 GLU HB3 H 1 1.885 0.010 . 2 . . . A 23 GLU HB3 . 19646 1
190 . 1 1 23 23 GLU HG2 H 1 2.131 0.017 . 2 . . . A 23 GLU HG2 . 19646 1
191 . 1 1 23 23 GLU HG3 H 1 1.710 0.005 . 2 . . . A 23 GLU HG3 . 19646 1
192 . 1 1 23 23 GLU CA C 13 56.544 0.050 . 1 . . . A 23 GLU CA . 19646 1
193 . 1 1 23 23 GLU N N 15 119.157 0.039 . 1 . . . A 23 GLU N . 19646 1
194 . 1 1 25 25 LEU HA H 1 4.315 0.003 . 1 . . . A 25 LEU HA . 19646 1
195 . 1 1 25 25 LEU HB2 H 1 1.666 0.000 . 2 . . . A 25 LEU HB2 . 19646 1
196 . 1 1 25 25 LEU HB3 H 1 1.576 0.000 . 2 . . . A 25 LEU HB3 . 19646 1
197 . 1 1 25 25 LEU HG H 1 1.600 0.000 . 1 . . . A 25 LEU HG . 19646 1
198 . 1 1 25 25 LEU HD11 H 1 0.895 0.001 . 2 . . . A 25 LEU HD11 . 19646 1
199 . 1 1 25 25 LEU HD12 H 1 0.895 0.001 . 2 . . . A 25 LEU HD12 . 19646 1
200 . 1 1 25 25 LEU HD13 H 1 0.895 0.001 . 2 . . . A 25 LEU HD13 . 19646 1
201 . 1 1 25 25 LEU HD21 H 1 0.835 0.001 . 2 . . . A 25 LEU HD21 . 19646 1
202 . 1 1 25 25 LEU HD22 H 1 0.835 0.001 . 2 . . . A 25 LEU HD22 . 19646 1
203 . 1 1 25 25 LEU HD23 H 1 0.835 0.001 . 2 . . . A 25 LEU HD23 . 19646 1
204 . 1 1 25 25 LEU CA C 13 55.313 0.013 . 1 . . . A 25 LEU CA . 19646 1
205 . 1 1 25 25 LEU CB C 13 42.152 0.007 . 1 . . . A 25 LEU CB . 19646 1
206 . 1 1 25 25 LEU CG C 13 26.986 0.000 . 1 . . . A 25 LEU CG . 19646 1
207 . 1 1 25 25 LEU CD1 C 13 25.081 0.002 . 2 . . . A 25 LEU CD1 . 19646 1
208 . 1 1 25 25 LEU CD2 C 13 23.503 0.008 . 2 . . . A 25 LEU CD2 . 19646 1
209 . 1 1 26 26 GLU H H 1 8.165 0.004 . 1 . . . A 26 GLU H . 19646 1
210 . 1 1 26 26 GLU N N 15 121.770 0.058 . 1 . . . A 26 GLU N . 19646 1
211 . 1 1 28 28 THR HB H 1 4.085 0.002 . 1 . . . A 28 THR HB . 19646 1
212 . 1 1 28 28 THR HG21 H 1 1.224 0.003 . 1 . . . A 28 THR HG21 . 19646 1
213 . 1 1 28 28 THR HG22 H 1 1.224 0.003 . 1 . . . A 28 THR HG22 . 19646 1
214 . 1 1 28 28 THR HG23 H 1 1.224 0.003 . 1 . . . A 28 THR HG23 . 19646 1
215 . 1 1 28 28 THR CB C 13 70.366 0.016 . 1 . . . A 28 THR CB . 19646 1
216 . 1 1 28 28 THR CG2 C 13 21.424 0.019 . 1 . . . A 28 THR CG2 . 19646 1
217 . 1 1 29 29 LYS H H 1 8.762 0.005 . 1 . . . A 29 LYS H . 19646 1
218 . 1 1 29 29 LYS HA H 1 5.059 0.004 . 1 . . . A 29 LYS HA . 19646 1
219 . 1 1 29 29 LYS HB2 H 1 1.863 0.002 . 2 . . . A 29 LYS HB2 . 19646 1
220 . 1 1 29 29 LYS HB3 H 1 1.845 0.003 . 2 . . . A 29 LYS HB3 . 19646 1
221 . 1 1 29 29 LYS HG2 H 1 1.655 0.003 . 2 . . . A 29 LYS HG2 . 19646 1
222 . 1 1 29 29 LYS HG3 H 1 1.621 0.004 . 2 . . . A 29 LYS HG3 . 19646 1
223 . 1 1 29 29 LYS HE2 H 1 2.925 0.004 . 2 . . . A 29 LYS HE2 . 19646 1
224 . 1 1 29 29 LYS HE3 H 1 2.928 0.000 . 2 . . . A 29 LYS HE3 . 19646 1
225 . 1 1 29 29 LYS CA C 13 54.874 0.015 . 1 . . . A 29 LYS CA . 19646 1
226 . 1 1 29 29 LYS CB C 13 34.598 0.032 . 1 . . . A 29 LYS CB . 19646 1
227 . 1 1 29 29 LYS CG C 13 24.691 0.015 . 1 . . . A 29 LYS CG . 19646 1
228 . 1 1 29 29 LYS CE C 13 42.477 0.027 . 1 . . . A 29 LYS CE . 19646 1
229 . 1 1 29 29 LYS N N 15 128.269 0.040 . 1 . . . A 29 LYS N . 19646 1
230 . 1 1 30 30 THR H H 1 9.410 0.004 . 1 . . . A 30 THR H . 19646 1
231 . 1 1 30 30 THR HA H 1 5.450 0.006 . 1 . . . A 30 THR HA . 19646 1
232 . 1 1 30 30 THR HB H 1 4.953 0.006 . 1 . . . A 30 THR HB . 19646 1
233 . 1 1 30 30 THR HG21 H 1 1.217 0.003 . 1 . . . A 30 THR HG21 . 19646 1
234 . 1 1 30 30 THR HG22 H 1 1.217 0.003 . 1 . . . A 30 THR HG22 . 19646 1
235 . 1 1 30 30 THR HG23 H 1 1.217 0.003 . 1 . . . A 30 THR HG23 . 19646 1
236 . 1 1 30 30 THR CA C 13 58.958 0.026 . 1 . . . A 30 THR CA . 19646 1
237 . 1 1 30 30 THR CB C 13 72.724 0.039 . 1 . . . A 30 THR CB . 19646 1
238 . 1 1 30 30 THR CG2 C 13 21.387 0.034 . 1 . . . A 30 THR CG2 . 19646 1
239 . 1 1 30 30 THR N N 15 116.019 0.037 . 1 . . . A 30 THR N . 19646 1
240 . 1 1 31 31 CYS H H 1 8.587 0.005 . 1 . . . A 31 CYS H . 19646 1
241 . 1 1 31 31 CYS HA H 1 4.376 0.003 . 1 . . . A 31 CYS HA . 19646 1
242 . 1 1 31 31 CYS HB2 H 1 3.181 0.003 . 2 . . . A 31 CYS HB2 . 19646 1
243 . 1 1 31 31 CYS HB3 H 1 3.034 0.005 . 2 . . . A 31 CYS HB3 . 19646 1
244 . 1 1 31 31 CYS CA C 13 57.480 0.072 . 1 . . . A 31 CYS CA . 19646 1
245 . 1 1 31 31 CYS CB C 13 36.316 0.037 . 1 . . . A 31 CYS CB . 19646 1
246 . 1 1 31 31 CYS N N 15 115.821 0.026 . 1 . . . A 31 CYS N . 19646 1
247 . 1 1 32 32 GLN H H 1 8.303 0.004 . 1 . . . A 32 GLN H . 19646 1
248 . 1 1 32 32 GLN HA H 1 4.127 0.003 . 1 . . . A 32 GLN HA . 19646 1
249 . 1 1 32 32 GLN HB2 H 1 1.945 0.004 . 2 . . . A 32 GLN HB2 . 19646 1
250 . 1 1 32 32 GLN HB3 H 1 1.863 0.003 . 2 . . . A 32 GLN HB3 . 19646 1
251 . 1 1 32 32 GLN HG2 H 1 2.155 0.007 . 2 . . . A 32 GLN HG2 . 19646 1
252 . 1 1 32 32 GLN HG3 H 1 2.162 0.001 . 2 . . . A 32 GLN HG3 . 19646 1
253 . 1 1 32 32 GLN HE21 H 1 7.329 0.004 . 1 . . . A 32 GLN HE21 . 19646 1
254 . 1 1 32 32 GLN HE22 H 1 6.751 0.002 . 1 . . . A 32 GLN HE22 . 19646 1
255 . 1 1 32 32 GLN CA C 13 58.102 0.038 . 1 . . . A 32 GLN CA . 19646 1
256 . 1 1 32 32 GLN CB C 13 29.341 0.052 . 1 . . . A 32 GLN CB . 19646 1
257 . 1 1 32 32 GLN CG C 13 34.424 0.065 . 1 . . . A 32 GLN CG . 19646 1
258 . 1 1 32 32 GLN N N 15 115.926 0.043 . 1 . . . A 32 GLN N . 19646 1
259 . 1 1 32 32 GLN NE2 N 15 111.938 0.031 . 1 . . . A 32 GLN NE2 . 19646 1
260 . 1 1 33 33 ASN H H 1 7.925 0.006 . 1 . . . A 33 ASN H . 19646 1
261 . 1 1 33 33 ASN HA H 1 4.760 0.006 . 1 . . . A 33 ASN HA . 19646 1
262 . 1 1 33 33 ASN HB2 H 1 3.316 0.007 . 2 . . . A 33 ASN HB2 . 19646 1
263 . 1 1 33 33 ASN HB3 H 1 2.628 0.006 . 2 . . . A 33 ASN HB3 . 19646 1
264 . 1 1 33 33 ASN HD21 H 1 7.396 0.005 . 1 . . . A 33 ASN HD21 . 19646 1
265 . 1 1 33 33 ASN HD22 H 1 7.010 0.009 . 1 . . . A 33 ASN HD22 . 19646 1
266 . 1 1 33 33 ASN CA C 13 51.927 0.000 . 1 . . . A 33 ASN CA . 19646 1
267 . 1 1 33 33 ASN CB C 13 39.325 0.039 . 1 . . . A 33 ASN CB . 19646 1
268 . 1 1 33 33 ASN N N 15 117.107 0.053 . 1 . . . A 33 ASN N . 19646 1
269 . 1 1 33 33 ASN ND2 N 15 108.104 0.062 . 1 . . . A 33 ASN ND2 . 19646 1
270 . 1 1 34 34 TYR H H 1 7.310 0.003 . 1 . . . A 34 TYR H . 19646 1
271 . 1 1 34 34 TYR HA H 1 3.885 0.007 . 1 . . . A 34 TYR HA . 19646 1
272 . 1 1 34 34 TYR HB2 H 1 3.384 0.004 . 2 . . . A 34 TYR HB2 . 19646 1
273 . 1 1 34 34 TYR HB3 H 1 2.739 0.007 . 2 . . . A 34 TYR HB3 . 19646 1
274 . 1 1 34 34 TYR HD1 H 1 6.952 0.005 . 3 . . . A 34 TYR HD1 . 19646 1
275 . 1 1 34 34 TYR HD2 H 1 6.952 0.005 . 3 . . . A 34 TYR HD2 . 19646 1
276 . 1 1 34 34 TYR HE1 H 1 6.702 0.003 . 3 . . . A 34 TYR HE1 . 19646 1
277 . 1 1 34 34 TYR HE2 H 1 6.702 0.003 . 3 . . . A 34 TYR HE2 . 19646 1
278 . 1 1 34 34 TYR CA C 13 63.779 0.033 . 1 . . . A 34 TYR CA . 19646 1
279 . 1 1 34 34 TYR CB C 13 39.078 0.046 . 1 . . . A 34 TYR CB . 19646 1
280 . 1 1 34 34 TYR CD1 C 13 133.344 0.060 . 3 . . . A 34 TYR CD1 . 19646 1
281 . 1 1 34 34 TYR CD2 C 13 133.344 0.060 . 3 . . . A 34 TYR CD2 . 19646 1
282 . 1 1 34 34 TYR CE1 C 13 118.227 0.087 . 3 . . . A 34 TYR CE1 . 19646 1
283 . 1 1 34 34 TYR CE2 C 13 118.227 0.087 . 3 . . . A 34 TYR CE2 . 19646 1
284 . 1 1 34 34 TYR N N 15 120.190 0.033 . 1 . . . A 34 TYR N . 19646 1
285 . 1 1 35 35 ASP H H 1 8.291 0.003 . 1 . . . A 35 ASP H . 19646 1
286 . 1 1 35 35 ASP HA H 1 4.507 0.003 . 1 . . . A 35 ASP HA . 19646 1
287 . 1 1 35 35 ASP HB2 H 1 2.793 0.010 . 2 . . . A 35 ASP HB2 . 19646 1
288 . 1 1 35 35 ASP HB3 H 1 2.472 0.003 . 2 . . . A 35 ASP HB3 . 19646 1
289 . 1 1 35 35 ASP CA C 13 54.482 0.063 . 1 . . . A 35 ASP CA . 19646 1
290 . 1 1 35 35 ASP CB C 13 41.078 0.046 . 1 . . . A 35 ASP CB . 19646 1
291 . 1 1 35 35 ASP N N 15 113.579 0.032 . 1 . . . A 35 ASP N . 19646 1
292 . 1 1 36 36 LEU H H 1 7.787 0.004 . 1 . . . A 36 LEU H . 19646 1
293 . 1 1 36 36 LEU HA H 1 4.406 0.004 . 1 . . . A 36 LEU HA . 19646 1
294 . 1 1 36 36 LEU HB2 H 1 1.742 0.004 . 2 . . . A 36 LEU HB2 . 19646 1
295 . 1 1 36 36 LEU HB3 H 1 1.490 0.003 . 2 . . . A 36 LEU HB3 . 19646 1
296 . 1 1 36 36 LEU HG H 1 1.566 0.004 . 1 . . . A 36 LEU HG . 19646 1
297 . 1 1 36 36 LEU HD11 H 1 0.912 0.004 . 2 . . . A 36 LEU HD11 . 19646 1
298 . 1 1 36 36 LEU HD12 H 1 0.912 0.004 . 2 . . . A 36 LEU HD12 . 19646 1
299 . 1 1 36 36 LEU HD13 H 1 0.912 0.004 . 2 . . . A 36 LEU HD13 . 19646 1
300 . 1 1 36 36 LEU HD21 H 1 0.813 0.005 . 2 . . . A 36 LEU HD21 . 19646 1
301 . 1 1 36 36 LEU HD22 H 1 0.813 0.005 . 2 . . . A 36 LEU HD22 . 19646 1
302 . 1 1 36 36 LEU HD23 H 1 0.813 0.005 . 2 . . . A 36 LEU HD23 . 19646 1
303 . 1 1 36 36 LEU CA C 13 53.959 0.018 . 1 . . . A 36 LEU CA . 19646 1
304 . 1 1 36 36 LEU CB C 13 42.569 0.050 . 1 . . . A 36 LEU CB . 19646 1
305 . 1 1 36 36 LEU CG C 13 26.865 0.017 . 1 . . . A 36 LEU CG . 19646 1
306 . 1 1 36 36 LEU CD1 C 13 25.304 0.021 . 2 . . . A 36 LEU CD1 . 19646 1
307 . 1 1 36 36 LEU CD2 C 13 22.659 0.026 . 2 . . . A 36 LEU CD2 . 19646 1
308 . 1 1 36 36 LEU N N 15 120.878 0.042 . 1 . . . A 36 LEU N . 19646 1
309 . 1 1 37 37 GLU H H 1 8.490 0.005 . 1 . . . A 37 GLU H . 19646 1
310 . 1 1 37 37 GLU HA H 1 4.120 0.005 . 1 . . . A 37 GLU HA . 19646 1
311 . 1 1 37 37 GLU HB2 H 1 1.909 0.001 . 2 . . . A 37 GLU HB2 . 19646 1
312 . 1 1 37 37 GLU HB3 H 1 1.863 0.003 . 2 . . . A 37 GLU HB3 . 19646 1
313 . 1 1 37 37 GLU HG2 H 1 2.241 0.004 . 2 . . . A 37 GLU HG2 . 19646 1
314 . 1 1 37 37 GLU HG3 H 1 2.168 0.002 . 2 . . . A 37 GLU HG3 . 19646 1
315 . 1 1 37 37 GLU CA C 13 56.295 0.037 . 1 . . . A 37 GLU CA . 19646 1
316 . 1 1 37 37 GLU CB C 13 30.252 0.013 . 1 . . . A 37 GLU CB . 19646 1
317 . 1 1 37 37 GLU CG C 13 36.298 0.023 . 1 . . . A 37 GLU CG . 19646 1
318 . 1 1 37 37 GLU N N 15 122.509 0.035 . 1 . . . A 37 GLU N . 19646 1
319 . 1 1 39 39 MET HA H 1 4.588 0.009 . 1 . . . A 39 MET HA . 19646 1
320 . 1 1 39 39 MET HB2 H 1 2.008 0.001 . 2 . . . A 39 MET HB2 . 19646 1
321 . 1 1 39 39 MET HB3 H 1 1.925 0.001 . 2 . . . A 39 MET HB3 . 19646 1
322 . 1 1 39 39 MET HG2 H 1 2.498 0.001 . 2 . . . A 39 MET HG2 . 19646 1
323 . 1 1 39 39 MET HG3 H 1 2.414 0.002 . 2 . . . A 39 MET HG3 . 19646 1
324 . 1 1 39 39 MET CA C 13 54.180 0.000 . 1 . . . A 39 MET CA . 19646 1
325 . 1 1 39 39 MET CB C 13 31.754 0.009 . 1 . . . A 39 MET CB . 19646 1
326 . 1 1 39 39 MET CG C 13 32.049 0.002 . 1 . . . A 39 MET CG . 19646 1
327 . 1 1 40 40 SER H H 1 8.374 0.005 . 1 . . . A 40 SER H . 19646 1
328 . 1 1 40 40 SER HA H 1 4.288 0.002 . 1 . . . A 40 SER HA . 19646 1
329 . 1 1 40 40 SER HB2 H 1 3.924 0.005 . 2 . . . A 40 SER HB2 . 19646 1
330 . 1 1 40 40 SER HB3 H 1 3.698 0.002 . 2 . . . A 40 SER HB3 . 19646 1
331 . 1 1 40 40 SER CA C 13 58.207 0.030 . 1 . . . A 40 SER CA . 19646 1
332 . 1 1 40 40 SER CB C 13 63.324 0.018 . 1 . . . A 40 SER CB . 19646 1
333 . 1 1 40 40 SER N N 15 118.194 0.028 . 1 . . . A 40 SER N . 19646 1
334 . 1 1 41 41 MET HA H 1 4.677 0.001 . 1 . . . A 41 MET HA . 19646 1
335 . 1 1 41 41 MET HG2 H 1 2.687 0.000 . 2 . . . A 41 MET HG2 . 19646 1
336 . 1 1 41 41 MET HG3 H 1 2.491 0.002 . 2 . . . A 41 MET HG3 . 19646 1
337 . 1 1 41 41 MET CA C 13 54.482 0.000 . 1 . . . A 41 MET CA . 19646 1
338 . 1 1 41 41 MET CG C 13 32.366 0.033 . 1 . . . A 41 MET CG . 19646 1
339 . 1 1 42 42 GLY H H 1 8.035 0.003 . 1 . . . A 42 GLY H . 19646 1
340 . 1 1 42 42 GLY HA2 H 1 4.081 0.007 . 2 . . . A 42 GLY HA2 . 19646 1
341 . 1 1 42 42 GLY HA3 H 1 3.601 0.004 . 2 . . . A 42 GLY HA3 . 19646 1
342 . 1 1 42 42 GLY CA C 13 45.423 0.041 . 1 . . . A 42 GLY CA . 19646 1
343 . 1 1 42 42 GLY N N 15 111.120 0.027 . 1 . . . A 42 GLY N . 19646 1
344 . 1 1 43 43 CYS H H 1 8.463 0.004 . 1 . . . A 43 CYS H . 19646 1
345 . 1 1 43 43 CYS HA H 1 4.556 0.002 . 1 . . . A 43 CYS HA . 19646 1
346 . 1 1 43 43 CYS HB2 H 1 3.105 0.010 . 2 . . . A 43 CYS HB2 . 19646 1
347 . 1 1 43 43 CYS HB3 H 1 2.843 0.003 . 2 . . . A 43 CYS HB3 . 19646 1
348 . 1 1 43 43 CYS CB C 13 38.600 0.042 . 1 . . . A 43 CYS CB . 19646 1
349 . 1 1 43 43 CYS N N 15 126.270 0.086 . 1 . . . A 43 CYS N . 19646 1
350 . 1 1 44 44 VAL HA H 1 4.218 0.003 . 1 . . . A 44 VAL HA . 19646 1
351 . 1 1 44 44 VAL HB H 1 2.007 0.003 . 1 . . . A 44 VAL HB . 19646 1
352 . 1 1 44 44 VAL HG11 H 1 1.055 0.003 . 2 . . . A 44 VAL HG11 . 19646 1
353 . 1 1 44 44 VAL HG12 H 1 1.055 0.003 . 2 . . . A 44 VAL HG12 . 19646 1
354 . 1 1 44 44 VAL HG13 H 1 1.055 0.003 . 2 . . . A 44 VAL HG13 . 19646 1
355 . 1 1 44 44 VAL HG21 H 1 1.029 0.001 . 2 . . . A 44 VAL HG21 . 19646 1
356 . 1 1 44 44 VAL HG22 H 1 1.029 0.001 . 2 . . . A 44 VAL HG22 . 19646 1
357 . 1 1 44 44 VAL HG23 H 1 1.029 0.001 . 2 . . . A 44 VAL HG23 . 19646 1
358 . 1 1 44 44 VAL CA C 13 62.334 0.024 . 1 . . . A 44 VAL CA . 19646 1
359 . 1 1 44 44 VAL CB C 13 34.050 0.063 . 1 . . . A 44 VAL CB . 19646 1
360 . 1 1 44 44 VAL CG1 C 13 21.145 0.030 . 2 . . . A 44 VAL CG1 . 19646 1
361 . 1 1 44 44 VAL CG2 C 13 21.330 0.055 . 2 . . . A 44 VAL CG2 . 19646 1
362 . 1 1 45 45 SER H H 1 8.484 0.003 . 1 . . . A 45 SER H . 19646 1
363 . 1 1 45 45 SER HA H 1 4.528 0.005 . 1 . . . A 45 SER HA . 19646 1
364 . 1 1 45 45 SER HB2 H 1 4.186 0.005 . 2 . . . A 45 SER HB2 . 19646 1
365 . 1 1 45 45 SER HB3 H 1 3.848 0.007 . 2 . . . A 45 SER HB3 . 19646 1
366 . 1 1 45 45 SER CA C 13 59.211 0.043 . 1 . . . A 45 SER CA . 19646 1
367 . 1 1 45 45 SER CB C 13 64.191 0.051 . 1 . . . A 45 SER CB . 19646 1
368 . 1 1 45 45 SER N N 15 126.084 0.037 . 1 . . . A 45 SER N . 19646 1
369 . 1 1 46 46 GLY H H 1 8.516 0.004 . 1 . . . A 46 GLY H . 19646 1
370 . 1 1 46 46 GLY HA2 H 1 4.320 0.006 . 2 . . . A 46 GLY HA2 . 19646 1
371 . 1 1 46 46 GLY HA3 H 1 3.916 0.009 . 2 . . . A 46 GLY HA3 . 19646 1
372 . 1 1 46 46 GLY CA C 13 45.758 0.085 . 1 . . . A 46 GLY CA . 19646 1
373 . 1 1 46 46 GLY N N 15 107.758 0.051 . 1 . . . A 46 GLY N . 19646 1
374 . 1 1 47 47 CYS H H 1 8.554 0.007 . 1 . . . A 47 CYS H . 19646 1
375 . 1 1 47 47 CYS HA H 1 5.227 0.008 . 1 . . . A 47 CYS HA . 19646 1
376 . 1 1 47 47 CYS HB2 H 1 2.825 0.007 . 2 . . . A 47 CYS HB2 . 19646 1
377 . 1 1 47 47 CYS HB3 H 1 2.798 0.003 . 2 . . . A 47 CYS HB3 . 19646 1
378 . 1 1 47 47 CYS CA C 13 54.413 0.038 . 1 . . . A 47 CYS CA . 19646 1
379 . 1 1 47 47 CYS CB C 13 41.276 0.009 . 1 . . . A 47 CYS CB . 19646 1
380 . 1 1 47 47 CYS N N 15 120.532 0.019 . 1 . . . A 47 CYS N . 19646 1
381 . 1 1 48 48 LEU H H 1 9.410 0.004 . 1 . . . A 48 LEU H . 19646 1
382 . 1 1 48 48 LEU HA H 1 4.686 0.007 . 1 . . . A 48 LEU HA . 19646 1
383 . 1 1 48 48 LEU HB2 H 1 1.737 0.005 . 2 . . . A 48 LEU HB2 . 19646 1
384 . 1 1 48 48 LEU HB3 H 1 1.600 0.003 . 2 . . . A 48 LEU HB3 . 19646 1
385 . 1 1 48 48 LEU HG H 1 1.748 0.004 . 1 . . . A 48 LEU HG . 19646 1
386 . 1 1 48 48 LEU HD11 H 1 0.883 0.004 . 2 . . . A 48 LEU HD11 . 19646 1
387 . 1 1 48 48 LEU HD12 H 1 0.883 0.004 . 2 . . . A 48 LEU HD12 . 19646 1
388 . 1 1 48 48 LEU HD13 H 1 0.883 0.004 . 2 . . . A 48 LEU HD13 . 19646 1
389 . 1 1 48 48 LEU HD21 H 1 0.834 0.004 . 2 . . . A 48 LEU HD21 . 19646 1
390 . 1 1 48 48 LEU HD22 H 1 0.834 0.004 . 2 . . . A 48 LEU HD22 . 19646 1
391 . 1 1 48 48 LEU HD23 H 1 0.834 0.004 . 2 . . . A 48 LEU HD23 . 19646 1
392 . 1 1 48 48 LEU CA C 13 53.774 0.017 . 1 . . . A 48 LEU CA . 19646 1
393 . 1 1 48 48 LEU CB C 13 45.572 0.041 . 1 . . . A 48 LEU CB . 19646 1
394 . 1 1 48 48 LEU CG C 13 27.044 0.038 . 1 . . . A 48 LEU CG . 19646 1
395 . 1 1 48 48 LEU CD1 C 13 25.905 0.029 . 2 . . . A 48 LEU CD1 . 19646 1
396 . 1 1 48 48 LEU CD2 C 13 24.858 0.065 . 2 . . . A 48 LEU CD2 . 19646 1
397 . 1 1 48 48 LEU N N 15 125.794 0.035 . 1 . . . A 48 LEU N . 19646 1
398 . 1 1 49 49 CYS H H 1 9.188 0.010 . 1 . . . A 49 CYS H . 19646 1
399 . 1 1 49 49 CYS HA H 1 4.522 0.000 . 1 . . . A 49 CYS HA . 19646 1
400 . 1 1 49 49 CYS HB2 H 1 2.271 0.004 . 2 . . . A 49 CYS HB2 . 19646 1
401 . 1 1 49 49 CYS HB3 H 1 2.144 0.004 . 2 . . . A 49 CYS HB3 . 19646 1
402 . 1 1 49 49 CYS CA C 13 54.090 0.000 . 1 . . . A 49 CYS CA . 19646 1
403 . 1 1 49 49 CYS CB C 13 36.633 0.045 . 1 . . . A 49 CYS CB . 19646 1
404 . 1 1 49 49 CYS N N 15 119.162 0.032 . 1 . . . A 49 CYS N . 19646 1
405 . 1 1 52 52 GLY HA2 H 1 4.328 0.009 . 2 . . . A 52 GLY HA2 . 19646 1
406 . 1 1 52 52 GLY HA3 H 1 3.662 0.002 . 2 . . . A 52 GLY HA3 . 19646 1
407 . 1 1 52 52 GLY CA C 13 44.936 0.017 . 1 . . . A 52 GLY CA . 19646 1
408 . 1 1 53 53 MET H H 1 8.297 0.004 . 1 . . . A 53 MET H . 19646 1
409 . 1 1 53 53 MET HA H 1 5.043 0.008 . 1 . . . A 53 MET HA . 19646 1
410 . 1 1 53 53 MET HB2 H 1 1.957 0.011 . 2 . . . A 53 MET HB2 . 19646 1
411 . 1 1 53 53 MET HB3 H 1 1.755 0.007 . 2 . . . A 53 MET HB3 . 19646 1
412 . 1 1 53 53 MET HG2 H 1 2.447 0.004 . 2 . . . A 53 MET HG2 . 19646 1
413 . 1 1 53 53 MET HG3 H 1 2.050 0.006 . 2 . . . A 53 MET HG3 . 19646 1
414 . 1 1 53 53 MET HE1 H 1 1.933 0.002 . 1 . . . A 53 MET HE1 . 19646 1
415 . 1 1 53 53 MET HE2 H 1 1.933 0.002 . 1 . . . A 53 MET HE2 . 19646 1
416 . 1 1 53 53 MET HE3 H 1 1.933 0.002 . 1 . . . A 53 MET HE3 . 19646 1
417 . 1 1 53 53 MET CA C 13 54.425 0.064 . 1 . . . A 53 MET CA . 19646 1
418 . 1 1 53 53 MET CB C 13 37.090 0.025 . 1 . . . A 53 MET CB . 19646 1
419 . 1 1 53 53 MET CG C 13 33.534 0.048 . 1 . . . A 53 MET CG . 19646 1
420 . 1 1 53 53 MET CE C 13 18.403 0.089 . 1 . . . A 53 MET CE . 19646 1
421 . 1 1 53 53 MET N N 15 118.736 0.031 . 1 . . . A 53 MET N . 19646 1
422 . 1 1 54 54 VAL H H 1 9.126 0.005 . 1 . . . A 54 VAL H . 19646 1
423 . 1 1 54 54 VAL HA H 1 4.576 0.006 . 1 . . . A 54 VAL HA . 19646 1
424 . 1 1 54 54 VAL HB H 1 1.825 0.004 . 1 . . . A 54 VAL HB . 19646 1
425 . 1 1 54 54 VAL HG11 H 1 0.734 0.004 . 2 . . . A 54 VAL HG11 . 19646 1
426 . 1 1 54 54 VAL HG12 H 1 0.734 0.004 . 2 . . . A 54 VAL HG12 . 19646 1
427 . 1 1 54 54 VAL HG13 H 1 0.734 0.004 . 2 . . . A 54 VAL HG13 . 19646 1
428 . 1 1 54 54 VAL HG21 H 1 0.571 0.004 . 2 . . . A 54 VAL HG21 . 19646 1
429 . 1 1 54 54 VAL HG22 H 1 0.571 0.004 . 2 . . . A 54 VAL HG22 . 19646 1
430 . 1 1 54 54 VAL HG23 H 1 0.571 0.004 . 2 . . . A 54 VAL HG23 . 19646 1
431 . 1 1 54 54 VAL CA C 13 58.879 0.039 . 1 . . . A 54 VAL CA . 19646 1
432 . 1 1 54 54 VAL CB C 13 35.361 0.046 . 1 . . . A 54 VAL CB . 19646 1
433 . 1 1 54 54 VAL CG1 C 13 23.542 0.029 . 2 . . . A 54 VAL CG1 . 19646 1
434 . 1 1 54 54 VAL CG2 C 13 19.578 0.023 . 2 . . . A 54 VAL CG2 . 19646 1
435 . 1 1 54 54 VAL N N 15 113.319 0.052 . 1 . . . A 54 VAL N . 19646 1
436 . 1 1 55 55 ARG H H 1 8.490 0.005 . 1 . . . A 55 ARG H . 19646 1
437 . 1 1 55 55 ARG HA H 1 4.980 0.005 . 1 . . . A 55 ARG HA . 19646 1
438 . 1 1 55 55 ARG HB2 H 1 1.821 0.002 . 2 . . . A 55 ARG HB2 . 19646 1
439 . 1 1 55 55 ARG HB3 H 1 1.776 0.004 . 2 . . . A 55 ARG HB3 . 19646 1
440 . 1 1 55 55 ARG HG2 H 1 1.633 0.003 . 2 . . . A 55 ARG HG2 . 19646 1
441 . 1 1 55 55 ARG HG3 H 1 1.520 0.005 . 2 . . . A 55 ARG HG3 . 19646 1
442 . 1 1 55 55 ARG HD2 H 1 3.112 0.006 . 2 . . . A 55 ARG HD2 . 19646 1
443 . 1 1 55 55 ARG HD3 H 1 3.075 0.003 . 2 . . . A 55 ARG HD3 . 19646 1
444 . 1 1 55 55 ARG CA C 13 55.602 0.041 . 1 . . . A 55 ARG CA . 19646 1
445 . 1 1 55 55 ARG CB C 13 31.287 0.030 . 1 . . . A 55 ARG CB . 19646 1
446 . 1 1 55 55 ARG CG C 13 27.370 0.045 . 1 . . . A 55 ARG CG . 19646 1
447 . 1 1 55 55 ARG CD C 13 43.535 0.038 . 1 . . . A 55 ARG CD . 19646 1
448 . 1 1 55 55 ARG N N 15 122.532 0.038 . 1 . . . A 55 ARG N . 19646 1
449 . 1 1 56 56 HIS H H 1 9.100 0.009 . 1 . . . A 56 HIS H . 19646 1
450 . 1 1 56 56 HIS HA H 1 4.858 0.006 . 1 . . . A 56 HIS HA . 19646 1
451 . 1 1 56 56 HIS HB2 H 1 3.006 0.004 . 2 . . . A 56 HIS HB2 . 19646 1
452 . 1 1 56 56 HIS HB3 H 1 2.840 0.007 . 2 . . . A 56 HIS HB3 . 19646 1
453 . 1 1 56 56 HIS HD2 H 1 6.896 0.007 . 1 . . . A 56 HIS HD2 . 19646 1
454 . 1 1 56 56 HIS HE1 H 1 7.793 0.004 . 1 . . . A 56 HIS HE1 . 19646 1
455 . 1 1 56 56 HIS CA C 13 56.971 0.057 . 1 . . . A 56 HIS CA . 19646 1
456 . 1 1 56 56 HIS CB C 13 34.758 0.033 . 1 . . . A 56 HIS CB . 19646 1
457 . 1 1 56 56 HIS CD2 C 13 117.027 0.038 . 1 . . . A 56 HIS CD2 . 19646 1
458 . 1 1 56 56 HIS CE1 C 13 138.910 0.035 . 1 . . . A 56 HIS CE1 . 19646 1
459 . 1 1 56 56 HIS N N 15 126.203 0.043 . 1 . . . A 56 HIS N . 19646 1
460 . 1 1 57 57 GLU H H 1 8.953 0.007 . 1 . . . A 57 GLU H . 19646 1
461 . 1 1 57 57 GLU HA H 1 3.563 0.004 . 1 . . . A 57 GLU HA . 19646 1
462 . 1 1 57 57 GLU HB2 H 1 1.915 0.002 . 2 . . . A 57 GLU HB2 . 19646 1
463 . 1 1 57 57 GLU HB3 H 1 1.893 0.005 . 2 . . . A 57 GLU HB3 . 19646 1
464 . 1 1 57 57 GLU HG2 H 1 1.714 0.006 . 2 . . . A 57 GLU HG2 . 19646 1
465 . 1 1 57 57 GLU HG3 H 1 1.587 0.004 . 2 . . . A 57 GLU HG3 . 19646 1
466 . 1 1 57 57 GLU CA C 13 57.676 0.025 . 1 . . . A 57 GLU CA . 19646 1
467 . 1 1 57 57 GLU CB C 13 26.921 0.032 . 1 . . . A 57 GLU CB . 19646 1
468 . 1 1 57 57 GLU CG C 13 35.712 0.072 . 1 . . . A 57 GLU CG . 19646 1
469 . 1 1 57 57 GLU N N 15 125.530 0.041 . 1 . . . A 57 GLU N . 19646 1
470 . 1 1 58 58 ASN H H 1 8.687 0.004 . 1 . . . A 58 ASN H . 19646 1
471 . 1 1 58 58 ASN HA H 1 4.407 0.002 . 1 . . . A 58 ASN HA . 19646 1
472 . 1 1 58 58 ASN HB2 H 1 2.986 0.003 . 2 . . . A 58 ASN HB2 . 19646 1
473 . 1 1 58 58 ASN HB3 H 1 2.866 0.004 . 2 . . . A 58 ASN HB3 . 19646 1
474 . 1 1 58 58 ASN HD21 H 1 7.569 0.004 . 1 . . . A 58 ASN HD21 . 19646 1
475 . 1 1 58 58 ASN HD22 H 1 6.904 0.004 . 1 . . . A 58 ASN HD22 . 19646 1
476 . 1 1 58 58 ASN CA C 13 53.973 0.013 . 1 . . . A 58 ASN CA . 19646 1
477 . 1 1 58 58 ASN CB C 13 38.074 0.034 . 1 . . . A 58 ASN CB . 19646 1
478 . 1 1 58 58 ASN N N 15 114.182 0.049 . 1 . . . A 58 ASN N . 19646 1
479 . 1 1 58 58 ASN ND2 N 15 113.597 0.014 . 1 . . . A 58 ASN ND2 . 19646 1
480 . 1 1 59 59 ARG H H 1 8.027 0.005 . 1 . . . A 59 ARG H . 19646 1
481 . 1 1 59 59 ARG HA H 1 4.750 0.006 . 1 . . . A 59 ARG HA . 19646 1
482 . 1 1 59 59 ARG HB2 H 1 1.893 0.002 . 2 . . . A 59 ARG HB2 . 19646 1
483 . 1 1 59 59 ARG HB3 H 1 1.832 0.004 . 2 . . . A 59 ARG HB3 . 19646 1
484 . 1 1 59 59 ARG HG2 H 1 1.750 0.003 . 2 . . . A 59 ARG HG2 . 19646 1
485 . 1 1 59 59 ARG HG3 H 1 1.572 0.006 . 2 . . . A 59 ARG HG3 . 19646 1
486 . 1 1 59 59 ARG HD2 H 1 3.190 0.004 . 2 . . . A 59 ARG HD2 . 19646 1
487 . 1 1 59 59 ARG HD3 H 1 3.192 0.000 . 2 . . . A 59 ARG HD3 . 19646 1
488 . 1 1 59 59 ARG CA C 13 54.554 0.000 . 1 . . . A 59 ARG CA . 19646 1
489 . 1 1 59 59 ARG CB C 13 33.324 0.014 . 1 . . . A 59 ARG CB . 19646 1
490 . 1 1 59 59 ARG CG C 13 26.545 0.040 . 1 . . . A 59 ARG CG . 19646 1
491 . 1 1 59 59 ARG CD C 13 43.533 0.069 . 1 . . . A 59 ARG CD . 19646 1
492 . 1 1 59 59 ARG N N 15 118.232 0.052 . 1 . . . A 59 ARG N . 19646 1
493 . 1 1 60 60 CYS H H 1 8.703 0.006 . 1 . . . A 60 CYS H . 19646 1
494 . 1 1 60 60 CYS HA H 1 5.477 0.009 . 1 . . . A 60 CYS HA . 19646 1
495 . 1 1 60 60 CYS HB2 H 1 2.878 0.006 . 2 . . . A 60 CYS HB2 . 19646 1
496 . 1 1 60 60 CYS HB3 H 1 2.728 0.007 . 2 . . . A 60 CYS HB3 . 19646 1
497 . 1 1 60 60 CYS CA C 13 53.980 0.044 . 1 . . . A 60 CYS CA . 19646 1
498 . 1 1 60 60 CYS CB C 13 40.976 0.030 . 1 . . . A 60 CYS CB . 19646 1
499 . 1 1 60 60 CYS N N 15 117.965 0.030 . 1 . . . A 60 CYS N . 19646 1
500 . 1 1 61 61 VAL H H 1 9.671 0.004 . 1 . . . A 61 VAL H . 19646 1
501 . 1 1 61 61 VAL HA H 1 4.625 0.004 . 1 . . . A 61 VAL HA . 19646 1
502 . 1 1 61 61 VAL HB H 1 2.025 0.004 . 1 . . . A 61 VAL HB . 19646 1
503 . 1 1 61 61 VAL HG11 H 1 0.885 0.004 . 2 . . . A 61 VAL HG11 . 19646 1
504 . 1 1 61 61 VAL HG12 H 1 0.885 0.004 . 2 . . . A 61 VAL HG12 . 19646 1
505 . 1 1 61 61 VAL HG13 H 1 0.885 0.004 . 2 . . . A 61 VAL HG13 . 19646 1
506 . 1 1 61 61 VAL HG21 H 1 0.691 0.004 . 2 . . . A 61 VAL HG21 . 19646 1
507 . 1 1 61 61 VAL HG22 H 1 0.691 0.004 . 2 . . . A 61 VAL HG22 . 19646 1
508 . 1 1 61 61 VAL HG23 H 1 0.691 0.004 . 2 . . . A 61 VAL HG23 . 19646 1
509 . 1 1 61 61 VAL CA C 13 58.996 0.012 . 1 . . . A 61 VAL CA . 19646 1
510 . 1 1 61 61 VAL CB C 13 36.362 0.040 . 1 . . . A 61 VAL CB . 19646 1
511 . 1 1 61 61 VAL CG1 C 13 21.682 0.043 . 2 . . . A 61 VAL CG1 . 19646 1
512 . 1 1 61 61 VAL CG2 C 13 19.875 0.020 . 2 . . . A 61 VAL CG2 . 19646 1
513 . 1 1 61 61 VAL N N 15 119.418 0.040 . 1 . . . A 61 VAL N . 19646 1
514 . 1 1 62 62 ALA H H 1 8.552 0.004 . 1 . . . A 62 ALA H . 19646 1
515 . 1 1 62 62 ALA HA H 1 4.356 0.006 . 1 . . . A 62 ALA HA . 19646 1
516 . 1 1 62 62 ALA HB1 H 1 1.388 0.004 . 1 . . . A 62 ALA HB1 . 19646 1
517 . 1 1 62 62 ALA HB2 H 1 1.388 0.004 . 1 . . . A 62 ALA HB2 . 19646 1
518 . 1 1 62 62 ALA HB3 H 1 1.388 0.004 . 1 . . . A 62 ALA HB3 . 19646 1
519 . 1 1 62 62 ALA CA C 13 52.418 0.027 . 1 . . . A 62 ALA CA . 19646 1
520 . 1 1 62 62 ALA CB C 13 18.618 0.033 . 1 . . . A 62 ALA CB . 19646 1
521 . 1 1 62 62 ALA N N 15 125.768 0.063 . 1 . . . A 62 ALA N . 19646 1
522 . 1 1 63 63 LEU H H 1 7.979 0.007 . 1 . . . A 63 LEU H . 19646 1
523 . 1 1 63 63 LEU HA H 1 3.782 0.004 . 1 . . . A 63 LEU HA . 19646 1
524 . 1 1 63 63 LEU HB2 H 1 1.410 0.004 . 2 . . . A 63 LEU HB2 . 19646 1
525 . 1 1 63 63 LEU HB3 H 1 1.135 0.004 . 2 . . . A 63 LEU HB3 . 19646 1
526 . 1 1 63 63 LEU HG H 1 1.123 0.004 . 1 . . . A 63 LEU HG . 19646 1
527 . 1 1 63 63 LEU HD11 H 1 0.182 0.005 . 2 . . . A 63 LEU HD11 . 19646 1
528 . 1 1 63 63 LEU HD12 H 1 0.182 0.005 . 2 . . . A 63 LEU HD12 . 19646 1
529 . 1 1 63 63 LEU HD13 H 1 0.182 0.005 . 2 . . . A 63 LEU HD13 . 19646 1
530 . 1 1 63 63 LEU HD21 H 1 0.310 0.005 . 2 . . . A 63 LEU HD21 . 19646 1
531 . 1 1 63 63 LEU HD22 H 1 0.310 0.005 . 2 . . . A 63 LEU HD22 . 19646 1
532 . 1 1 63 63 LEU HD23 H 1 0.310 0.005 . 2 . . . A 63 LEU HD23 . 19646 1
533 . 1 1 63 63 LEU CA C 13 58.182 0.053 . 1 . . . A 63 LEU CA . 19646 1
534 . 1 1 63 63 LEU CB C 13 42.411 0.033 . 1 . . . A 63 LEU CB . 19646 1
535 . 1 1 63 63 LEU CG C 13 26.685 0.057 . 1 . . . A 63 LEU CG . 19646 1
536 . 1 1 63 63 LEU CD1 C 13 22.890 0.024 . 2 . . . A 63 LEU CD1 . 19646 1
537 . 1 1 63 63 LEU CD2 C 13 25.021 0.023 . 2 . . . A 63 LEU CD2 . 19646 1
538 . 1 1 63 63 LEU N N 15 123.359 0.024 . 1 . . . A 63 LEU N . 19646 1
539 . 1 1 64 64 GLU H H 1 8.950 0.003 . 1 . . . A 64 GLU H . 19646 1
540 . 1 1 64 64 GLU HA H 1 4.025 0.006 . 1 . . . A 64 GLU HA . 19646 1
541 . 1 1 64 64 GLU HB2 H 1 2.018 0.006 . 2 . . . A 64 GLU HB2 . 19646 1
542 . 1 1 64 64 GLU HB3 H 1 2.008 0.000 . 2 . . . A 64 GLU HB3 . 19646 1
543 . 1 1 64 64 GLU HG2 H 1 2.165 0.004 . 2 . . . A 64 GLU HG2 . 19646 1
544 . 1 1 64 64 GLU HG3 H 1 2.167 0.000 . 2 . . . A 64 GLU HG3 . 19646 1
545 . 1 1 64 64 GLU CA C 13 58.502 0.054 . 1 . . . A 64 GLU CA . 19646 1
546 . 1 1 64 64 GLU CB C 13 28.267 0.062 . 1 . . . A 64 GLU CB . 19646 1
547 . 1 1 64 64 GLU CG C 13 36.068 0.070 . 1 . . . A 64 GLU CG . 19646 1
548 . 1 1 64 64 GLU N N 15 113.695 0.033 . 1 . . . A 64 GLU N . 19646 1
549 . 1 1 65 65 ARG H H 1 8.153 0.007 . 1 . . . A 65 ARG H . 19646 1
550 . 1 1 65 65 ARG HA H 1 4.245 0.006 . 1 . . . A 65 ARG HA . 19646 1
551 . 1 1 65 65 ARG HB2 H 1 2.060 0.006 . 2 . . . A 65 ARG HB2 . 19646 1
552 . 1 1 65 65 ARG HB3 H 1 1.835 0.006 . 2 . . . A 65 ARG HB3 . 19646 1
553 . 1 1 65 65 ARG HG2 H 1 1.741 0.002 . 2 . . . A 65 ARG HG2 . 19646 1
554 . 1 1 65 65 ARG HG3 H 1 1.528 0.004 . 2 . . . A 65 ARG HG3 . 19646 1
555 . 1 1 65 65 ARG HD2 H 1 3.174 0.005 . 2 . . . A 65 ARG HD2 . 19646 1
556 . 1 1 65 65 ARG HD3 H 1 3.171 0.004 . 2 . . . A 65 ARG HD3 . 19646 1
557 . 1 1 65 65 ARG CA C 13 54.554 0.021 . 1 . . . A 65 ARG CA . 19646 1
558 . 1 1 65 65 ARG CB C 13 29.158 0.055 . 1 . . . A 65 ARG CB . 19646 1
559 . 1 1 65 65 ARG CG C 13 26.950 0.025 . 1 . . . A 65 ARG CG . 19646 1
560 . 1 1 65 65 ARG CD C 13 42.526 0.030 . 1 . . . A 65 ARG CD . 19646 1
561 . 1 1 65 65 ARG N N 15 118.469 0.026 . 1 . . . A 65 ARG N . 19646 1
562 . 1 1 66 66 CYS H H 1 7.601 0.004 . 1 . . . A 66 CYS H . 19646 1
563 . 1 1 66 66 CYS HA H 1 4.224 0.006 . 1 . . . A 66 CYS HA . 19646 1
564 . 1 1 66 66 CYS HB2 H 1 3.019 0.005 . 2 . . . A 66 CYS HB2 . 19646 1
565 . 1 1 66 66 CYS HB3 H 1 2.744 0.006 . 2 . . . A 66 CYS HB3 . 19646 1
566 . 1 1 66 66 CYS CA C 13 55.125 0.044 . 1 . . . A 66 CYS CA . 19646 1
567 . 1 1 66 66 CYS CB C 13 37.198 0.046 . 1 . . . A 66 CYS CB . 19646 1
568 . 1 1 66 66 CYS N N 15 119.490 0.038 . 1 . . . A 66 CYS N . 19646 1
569 . 1 1 67 67 PRO HA H 1 4.437 0.005 . 1 . . . A 67 PRO HA . 19646 1
570 . 1 1 67 67 PRO HB2 H 1 1.970 0.004 . 2 . . . A 67 PRO HB2 . 19646 1
571 . 1 1 67 67 PRO HB3 H 1 1.496 0.005 . 2 . . . A 67 PRO HB3 . 19646 1
572 . 1 1 67 67 PRO HG2 H 1 1.682 0.005 . 2 . . . A 67 PRO HG2 . 19646 1
573 . 1 1 67 67 PRO HG3 H 1 1.426 0.007 . 2 . . . A 67 PRO HG3 . 19646 1
574 . 1 1 67 67 PRO HD2 H 1 3.226 0.005 . 2 . . . A 67 PRO HD2 . 19646 1
575 . 1 1 67 67 PRO HD3 H 1 3.170 0.005 . 2 . . . A 67 PRO HD3 . 19646 1
576 . 1 1 67 67 PRO CA C 13 62.458 0.013 . 1 . . . A 67 PRO CA . 19646 1
577 . 1 1 67 67 PRO CB C 13 33.668 0.037 . 1 . . . A 67 PRO CB . 19646 1
578 . 1 1 67 67 PRO CG C 13 26.386 0.045 . 1 . . . A 67 PRO CG . 19646 1
579 . 1 1 67 67 PRO CD C 13 49.726 0.029 . 1 . . . A 67 PRO CD . 19646 1
580 . 1 1 68 68 CYS H H 1 8.424 0.005 . 1 . . . A 68 CYS H . 19646 1
581 . 1 1 68 68 CYS HA H 1 4.328 0.002 . 1 . . . A 68 CYS HA . 19646 1
582 . 1 1 68 68 CYS HB2 H 1 1.955 0.004 . 2 . . . A 68 CYS HB2 . 19646 1
583 . 1 1 68 68 CYS HB3 H 1 1.536 0.005 . 2 . . . A 68 CYS HB3 . 19646 1
584 . 1 1 68 68 CYS CA C 13 56.386 0.015 . 1 . . . A 68 CYS CA . 19646 1
585 . 1 1 68 68 CYS CB C 13 42.435 0.042 . 1 . . . A 68 CYS CB . 19646 1
586 . 1 1 68 68 CYS N N 15 112.961 0.037 . 1 . . . A 68 CYS N . 19646 1
587 . 1 1 69 69 PHE H H 1 8.799 0.004 . 1 . . . A 69 PHE H . 19646 1
588 . 1 1 69 69 PHE HA H 1 5.831 0.003 . 1 . . . A 69 PHE HA . 19646 1
589 . 1 1 69 69 PHE HB2 H 1 3.080 0.002 . 2 . . . A 69 PHE HB2 . 19646 1
590 . 1 1 69 69 PHE HB3 H 1 2.956 0.003 . 2 . . . A 69 PHE HB3 . 19646 1
591 . 1 1 69 69 PHE HD1 H 1 7.109 0.005 . 3 . . . A 69 PHE HD1 . 19646 1
592 . 1 1 69 69 PHE HD2 H 1 7.109 0.005 . 3 . . . A 69 PHE HD2 . 19646 1
593 . 1 1 69 69 PHE HE1 H 1 7.239 0.004 . 3 . . . A 69 PHE HE1 . 19646 1
594 . 1 1 69 69 PHE HE2 H 1 7.239 0.004 . 3 . . . A 69 PHE HE2 . 19646 1
595 . 1 1 69 69 PHE HZ H 1 7.131 0.004 . 1 . . . A 69 PHE HZ . 19646 1
596 . 1 1 69 69 PHE CA C 13 57.124 0.022 . 1 . . . A 69 PHE CA . 19646 1
597 . 1 1 69 69 PHE CB C 13 42.551 0.019 . 1 . . . A 69 PHE CB . 19646 1
598 . 1 1 69 69 PHE CD1 C 13 132.054 0.043 . 3 . . . A 69 PHE CD1 . 19646 1
599 . 1 1 69 69 PHE CD2 C 13 132.054 0.043 . 3 . . . A 69 PHE CD2 . 19646 1
600 . 1 1 69 69 PHE CE1 C 13 131.598 0.355 . 3 . . . A 69 PHE CE1 . 19646 1
601 . 1 1 69 69 PHE CE2 C 13 131.598 0.355 . 3 . . . A 69 PHE CE2 . 19646 1
602 . 1 1 69 69 PHE CZ C 13 129.002 0.062 . 1 . . . A 69 PHE CZ . 19646 1
603 . 1 1 69 69 PHE N N 15 118.787 0.020 . 1 . . . A 69 PHE N . 19646 1
604 . 1 1 70 70 HIS H H 1 9.441 0.005 . 1 . . . A 70 HIS H . 19646 1
605 . 1 1 70 70 HIS HA H 1 4.968 0.004 . 1 . . . A 70 HIS HA . 19646 1
606 . 1 1 70 70 HIS HB2 H 1 2.988 0.006 . 2 . . . A 70 HIS HB2 . 19646 1
607 . 1 1 70 70 HIS HB3 H 1 2.868 0.004 . 2 . . . A 70 HIS HB3 . 19646 1
608 . 1 1 70 70 HIS HD2 H 1 6.682 0.008 . 1 . . . A 70 HIS HD2 . 19646 1
609 . 1 1 70 70 HIS HE1 H 1 7.482 0.003 . 1 . . . A 70 HIS HE1 . 19646 1
610 . 1 1 70 70 HIS CA C 13 57.755 0.053 . 1 . . . A 70 HIS CA . 19646 1
611 . 1 1 70 70 HIS CB C 13 33.828 0.048 . 1 . . . A 70 HIS CB . 19646 1
612 . 1 1 70 70 HIS CD2 C 13 118.872 0.048 . 1 . . . A 70 HIS CD2 . 19646 1
613 . 1 1 70 70 HIS CE1 C 13 138.664 0.036 . 1 . . . A 70 HIS CE1 . 19646 1
614 . 1 1 70 70 HIS N N 15 123.887 0.030 . 1 . . . A 70 HIS N . 19646 1
615 . 1 1 71 71 GLN HA H 1 3.733 0.001 . 1 . . . A 71 GLN HA . 19646 1
616 . 1 1 71 71 GLN HB2 H 1 2.087 0.002 . 2 . . . A 71 GLN HB2 . 19646 1
617 . 1 1 71 71 GLN HB3 H 1 1.650 0.005 . 2 . . . A 71 GLN HB3 . 19646 1
618 . 1 1 71 71 GLN HG2 H 1 1.746 0.003 . 2 . . . A 71 GLN HG2 . 19646 1
619 . 1 1 71 71 GLN HG3 H 1 1.334 0.005 . 2 . . . A 71 GLN HG3 . 19646 1
620 . 1 1 71 71 GLN HE21 H 1 7.273 0.005 . 1 . . . A 71 GLN HE21 . 19646 1
621 . 1 1 71 71 GLN HE22 H 1 6.785 0.001 . 1 . . . A 71 GLN HE22 . 19646 1
622 . 1 1 71 71 GLN CA C 13 56.512 0.056 . 1 . . . A 71 GLN CA . 19646 1
623 . 1 1 71 71 GLN CB C 13 26.732 0.028 . 1 . . . A 71 GLN CB . 19646 1
624 . 1 1 71 71 GLN CG C 13 33.404 0.048 . 1 . . . A 71 GLN CG . 19646 1
625 . 1 1 71 71 GLN NE2 N 15 111.289 0.035 . 1 . . . A 71 GLN NE2 . 19646 1
626 . 1 1 72 72 GLY H H 1 8.665 0.005 . 1 . . . A 72 GLY H . 19646 1
627 . 1 1 72 72 GLY HA2 H 1 4.206 0.005 . 2 . . . A 72 GLY HA2 . 19646 1
628 . 1 1 72 72 GLY HA3 H 1 3.693 0.009 . 2 . . . A 72 GLY HA3 . 19646 1
629 . 1 1 72 72 GLY CA C 13 45.486 0.029 . 1 . . . A 72 GLY CA . 19646 1
630 . 1 1 72 72 GLY N N 15 104.219 0.043 . 1 . . . A 72 GLY N . 19646 1
631 . 1 1 73 73 LYS H H 1 7.951 0.003 . 1 . . . A 73 LYS H . 19646 1
632 . 1 1 73 73 LYS HA H 1 4.670 0.005 . 1 . . . A 73 LYS HA . 19646 1
633 . 1 1 73 73 LYS HB2 H 1 1.901 0.003 . 2 . . . A 73 LYS HB2 . 19646 1
634 . 1 1 73 73 LYS HB3 H 1 1.832 0.002 . 2 . . . A 73 LYS HB3 . 19646 1
635 . 1 1 73 73 LYS HG2 H 1 1.430 0.003 . 2 . . . A 73 LYS HG2 . 19646 1
636 . 1 1 73 73 LYS HG3 H 1 1.208 0.003 . 2 . . . A 73 LYS HG3 . 19646 1
637 . 1 1 73 73 LYS HD2 H 1 1.677 0.004 . 2 . . . A 73 LYS HD2 . 19646 1
638 . 1 1 73 73 LYS HD3 H 1 1.680 0.001 . 2 . . . A 73 LYS HD3 . 19646 1
639 . 1 1 73 73 LYS HE2 H 1 2.918 0.004 . 2 . . . A 73 LYS HE2 . 19646 1
640 . 1 1 73 73 LYS HE3 H 1 2.917 0.000 . 2 . . . A 73 LYS HE3 . 19646 1
641 . 1 1 73 73 LYS CA C 13 54.931 0.024 . 1 . . . A 73 LYS CA . 19646 1
642 . 1 1 73 73 LYS CB C 13 35.124 0.028 . 1 . . . A 73 LYS CB . 19646 1
643 . 1 1 73 73 LYS CG C 13 25.305 0.028 . 1 . . . A 73 LYS CG . 19646 1
644 . 1 1 73 73 LYS CD C 13 28.949 0.041 . 1 . . . A 73 LYS CD . 19646 1
645 . 1 1 73 73 LYS CE C 13 42.349 0.040 . 1 . . . A 73 LYS CE . 19646 1
646 . 1 1 73 73 LYS N N 15 122.208 0.024 . 1 . . . A 73 LYS N . 19646 1
647 . 1 1 74 74 GLU H H 1 8.216 0.005 . 1 . . . A 74 GLU H . 19646 1
648 . 1 1 74 74 GLU HA H 1 4.322 0.006 . 1 . . . A 74 GLU HA . 19646 1
649 . 1 1 74 74 GLU HB2 H 1 1.828 0.006 . 2 . . . A 74 GLU HB2 . 19646 1
650 . 1 1 74 74 GLU HB3 H 1 1.704 0.003 . 2 . . . A 74 GLU HB3 . 19646 1
651 . 1 1 74 74 GLU HG2 H 1 1.942 0.003 . 2 . . . A 74 GLU HG2 . 19646 1
652 . 1 1 74 74 GLU HG3 H 1 1.841 0.004 . 2 . . . A 74 GLU HG3 . 19646 1
653 . 1 1 74 74 GLU CA C 13 55.614 0.052 . 1 . . . A 74 GLU CA . 19646 1
654 . 1 1 74 74 GLU CB C 13 31.797 0.042 . 1 . . . A 74 GLU CB . 19646 1
655 . 1 1 74 74 GLU CG C 13 36.920 0.038 . 1 . . . A 74 GLU CG . 19646 1
656 . 1 1 74 74 GLU N N 15 122.599 0.022 . 1 . . . A 74 GLU N . 19646 1
657 . 1 1 75 75 TYR H H 1 8.937 0.005 . 1 . . . A 75 TYR H . 19646 1
658 . 1 1 75 75 TYR HA H 1 4.431 0.003 . 1 . . . A 75 TYR HA . 19646 1
659 . 1 1 75 75 TYR HB2 H 1 2.809 0.007 . 2 . . . A 75 TYR HB2 . 19646 1
660 . 1 1 75 75 TYR HB3 H 1 2.502 0.009 . 2 . . . A 75 TYR HB3 . 19646 1
661 . 1 1 75 75 TYR HD1 H 1 7.227 0.005 . 3 . . . A 75 TYR HD1 . 19646 1
662 . 1 1 75 75 TYR HD2 H 1 7.227 0.005 . 3 . . . A 75 TYR HD2 . 19646 1
663 . 1 1 75 75 TYR HE1 H 1 6.990 0.004 . 3 . . . A 75 TYR HE1 . 19646 1
664 . 1 1 75 75 TYR HE2 H 1 6.990 0.004 . 3 . . . A 75 TYR HE2 . 19646 1
665 . 1 1 75 75 TYR CA C 13 57.231 0.035 . 1 . . . A 75 TYR CA . 19646 1
666 . 1 1 75 75 TYR CB C 13 41.874 0.046 . 1 . . . A 75 TYR CB . 19646 1
667 . 1 1 75 75 TYR CD1 C 13 133.347 0.081 . 3 . . . A 75 TYR CD1 . 19646 1
668 . 1 1 75 75 TYR CD2 C 13 133.347 0.081 . 3 . . . A 75 TYR CD2 . 19646 1
669 . 1 1 75 75 TYR CE1 C 13 118.515 0.074 . 3 . . . A 75 TYR CE1 . 19646 1
670 . 1 1 75 75 TYR CE2 C 13 118.515 0.074 . 3 . . . A 75 TYR CE2 . 19646 1
671 . 1 1 75 75 TYR N N 15 124.173 0.026 . 1 . . . A 75 TYR N . 19646 1
672 . 1 1 76 76 ALA H H 1 8.676 0.002 . 1 . . . A 76 ALA H . 19646 1
673 . 1 1 76 76 ALA HA H 1 4.357 0.003 . 1 . . . A 76 ALA HA . 19646 1
674 . 1 1 76 76 ALA HB1 H 1 1.295 0.003 . 1 . . . A 76 ALA HB1 . 19646 1
675 . 1 1 76 76 ALA HB2 H 1 1.295 0.003 . 1 . . . A 76 ALA HB2 . 19646 1
676 . 1 1 76 76 ALA HB3 H 1 1.295 0.003 . 1 . . . A 76 ALA HB3 . 19646 1
677 . 1 1 76 76 ALA CA C 13 49.933 0.040 . 1 . . . A 76 ALA CA . 19646 1
678 . 1 1 76 76 ALA CB C 13 17.807 0.026 . 1 . . . A 76 ALA CB . 19646 1
679 . 1 1 76 76 ALA N N 15 124.606 0.029 . 1 . . . A 76 ALA N . 19646 1
680 . 1 1 77 77 PRO HA H 1 3.854 0.003 . 1 . . . A 77 PRO HA . 19646 1
681 . 1 1 77 77 PRO HB2 H 1 2.260 0.004 . 2 . . . A 77 PRO HB2 . 19646 1
682 . 1 1 77 77 PRO HB3 H 1 1.774 0.003 . 2 . . . A 77 PRO HB3 . 19646 1
683 . 1 1 77 77 PRO HG2 H 1 1.979 0.006 . 2 . . . A 77 PRO HG2 . 19646 1
684 . 1 1 77 77 PRO HG3 H 1 1.937 0.002 . 2 . . . A 77 PRO HG3 . 19646 1
685 . 1 1 77 77 PRO HD2 H 1 3.478 0.003 . 2 . . . A 77 PRO HD2 . 19646 1
686 . 1 1 77 77 PRO HD3 H 1 3.389 0.003 . 2 . . . A 77 PRO HD3 . 19646 1
687 . 1 1 77 77 PRO CA C 13 63.884 0.028 . 1 . . . A 77 PRO CA . 19646 1
688 . 1 1 77 77 PRO CB C 13 31.167 0.038 . 1 . . . A 77 PRO CB . 19646 1
689 . 1 1 77 77 PRO CG C 13 28.326 0.046 . 1 . . . A 77 PRO CG . 19646 1
690 . 1 1 77 77 PRO CD C 13 50.032 0.028 . 1 . . . A 77 PRO CD . 19646 1
691 . 1 1 78 78 GLY H H 1 9.487 0.003 . 1 . . . A 78 GLY H . 19646 1
692 . 1 1 78 78 GLY HA2 H 1 4.369 0.007 . 2 . . . A 78 GLY HA2 . 19646 1
693 . 1 1 78 78 GLY HA3 H 1 3.407 0.006 . 2 . . . A 78 GLY HA3 . 19646 1
694 . 1 1 78 78 GLY CA C 13 44.966 0.041 . 1 . . . A 78 GLY CA . 19646 1
695 . 1 1 78 78 GLY N N 15 113.317 0.032 . 1 . . . A 78 GLY N . 19646 1
696 . 1 1 79 79 GLU H H 1 8.254 0.004 . 1 . . . A 79 GLU H . 19646 1
697 . 1 1 79 79 GLU HA H 1 4.486 0.004 . 1 . . . A 79 GLU HA . 19646 1
698 . 1 1 79 79 GLU HB2 H 1 2.553 0.005 . 2 . . . A 79 GLU HB2 . 19646 1
699 . 1 1 79 79 GLU HB3 H 1 2.416 0.003 . 2 . . . A 79 GLU HB3 . 19646 1
700 . 1 1 79 79 GLU HG2 H 1 2.562 0.004 . 2 . . . A 79 GLU HG2 . 19646 1
701 . 1 1 79 79 GLU HG3 H 1 2.337 0.002 . 2 . . . A 79 GLU HG3 . 19646 1
702 . 1 1 79 79 GLU CA C 13 57.610 0.053 . 1 . . . A 79 GLU CA . 19646 1
703 . 1 1 79 79 GLU CB C 13 31.261 0.047 . 1 . . . A 79 GLU CB . 19646 1
704 . 1 1 79 79 GLU CG C 13 38.679 0.033 . 1 . . . A 79 GLU CG . 19646 1
705 . 1 1 79 79 GLU N N 15 120.804 0.029 . 1 . . . A 79 GLU N . 19646 1
706 . 1 1 80 80 THR H H 1 8.132 0.004 . 1 . . . A 80 THR H . 19646 1
707 . 1 1 80 80 THR HA H 1 5.752 0.003 . 1 . . . A 80 THR HA . 19646 1
708 . 1 1 80 80 THR HB H 1 3.957 0.003 . 1 . . . A 80 THR HB . 19646 1
709 . 1 1 80 80 THR HG21 H 1 1.096 0.001 . 1 . . . A 80 THR HG21 . 19646 1
710 . 1 1 80 80 THR HG22 H 1 1.096 0.001 . 1 . . . A 80 THR HG22 . 19646 1
711 . 1 1 80 80 THR HG23 H 1 1.096 0.001 . 1 . . . A 80 THR HG23 . 19646 1
712 . 1 1 80 80 THR CA C 13 59.984 0.019 . 1 . . . A 80 THR CA . 19646 1
713 . 1 1 80 80 THR CB C 13 72.217 0.023 . 1 . . . A 80 THR CB . 19646 1
714 . 1 1 80 80 THR CG2 C 13 21.464 0.051 . 1 . . . A 80 THR CG2 . 19646 1
715 . 1 1 80 80 THR N N 15 110.916 0.049 . 1 . . . A 80 THR N . 19646 1
716 . 1 1 81 81 VAL H H 1 8.459 0.004 . 1 . . . A 81 VAL H . 19646 1
717 . 1 1 81 81 VAL HA H 1 4.204 0.002 . 1 . . . A 81 VAL HA . 19646 1
718 . 1 1 81 81 VAL HB H 1 1.081 0.004 . 1 . . . A 81 VAL HB . 19646 1
719 . 1 1 81 81 VAL HG11 H 1 -0.411 0.005 . 2 . . . A 81 VAL HG11 . 19646 1
720 . 1 1 81 81 VAL HG12 H 1 -0.411 0.005 . 2 . . . A 81 VAL HG12 . 19646 1
721 . 1 1 81 81 VAL HG13 H 1 -0.411 0.005 . 2 . . . A 81 VAL HG13 . 19646 1
722 . 1 1 81 81 VAL HG21 H 1 -0.446 0.006 . 2 . . . A 81 VAL HG21 . 19646 1
723 . 1 1 81 81 VAL HG22 H 1 -0.446 0.006 . 2 . . . A 81 VAL HG22 . 19646 1
724 . 1 1 81 81 VAL HG23 H 1 -0.446 0.006 . 2 . . . A 81 VAL HG23 . 19646 1
725 . 1 1 81 81 VAL CA C 13 59.688 0.031 . 1 . . . A 81 VAL CA . 19646 1
726 . 1 1 81 81 VAL CB C 13 35.482 0.033 . 1 . . . A 81 VAL CB . 19646 1
727 . 1 1 81 81 VAL CG1 C 13 20.212 0.024 . 2 . . . A 81 VAL CG1 . 19646 1
728 . 1 1 81 81 VAL CG2 C 13 18.397 0.021 . 2 . . . A 81 VAL CG2 . 19646 1
729 . 1 1 81 81 VAL N N 15 117.320 0.034 . 1 . . . A 81 VAL N . 19646 1
730 . 1 1 82 82 LYS H H 1 8.017 0.006 . 1 . . . A 82 LYS H . 19646 1
731 . 1 1 82 82 LYS HA H 1 4.811 0.004 . 1 . . . A 82 LYS HA . 19646 1
732 . 1 1 82 82 LYS HB2 H 1 1.667 0.004 . 2 . . . A 82 LYS HB2 . 19646 1
733 . 1 1 82 82 LYS HB3 H 1 1.509 0.003 . 2 . . . A 82 LYS HB3 . 19646 1
734 . 1 1 82 82 LYS HG2 H 1 1.249 0.007 . 2 . . . A 82 LYS HG2 . 19646 1
735 . 1 1 82 82 LYS HG3 H 1 1.221 0.002 . 2 . . . A 82 LYS HG3 . 19646 1
736 . 1 1 82 82 LYS HD2 H 1 1.531 0.005 . 2 . . . A 82 LYS HD2 . 19646 1
737 . 1 1 82 82 LYS HD3 H 1 1.530 0.001 . 2 . . . A 82 LYS HD3 . 19646 1
738 . 1 1 82 82 LYS HE2 H 1 2.868 0.001 . 2 . . . A 82 LYS HE2 . 19646 1
739 . 1 1 82 82 LYS HE3 H 1 2.808 0.002 . 2 . . . A 82 LYS HE3 . 19646 1
740 . 1 1 82 82 LYS CA C 13 54.855 0.057 . 1 . . . A 82 LYS CA . 19646 1
741 . 1 1 82 82 LYS CB C 13 33.297 0.031 . 1 . . . A 82 LYS CB . 19646 1
742 . 1 1 82 82 LYS CG C 13 24.529 0.033 . 1 . . . A 82 LYS CG . 19646 1
743 . 1 1 82 82 LYS CD C 13 29.130 0.025 . 1 . . . A 82 LYS CD . 19646 1
744 . 1 1 82 82 LYS CE C 13 41.898 0.030 . 1 . . . A 82 LYS CE . 19646 1
745 . 1 1 82 82 LYS N N 15 123.511 0.037 . 1 . . . A 82 LYS N . 19646 1
746 . 1 1 83 83 ILE H H 1 8.039 0.004 . 1 . . . A 83 ILE H . 19646 1
747 . 1 1 83 83 ILE HA H 1 3.995 0.001 . 1 . . . A 83 ILE HA . 19646 1
748 . 1 1 83 83 ILE HB H 1 1.478 0.002 . 1 . . . A 83 ILE HB . 19646 1
749 . 1 1 83 83 ILE HG12 H 1 0.839 0.005 . 2 . . . A 83 ILE HG12 . 19646 1
750 . 1 1 83 83 ILE HG13 H 1 0.246 0.003 . 2 . . . A 83 ILE HG13 . 19646 1
751 . 1 1 83 83 ILE HG21 H 1 0.703 0.003 . 1 . . . A 83 ILE HG21 . 19646 1
752 . 1 1 83 83 ILE HG22 H 1 0.703 0.003 . 1 . . . A 83 ILE HG22 . 19646 1
753 . 1 1 83 83 ILE HG23 H 1 0.703 0.003 . 1 . . . A 83 ILE HG23 . 19646 1
754 . 1 1 83 83 ILE HD11 H 1 0.076 0.003 . 1 . . . A 83 ILE HD11 . 19646 1
755 . 1 1 83 83 ILE HD12 H 1 0.076 0.003 . 1 . . . A 83 ILE HD12 . 19646 1
756 . 1 1 83 83 ILE HD13 H 1 0.076 0.003 . 1 . . . A 83 ILE HD13 . 19646 1
757 . 1 1 83 83 ILE CA C 13 60.858 0.012 . 1 . . . A 83 ILE CA . 19646 1
758 . 1 1 83 83 ILE CB C 13 38.347 0.022 . 1 . . . A 83 ILE CB . 19646 1
759 . 1 1 83 83 ILE CG1 C 13 26.765 0.030 . 1 . . . A 83 ILE CG1 . 19646 1
760 . 1 1 83 83 ILE CG2 C 13 16.839 0.028 . 1 . . . A 83 ILE CG2 . 19646 1
761 . 1 1 83 83 ILE CD1 C 13 12.200 0.027 . 1 . . . A 83 ILE CD1 . 19646 1
762 . 1 1 83 83 ILE N N 15 125.653 0.019 . 1 . . . A 83 ILE N . 19646 1
763 . 1 1 84 84 GLY HA2 H 1 3.984 0.003 . 2 . . . A 84 GLY HA2 . 19646 1
764 . 1 1 84 84 GLY HA3 H 1 3.662 0.006 . 2 . . . A 84 GLY HA3 . 19646 1
765 . 1 1 84 84 GLY CA C 13 47.357 0.043 . 1 . . . A 84 GLY CA . 19646 1
766 . 1 1 85 85 CYS H H 1 8.522 0.004 . 1 . . . A 85 CYS H . 19646 1
767 . 1 1 85 85 CYS HA H 1 4.929 0.003 . 1 . . . A 85 CYS HA . 19646 1
768 . 1 1 85 85 CYS HB2 H 1 3.191 0.004 . 2 . . . A 85 CYS HB2 . 19646 1
769 . 1 1 85 85 CYS HB3 H 1 3.189 0.003 . 2 . . . A 85 CYS HB3 . 19646 1
770 . 1 1 85 85 CYS CA C 13 58.558 0.053 . 1 . . . A 85 CYS CA . 19646 1
771 . 1 1 85 85 CYS CB C 13 37.971 0.026 . 1 . . . A 85 CYS CB . 19646 1
772 . 1 1 85 85 CYS N N 15 122.743 0.032 . 1 . . . A 85 CYS N . 19646 1
773 . 1 1 86 86 ASN H H 1 8.165 0.002 . 1 . . . A 86 ASN H . 19646 1
774 . 1 1 86 86 ASN HA H 1 4.923 0.004 . 1 . . . A 86 ASN HA . 19646 1
775 . 1 1 86 86 ASN HB2 H 1 2.724 0.005 . 2 . . . A 86 ASN HB2 . 19646 1
776 . 1 1 86 86 ASN HB3 H 1 2.451 0.007 . 2 . . . A 86 ASN HB3 . 19646 1
777 . 1 1 86 86 ASN HD21 H 1 8.262 0.009 . 1 . . . A 86 ASN HD21 . 19646 1
778 . 1 1 86 86 ASN HD22 H 1 7.901 0.003 . 1 . . . A 86 ASN HD22 . 19646 1
779 . 1 1 86 86 ASN CA C 13 53.858 0.031 . 1 . . . A 86 ASN CA . 19646 1
780 . 1 1 86 86 ASN CB C 13 41.629 0.060 . 1 . . . A 86 ASN CB . 19646 1
781 . 1 1 86 86 ASN N N 15 121.768 0.035 . 1 . . . A 86 ASN N . 19646 1
782 . 1 1 86 86 ASN ND2 N 15 118.942 0.125 . 1 . . . A 86 ASN ND2 . 19646 1
783 . 1 1 87 87 THR H H 1 8.250 0.009 . 1 . . . A 87 THR H . 19646 1
784 . 1 1 87 87 THR HA H 1 4.613 0.006 . 1 . . . A 87 THR HA . 19646 1
785 . 1 1 87 87 THR HB H 1 3.936 0.006 . 1 . . . A 87 THR HB . 19646 1
786 . 1 1 87 87 THR HG21 H 1 1.094 0.004 . 1 . . . A 87 THR HG21 . 19646 1
787 . 1 1 87 87 THR HG22 H 1 1.094 0.004 . 1 . . . A 87 THR HG22 . 19646 1
788 . 1 1 87 87 THR HG23 H 1 1.094 0.004 . 1 . . . A 87 THR HG23 . 19646 1
789 . 1 1 87 87 THR CA C 13 62.341 0.034 . 1 . . . A 87 THR CA . 19646 1
790 . 1 1 87 87 THR CB C 13 70.460 0.034 . 1 . . . A 87 THR CB . 19646 1
791 . 1 1 87 87 THR CG2 C 13 21.606 0.062 . 1 . . . A 87 THR CG2 . 19646 1
792 . 1 1 87 87 THR N N 15 115.576 0.029 . 1 . . . A 87 THR N . 19646 1
793 . 1 1 88 88 CYS H H 1 9.054 0.006 . 1 . . . A 88 CYS H . 19646 1
794 . 1 1 88 88 CYS HA H 1 5.544 0.005 . 1 . . . A 88 CYS HA . 19646 1
795 . 1 1 88 88 CYS HB2 H 1 2.732 0.005 . 2 . . . A 88 CYS HB2 . 19646 1
796 . 1 1 88 88 CYS HB3 H 1 2.595 0.007 . 2 . . . A 88 CYS HB3 . 19646 1
797 . 1 1 88 88 CYS CA C 13 54.867 0.021 . 1 . . . A 88 CYS CA . 19646 1
798 . 1 1 88 88 CYS CB C 13 50.459 0.022 . 1 . . . A 88 CYS CB . 19646 1
799 . 1 1 88 88 CYS N N 15 124.212 0.015 . 1 . . . A 88 CYS N . 19646 1
800 . 1 1 89 89 VAL H H 1 8.888 0.004 . 1 . . . A 89 VAL H . 19646 1
801 . 1 1 89 89 VAL HA H 1 5.046 0.004 . 1 . . . A 89 VAL HA . 19646 1
802 . 1 1 89 89 VAL HB H 1 1.971 0.004 . 1 . . . A 89 VAL HB . 19646 1
803 . 1 1 89 89 VAL HG11 H 1 0.940 0.003 . 2 . . . A 89 VAL HG11 . 19646 1
804 . 1 1 89 89 VAL HG12 H 1 0.940 0.003 . 2 . . . A 89 VAL HG12 . 19646 1
805 . 1 1 89 89 VAL HG13 H 1 0.940 0.003 . 2 . . . A 89 VAL HG13 . 19646 1
806 . 1 1 89 89 VAL HG21 H 1 0.923 0.004 . 2 . . . A 89 VAL HG21 . 19646 1
807 . 1 1 89 89 VAL HG22 H 1 0.923 0.004 . 2 . . . A 89 VAL HG22 . 19646 1
808 . 1 1 89 89 VAL HG23 H 1 0.923 0.004 . 2 . . . A 89 VAL HG23 . 19646 1
809 . 1 1 89 89 VAL CA C 13 59.590 0.046 . 1 . . . A 89 VAL CA . 19646 1
810 . 1 1 89 89 VAL CB C 13 35.195 0.039 . 1 . . . A 89 VAL CB . 19646 1
811 . 1 1 89 89 VAL CG1 C 13 20.202 0.030 . 2 . . . A 89 VAL CG1 . 19646 1
812 . 1 1 89 89 VAL CG2 C 13 21.444 0.036 . 2 . . . A 89 VAL CG2 . 19646 1
813 . 1 1 89 89 VAL N N 15 122.162 0.021 . 1 . . . A 89 VAL N . 19646 1
814 . 1 1 90 90 CYS H H 1 8.382 0.004 . 1 . . . A 90 CYS H . 19646 1
815 . 1 1 90 90 CYS HA H 1 4.170 0.005 . 1 . . . A 90 CYS HA . 19646 1
816 . 1 1 90 90 CYS HB2 H 1 2.585 0.007 . 2 . . . A 90 CYS HB2 . 19646 1
817 . 1 1 90 90 CYS HB3 H 1 1.798 0.005 . 2 . . . A 90 CYS HB3 . 19646 1
818 . 1 1 90 90 CYS CA C 13 54.727 0.036 . 1 . . . A 90 CYS CA . 19646 1
819 . 1 1 90 90 CYS CB C 13 36.915 0.047 . 1 . . . A 90 CYS CB . 19646 1
820 . 1 1 90 90 CYS N N 15 128.312 0.024 . 1 . . . A 90 CYS N . 19646 1
821 . 1 1 91 91 ARG H H 1 9.051 0.005 . 1 . . . A 91 ARG H . 19646 1
822 . 1 1 91 91 ARG HA H 1 4.309 0.004 . 1 . . . A 91 ARG HA . 19646 1
823 . 1 1 91 91 ARG HB2 H 1 1.654 0.007 . 2 . . . A 91 ARG HB2 . 19646 1
824 . 1 1 91 91 ARG HB3 H 1 1.650 0.000 . 2 . . . A 91 ARG HB3 . 19646 1
825 . 1 1 91 91 ARG HG2 H 1 1.538 0.004 . 2 . . . A 91 ARG HG2 . 19646 1
826 . 1 1 91 91 ARG HG3 H 1 1.470 0.003 . 2 . . . A 91 ARG HG3 . 19646 1
827 . 1 1 91 91 ARG HD2 H 1 3.170 0.004 . 2 . . . A 91 ARG HD2 . 19646 1
828 . 1 1 91 91 ARG HD3 H 1 3.115 0.005 . 2 . . . A 91 ARG HD3 . 19646 1
829 . 1 1 91 91 ARG CA C 13 56.304 0.044 . 1 . . . A 91 ARG CA . 19646 1
830 . 1 1 91 91 ARG CB C 13 32.883 0.037 . 1 . . . A 91 ARG CB . 19646 1
831 . 1 1 91 91 ARG CG C 13 27.026 0.013 . 1 . . . A 91 ARG CG . 19646 1
832 . 1 1 91 91 ARG CD C 13 43.304 0.032 . 1 . . . A 91 ARG CD . 19646 1
833 . 1 1 91 91 ARG N N 15 132.067 0.024 . 1 . . . A 91 ARG N . 19646 1
834 . 1 1 92 92 ASP H H 1 9.328 0.004 . 1 . . . A 92 ASP H . 19646 1
835 . 1 1 92 92 ASP HA H 1 4.204 0.004 . 1 . . . A 92 ASP HA . 19646 1
836 . 1 1 92 92 ASP HB2 H 1 2.732 0.004 . 2 . . . A 92 ASP HB2 . 19646 1
837 . 1 1 92 92 ASP HB3 H 1 2.565 0.005 . 2 . . . A 92 ASP HB3 . 19646 1
838 . 1 1 92 92 ASP CA C 13 55.745 0.049 . 1 . . . A 92 ASP CA . 19646 1
839 . 1 1 92 92 ASP CB C 13 39.142 0.051 . 1 . . . A 92 ASP CB . 19646 1
840 . 1 1 92 92 ASP N N 15 128.437 0.080 . 1 . . . A 92 ASP N . 19646 1
841 . 1 1 93 93 ARG H H 1 8.607 0.005 . 1 . . . A 93 ARG H . 19646 1
842 . 1 1 93 93 ARG HA H 1 3.274 0.004 . 1 . . . A 93 ARG HA . 19646 1
843 . 1 1 93 93 ARG HB2 H 1 2.065 0.005 . 2 . . . A 93 ARG HB2 . 19646 1
844 . 1 1 93 93 ARG HB3 H 1 1.915 0.003 . 2 . . . A 93 ARG HB3 . 19646 1
845 . 1 1 93 93 ARG HG2 H 1 1.443 0.005 . 2 . . . A 93 ARG HG2 . 19646 1
846 . 1 1 93 93 ARG HG3 H 1 1.385 0.003 . 2 . . . A 93 ARG HG3 . 19646 1
847 . 1 1 93 93 ARG HD2 H 1 3.146 0.005 . 2 . . . A 93 ARG HD2 . 19646 1
848 . 1 1 93 93 ARG HD3 H 1 2.981 0.004 . 2 . . . A 93 ARG HD3 . 19646 1
849 . 1 1 93 93 ARG CA C 13 58.401 0.039 . 1 . . . A 93 ARG CA . 19646 1
850 . 1 1 93 93 ARG CB C 13 28.561 0.028 . 1 . . . A 93 ARG CB . 19646 1
851 . 1 1 93 93 ARG CG C 13 28.766 0.051 . 1 . . . A 93 ARG CG . 19646 1
852 . 1 1 93 93 ARG CD C 13 43.223 0.039 . 1 . . . A 93 ARG CD . 19646 1
853 . 1 1 93 93 ARG N N 15 108.225 0.023 . 1 . . . A 93 ARG N . 19646 1
854 . 1 1 94 94 LYS H H 1 7.712 0.005 . 1 . . . A 94 LYS H . 19646 1
855 . 1 1 94 94 LYS HA H 1 4.524 0.003 . 1 . . . A 94 LYS HA . 19646 1
856 . 1 1 94 94 LYS HB2 H 1 1.756 0.002 . 2 . . . A 94 LYS HB2 . 19646 1
857 . 1 1 94 94 LYS HB3 H 1 1.701 0.002 . 2 . . . A 94 LYS HB3 . 19646 1
858 . 1 1 94 94 LYS HG2 H 1 1.411 0.001 . 2 . . . A 94 LYS HG2 . 19646 1
859 . 1 1 94 94 LYS HG3 H 1 1.367 0.004 . 2 . . . A 94 LYS HG3 . 19646 1
860 . 1 1 94 94 LYS HD2 H 1 1.725 0.003 . 2 . . . A 94 LYS HD2 . 19646 1
861 . 1 1 94 94 LYS HD3 H 1 1.671 0.005 . 2 . . . A 94 LYS HD3 . 19646 1
862 . 1 1 94 94 LYS HE2 H 1 3.024 0.004 . 2 . . . A 94 LYS HE2 . 19646 1
863 . 1 1 94 94 LYS HE3 H 1 3.028 0.000 . 2 . . . A 94 LYS HE3 . 19646 1
864 . 1 1 94 94 LYS CA C 13 53.875 0.023 . 1 . . . A 94 LYS CA . 19646 1
865 . 1 1 94 94 LYS CB C 13 36.106 0.028 . 1 . . . A 94 LYS CB . 19646 1
866 . 1 1 94 94 LYS CG C 13 24.041 0.029 . 1 . . . A 94 LYS CG . 19646 1
867 . 1 1 94 94 LYS CD C 13 29.110 0.036 . 1 . . . A 94 LYS CD . 19646 1
868 . 1 1 94 94 LYS CE C 13 42.201 0.014 . 1 . . . A 94 LYS CE . 19646 1
869 . 1 1 94 94 LYS N N 15 121.587 0.023 . 1 . . . A 94 LYS N . 19646 1
870 . 1 1 95 95 TRP H H 1 8.366 0.005 . 1 . . . A 95 TRP H . 19646 1
871 . 1 1 95 95 TRP HA H 1 4.812 0.007 . 1 . . . A 95 TRP HA . 19646 1
872 . 1 1 95 95 TRP HB2 H 1 3.024 0.006 . 2 . . . A 95 TRP HB2 . 19646 1
873 . 1 1 95 95 TRP HB3 H 1 2.881 0.004 . 2 . . . A 95 TRP HB3 . 19646 1
874 . 1 1 95 95 TRP HD1 H 1 7.353 0.003 . 1 . . . A 95 TRP HD1 . 19646 1
875 . 1 1 95 95 TRP HE1 H 1 9.618 0.005 . 1 . . . A 95 TRP HE1 . 19646 1
876 . 1 1 95 95 TRP HE3 H 1 6.723 0.007 . 1 . . . A 95 TRP HE3 . 19646 1
877 . 1 1 95 95 TRP HZ2 H 1 6.552 0.003 . 1 . . . A 95 TRP HZ2 . 19646 1
878 . 1 1 95 95 TRP HZ3 H 1 6.768 0.006 . 1 . . . A 95 TRP HZ3 . 19646 1
879 . 1 1 95 95 TRP HH2 H 1 6.092 0.005 . 1 . . . A 95 TRP HH2 . 19646 1
880 . 1 1 95 95 TRP CA C 13 55.886 0.078 . 1 . . . A 95 TRP CA . 19646 1
881 . 1 1 95 95 TRP CB C 13 30.257 0.029 . 1 . . . A 95 TRP CB . 19646 1
882 . 1 1 95 95 TRP CD1 C 13 127.360 0.038 . 1 . . . A 95 TRP CD1 . 19646 1
883 . 1 1 95 95 TRP CE3 C 13 119.588 0.098 . 1 . . . A 95 TRP CE3 . 19646 1
884 . 1 1 95 95 TRP CZ2 C 13 113.591 0.063 . 1 . . . A 95 TRP CZ2 . 19646 1
885 . 1 1 95 95 TRP CZ3 C 13 123.071 0.139 . 1 . . . A 95 TRP CZ3 . 19646 1
886 . 1 1 95 95 TRP CH2 C 13 123.627 0.154 . 1 . . . A 95 TRP CH2 . 19646 1
887 . 1 1 95 95 TRP N N 15 120.035 0.025 . 1 . . . A 95 TRP N . 19646 1
888 . 1 1 95 95 TRP NE1 N 15 126.126 0.022 . 1 . . . A 95 TRP NE1 . 19646 1
889 . 1 1 96 96 ASN H H 1 9.268 0.005 . 1 . . . A 96 ASN H . 19646 1
890 . 1 1 96 96 ASN HA H 1 5.068 0.003 . 1 . . . A 96 ASN HA . 19646 1
891 . 1 1 96 96 ASN HB2 H 1 2.917 0.006 . 2 . . . A 96 ASN HB2 . 19646 1
892 . 1 1 96 96 ASN HB3 H 1 2.776 0.003 . 2 . . . A 96 ASN HB3 . 19646 1
893 . 1 1 96 96 ASN HD21 H 1 7.093 0.002 . 1 . . . A 96 ASN HD21 . 19646 1
894 . 1 1 96 96 ASN HD22 H 1 6.919 0.002 . 1 . . . A 96 ASN HD22 . 19646 1
895 . 1 1 96 96 ASN CA C 13 52.832 0.042 . 1 . . . A 96 ASN CA . 19646 1
896 . 1 1 96 96 ASN CB C 13 39.532 0.038 . 1 . . . A 96 ASN CB . 19646 1
897 . 1 1 96 96 ASN N N 15 125.356 0.023 . 1 . . . A 96 ASN N . 19646 1
898 . 1 1 96 96 ASN ND2 N 15 113.428 0.036 . 1 . . . A 96 ASN ND2 . 19646 1
899 . 1 1 97 97 CYS HA H 1 5.712 0.005 . 1 . . . A 97 CYS HA . 19646 1
900 . 1 1 97 97 CYS HB2 H 1 3.016 0.005 . 2 . . . A 97 CYS HB2 . 19646 1
901 . 1 1 97 97 CYS HB3 H 1 2.977 0.003 . 2 . . . A 97 CYS HB3 . 19646 1
902 . 1 1 97 97 CYS CA C 13 55.808 0.032 . 1 . . . A 97 CYS CA . 19646 1
903 . 1 1 97 97 CYS CB C 13 47.903 0.015 . 1 . . . A 97 CYS CB . 19646 1
904 . 1 1 98 98 THR H H 1 8.221 0.009 . 1 . . . A 98 THR H . 19646 1
905 . 1 1 98 98 THR HA H 1 4.183 0.006 . 1 . . . A 98 THR HA . 19646 1
906 . 1 1 98 98 THR HB H 1 4.012 0.005 . 1 . . . A 98 THR HB . 19646 1
907 . 1 1 98 98 THR HG21 H 1 1.358 0.003 . 1 . . . A 98 THR HG21 . 19646 1
908 . 1 1 98 98 THR HG22 H 1 1.358 0.003 . 1 . . . A 98 THR HG22 . 19646 1
909 . 1 1 98 98 THR HG23 H 1 1.358 0.003 . 1 . . . A 98 THR HG23 . 19646 1
910 . 1 1 98 98 THR CA C 13 62.852 0.031 . 1 . . . A 98 THR CA . 19646 1
911 . 1 1 98 98 THR CB C 13 70.176 0.033 . 1 . . . A 98 THR CB . 19646 1
912 . 1 1 98 98 THR CG2 C 13 21.732 0.014 . 1 . . . A 98 THR CG2 . 19646 1
913 . 1 1 98 98 THR N N 15 112.700 0.021 . 1 . . . A 98 THR N . 19646 1
914 . 1 1 99 99 ASP H H 1 8.038 0.009 . 1 . . . A 99 ASP H . 19646 1
915 . 1 1 99 99 ASP HA H 1 4.649 0.004 . 1 . . . A 99 ASP HA . 19646 1
916 . 1 1 99 99 ASP HB2 H 1 2.554 0.003 . 2 . . . A 99 ASP HB2 . 19646 1
917 . 1 1 99 99 ASP HB3 H 1 2.496 0.004 . 2 . . . A 99 ASP HB3 . 19646 1
918 . 1 1 99 99 ASP CA C 13 52.707 0.062 . 1 . . . A 99 ASP CA . 19646 1
919 . 1 1 99 99 ASP CB C 13 40.809 0.032 . 1 . . . A 99 ASP CB . 19646 1
920 . 1 1 99 99 ASP N N 15 120.286 0.023 . 1 . . . A 99 ASP N . 19646 1
921 . 1 1 100 100 HIS H H 1 8.654 0.005 . 1 . . . A 100 HIS H . 19646 1
922 . 1 1 100 100 HIS HA H 1 4.655 0.005 . 1 . . . A 100 HIS HA . 19646 1
923 . 1 1 100 100 HIS HB2 H 1 3.041 0.007 . 2 . . . A 100 HIS HB2 . 19646 1
924 . 1 1 100 100 HIS HB3 H 1 2.938 0.003 . 2 . . . A 100 HIS HB3 . 19646 1
925 . 1 1 100 100 HIS HD2 H 1 7.044 0.003 . 1 . . . A 100 HIS HD2 . 19646 1
926 . 1 1 100 100 HIS HE1 H 1 7.854 0.007 . 1 . . . A 100 HIS HE1 . 19646 1
927 . 1 1 100 100 HIS CA C 13 55.554 0.038 . 1 . . . A 100 HIS CA . 19646 1
928 . 1 1 100 100 HIS CB C 13 30.875 0.053 . 1 . . . A 100 HIS CB . 19646 1
929 . 1 1 100 100 HIS CD2 C 13 120.696 0.061 . 1 . . . A 100 HIS CD2 . 19646 1
930 . 1 1 100 100 HIS CE1 C 13 138.890 0.032 . 1 . . . A 100 HIS CE1 . 19646 1
931 . 1 1 100 100 HIS N N 15 120.257 0.165 . 1 . . . A 100 HIS N . 19646 1
932 . 1 1 101 101 VAL H H 1 8.687 0.003 . 1 . . . A 101 VAL H . 19646 1
933 . 1 1 101 101 VAL HA H 1 3.982 0.004 . 1 . . . A 101 VAL HA . 19646 1
934 . 1 1 101 101 VAL HB H 1 2.008 0.001 . 1 . . . A 101 VAL HB . 19646 1
935 . 1 1 101 101 VAL HG11 H 1 0.944 0.005 . 2 . . . A 101 VAL HG11 . 19646 1
936 . 1 1 101 101 VAL HG12 H 1 0.944 0.005 . 2 . . . A 101 VAL HG12 . 19646 1
937 . 1 1 101 101 VAL HG13 H 1 0.944 0.005 . 2 . . . A 101 VAL HG13 . 19646 1
938 . 1 1 101 101 VAL HG21 H 1 0.999 0.008 . 2 . . . A 101 VAL HG21 . 19646 1
939 . 1 1 101 101 VAL HG22 H 1 0.999 0.008 . 2 . . . A 101 VAL HG22 . 19646 1
940 . 1 1 101 101 VAL HG23 H 1 0.999 0.008 . 2 . . . A 101 VAL HG23 . 19646 1
941 . 1 1 101 101 VAL CA C 13 62.929 0.028 . 1 . . . A 101 VAL CA . 19646 1
942 . 1 1 101 101 VAL CB C 13 31.843 0.010 . 1 . . . A 101 VAL CB . 19646 1
943 . 1 1 101 101 VAL CG1 C 13 21.349 0.039 . 2 . . . A 101 VAL CG1 . 19646 1
944 . 1 1 101 101 VAL CG2 C 13 21.206 0.021 . 2 . . . A 101 VAL CG2 . 19646 1
945 . 1 1 101 101 VAL N N 15 123.478 0.073 . 1 . . . A 101 VAL N . 19646 1
946 . 1 1 102 102 CYS H H 1 8.700 0.007 . 1 . . . A 102 CYS H . 19646 1
947 . 1 1 102 102 CYS HA H 1 4.844 0.005 . 1 . . . A 102 CYS HA . 19646 1
948 . 1 1 102 102 CYS HB2 H 1 3.532 0.005 . 2 . . . A 102 CYS HB2 . 19646 1
949 . 1 1 102 102 CYS HB3 H 1 2.831 0.004 . 2 . . . A 102 CYS HB3 . 19646 1
950 . 1 1 102 102 CYS CA C 13 52.964 0.026 . 1 . . . A 102 CYS CA . 19646 1
951 . 1 1 102 102 CYS CB C 13 37.591 0.047 . 1 . . . A 102 CYS CB . 19646 1
952 . 1 1 102 102 CYS N N 15 125.981 0.017 . 1 . . . A 102 CYS N . 19646 1
953 . 1 1 103 103 ASP H H 1 8.041 0.002 . 1 . . . A 103 ASP H . 19646 1
954 . 1 1 103 103 ASP HA H 1 4.345 0.002 . 1 . . . A 103 ASP HA . 19646 1
955 . 1 1 103 103 ASP HB2 H 1 2.618 0.002 . 2 . . . A 103 ASP HB2 . 19646 1
956 . 1 1 103 103 ASP HB3 H 1 2.534 0.002 . 2 . . . A 103 ASP HB3 . 19646 1
957 . 1 1 103 103 ASP CA C 13 55.939 0.005 . 1 . . . A 103 ASP CA . 19646 1
958 . 1 1 103 103 ASP CB C 13 42.176 0.020 . 1 . . . A 103 ASP CB . 19646 1
959 . 1 1 103 103 ASP N N 15 127.664 0.030 . 1 . . . A 103 ASP N . 19646 1
stop_
save_