Content for NMR-STAR saveframe, assigned_chemical_shifts_1
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 36403
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' 2 $13C_15N_sample isotropic 36403 1
2 '3D HNCA' 3 . isotropic 36403 1
3 '3D HN(CO)CA' 3 . isotropic 36403 1
4 '3D HCCH-TOCSY' 3 . isotropic 36403 1
5 '3D 1H-15N NOESY' 3 . isotropic 36403 1
6 '3D 1H-13C NOESY' 3 . isotropic 36403 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 12 12 ASP HA H 1 4.489 0.001 . 1 . . . . A 1 ASP HA . 36403 1
2 . 1 . 1 12 12 ASP HB2 H 1 2.612 0.003 . 2 . . . . A 1 ASP HB2 . 36403 1
3 . 1 . 1 12 12 ASP HB3 H 1 2.525 0.003 . 2 . . . . A 1 ASP HB3 . 36403 1
4 . 1 . 1 12 12 ASP CA C 13 54.345 0.021 . 1 . . . . A 1 ASP CA . 36403 1
5 . 1 . 1 12 12 ASP CB C 13 41.003 0.000 . 1 . . . . A 1 ASP CB . 36403 1
6 . 1 . 1 13 13 LEU H H 1 7.924 0.006 . 1 . . . . A 2 LEU H . 36403 1
7 . 1 . 1 13 13 LEU HA H 1 4.196 0.006 . 1 . . . . A 2 LEU HA . 36403 1
8 . 1 . 1 13 13 LEU HB2 H 1 1.500 0.004 . 2 . . . . A 2 LEU HB2 . 36403 1
9 . 1 . 1 13 13 LEU HB3 H 1 1.500 0.004 . 2 . . . . A 2 LEU HB3 . 36403 1
10 . 1 . 1 13 13 LEU HG H 1 1.516 0.005 . 1 . . . . A 2 LEU HG . 36403 1
11 . 1 . 1 13 13 LEU HD11 H 1 0.804 0.002 . 2 . . . . A 2 LEU HD11 . 36403 1
12 . 1 . 1 13 13 LEU HD12 H 1 0.804 0.002 . 2 . . . . A 2 LEU HD12 . 36403 1
13 . 1 . 1 13 13 LEU HD13 H 1 0.804 0.002 . 2 . . . . A 2 LEU HD13 . 36403 1
14 . 1 . 1 13 13 LEU HD21 H 1 0.745 0.003 . 2 . . . . A 2 LEU HD21 . 36403 1
15 . 1 . 1 13 13 LEU HD22 H 1 0.745 0.003 . 2 . . . . A 2 LEU HD22 . 36403 1
16 . 1 . 1 13 13 LEU HD23 H 1 0.745 0.003 . 2 . . . . A 2 LEU HD23 . 36403 1
17 . 1 . 1 13 13 LEU CA C 13 55.103 0.074 . 1 . . . . A 2 LEU CA . 36403 1
18 . 1 . 1 13 13 LEU CB C 13 42.497 0.026 . 1 . . . . A 2 LEU CB . 36403 1
19 . 1 . 1 13 13 LEU CG C 13 26.942 0.036 . 1 . . . . A 2 LEU CG . 36403 1
20 . 1 . 1 13 13 LEU CD1 C 13 25.007 0.073 . 2 . . . . A 2 LEU CD1 . 36403 1
21 . 1 . 1 13 13 LEU CD2 C 13 23.619 0.038 . 2 . . . . A 2 LEU CD2 . 36403 1
22 . 1 . 1 13 13 LEU N N 15 122.461 0.082 . 1 . . . . A 2 LEU N . 36403 1
23 . 1 . 1 14 14 ALA HA H 1 4.238 0.006 . 1 . . . . A 3 ALA HA . 36403 1
24 . 1 . 1 14 14 ALA HB1 H 1 1.288 0.002 . 1 . . . . A 3 ALA HB1 . 36403 1
25 . 1 . 1 14 14 ALA HB2 H 1 1.288 0.002 . 1 . . . . A 3 ALA HB2 . 36403 1
26 . 1 . 1 14 14 ALA HB3 H 1 1.288 0.002 . 1 . . . . A 3 ALA HB3 . 36403 1
27 . 1 . 1 14 14 ALA CA C 13 52.401 0.029 . 1 . . . . A 3 ALA CA . 36403 1
28 . 1 . 1 14 14 ALA CB C 13 19.183 0.045 . 1 . . . . A 3 ALA CB . 36403 1
29 . 1 . 1 15 15 VAL H H 1 7.898 0.005 . 1 . . . . A 4 VAL H . 36403 1
30 . 1 . 1 15 15 VAL HA H 1 4.001 0.003 . 1 . . . . A 4 VAL HA . 36403 1
31 . 1 . 1 15 15 VAL HB H 1 2.003 0.005 . 1 . . . . A 4 VAL HB . 36403 1
32 . 1 . 1 15 15 VAL HG11 H 1 0.869 0.006 . 2 . . . . A 4 VAL HG11 . 36403 1
33 . 1 . 1 15 15 VAL HG12 H 1 0.869 0.006 . 2 . . . . A 4 VAL HG12 . 36403 1
34 . 1 . 1 15 15 VAL HG13 H 1 0.869 0.006 . 2 . . . . A 4 VAL HG13 . 36403 1
35 . 1 . 1 15 15 VAL HG21 H 1 0.798 0.008 . 2 . . . . A 4 VAL HG21 . 36403 1
36 . 1 . 1 15 15 VAL HG22 H 1 0.798 0.008 . 2 . . . . A 4 VAL HG22 . 36403 1
37 . 1 . 1 15 15 VAL HG23 H 1 0.798 0.008 . 2 . . . . A 4 VAL HG23 . 36403 1
38 . 1 . 1 15 15 VAL CA C 13 62.470 0.019 . 1 . . . . A 4 VAL CA . 36403 1
39 . 1 . 1 15 15 VAL CB C 13 32.700 0.022 . 1 . . . . A 4 VAL CB . 36403 1
40 . 1 . 1 15 15 VAL CG1 C 13 20.995 0.077 . 2 . . . . A 4 VAL CG1 . 36403 1
41 . 1 . 1 15 15 VAL CG2 C 13 20.881 0.048 . 2 . . . . A 4 VAL CG2 . 36403 1
42 . 1 . 1 15 15 VAL N N 15 118.759 0.047 . 1 . . . . A 4 VAL N . 36403 1
43 . 1 . 1 16 16 GLN HA H 1 4.308 0.006 . 1 . . . . A 5 GLN HA . 36403 1
44 . 1 . 1 16 16 GLN HB2 H 1 2.120 0.006 . 2 . . . . A 5 GLN HB2 . 36403 1
45 . 1 . 1 16 16 GLN HB3 H 1 1.905 0.004 . 2 . . . . A 5 GLN HB3 . 36403 1
46 . 1 . 1 16 16 GLN HG2 H 1 2.287 0.006 . 2 . . . . A 5 GLN HG2 . 36403 1
47 . 1 . 1 16 16 GLN HG3 H 1 2.287 0.006 . 2 . . . . A 5 GLN HG3 . 36403 1
48 . 1 . 1 16 16 GLN CA C 13 55.872 0.054 . 1 . . . . A 5 GLN CA . 36403 1
49 . 1 . 1 16 16 GLN CB C 13 29.083 0.137 . 1 . . . . A 5 GLN CB . 36403 1
50 . 1 . 1 16 16 GLN CG C 13 33.972 0.006 . 1 . . . . A 5 GLN CG . 36403 1
51 . 1 . 1 17 17 GLU H H 1 7.944 0.006 . 1 . . . . A 6 GLU H . 36403 1
52 . 1 . 1 17 17 GLU HA H 1 4.812 0.004 . 1 . . . . A 6 GLU HA . 36403 1
53 . 1 . 1 17 17 GLU HB2 H 1 1.731 0.002 . 2 . . . . A 6 GLU HB2 . 36403 1
54 . 1 . 1 17 17 GLU HB3 H 1 1.679 0.003 . 2 . . . . A 6 GLU HB3 . 36403 1
55 . 1 . 1 17 17 GLU HG2 H 1 1.936 0.006 . 2 . . . . A 6 GLU HG2 . 36403 1
56 . 1 . 1 17 17 GLU HG3 H 1 1.860 0.002 . 2 . . . . A 6 GLU HG3 . 36403 1
57 . 1 . 1 17 17 GLU CA C 13 55.152 0.071 . 1 . . . . A 6 GLU CA . 36403 1
58 . 1 . 1 17 17 GLU CB C 13 33.565 0.045 . 1 . . . . A 6 GLU CB . 36403 1
59 . 1 . 1 17 17 GLU CG C 13 36.539 0.028 . 1 . . . . A 6 GLU CG . 36403 1
60 . 1 . 1 17 17 GLU N N 15 121.985 0.121 . 1 . . . . A 6 GLU N . 36403 1
61 . 1 . 1 18 18 ILE H H 1 9.048 0.004 . 1 . . . . A 7 ILE H . 36403 1
62 . 1 . 1 18 18 ILE HA H 1 4.762 0.012 . 1 . . . . A 7 ILE HA . 36403 1
63 . 1 . 1 18 18 ILE HB H 1 1.429 0.013 . 1 . . . . A 7 ILE HB . 36403 1
64 . 1 . 1 18 18 ILE HG12 H 1 0.965 0.002 . 2 . . . . A 7 ILE HG12 . 36403 1
65 . 1 . 1 18 18 ILE HG13 H 1 0.709 0.002 . 2 . . . . A 7 ILE HG13 . 36403 1
66 . 1 . 1 18 18 ILE HG21 H 1 0.725 0.008 . 1 . . . . A 7 ILE HG21 . 36403 1
67 . 1 . 1 18 18 ILE HG22 H 1 0.725 0.008 . 1 . . . . A 7 ILE HG22 . 36403 1
68 . 1 . 1 18 18 ILE HG23 H 1 0.725 0.008 . 1 . . . . A 7 ILE HG23 . 36403 1
69 . 1 . 1 18 18 ILE HD11 H 1 0.403 0.007 . 1 . . . . A 7 ILE HD11 . 36403 1
70 . 1 . 1 18 18 ILE HD12 H 1 0.403 0.007 . 1 . . . . A 7 ILE HD12 . 36403 1
71 . 1 . 1 18 18 ILE HD13 H 1 0.403 0.007 . 1 . . . . A 7 ILE HD13 . 36403 1
72 . 1 . 1 18 18 ILE CA C 13 59.146 0.083 . 1 . . . . A 7 ILE CA . 36403 1
73 . 1 . 1 18 18 ILE CB C 13 42.404 0.095 . 1 . . . . A 7 ILE CB . 36403 1
74 . 1 . 1 18 18 ILE CG1 C 13 25.686 0.027 . 1 . . . . A 7 ILE CG1 . 36403 1
75 . 1 . 1 18 18 ILE CG2 C 13 18.206 0.024 . 1 . . . . A 7 ILE CG2 . 36403 1
76 . 1 . 1 18 18 ILE CD1 C 13 15.000 0.083 . 1 . . . . A 7 ILE CD1 . 36403 1
77 . 1 . 1 18 18 ILE N N 15 115.436 0.092 . 1 . . . . A 7 ILE N . 36403 1
78 . 1 . 1 19 19 PHE H H 1 8.128 0.002 . 1 . . . . A 8 PHE H . 36403 1
79 . 1 . 1 19 19 PHE HA H 1 5.390 0.008 . 1 . . . . A 8 PHE HA . 36403 1
80 . 1 . 1 19 19 PHE HB2 H 1 2.567 0.015 . 2 . . . . A 8 PHE HB2 . 36403 1
81 . 1 . 1 19 19 PHE HB3 H 1 2.567 0.015 . 2 . . . . A 8 PHE HB3 . 36403 1
82 . 1 . 1 19 19 PHE HD1 H 1 6.770 0.010 . 3 . . . . A 8 PHE HD1 . 36403 1
83 . 1 . 1 19 19 PHE HD2 H 1 6.700 0.010 . 3 . . . . A 8 PHE HD2 . 36403 1
84 . 1 . 1 19 19 PHE CA C 13 55.105 0.088 . 1 . . . . A 8 PHE CA . 36403 1
85 . 1 . 1 19 19 PHE CB C 13 40.880 0.068 . 1 . . . . A 8 PHE CB . 36403 1
86 . 1 . 1 19 19 PHE N N 15 117.662 0.069 . 1 . . . . A 8 PHE N . 36403 1
87 . 1 . 1 20 20 VAL H H 1 8.752 0.003 . 1 . . . . A 9 VAL H . 36403 1
88 . 1 . 1 20 20 VAL HA H 1 4.471 0.010 . 1 . . . . A 9 VAL HA . 36403 1
89 . 1 . 1 20 20 VAL HB H 1 2.332 0.011 . 1 . . . . A 9 VAL HB . 36403 1
90 . 1 . 1 20 20 VAL HG11 H 1 0.718 0.006 . 2 . . . . A 9 VAL HG11 . 36403 1
91 . 1 . 1 20 20 VAL HG12 H 1 0.718 0.006 . 2 . . . . A 9 VAL HG12 . 36403 1
92 . 1 . 1 20 20 VAL HG13 H 1 0.718 0.006 . 2 . . . . A 9 VAL HG13 . 36403 1
93 . 1 . 1 20 20 VAL HG21 H 1 0.700 0.004 . 2 . . . . A 9 VAL HG21 . 36403 1
94 . 1 . 1 20 20 VAL HG22 H 1 0.700 0.004 . 2 . . . . A 9 VAL HG22 . 36403 1
95 . 1 . 1 20 20 VAL HG23 H 1 0.700 0.004 . 2 . . . . A 9 VAL HG23 . 36403 1
96 . 1 . 1 20 20 VAL CA C 13 58.629 0.076 . 1 . . . . A 9 VAL CA . 36403 1
97 . 1 . 1 20 20 VAL CB C 13 34.943 0.062 . 1 . . . . A 9 VAL CB . 36403 1
98 . 1 . 1 20 20 VAL CG1 C 13 23.363 0.079 . 2 . . . . A 9 VAL CG1 . 36403 1
99 . 1 . 1 20 20 VAL CG2 C 13 19.387 0.039 . 2 . . . . A 9 VAL CG2 . 36403 1
100 . 1 . 1 20 20 VAL N N 15 115.502 0.125 . 1 . . . . A 9 VAL N . 36403 1
101 . 1 . 1 21 21 PHE H H 1 8.895 0.005 . 1 . . . . A 10 PHE H . 36403 1
102 . 1 . 1 21 21 PHE HA H 1 6.078 0.012 . 1 . . . . A 10 PHE HA . 36403 1
103 . 1 . 1 21 21 PHE HB2 H 1 3.240 0.008 . 2 . . . . A 10 PHE HB2 . 36403 1
104 . 1 . 1 21 21 PHE HB3 H 1 2.553 0.009 . 2 . . . . A 10 PHE HB3 . 36403 1
105 . 1 . 1 21 21 PHE HD1 H 1 6.927 0.011 . 3 . . . . A 10 PHE HD1 . 36403 1
106 . 1 . 1 21 21 PHE HD2 H 1 6.927 0.011 . 3 . . . . A 10 PHE HD2 . 36403 1
107 . 1 . 1 21 21 PHE CA C 13 55.834 0.026 . 1 . . . . A 10 PHE CA . 36403 1
108 . 1 . 1 21 21 PHE CB C 13 43.729 0.044 . 1 . . . . A 10 PHE CB . 36403 1
109 . 1 . 1 21 21 PHE N N 15 116.843 0.082 . 1 . . . . A 10 PHE N . 36403 1
110 . 1 . 1 22 22 THR H H 1 8.561 0.006 . 1 . . . . A 11 THR H . 36403 1
111 . 1 . 1 22 22 THR HA H 1 5.298 0.007 . 1 . . . . A 11 THR HA . 36403 1
112 . 1 . 1 22 22 THR HB H 1 5.043 0.009 . 1 . . . . A 11 THR HB . 36403 1
113 . 1 . 1 22 22 THR HG21 H 1 1.495 0.005 . 1 . . . . A 11 THR HG21 . 36403 1
114 . 1 . 1 22 22 THR HG22 H 1 1.495 0.005 . 1 . . . . A 11 THR HG22 . 36403 1
115 . 1 . 1 22 22 THR HG23 H 1 1.495 0.005 . 1 . . . . A 11 THR HG23 . 36403 1
116 . 1 . 1 22 22 THR CA C 13 59.517 0.062 . 1 . . . . A 11 THR CA . 36403 1
117 . 1 . 1 22 22 THR CB C 13 69.087 0.115 . 1 . . . . A 11 THR CB . 36403 1
118 . 1 . 1 22 22 THR CG2 C 13 22.228 0.102 . 1 . . . . A 11 THR CG2 . 36403 1
119 . 1 . 1 22 22 THR N N 15 109.126 0.077 . 1 . . . . A 11 THR N . 36403 1
120 . 1 . 1 23 23 PRO HA H 1 4.143 0.005 . 1 . . . . A 12 PRO HA . 36403 1
121 . 1 . 1 23 23 PRO HB2 H 1 2.371 0.005 . 2 . . . . A 12 PRO HB2 . 36403 1
122 . 1 . 1 23 23 PRO HB3 H 1 1.872 0.008 . 2 . . . . A 12 PRO HB3 . 36403 1
123 . 1 . 1 23 23 PRO HG2 H 1 2.121 0.013 . 2 . . . . A 12 PRO HG2 . 36403 1
124 . 1 . 1 23 23 PRO HG3 H 1 1.664 0.008 . 2 . . . . A 12 PRO HG3 . 36403 1
125 . 1 . 1 23 23 PRO HD2 H 1 4.188 0.004 . 2 . . . . A 12 PRO HD2 . 36403 1
126 . 1 . 1 23 23 PRO HD3 H 1 4.026 0.009 . 2 . . . . A 12 PRO HD3 . 36403 1
127 . 1 . 1 23 23 PRO CA C 13 65.552 0.057 . 1 . . . . A 12 PRO CA . 36403 1
128 . 1 . 1 23 23 PRO CB C 13 31.964 0.064 . 1 . . . . A 12 PRO CB . 36403 1
129 . 1 . 1 23 23 PRO CG C 13 28.477 0.094 . 1 . . . . A 12 PRO CG . 36403 1
130 . 1 . 1 23 23 PRO CD C 13 50.648 0.098 . 1 . . . . A 12 PRO CD . 36403 1
131 . 1 . 1 24 24 LYS HA H 1 4.297 0.005 . 1 . . . . A 13 LYS HA . 36403 1
132 . 1 . 1 24 24 LYS HB2 H 1 1.883 0.012 . 2 . . . . A 13 LYS HB2 . 36403 1
133 . 1 . 1 24 24 LYS HB3 H 1 1.715 0.010 . 2 . . . . A 13 LYS HB3 . 36403 1
134 . 1 . 1 24 24 LYS HG2 H 1 1.438 0.018 . 2 . . . . A 13 LYS HG2 . 36403 1
135 . 1 . 1 24 24 LYS HG3 H 1 1.438 0.018 . 2 . . . . A 13 LYS HG3 . 36403 1
136 . 1 . 1 24 24 LYS HD2 H 1 1.635 0.006 . 2 . . . . A 13 LYS HD2 . 36403 1
137 . 1 . 1 24 24 LYS HD3 H 1 1.635 0.006 . 2 . . . . A 13 LYS HD3 . 36403 1
138 . 1 . 1 24 24 LYS HE2 H 1 2.952 0.001 . 2 . . . . A 13 LYS HE2 . 36403 1
139 . 1 . 1 24 24 LYS HE3 H 1 2.952 0.001 . 2 . . . . A 13 LYS HE3 . 36403 1
140 . 1 . 1 24 24 LYS CA C 13 55.990 0.044 . 1 . . . . A 13 LYS CA . 36403 1
141 . 1 . 1 24 24 LYS CB C 13 32.679 0.030 . 1 . . . . A 13 LYS CB . 36403 1
142 . 1 . 1 24 24 LYS CG C 13 25.199 0.010 . 1 . . . . A 13 LYS CG . 36403 1
143 . 1 . 1 24 24 LYS CD C 13 28.993 0.045 . 1 . . . . A 13 LYS CD . 36403 1
144 . 1 . 1 24 24 LYS CE C 13 42.079 0.010 . 1 . . . . A 13 LYS CE . 36403 1
145 . 1 . 1 25 25 GLY H H 1 8.185 0.006 . 1 . . . . A 14 GLY H . 36403 1
146 . 1 . 1 25 25 GLY HA2 H 1 4.219 0.012 . 2 . . . . A 14 GLY HA2 . 36403 1
147 . 1 . 1 25 25 GLY HA3 H 1 3.480 0.009 . 2 . . . . A 14 GLY HA3 . 36403 1
148 . 1 . 1 25 25 GLY CA C 13 45.135 0.035 . 1 . . . . A 14 GLY CA . 36403 1
149 . 1 . 1 25 25 GLY N N 15 107.757 0.103 . 1 . . . . A 14 GLY N . 36403 1
150 . 1 . 1 26 26 ASP H H 1 7.424 0.004 . 1 . . . . A 15 ASP H . 36403 1
151 . 1 . 1 26 26 ASP HA H 1 4.633 0.006 . 1 . . . . A 15 ASP HA . 36403 1
152 . 1 . 1 26 26 ASP HB2 H 1 2.569 0.005 . 2 . . . . A 15 ASP HB2 . 36403 1
153 . 1 . 1 26 26 ASP HB3 H 1 2.569 0.005 . 2 . . . . A 15 ASP HB3 . 36403 1
154 . 1 . 1 26 26 ASP CA C 13 54.683 0.066 . 1 . . . . A 15 ASP CA . 36403 1
155 . 1 . 1 26 26 ASP CB C 13 41.352 0.100 . 1 . . . . A 15 ASP CB . 36403 1
156 . 1 . 1 26 26 ASP N N 15 119.558 0.072 . 1 . . . . A 15 ASP N . 36403 1
157 . 1 . 1 27 27 VAL H H 1 8.364 0.002 . 1 . . . . A 16 VAL H . 36403 1
158 . 1 . 1 27 27 VAL HA H 1 4.429 0.007 . 1 . . . . A 16 VAL HA . 36403 1
159 . 1 . 1 27 27 VAL HB H 1 1.850 0.008 . 1 . . . . A 16 VAL HB . 36403 1
160 . 1 . 1 27 27 VAL HG11 H 1 0.763 0.009 . 2 . . . . A 16 VAL HG11 . 36403 1
161 . 1 . 1 27 27 VAL HG12 H 1 0.763 0.009 . 2 . . . . A 16 VAL HG12 . 36403 1
162 . 1 . 1 27 27 VAL HG13 H 1 0.763 0.009 . 2 . . . . A 16 VAL HG13 . 36403 1
163 . 1 . 1 27 27 VAL HG21 H 1 0.668 0.010 . 2 . . . . A 16 VAL HG21 . 36403 1
164 . 1 . 1 27 27 VAL HG22 H 1 0.668 0.010 . 2 . . . . A 16 VAL HG22 . 36403 1
165 . 1 . 1 27 27 VAL HG23 H 1 0.668 0.010 . 2 . . . . A 16 VAL HG23 . 36403 1
166 . 1 . 1 27 27 VAL CA C 13 61.758 0.093 . 1 . . . . A 16 VAL CA . 36403 1
167 . 1 . 1 27 27 VAL CB C 13 32.990 0.059 . 1 . . . . A 16 VAL CB . 36403 1
168 . 1 . 1 27 27 VAL CG1 C 13 21.989 0.067 . 2 . . . . A 16 VAL CG1 . 36403 1
169 . 1 . 1 27 27 VAL CG2 C 13 21.070 0.049 . 2 . . . . A 16 VAL CG2 . 36403 1
170 . 1 . 1 27 27 VAL N N 15 120.909 0.085 . 1 . . . . A 16 VAL N . 36403 1
171 . 1 . 1 28 28 ILE H H 1 9.315 0.003 . 1 . . . . A 17 ILE H . 36403 1
172 . 1 . 1 28 28 ILE HA H 1 4.298 0.004 . 1 . . . . A 17 ILE HA . 36403 1
173 . 1 . 1 28 28 ILE HB H 1 1.768 0.007 . 1 . . . . A 17 ILE HB . 36403 1
174 . 1 . 1 28 28 ILE HG12 H 1 1.285 0.007 . 2 . . . . A 17 ILE HG12 . 36403 1
175 . 1 . 1 28 28 ILE HG13 H 1 1.010 0.005 . 2 . . . . A 17 ILE HG13 . 36403 1
176 . 1 . 1 28 28 ILE HG21 H 1 0.530 0.003 . 1 . . . . A 17 ILE HG21 . 36403 1
177 . 1 . 1 28 28 ILE HG22 H 1 0.530 0.003 . 1 . . . . A 17 ILE HG22 . 36403 1
178 . 1 . 1 28 28 ILE HG23 H 1 0.530 0.003 . 1 . . . . A 17 ILE HG23 . 36403 1
179 . 1 . 1 28 28 ILE HD11 H 1 0.477 0.004 . 1 . . . . A 17 ILE HD11 . 36403 1
180 . 1 . 1 28 28 ILE HD12 H 1 0.477 0.004 . 1 . . . . A 17 ILE HD12 . 36403 1
181 . 1 . 1 28 28 ILE HD13 H 1 0.477 0.004 . 1 . . . . A 17 ILE HD13 . 36403 1
182 . 1 . 1 28 28 ILE CA C 13 58.439 0.063 . 1 . . . . A 17 ILE CA . 36403 1
183 . 1 . 1 28 28 ILE CB C 13 38.957 0.018 . 1 . . . . A 17 ILE CB . 36403 1
184 . 1 . 1 28 28 ILE CG1 C 13 27.167 0.033 . 1 . . . . A 17 ILE CG1 . 36403 1
185 . 1 . 1 28 28 ILE CG2 C 13 16.764 0.040 . 1 . . . . A 17 ILE CG2 . 36403 1
186 . 1 . 1 28 28 ILE CD1 C 13 10.612 0.050 . 1 . . . . A 17 ILE CD1 . 36403 1
187 . 1 . 1 28 28 ILE N N 15 131.900 0.097 . 1 . . . . A 17 ILE N . 36403 1
188 . 1 . 1 29 29 THR H H 1 8.089 0.003 . 1 . . . . A 18 THR H . 36403 1
189 . 1 . 1 29 29 THR HA H 1 5.048 0.012 . 1 . . . . A 18 THR HA . 36403 1
190 . 1 . 1 29 29 THR HB H 1 3.859 0.006 . 1 . . . . A 18 THR HB . 36403 1
191 . 1 . 1 29 29 THR HG21 H 1 0.921 0.006 . 1 . . . . A 18 THR HG21 . 36403 1
192 . 1 . 1 29 29 THR HG22 H 1 0.921 0.006 . 1 . . . . A 18 THR HG22 . 36403 1
193 . 1 . 1 29 29 THR HG23 H 1 0.921 0.006 . 1 . . . . A 18 THR HG23 . 36403 1
194 . 1 . 1 29 29 THR CA C 13 60.909 0.101 . 1 . . . . A 18 THR CA . 36403 1
195 . 1 . 1 29 29 THR CB C 13 69.654 0.027 . 1 . . . . A 18 THR CB . 36403 1
196 . 1 . 1 29 29 THR CG2 C 13 21.510 0.000 . 1 . . . . A 18 THR CG2 . 36403 1
197 . 1 . 1 29 29 THR N N 15 120.969 0.079 . 1 . . . . A 18 THR N . 36403 1
198 . 1 . 1 30 30 LEU H H 1 8.627 0.004 . 1 . . . . A 19 LEU H . 36403 1
199 . 1 . 1 30 30 LEU HA H 1 4.852 0.008 . 1 . . . . A 19 LEU HA . 36403 1
200 . 1 . 1 30 30 LEU HB2 H 1 1.650 0.006 . 2 . . . . A 19 LEU HB2 . 36403 1
201 . 1 . 1 30 30 LEU HB3 H 1 1.069 0.008 . 2 . . . . A 19 LEU HB3 . 36403 1
202 . 1 . 1 30 30 LEU HG H 1 1.353 0.005 . 1 . . . . A 19 LEU HG . 36403 1
203 . 1 . 1 30 30 LEU HD11 H 1 0.687 0.009 . 2 . . . . A 19 LEU HD11 . 36403 1
204 . 1 . 1 30 30 LEU HD12 H 1 0.687 0.009 . 2 . . . . A 19 LEU HD12 . 36403 1
205 . 1 . 1 30 30 LEU HD13 H 1 0.687 0.009 . 2 . . . . A 19 LEU HD13 . 36403 1
206 . 1 . 1 30 30 LEU HD21 H 1 0.715 0.006 . 2 . . . . A 19 LEU HD21 . 36403 1
207 . 1 . 1 30 30 LEU HD22 H 1 0.715 0.006 . 2 . . . . A 19 LEU HD22 . 36403 1
208 . 1 . 1 30 30 LEU HD23 H 1 0.715 0.006 . 2 . . . . A 19 LEU HD23 . 36403 1
209 . 1 . 1 30 30 LEU CA C 13 51.707 0.041 . 1 . . . . A 19 LEU CA . 36403 1
210 . 1 . 1 30 30 LEU CB C 13 45.413 0.044 . 1 . . . . A 19 LEU CB . 36403 1
211 . 1 . 1 30 30 LEU CG C 13 26.533 0.018 . 1 . . . . A 19 LEU CG . 36403 1
212 . 1 . 1 30 30 LEU CD1 C 13 27.617 0.061 . 2 . . . . A 19 LEU CD1 . 36403 1
213 . 1 . 1 30 30 LEU CD2 C 13 23.232 0.093 . 2 . . . . A 19 LEU CD2 . 36403 1
214 . 1 . 1 30 30 LEU N N 15 125.450 0.113 . 1 . . . . A 19 LEU N . 36403 1
215 . 1 . 1 31 31 PRO HA H 1 4.618 0.006 . 1 . . . . A 20 PRO HA . 36403 1
216 . 1 . 1 31 31 PRO HB2 H 1 2.318 0.012 . 2 . . . . A 20 PRO HB2 . 36403 1
217 . 1 . 1 31 31 PRO HB3 H 1 1.646 0.009 . 2 . . . . A 20 PRO HB3 . 36403 1
218 . 1 . 1 31 31 PRO HG2 H 1 1.919 0.004 . 2 . . . . A 20 PRO HG2 . 36403 1
219 . 1 . 1 31 31 PRO HG3 H 1 1.889 0.005 . 2 . . . . A 20 PRO HG3 . 36403 1
220 . 1 . 1 31 31 PRO HD2 H 1 3.707 0.009 . 2 . . . . A 20 PRO HD2 . 36403 1
221 . 1 . 1 31 31 PRO HD3 H 1 3.405 0.010 . 2 . . . . A 20 PRO HD3 . 36403 1
222 . 1 . 1 31 31 PRO CA C 13 62.539 0.057 . 1 . . . . A 20 PRO CA . 36403 1
223 . 1 . 1 31 31 PRO CB C 13 32.225 0.050 . 1 . . . . A 20 PRO CB . 36403 1
224 . 1 . 1 31 31 PRO CG C 13 27.816 0.090 . 1 . . . . A 20 PRO CG . 36403 1
225 . 1 . 1 31 31 PRO CD C 13 49.975 0.094 . 1 . . . . A 20 PRO CD . 36403 1
226 . 1 . 1 32 32 THR H H 1 8.281 0.004 . 1 . . . . A 21 THR H . 36403 1
227 . 1 . 1 32 32 THR HA H 1 3.805 0.005 . 1 . . . . A 21 THR HA . 36403 1
228 . 1 . 1 32 32 THR HB H 1 3.830 0.004 . 1 . . . . A 21 THR HB . 36403 1
229 . 1 . 1 32 32 THR HG21 H 1 1.091 0.004 . 1 . . . . A 21 THR HG21 . 36403 1
230 . 1 . 1 32 32 THR HG22 H 1 1.091 0.004 . 1 . . . . A 21 THR HG22 . 36403 1
231 . 1 . 1 32 32 THR HG23 H 1 1.091 0.004 . 1 . . . . A 21 THR HG23 . 36403 1
232 . 1 . 1 32 32 THR CA C 13 64.922 0.053 . 1 . . . . A 21 THR CA . 36403 1
233 . 1 . 1 32 32 THR CB C 13 68.465 0.049 . 1 . . . . A 21 THR CB . 36403 1
234 . 1 . 1 32 32 THR CG2 C 13 21.958 0.068 . 1 . . . . A 21 THR CG2 . 36403 1
235 . 1 . 1 32 32 THR N N 15 119.851 0.098 . 1 . . . . A 21 THR N . 36403 1
236 . 1 . 1 33 33 GLY H H 1 9.150 0.005 . 1 . . . . A 22 GLY H . 36403 1
237 . 1 . 1 33 33 GLY HA2 H 1 4.282 0.006 . 2 . . . . A 22 GLY HA2 . 36403 1
238 . 1 . 1 33 33 GLY HA3 H 1 3.377 0.008 . 2 . . . . A 22 GLY HA3 . 36403 1
239 . 1 . 1 33 33 GLY CA C 13 45.075 0.056 . 1 . . . . A 22 GLY CA . 36403 1
240 . 1 . 1 33 33 GLY N N 15 115.621 0.084 . 1 . . . . A 22 GLY N . 36403 1
241 . 1 . 1 34 34 SER H H 1 7.303 0.003 . 1 . . . . A 23 SER H . 36403 1
242 . 1 . 1 34 34 SER HA H 1 4.605 0.011 . 1 . . . . A 23 SER HA . 36403 1
243 . 1 . 1 34 34 SER HB2 H 1 3.854 0.011 . 2 . . . . A 23 SER HB2 . 36403 1
244 . 1 . 1 34 34 SER HB3 H 1 3.524 0.014 . 2 . . . . A 23 SER HB3 . 36403 1
245 . 1 . 1 34 34 SER CA C 13 60.642 0.054 . 1 . . . . A 23 SER CA . 36403 1
246 . 1 . 1 34 34 SER N N 15 115.602 0.075 . 1 . . . . A 23 SER N . 36403 1
247 . 1 . 1 35 35 THR H H 1 9.632 0.004 . 1 . . . . A 24 THR H . 36403 1
248 . 1 . 1 35 35 THR HA H 1 5.372 0.008 . 1 . . . . A 24 THR HA . 36403 1
249 . 1 . 1 35 35 THR HB H 1 4.894 0.009 . 1 . . . . A 24 THR HB . 36403 1
250 . 1 . 1 35 35 THR HG21 H 1 1.030 0.009 . 1 . . . . A 24 THR HG21 . 36403 1
251 . 1 . 1 35 35 THR HG22 H 1 1.030 0.009 . 1 . . . . A 24 THR HG22 . 36403 1
252 . 1 . 1 35 35 THR HG23 H 1 1.030 0.009 . 1 . . . . A 24 THR HG23 . 36403 1
253 . 1 . 1 35 35 THR CA C 13 60.040 0.073 . 1 . . . . A 24 THR CA . 36403 1
254 . 1 . 1 35 35 THR CB C 13 70.282 0.095 . 1 . . . . A 24 THR CB . 36403 1
255 . 1 . 1 35 35 THR CG2 C 13 21.157 0.027 . 1 . . . . A 24 THR CG2 . 36403 1
256 . 1 . 1 35 35 THR N N 15 115.113 0.116 . 1 . . . . A 24 THR N . 36403 1
257 . 1 . 1 36 36 PRO HA H 1 3.987 0.009 . 1 . . . . A 25 PRO HA . 36403 1
258 . 1 . 1 36 36 PRO HB2 H 1 1.863 0.008 . 2 . . . . A 25 PRO HB2 . 36403 1
259 . 1 . 1 36 36 PRO HB3 H 1 1.578 0.007 . 2 . . . . A 25 PRO HB3 . 36403 1
260 . 1 . 1 36 36 PRO HG2 H 1 1.355 0.001 . 2 . . . . A 25 PRO HG2 . 36403 1
261 . 1 . 1 36 36 PRO HG3 H 1 1.355 0.001 . 2 . . . . A 25 PRO HG3 . 36403 1
262 . 1 . 1 36 36 PRO HD2 H 1 4.308 0.004 . 2 . . . . A 25 PRO HD2 . 36403 1
263 . 1 . 1 36 36 PRO HD3 H 1 4.027 0.008 . 2 . . . . A 25 PRO HD3 . 36403 1
264 . 1 . 1 36 36 PRO CA C 13 65.825 0.027 . 1 . . . . A 25 PRO CA . 36403 1
265 . 1 . 1 36 36 PRO CB C 13 32.729 0.054 . 1 . . . . A 25 PRO CB . 36403 1
266 . 1 . 1 36 36 PRO CG C 13 27.938 0.010 . 1 . . . . A 25 PRO CG . 36403 1
267 . 1 . 1 36 36 PRO CD C 13 51.065 0.077 . 1 . . . . A 25 PRO CD . 36403 1
268 . 1 . 1 37 37 VAL H H 1 7.432 0.003 . 1 . . . . A 26 VAL H . 36403 1
269 . 1 . 1 37 37 VAL HA H 1 3.574 0.010 . 1 . . . . A 26 VAL HA . 36403 1
270 . 1 . 1 37 37 VAL HB H 1 1.792 0.007 . 1 . . . . A 26 VAL HB . 36403 1
271 . 1 . 1 37 37 VAL HG11 H 1 0.959 0.008 . 2 . . . . A 26 VAL HG11 . 36403 1
272 . 1 . 1 37 37 VAL HG12 H 1 0.959 0.008 . 2 . . . . A 26 VAL HG12 . 36403 1
273 . 1 . 1 37 37 VAL HG13 H 1 0.959 0.008 . 2 . . . . A 26 VAL HG13 . 36403 1
274 . 1 . 1 37 37 VAL HG21 H 1 0.908 0.004 . 2 . . . . A 26 VAL HG21 . 36403 1
275 . 1 . 1 37 37 VAL HG22 H 1 0.908 0.004 . 2 . . . . A 26 VAL HG22 . 36403 1
276 . 1 . 1 37 37 VAL HG23 H 1 0.908 0.004 . 2 . . . . A 26 VAL HG23 . 36403 1
277 . 1 . 1 37 37 VAL CA C 13 66.643 0.064 . 1 . . . . A 26 VAL CA . 36403 1
278 . 1 . 1 37 37 VAL CB C 13 32.055 0.007 . 1 . . . . A 26 VAL CB . 36403 1
279 . 1 . 1 37 37 VAL CG1 C 13 23.728 0.035 . 2 . . . . A 26 VAL CG1 . 36403 1
280 . 1 . 1 37 37 VAL CG2 C 13 21.690 0.052 . 2 . . . . A 26 VAL CG2 . 36403 1
281 . 1 . 1 37 37 VAL N N 15 115.342 0.096 . 1 . . . . A 26 VAL N . 36403 1
282 . 1 . 1 38 38 ASP H H 1 7.864 0.004 . 1 . . . . A 27 ASP H . 36403 1
283 . 1 . 1 38 38 ASP HA H 1 4.436 0.010 . 1 . . . . A 27 ASP HA . 36403 1
284 . 1 . 1 38 38 ASP HB2 H 1 2.895 0.005 . 2 . . . . A 27 ASP HB2 . 36403 1
285 . 1 . 1 38 38 ASP HB3 H 1 2.746 0.007 . 2 . . . . A 27 ASP HB3 . 36403 1
286 . 1 . 1 38 38 ASP CA C 13 57.750 0.075 . 1 . . . . A 27 ASP CA . 36403 1
287 . 1 . 1 38 38 ASP CB C 13 41.512 0.018 . 1 . . . . A 27 ASP CB . 36403 1
288 . 1 . 1 38 38 ASP N N 15 118.602 0.081 . 1 . . . . A 27 ASP N . 36403 1
289 . 1 . 1 39 39 PHE H H 1 7.864 0.004 . 1 . . . . A 28 PHE H . 36403 1
290 . 1 . 1 39 39 PHE HA H 1 3.813 0.002 . 1 . . . . A 28 PHE HA . 36403 1
291 . 1 . 1 39 39 PHE HB2 H 1 3.323 0.014 . 2 . . . . A 28 PHE HB2 . 36403 1
292 . 1 . 1 39 39 PHE HB3 H 1 2.530 0.013 . 2 . . . . A 28 PHE HB3 . 36403 1
293 . 1 . 1 39 39 PHE HD1 H 1 6.776 0.013 . 3 . . . . A 28 PHE HD1 . 36403 1
294 . 1 . 1 39 39 PHE HD2 H 1 6.776 0.013 . 3 . . . . A 28 PHE HD2 . 36403 1
295 . 1 . 1 39 39 PHE HE1 H 1 6.726 0.003 . 3 . . . . A 28 PHE HE1 . 36403 1
296 . 1 . 1 39 39 PHE HE2 H 1 6.726 0.003 . 3 . . . . A 28 PHE HE2 . 36403 1
297 . 1 . 1 39 39 PHE CA C 13 61.604 0.095 . 1 . . . . A 28 PHE CA . 36403 1
298 . 1 . 1 39 39 PHE CB C 13 38.571 0.050 . 1 . . . . A 28 PHE CB . 36403 1
299 . 1 . 1 39 39 PHE N N 15 119.766 0.118 . 1 . . . . A 28 PHE N . 36403 1
300 . 1 . 1 40 40 ALA H H 1 8.477 0.003 . 1 . . . . A 29 ALA H . 36403 1
301 . 1 . 1 40 40 ALA HA H 1 3.698 0.007 . 1 . . . . A 29 ALA HA . 36403 1
302 . 1 . 1 40 40 ALA HB1 H 1 1.491 0.004 . 1 . . . . A 29 ALA HB1 . 36403 1
303 . 1 . 1 40 40 ALA HB2 H 1 1.491 0.004 . 1 . . . . A 29 ALA HB2 . 36403 1
304 . 1 . 1 40 40 ALA HB3 H 1 1.491 0.004 . 1 . . . . A 29 ALA HB3 . 36403 1
305 . 1 . 1 40 40 ALA CA C 13 55.572 0.042 . 1 . . . . A 29 ALA CA . 36403 1
306 . 1 . 1 40 40 ALA CB C 13 18.428 0.026 . 1 . . . . A 29 ALA CB . 36403 1
307 . 1 . 1 40 40 ALA N N 15 121.824 0.121 . 1 . . . . A 29 ALA N . 36403 1
308 . 1 . 1 41 41 TYR H H 1 7.765 0.004 . 1 . . . . A 30 TYR H . 36403 1
309 . 1 . 1 41 41 TYR HA H 1 4.057 0.007 . 1 . . . . A 30 TYR HA . 36403 1
310 . 1 . 1 41 41 TYR HB2 H 1 2.983 0.012 . 2 . . . . A 30 TYR HB2 . 36403 1
311 . 1 . 1 41 41 TYR HB3 H 1 2.871 0.005 . 2 . . . . A 30 TYR HB3 . 36403 1
312 . 1 . 1 41 41 TYR HD1 H 1 7.176 0.011 . 3 . . . . A 30 TYR HD1 . 36403 1
313 . 1 . 1 41 41 TYR HD2 H 1 7.176 0.011 . 3 . . . . A 30 TYR HD2 . 36403 1
314 . 1 . 1 41 41 TYR CA C 13 61.556 0.059 . 1 . . . . A 30 TYR CA . 36403 1
315 . 1 . 1 41 41 TYR CB C 13 38.311 0.038 . 1 . . . . A 30 TYR CB . 36403 1
316 . 1 . 1 41 41 TYR N N 15 114.209 0.113 . 1 . . . . A 30 TYR N . 36403 1
317 . 1 . 1 42 42 ALA H H 1 7.515 0.003 . 1 . . . . A 31 ALA H . 36403 1
318 . 1 . 1 42 42 ALA HA H 1 4.032 0.003 . 1 . . . . A 31 ALA HA . 36403 1
319 . 1 . 1 42 42 ALA HB1 H 1 1.250 0.003 . 1 . . . . A 31 ALA HB1 . 36403 1
320 . 1 . 1 42 42 ALA HB2 H 1 1.250 0.003 . 1 . . . . A 31 ALA HB2 . 36403 1
321 . 1 . 1 42 42 ALA HB3 H 1 1.250 0.003 . 1 . . . . A 31 ALA HB3 . 36403 1
322 . 1 . 1 42 42 ALA CA C 13 54.008 0.051 . 1 . . . . A 31 ALA CA . 36403 1
323 . 1 . 1 42 42 ALA CB C 13 18.753 0.032 . 1 . . . . A 31 ALA CB . 36403 1
324 . 1 . 1 42 42 ALA N N 15 120.650 0.106 . 1 . . . . A 31 ALA N . 36403 1
325 . 1 . 1 43 43 VAL H H 1 7.448 0.005 . 1 . . . . A 32 VAL H . 36403 1
326 . 1 . 1 43 43 VAL HA H 1 3.653 0.004 . 1 . . . . A 32 VAL HA . 36403 1
327 . 1 . 1 43 43 VAL HB H 1 1.555 0.009 . 1 . . . . A 32 VAL HB . 36403 1
328 . 1 . 1 43 43 VAL HG11 H 1 0.368 0.007 . 2 . . . . A 32 VAL HG11 . 36403 1
329 . 1 . 1 43 43 VAL HG12 H 1 0.368 0.007 . 2 . . . . A 32 VAL HG12 . 36403 1
330 . 1 . 1 43 43 VAL HG13 H 1 0.368 0.007 . 2 . . . . A 32 VAL HG13 . 36403 1
331 . 1 . 1 43 43 VAL HG21 H 1 0.203 0.006 . 2 . . . . A 32 VAL HG21 . 36403 1
332 . 1 . 1 43 43 VAL HG22 H 1 0.203 0.006 . 2 . . . . A 32 VAL HG22 . 36403 1
333 . 1 . 1 43 43 VAL HG23 H 1 0.203 0.006 . 2 . . . . A 32 VAL HG23 . 36403 1
334 . 1 . 1 43 43 VAL CA C 13 64.159 0.032 . 1 . . . . A 32 VAL CA . 36403 1
335 . 1 . 1 43 43 VAL CB C 13 32.639 0.006 . 1 . . . . A 32 VAL CB . 36403 1
336 . 1 . 1 43 43 VAL CG1 C 13 20.835 0.039 . 2 . . . . A 32 VAL CG1 . 36403 1
337 . 1 . 1 43 43 VAL CG2 C 13 20.809 0.068 . 2 . . . . A 32 VAL CG2 . 36403 1
338 . 1 . 1 43 43 VAL N N 15 115.315 0.063 . 1 . . . . A 32 VAL N . 36403 1
339 . 1 . 1 44 44 HIS H H 1 7.904 0.005 . 1 . . . . A 33 HIS H . 36403 1
340 . 1 . 1 44 44 HIS HA H 1 4.566 0.018 . 1 . . . . A 33 HIS HA . 36403 1
341 . 1 . 1 44 44 HIS HB2 H 1 3.053 0.012 . 2 . . . . A 33 HIS HB2 . 36403 1
342 . 1 . 1 44 44 HIS HB3 H 1 2.938 0.007 . 2 . . . . A 33 HIS HB3 . 36403 1
343 . 1 . 1 44 44 HIS CA C 13 56.424 0.013 . 1 . . . . A 33 HIS CA . 36403 1
344 . 1 . 1 44 44 HIS CB C 13 30.903 0.110 . 1 . . . . A 33 HIS CB . 36403 1
345 . 1 . 1 44 44 HIS N N 15 119.168 0.138 . 1 . . . . A 33 HIS N . 36403 1
346 . 1 . 1 45 45 THR HA H 1 3.973 0.006 . 1 . . . . A 34 THR HA . 36403 1
347 . 1 . 1 45 45 THR HB H 1 4.021 0.004 . 1 . . . . A 34 THR HB . 36403 1
348 . 1 . 1 45 45 THR HG21 H 1 1.114 0.004 . 1 . . . . A 34 THR HG21 . 36403 1
349 . 1 . 1 45 45 THR HG22 H 1 1.114 0.004 . 1 . . . . A 34 THR HG22 . 36403 1
350 . 1 . 1 45 45 THR HG23 H 1 1.114 0.004 . 1 . . . . A 34 THR HG23 . 36403 1
351 . 1 . 1 45 45 THR CA C 13 64.971 0.056 . 1 . . . . A 34 THR CA . 36403 1
352 . 1 . 1 45 45 THR CB C 13 69.341 0.027 . 1 . . . . A 34 THR CB . 36403 1
353 . 1 . 1 45 45 THR CG2 C 13 21.692 0.131 . 1 . . . . A 34 THR CG2 . 36403 1
354 . 1 . 1 46 46 GLU HA H 1 4.128 0.007 . 1 . . . . A 35 GLU HA . 36403 1
355 . 1 . 1 46 46 GLU HB2 H 1 1.956 0.009 . 2 . . . . A 35 GLU HB2 . 36403 1
356 . 1 . 1 46 46 GLU HB3 H 1 1.904 0.003 . 2 . . . . A 35 GLU HB3 . 36403 1
357 . 1 . 1 46 46 GLU HG2 H 1 2.201 0.011 . 2 . . . . A 35 GLU HG2 . 36403 1
358 . 1 . 1 46 46 GLU HG3 H 1 2.201 0.011 . 2 . . . . A 35 GLU HG3 . 36403 1
359 . 1 . 1 46 46 GLU CA C 13 57.763 0.116 . 1 . . . . A 35 GLU CA . 36403 1
360 . 1 . 1 46 46 GLU CB C 13 29.780 0.074 . 1 . . . . A 35 GLU CB . 36403 1
361 . 1 . 1 46 46 GLU CG C 13 36.374 0.037 . 1 . . . . A 35 GLU CG . 36403 1
362 . 1 . 1 47 47 VAL H H 1 7.727 0.012 . 1 . . . . A 36 VAL H . 36403 1
363 . 1 . 1 47 47 VAL HA H 1 3.768 0.005 . 1 . . . . A 36 VAL HA . 36403 1
364 . 1 . 1 47 47 VAL HB H 1 2.015 0.004 . 1 . . . . A 36 VAL HB . 36403 1
365 . 1 . 1 47 47 VAL HG11 H 1 0.737 0.008 . 2 . . . . A 36 VAL HG11 . 36403 1
366 . 1 . 1 47 47 VAL HG12 H 1 0.737 0.008 . 2 . . . . A 36 VAL HG12 . 36403 1
367 . 1 . 1 47 47 VAL HG13 H 1 0.737 0.008 . 2 . . . . A 36 VAL HG13 . 36403 1
368 . 1 . 1 47 47 VAL HG21 H 1 0.706 0.006 . 2 . . . . A 36 VAL HG21 . 36403 1
369 . 1 . 1 47 47 VAL HG22 H 1 0.706 0.006 . 2 . . . . A 36 VAL HG22 . 36403 1
370 . 1 . 1 47 47 VAL HG23 H 1 0.706 0.006 . 2 . . . . A 36 VAL HG23 . 36403 1
371 . 1 . 1 47 47 VAL CA C 13 63.136 0.010 . 1 . . . . A 36 VAL CA . 36403 1
372 . 1 . 1 47 47 VAL CB C 13 31.895 0.035 . 1 . . . . A 36 VAL CB . 36403 1
373 . 1 . 1 47 47 VAL CG1 C 13 21.323 0.054 . 2 . . . . A 36 VAL CG1 . 36403 1
374 . 1 . 1 47 47 VAL CG2 C 13 21.206 0.085 . 2 . . . . A 36 VAL CG2 . 36403 1
375 . 1 . 1 47 47 VAL N N 15 120.648 0.073 . 1 . . . . A 36 VAL N . 36403 1
376 . 1 . 1 48 48 GLY HA2 H 1 3.892 0.000 . 2 . . . . A 37 GLY HA2 . 36403 1
377 . 1 . 1 48 48 GLY HA3 H 1 3.818 0.000 . 2 . . . . A 37 GLY HA3 . 36403 1
378 . 1 . 1 48 48 GLY CA C 13 45.167 0.020 . 1 . . . . A 37 GLY CA . 36403 1
379 . 1 . 1 49 49 HIS HA H 1 4.662 0.001 . 1 . . . . A 38 HIS HA . 36403 1
380 . 1 . 1 49 49 HIS HB2 H 1 2.911 0.000 . 2 . . . . A 38 HIS HB2 . 36403 1
381 . 1 . 1 49 49 HIS HB3 H 1 2.815 0.001 . 2 . . . . A 38 HIS HB3 . 36403 1
382 . 1 . 1 49 49 HIS CA C 13 54.389 0.003 . 1 . . . . A 38 HIS CA . 36403 1
383 . 1 . 1 50 50 ARG HA H 1 4.271 0.005 . 1 . . . . A 39 ARG HA . 36403 1
384 . 1 . 1 50 50 ARG HB2 H 1 1.835 0.006 . 2 . . . . A 39 ARG HB2 . 36403 1
385 . 1 . 1 50 50 ARG HB3 H 1 1.597 0.010 . 2 . . . . A 39 ARG HB3 . 36403 1
386 . 1 . 1 50 50 ARG HG2 H 1 1.403 0.011 . 2 . . . . A 39 ARG HG2 . 36403 1
387 . 1 . 1 50 50 ARG HG3 H 1 1.380 0.007 . 2 . . . . A 39 ARG HG3 . 36403 1
388 . 1 . 1 50 50 ARG HD2 H 1 3.071 0.005 . 2 . . . . A 39 ARG HD2 . 36403 1
389 . 1 . 1 50 50 ARG HD3 H 1 3.071 0.005 . 2 . . . . A 39 ARG HD3 . 36403 1
390 . 1 . 1 50 50 ARG CA C 13 55.207 0.033 . 1 . . . . A 39 ARG CA . 36403 1
391 . 1 . 1 50 50 ARG CB C 13 30.978 0.035 . 1 . . . . A 39 ARG CB . 36403 1
392 . 1 . 1 50 50 ARG CG C 13 27.331 0.081 . 1 . . . . A 39 ARG CG . 36403 1
393 . 1 . 1 50 50 ARG CD C 13 43.357 0.063 . 1 . . . . A 39 ARG CD . 36403 1
394 . 1 . 1 51 51 CYS HA H 1 4.231 0.011 . 1 . . . . A 40 CYS HA . 36403 1
395 . 1 . 1 51 51 CYS HB2 H 1 2.775 0.004 . 2 . . . . A 40 CYS HB2 . 36403 1
396 . 1 . 1 51 51 CYS HB3 H 1 2.660 0.011 . 2 . . . . A 40 CYS HB3 . 36403 1
397 . 1 . 1 51 51 CYS CA C 13 60.018 0.079 . 1 . . . . A 40 CYS CA . 36403 1
398 . 1 . 1 51 51 CYS CB C 13 27.132 0.020 . 1 . . . . A 40 CYS CB . 36403 1
399 . 1 . 1 52 52 ILE H H 1 8.694 0.007 . 1 . . . . A 41 ILE H . 36403 1
400 . 1 . 1 52 52 ILE HA H 1 4.484 0.005 . 1 . . . . A 41 ILE HA . 36403 1
401 . 1 . 1 52 52 ILE HB H 1 1.960 0.005 . 1 . . . . A 41 ILE HB . 36403 1
402 . 1 . 1 52 52 ILE HG12 H 1 1.181 0.010 . 2 . . . . A 41 ILE HG12 . 36403 1
403 . 1 . 1 52 52 ILE HG13 H 1 0.993 0.005 . 2 . . . . A 41 ILE HG13 . 36403 1
404 . 1 . 1 52 52 ILE HG21 H 1 0.819 0.006 . 1 . . . . A 41 ILE HG21 . 36403 1
405 . 1 . 1 52 52 ILE HG22 H 1 0.819 0.006 . 1 . . . . A 41 ILE HG22 . 36403 1
406 . 1 . 1 52 52 ILE HG23 H 1 0.819 0.006 . 1 . . . . A 41 ILE HG23 . 36403 1
407 . 1 . 1 52 52 ILE HD11 H 1 0.734 0.003 . 1 . . . . A 41 ILE HD11 . 36403 1
408 . 1 . 1 52 52 ILE HD12 H 1 0.734 0.003 . 1 . . . . A 41 ILE HD12 . 36403 1
409 . 1 . 1 52 52 ILE HD13 H 1 0.734 0.003 . 1 . . . . A 41 ILE HD13 . 36403 1
410 . 1 . 1 52 52 ILE CA C 13 60.690 0.028 . 1 . . . . A 41 ILE CA . 36403 1
411 . 1 . 1 52 52 ILE CB C 13 40.450 0.030 . 1 . . . . A 41 ILE CB . 36403 1
412 . 1 . 1 52 52 ILE CG1 C 13 26.772 0.040 . 1 . . . . A 41 ILE CG1 . 36403 1
413 . 1 . 1 52 52 ILE CG2 C 13 18.338 0.101 . 1 . . . . A 41 ILE CG2 . 36403 1
414 . 1 . 1 52 52 ILE CD1 C 13 13.822 0.057 . 1 . . . . A 41 ILE CD1 . 36403 1
415 . 1 . 1 52 52 ILE N N 15 120.090 0.052 . 1 . . . . A 41 ILE N . 36403 1
416 . 1 . 1 53 53 GLY H H 1 7.682 0.006 . 1 . . . . A 42 GLY H . 36403 1
417 . 1 . 1 53 53 GLY HA2 H 1 4.135 0.012 . 2 . . . . A 42 GLY HA2 . 36403 1
418 . 1 . 1 53 53 GLY HA3 H 1 3.627 0.012 . 2 . . . . A 42 GLY HA3 . 36403 1
419 . 1 . 1 53 53 GLY CA C 13 45.045 0.067 . 1 . . . . A 42 GLY CA . 36403 1
420 . 1 . 1 53 53 GLY N N 15 109.576 0.100 . 1 . . . . A 42 GLY N . 36403 1
421 . 1 . 1 54 54 ALA H H 1 8.438 0.004 . 1 . . . . A 43 ALA H . 36403 1
422 . 1 . 1 54 54 ALA HA H 1 4.967 0.007 . 1 . . . . A 43 ALA HA . 36403 1
423 . 1 . 1 54 54 ALA HB1 H 1 0.972 0.007 . 1 . . . . A 43 ALA HB1 . 36403 1
424 . 1 . 1 54 54 ALA HB2 H 1 0.972 0.007 . 1 . . . . A 43 ALA HB2 . 36403 1
425 . 1 . 1 54 54 ALA HB3 H 1 0.972 0.007 . 1 . . . . A 43 ALA HB3 . 36403 1
426 . 1 . 1 54 54 ALA CA C 13 51.199 0.048 . 1 . . . . A 43 ALA CA . 36403 1
427 . 1 . 1 54 54 ALA CB C 13 23.521 0.037 . 1 . . . . A 43 ALA CB . 36403 1
428 . 1 . 1 54 54 ALA N N 15 119.800 0.090 . 1 . . . . A 43 ALA N . 36403 1
429 . 1 . 1 55 55 ARG H H 1 8.861 0.014 . 1 . . . . A 44 ARG H . 36403 1
430 . 1 . 1 55 55 ARG HA H 1 5.092 0.006 . 1 . . . . A 44 ARG HA . 36403 1
431 . 1 . 1 55 55 ARG HB2 H 1 1.522 0.006 . 2 . . . . A 44 ARG HB2 . 36403 1
432 . 1 . 1 55 55 ARG HB3 H 1 1.313 0.007 . 2 . . . . A 44 ARG HB3 . 36403 1
433 . 1 . 1 55 55 ARG HG2 H 1 1.339 0.013 . 2 . . . . A 44 ARG HG2 . 36403 1
434 . 1 . 1 55 55 ARG HG3 H 1 1.220 0.012 . 2 . . . . A 44 ARG HG3 . 36403 1
435 . 1 . 1 55 55 ARG HD2 H 1 2.952 0.010 . 2 . . . . A 44 ARG HD2 . 36403 1
436 . 1 . 1 55 55 ARG HD3 H 1 2.952 0.010 . 2 . . . . A 44 ARG HD3 . 36403 1
437 . 1 . 1 55 55 ARG CA C 13 54.491 0.082 . 1 . . . . A 44 ARG CA . 36403 1
438 . 1 . 1 55 55 ARG CB C 13 35.136 0.064 . 1 . . . . A 44 ARG CB . 36403 1
439 . 1 . 1 55 55 ARG CG C 13 28.267 0.032 . 1 . . . . A 44 ARG CG . 36403 1
440 . 1 . 1 55 55 ARG CD C 13 43.626 0.066 . 1 . . . . A 44 ARG CD . 36403 1
441 . 1 . 1 55 55 ARG N N 15 118.632 0.093 . 1 . . . . A 44 ARG N . 36403 1
442 . 1 . 1 56 56 VAL H H 1 8.874 0.008 . 1 . . . . A 45 VAL H . 36403 1
443 . 1 . 1 56 56 VAL HA H 1 4.857 0.006 . 1 . . . . A 45 VAL HA . 36403 1
444 . 1 . 1 56 56 VAL HB H 1 1.598 0.004 . 1 . . . . A 45 VAL HB . 36403 1
445 . 1 . 1 56 56 VAL HG11 H 1 0.604 0.003 . 2 . . . . A 45 VAL HG11 . 36403 1
446 . 1 . 1 56 56 VAL HG12 H 1 0.604 0.003 . 2 . . . . A 45 VAL HG12 . 36403 1
447 . 1 . 1 56 56 VAL HG13 H 1 0.604 0.003 . 2 . . . . A 45 VAL HG13 . 36403 1
448 . 1 . 1 56 56 VAL HG21 H 1 0.697 0.003 . 2 . . . . A 45 VAL HG21 . 36403 1
449 . 1 . 1 56 56 VAL HG22 H 1 0.697 0.003 . 2 . . . . A 45 VAL HG22 . 36403 1
450 . 1 . 1 56 56 VAL HG23 H 1 0.697 0.003 . 2 . . . . A 45 VAL HG23 . 36403 1
451 . 1 . 1 56 56 VAL CA C 13 60.482 0.047 . 1 . . . . A 45 VAL CA . 36403 1
452 . 1 . 1 56 56 VAL CB C 13 33.779 0.028 . 1 . . . . A 45 VAL CB . 36403 1
453 . 1 . 1 56 56 VAL CG1 C 13 22.944 0.038 . 2 . . . . A 45 VAL CG1 . 36403 1
454 . 1 . 1 56 56 VAL CG2 C 13 21.492 0.049 . 2 . . . . A 45 VAL CG2 . 36403 1
455 . 1 . 1 56 56 VAL N N 15 122.383 0.047 . 1 . . . . A 45 VAL N . 36403 1
456 . 1 . 1 57 57 ASN H H 1 9.974 0.009 . 1 . . . . A 46 ASN H . 36403 1
457 . 1 . 1 57 57 ASN HA H 1 4.291 0.006 . 1 . . . . A 46 ASN HA . 36403 1
458 . 1 . 1 57 57 ASN HB2 H 1 3.065 0.010 . 2 . . . . A 46 ASN HB2 . 36403 1
459 . 1 . 1 57 57 ASN HB3 H 1 2.838 0.005 . 2 . . . . A 46 ASN HB3 . 36403 1
460 . 1 . 1 57 57 ASN CA C 13 53.779 0.084 . 1 . . . . A 46 ASN CA . 36403 1
461 . 1 . 1 57 57 ASN CB C 13 36.536 0.071 . 1 . . . . A 46 ASN CB . 36403 1
462 . 1 . 1 57 57 ASN N N 15 129.478 0.076 . 1 . . . . A 46 ASN N . 36403 1
463 . 1 . 1 58 58 GLY H H 1 8.897 0.060 . 1 . . . . A 47 GLY H . 36403 1
464 . 1 . 1 58 58 GLY HA2 H 1 4.125 0.000 . 2 . . . . A 47 GLY HA2 . 36403 1
465 . 1 . 1 58 58 GLY HA3 H 1 3.502 0.000 . 2 . . . . A 47 GLY HA3 . 36403 1
466 . 1 . 1 58 58 GLY CA C 13 45.348 0.060 . 1 . . . . A 47 GLY CA . 36403 1
467 . 1 . 1 58 58 GLY N N 15 102.008 0.070 . 1 . . . . A 47 GLY N . 36403 1
468 . 1 . 1 59 59 ARG H H 1 7.734 0.005 . 1 . . . . A 48 ARG H . 36403 1
469 . 1 . 1 59 59 ARG HA H 1 4.636 0.004 . 1 . . . . A 48 ARG HA . 36403 1
470 . 1 . 1 59 59 ARG HB2 H 1 1.755 0.008 . 2 . . . . A 48 ARG HB2 . 36403 1
471 . 1 . 1 59 59 ARG HB3 H 1 1.675 0.001 . 2 . . . . A 48 ARG HB3 . 36403 1
472 . 1 . 1 59 59 ARG HG2 H 1 1.565 0.007 . 2 . . . . A 48 ARG HG2 . 36403 1
473 . 1 . 1 59 59 ARG HG3 H 1 1.565 0.007 . 2 . . . . A 48 ARG HG3 . 36403 1
474 . 1 . 1 59 59 ARG HD2 H 1 3.126 0.008 . 2 . . . . A 48 ARG HD2 . 36403 1
475 . 1 . 1 59 59 ARG HD3 H 1 3.126 0.008 . 2 . . . . A 48 ARG HD3 . 36403 1
476 . 1 . 1 59 59 ARG CA C 13 54.086 0.147 . 1 . . . . A 48 ARG CA . 36403 1
477 . 1 . 1 59 59 ARG CB C 13 32.294 0.020 . 1 . . . . A 48 ARG CB . 36403 1
478 . 1 . 1 59 59 ARG CG C 13 26.979 0.017 . 1 . . . . A 48 ARG CG . 36403 1
479 . 1 . 1 59 59 ARG CD C 13 43.306 0.034 . 1 . . . . A 48 ARG CD . 36403 1
480 . 1 . 1 59 59 ARG N N 15 121.592 0.088 . 1 . . . . A 48 ARG N . 36403 1
481 . 1 . 1 60 60 LEU H H 1 8.606 0.007 . 1 . . . . A 49 LEU H . 36403 1
482 . 1 . 1 60 60 LEU HA H 1 4.619 0.007 . 1 . . . . A 49 LEU HA . 36403 1
483 . 1 . 1 60 60 LEU HB2 H 1 1.620 0.008 . 2 . . . . A 49 LEU HB2 . 36403 1
484 . 1 . 1 60 60 LEU HB3 H 1 1.471 0.006 . 2 . . . . A 49 LEU HB3 . 36403 1
485 . 1 . 1 60 60 LEU HG H 1 1.627 0.004 . 1 . . . . A 49 LEU HG . 36403 1
486 . 1 . 1 60 60 LEU HD11 H 1 0.907 0.007 . 2 . . . . A 49 LEU HD11 . 36403 1
487 . 1 . 1 60 60 LEU HD12 H 1 0.907 0.007 . 2 . . . . A 49 LEU HD12 . 36403 1
488 . 1 . 1 60 60 LEU HD13 H 1 0.907 0.007 . 2 . . . . A 49 LEU HD13 . 36403 1
489 . 1 . 1 60 60 LEU HD21 H 1 0.860 0.004 . 2 . . . . A 49 LEU HD21 . 36403 1
490 . 1 . 1 60 60 LEU HD22 H 1 0.860 0.004 . 2 . . . . A 49 LEU HD22 . 36403 1
491 . 1 . 1 60 60 LEU HD23 H 1 0.860 0.004 . 2 . . . . A 49 LEU HD23 . 36403 1
492 . 1 . 1 60 60 LEU CA C 13 56.392 0.046 . 1 . . . . A 49 LEU CA . 36403 1
493 . 1 . 1 60 60 LEU CB C 13 42.165 0.034 . 1 . . . . A 49 LEU CB . 36403 1
494 . 1 . 1 60 60 LEU CG C 13 27.271 0.050 . 1 . . . . A 49 LEU CG . 36403 1
495 . 1 . 1 60 60 LEU CD1 C 13 25.243 0.053 . 2 . . . . A 49 LEU CD1 . 36403 1
496 . 1 . 1 60 60 LEU CD2 C 13 23.817 0.050 . 2 . . . . A 49 LEU CD2 . 36403 1
497 . 1 . 1 60 60 LEU N N 15 125.326 0.050 . 1 . . . . A 49 LEU N . 36403 1
498 . 1 . 1 61 61 VAL H H 1 7.946 0.005 . 1 . . . . A 50 VAL H . 36403 1
499 . 1 . 1 61 61 VAL HA H 1 4.689 0.010 . 1 . . . . A 50 VAL HA . 36403 1
500 . 1 . 1 61 61 VAL HB H 1 2.212 0.009 . 1 . . . . A 50 VAL HB . 36403 1
501 . 1 . 1 61 61 VAL HG11 H 1 0.816 0.005 . 2 . . . . A 50 VAL HG11 . 36403 1
502 . 1 . 1 61 61 VAL HG12 H 1 0.816 0.005 . 2 . . . . A 50 VAL HG12 . 36403 1
503 . 1 . 1 61 61 VAL HG13 H 1 0.816 0.005 . 2 . . . . A 50 VAL HG13 . 36403 1
504 . 1 . 1 61 61 VAL HG21 H 1 0.513 0.009 . 2 . . . . A 50 VAL HG21 . 36403 1
505 . 1 . 1 61 61 VAL HG22 H 1 0.513 0.009 . 2 . . . . A 50 VAL HG22 . 36403 1
506 . 1 . 1 61 61 VAL HG23 H 1 0.513 0.009 . 2 . . . . A 50 VAL HG23 . 36403 1
507 . 1 . 1 61 61 VAL CA C 13 58.420 0.034 . 1 . . . . A 50 VAL CA . 36403 1
508 . 1 . 1 61 61 VAL CB C 13 36.368 0.118 . 1 . . . . A 50 VAL CB . 36403 1
509 . 1 . 1 61 61 VAL CG1 C 13 21.980 0.065 . 2 . . . . A 50 VAL CG1 . 36403 1
510 . 1 . 1 61 61 VAL CG2 C 13 18.890 0.027 . 2 . . . . A 50 VAL CG2 . 36403 1
511 . 1 . 1 61 61 VAL N N 15 115.217 0.116 . 1 . . . . A 50 VAL N . 36403 1
512 . 1 . 1 62 62 ALA H H 1 8.168 0.004 . 1 . . . . A 51 ALA H . 36403 1
513 . 1 . 1 62 62 ALA HA H 1 4.313 0.005 . 1 . . . . A 51 ALA HA . 36403 1
514 . 1 . 1 62 62 ALA HB1 H 1 1.413 0.004 . 1 . . . . A 51 ALA HB1 . 36403 1
515 . 1 . 1 62 62 ALA HB2 H 1 1.413 0.004 . 1 . . . . A 51 ALA HB2 . 36403 1
516 . 1 . 1 62 62 ALA HB3 H 1 1.413 0.004 . 1 . . . . A 51 ALA HB3 . 36403 1
517 . 1 . 1 62 62 ALA CA C 13 51.452 0.023 . 1 . . . . A 51 ALA CA . 36403 1
518 . 1 . 1 62 62 ALA CB C 13 19.257 0.092 . 1 . . . . A 51 ALA CB . 36403 1
519 . 1 . 1 62 62 ALA N N 15 122.746 0.101 . 1 . . . . A 51 ALA N . 36403 1
520 . 1 . 1 63 63 LEU H H 1 8.375 0.004 . 1 . . . . A 52 LEU H . 36403 1
521 . 1 . 1 63 63 LEU HA H 1 3.683 0.009 . 1 . . . . A 52 LEU HA . 36403 1
522 . 1 . 1 63 63 LEU HB2 H 1 1.624 0.005 . 2 . . . . A 52 LEU HB2 . 36403 1
523 . 1 . 1 63 63 LEU HB3 H 1 1.316 0.007 . 2 . . . . A 52 LEU HB3 . 36403 1
524 . 1 . 1 63 63 LEU HG H 1 1.619 0.006 . 1 . . . . A 52 LEU HG . 36403 1
525 . 1 . 1 63 63 LEU HD11 H 1 0.678 0.009 . 2 . . . . A 52 LEU HD11 . 36403 1
526 . 1 . 1 63 63 LEU HD12 H 1 0.678 0.009 . 2 . . . . A 52 LEU HD12 . 36403 1
527 . 1 . 1 63 63 LEU HD13 H 1 0.678 0.009 . 2 . . . . A 52 LEU HD13 . 36403 1
528 . 1 . 1 63 63 LEU HD21 H 1 0.488 0.008 . 2 . . . . A 52 LEU HD21 . 36403 1
529 . 1 . 1 63 63 LEU HD22 H 1 0.488 0.008 . 2 . . . . A 52 LEU HD22 . 36403 1
530 . 1 . 1 63 63 LEU HD23 H 1 0.488 0.008 . 2 . . . . A 52 LEU HD23 . 36403 1
531 . 1 . 1 63 63 LEU CA C 13 57.124 0.028 . 1 . . . . A 52 LEU CA . 36403 1
532 . 1 . 1 63 63 LEU CB C 13 40.722 0.044 . 1 . . . . A 52 LEU CB . 36403 1
533 . 1 . 1 63 63 LEU CG C 13 27.040 0.026 . 1 . . . . A 52 LEU CG . 36403 1
534 . 1 . 1 63 63 LEU CD1 C 13 25.299 0.049 . 2 . . . . A 52 LEU CD1 . 36403 1
535 . 1 . 1 63 63 LEU CD2 C 13 22.781 0.054 . 2 . . . . A 52 LEU CD2 . 36403 1
536 . 1 . 1 63 63 LEU N N 15 118.493 0.095 . 1 . . . . A 52 LEU N . 36403 1
537 . 1 . 1 64 64 GLU H H 1 7.468 0.004 . 1 . . . . A 53 GLU H . 36403 1
538 . 1 . 1 64 64 GLU HA H 1 4.263 0.008 . 1 . . . . A 53 GLU HA . 36403 1
539 . 1 . 1 64 64 GLU HB2 H 1 2.046 0.012 . 2 . . . . A 53 GLU HB2 . 36403 1
540 . 1 . 1 64 64 GLU HB3 H 1 1.867 0.008 . 2 . . . . A 53 GLU HB3 . 36403 1
541 . 1 . 1 64 64 GLU HG2 H 1 2.220 0.009 . 2 . . . . A 53 GLU HG2 . 36403 1
542 . 1 . 1 64 64 GLU HG3 H 1 2.074 0.012 . 2 . . . . A 53 GLU HG3 . 36403 1
543 . 1 . 1 64 64 GLU CA C 13 56.074 0.066 . 1 . . . . A 53 GLU CA . 36403 1
544 . 1 . 1 64 64 GLU CB C 13 28.862 0.055 . 1 . . . . A 53 GLU CB . 36403 1
545 . 1 . 1 64 64 GLU CG C 13 36.372 0.047 . 1 . . . . A 53 GLU CG . 36403 1
546 . 1 . 1 64 64 GLU N N 15 111.505 0.108 . 1 . . . . A 53 GLU N . 36403 1
547 . 1 . 1 65 65 ARG H H 1 7.203 0.004 . 1 . . . . A 54 ARG H . 36403 1
548 . 1 . 1 65 65 ARG HA H 1 3.853 0.005 . 1 . . . . A 54 ARG HA . 36403 1
549 . 1 . 1 65 65 ARG HB2 H 1 1.909 0.006 . 2 . . . . A 54 ARG HB2 . 36403 1
550 . 1 . 1 65 65 ARG HB3 H 1 1.459 0.004 . 2 . . . . A 54 ARG HB3 . 36403 1
551 . 1 . 1 65 65 ARG HG2 H 1 1.587 0.005 . 2 . . . . A 54 ARG HG2 . 36403 1
552 . 1 . 1 65 65 ARG HG3 H 1 1.454 0.008 . 2 . . . . A 54 ARG HG3 . 36403 1
553 . 1 . 1 65 65 ARG HD2 H 1 3.168 0.006 . 2 . . . . A 54 ARG HD2 . 36403 1
554 . 1 . 1 65 65 ARG HD3 H 1 2.755 0.011 . 2 . . . . A 54 ARG HD3 . 36403 1
555 . 1 . 1 65 65 ARG CA C 13 56.370 0.088 . 1 . . . . A 54 ARG CA . 36403 1
556 . 1 . 1 65 65 ARG CB C 13 31.997 0.046 . 1 . . . . A 54 ARG CB . 36403 1
557 . 1 . 1 65 65 ARG CG C 13 27.804 0.000 . 1 . . . . A 54 ARG CG . 36403 1
558 . 1 . 1 65 65 ARG CD C 13 44.419 0.042 . 1 . . . . A 54 ARG CD . 36403 1
559 . 1 . 1 65 65 ARG N N 15 123.439 0.098 . 1 . . . . A 54 ARG N . 36403 1
560 . 1 . 1 66 66 LYS H H 1 8.246 0.004 . 1 . . . . A 55 LYS H . 36403 1
561 . 1 . 1 66 66 LYS HA H 1 4.052 0.006 . 1 . . . . A 55 LYS HA . 36403 1
562 . 1 . 1 66 66 LYS HB2 H 1 1.627 0.008 . 2 . . . . A 55 LYS HB2 . 36403 1
563 . 1 . 1 66 66 LYS HB3 H 1 1.627 0.008 . 2 . . . . A 55 LYS HB3 . 36403 1
564 . 1 . 1 66 66 LYS HG2 H 1 1.377 0.006 . 2 . . . . A 55 LYS HG2 . 36403 1
565 . 1 . 1 66 66 LYS HG3 H 1 1.329 0.006 . 2 . . . . A 55 LYS HG3 . 36403 1
566 . 1 . 1 66 66 LYS HD2 H 1 1.583 0.004 . 2 . . . . A 55 LYS HD2 . 36403 1
567 . 1 . 1 66 66 LYS HD3 H 1 1.533 0.006 . 2 . . . . A 55 LYS HD3 . 36403 1
568 . 1 . 1 66 66 LYS HE2 H 1 2.926 0.014 . 2 . . . . A 55 LYS HE2 . 36403 1
569 . 1 . 1 66 66 LYS HE3 H 1 2.906 0.007 . 2 . . . . A 55 LYS HE3 . 36403 1
570 . 1 . 1 66 66 LYS CA C 13 56.318 0.029 . 1 . . . . A 55 LYS CA . 36403 1
571 . 1 . 1 66 66 LYS CB C 13 32.073 0.038 . 1 . . . . A 55 LYS CB . 36403 1
572 . 1 . 1 66 66 LYS CG C 13 25.105 0.070 . 1 . . . . A 55 LYS CG . 36403 1
573 . 1 . 1 66 66 LYS CD C 13 29.146 0.047 . 1 . . . . A 55 LYS CD . 36403 1
574 . 1 . 1 66 66 LYS CE C 13 42.107 0.059 . 1 . . . . A 55 LYS CE . 36403 1
575 . 1 . 1 66 66 LYS N N 15 125.039 0.109 . 1 . . . . A 55 LYS N . 36403 1
576 . 1 . 1 67 67 LEU H H 1 8.363 0.006 . 1 . . . . A 56 LEU H . 36403 1
577 . 1 . 1 67 67 LEU HA H 1 4.075 0.007 . 1 . . . . A 56 LEU HA . 36403 1
578 . 1 . 1 67 67 LEU HB2 H 1 1.277 0.008 . 2 . . . . A 56 LEU HB2 . 36403 1
579 . 1 . 1 67 67 LEU HB3 H 1 0.993 0.006 . 2 . . . . A 56 LEU HB3 . 36403 1
580 . 1 . 1 67 67 LEU HG H 1 1.387 0.005 . 1 . . . . A 56 LEU HG . 36403 1
581 . 1 . 1 67 67 LEU HD11 H 1 0.433 0.008 . 2 . . . . A 56 LEU HD11 . 36403 1
582 . 1 . 1 67 67 LEU HD12 H 1 0.433 0.008 . 2 . . . . A 56 LEU HD12 . 36403 1
583 . 1 . 1 67 67 LEU HD13 H 1 0.433 0.008 . 2 . . . . A 56 LEU HD13 . 36403 1
584 . 1 . 1 67 67 LEU HD21 H 1 0.581 0.005 . 2 . . . . A 56 LEU HD21 . 36403 1
585 . 1 . 1 67 67 LEU HD22 H 1 0.581 0.005 . 2 . . . . A 56 LEU HD22 . 36403 1
586 . 1 . 1 67 67 LEU HD23 H 1 0.581 0.005 . 2 . . . . A 56 LEU HD23 . 36403 1
587 . 1 . 1 67 67 LEU CA C 13 54.291 0.099 . 1 . . . . A 56 LEU CA . 36403 1
588 . 1 . 1 67 67 LEU CB C 13 43.266 0.113 . 1 . . . . A 56 LEU CB . 36403 1
589 . 1 . 1 67 67 LEU CG C 13 27.429 0.000 . 1 . . . . A 56 LEU CG . 36403 1
590 . 1 . 1 67 67 LEU CD1 C 13 26.575 0.067 . 2 . . . . A 56 LEU CD1 . 36403 1
591 . 1 . 1 67 67 LEU CD2 C 13 23.755 0.041 . 2 . . . . A 56 LEU CD2 . 36403 1
592 . 1 . 1 67 67 LEU N N 15 125.007 0.083 . 1 . . . . A 56 LEU N . 36403 1
593 . 1 . 1 68 68 GLU H H 1 8.205 0.006 . 1 . . . . A 57 GLU H . 36403 1
594 . 1 . 1 68 68 GLU HA H 1 4.413 0.006 . 1 . . . . A 57 GLU HA . 36403 1
595 . 1 . 1 68 68 GLU HB2 H 1 1.898 0.006 . 2 . . . . A 57 GLU HB2 . 36403 1
596 . 1 . 1 68 68 GLU HB3 H 1 1.345 0.010 . 2 . . . . A 57 GLU HB3 . 36403 1
597 . 1 . 1 68 68 GLU HG2 H 1 2.107 0.013 . 2 . . . . A 57 GLU HG2 . 36403 1
598 . 1 . 1 68 68 GLU HG3 H 1 1.972 0.006 . 2 . . . . A 57 GLU HG3 . 36403 1
599 . 1 . 1 68 68 GLU CA C 13 53.344 0.054 . 1 . . . . A 57 GLU CA . 36403 1
600 . 1 . 1 68 68 GLU CB C 13 32.400 0.026 . 1 . . . . A 57 GLU CB . 36403 1
601 . 1 . 1 68 68 GLU CG C 13 35.477 0.011 . 1 . . . . A 57 GLU CG . 36403 1
602 . 1 . 1 68 68 GLU N N 15 118.491 0.078 . 1 . . . . A 57 GLU N . 36403 1
603 . 1 . 1 69 69 ASN H H 1 8.306 0.002 . 1 . . . . A 58 ASN H . 36403 1
604 . 1 . 1 69 69 ASN HA H 1 4.388 0.009 . 1 . . . . A 58 ASN HA . 36403 1
605 . 1 . 1 69 69 ASN HB2 H 1 2.419 0.007 . 2 . . . . A 58 ASN HB2 . 36403 1
606 . 1 . 1 69 69 ASN HB3 H 1 2.259 0.011 . 2 . . . . A 58 ASN HB3 . 36403 1
607 . 1 . 1 69 69 ASN CA C 13 54.332 0.068 . 1 . . . . A 58 ASN CA . 36403 1
608 . 1 . 1 69 69 ASN CB C 13 39.503 0.088 . 1 . . . . A 58 ASN CB . 36403 1
609 . 1 . 1 69 69 ASN N N 15 116.139 0.083 . 1 . . . . A 58 ASN N . 36403 1
610 . 1 . 1 70 70 GLY H H 1 8.938 0.010 . 1 . . . . A 59 GLY H . 36403 1
611 . 1 . 1 70 70 GLY HA2 H 1 4.116 0.006 . 2 . . . . A 59 GLY HA2 . 36403 1
612 . 1 . 1 70 70 GLY HA3 H 1 3.441 0.011 . 2 . . . . A 59 GLY HA3 . 36403 1
613 . 1 . 1 70 70 GLY CA C 13 45.366 0.069 . 1 . . . . A 59 GLY CA . 36403 1
614 . 1 . 1 70 70 GLY N N 15 110.865 0.078 . 1 . . . . A 59 GLY N . 36403 1
615 . 1 . 1 71 71 GLU H H 1 7.331 0.006 . 1 . . . . A 60 GLU H . 36403 1
616 . 1 . 1 71 71 GLU HA H 1 4.212 0.005 . 1 . . . . A 60 GLU HA . 36403 1
617 . 1 . 1 71 71 GLU HB2 H 1 2.008 0.002 . 2 . . . . A 60 GLU HB2 . 36403 1
618 . 1 . 1 71 71 GLU HB3 H 1 1.610 0.005 . 2 . . . . A 60 GLU HB3 . 36403 1
619 . 1 . 1 71 71 GLU HG2 H 1 2.222 0.010 . 2 . . . . A 60 GLU HG2 . 36403 1
620 . 1 . 1 71 71 GLU HG3 H 1 1.897 0.006 . 2 . . . . A 60 GLU HG3 . 36403 1
621 . 1 . 1 71 71 GLU CA C 13 57.679 0.058 . 1 . . . . A 60 GLU CA . 36403 1
622 . 1 . 1 71 71 GLU CB C 13 30.494 0.000 . 1 . . . . A 60 GLU CB . 36403 1
623 . 1 . 1 71 71 GLU CG C 13 39.508 0.077 . 1 . . . . A 60 GLU CG . 36403 1
624 . 1 . 1 71 71 GLU N N 15 119.825 0.105 . 1 . . . . A 60 GLU N . 36403 1
625 . 1 . 1 72 72 VAL H H 1 8.019 0.001 . 1 . . . . A 61 VAL H . 36403 1
626 . 1 . 1 72 72 VAL HA H 1 4.707 0.011 . 1 . . . . A 61 VAL HA . 36403 1
627 . 1 . 1 72 72 VAL HB H 1 1.951 0.002 . 1 . . . . A 61 VAL HB . 36403 1
628 . 1 . 1 72 72 VAL HG11 H 1 0.905 0.006 . 2 . . . . A 61 VAL HG11 . 36403 1
629 . 1 . 1 72 72 VAL HG12 H 1 0.905 0.006 . 2 . . . . A 61 VAL HG12 . 36403 1
630 . 1 . 1 72 72 VAL HG13 H 1 0.905 0.006 . 2 . . . . A 61 VAL HG13 . 36403 1
631 . 1 . 1 72 72 VAL HG21 H 1 0.666 0.010 . 2 . . . . A 61 VAL HG21 . 36403 1
632 . 1 . 1 72 72 VAL HG22 H 1 0.666 0.010 . 2 . . . . A 61 VAL HG22 . 36403 1
633 . 1 . 1 72 72 VAL HG23 H 1 0.666 0.010 . 2 . . . . A 61 VAL HG23 . 36403 1
634 . 1 . 1 72 72 VAL CA C 13 61.145 0.009 . 1 . . . . A 61 VAL CA . 36403 1
635 . 1 . 1 72 72 VAL CB C 13 32.395 0.010 . 1 . . . . A 61 VAL CB . 36403 1
636 . 1 . 1 72 72 VAL CG1 C 13 21.350 0.015 . 2 . . . . A 61 VAL CG1 . 36403 1
637 . 1 . 1 72 72 VAL CG2 C 13 20.957 0.083 . 2 . . . . A 61 VAL CG2 . 36403 1
638 . 1 . 1 72 72 VAL N N 15 120.267 0.089 . 1 . . . . A 61 VAL N . 36403 1
639 . 1 . 1 73 73 VAL H H 1 8.635 0.004 . 1 . . . . A 62 VAL H . 36403 1
640 . 1 . 1 73 73 VAL HA H 1 4.433 0.007 . 1 . . . . A 62 VAL HA . 36403 1
641 . 1 . 1 73 73 VAL HB H 1 0.528 0.006 . 1 . . . . A 62 VAL HB . 36403 1
642 . 1 . 1 73 73 VAL HG11 H 1 0.421 0.005 . 2 . . . . A 62 VAL HG11 . 36403 1
643 . 1 . 1 73 73 VAL HG12 H 1 0.421 0.005 . 2 . . . . A 62 VAL HG12 . 36403 1
644 . 1 . 1 73 73 VAL HG13 H 1 0.421 0.005 . 2 . . . . A 62 VAL HG13 . 36403 1
645 . 1 . 1 73 73 VAL HG21 H 1 -0.056 0.006 . 2 . . . . A 62 VAL HG21 . 36403 1
646 . 1 . 1 73 73 VAL HG22 H 1 -0.056 0.006 . 2 . . . . A 62 VAL HG22 . 36403 1
647 . 1 . 1 73 73 VAL HG23 H 1 -0.056 0.006 . 2 . . . . A 62 VAL HG23 . 36403 1
648 . 1 . 1 73 73 VAL CA C 13 62.214 0.036 . 1 . . . . A 62 VAL CA . 36403 1
649 . 1 . 1 73 73 VAL CB C 13 33.664 0.061 . 1 . . . . A 62 VAL CB . 36403 1
650 . 1 . 1 73 73 VAL CG1 C 13 22.208 0.063 . 2 . . . . A 62 VAL CG1 . 36403 1
651 . 1 . 1 73 73 VAL CG2 C 13 21.066 0.055 . 2 . . . . A 62 VAL CG2 . 36403 1
652 . 1 . 1 73 73 VAL N N 15 128.876 0.104 . 1 . . . . A 62 VAL N . 36403 1
653 . 1 . 1 74 74 GLU H H 1 8.470 0.004 . 1 . . . . A 63 GLU H . 36403 1
654 . 1 . 1 74 74 GLU HA H 1 4.519 0.005 . 1 . . . . A 63 GLU HA . 36403 1
655 . 1 . 1 74 74 GLU HB2 H 1 1.870 0.006 . 2 . . . . A 63 GLU HB2 . 36403 1
656 . 1 . 1 74 74 GLU HB3 H 1 1.692 0.009 . 2 . . . . A 63 GLU HB3 . 36403 1
657 . 1 . 1 74 74 GLU HG2 H 1 1.989 0.007 . 2 . . . . A 63 GLU HG2 . 36403 1
658 . 1 . 1 74 74 GLU HG3 H 1 1.954 0.009 . 2 . . . . A 63 GLU HG3 . 36403 1
659 . 1 . 1 74 74 GLU CA C 13 54.468 0.041 . 1 . . . . A 63 GLU CA . 36403 1
660 . 1 . 1 74 74 GLU CB C 13 34.532 0.119 . 1 . . . . A 63 GLU CB . 36403 1
661 . 1 . 1 74 74 GLU CG C 13 37.087 0.079 . 1 . . . . A 63 GLU CG . 36403 1
662 . 1 . 1 74 74 GLU N N 15 123.949 0.086 . 1 . . . . A 63 GLU N . 36403 1
663 . 1 . 1 75 75 VAL H H 1 8.522 0.002 . 1 . . . . A 64 VAL H . 36403 1
664 . 1 . 1 75 75 VAL HA H 1 4.782 0.011 . 1 . . . . A 64 VAL HA . 36403 1
665 . 1 . 1 75 75 VAL HB H 1 2.163 0.006 . 1 . . . . A 64 VAL HB . 36403 1
666 . 1 . 1 75 75 VAL HG11 H 1 0.915 0.003 . 2 . . . . A 64 VAL HG11 . 36403 1
667 . 1 . 1 75 75 VAL HG12 H 1 0.915 0.003 . 2 . . . . A 64 VAL HG12 . 36403 1
668 . 1 . 1 75 75 VAL HG13 H 1 0.915 0.003 . 2 . . . . A 64 VAL HG13 . 36403 1
669 . 1 . 1 75 75 VAL HG21 H 1 0.878 0.006 . 2 . . . . A 64 VAL HG21 . 36403 1
670 . 1 . 1 75 75 VAL HG22 H 1 0.878 0.006 . 2 . . . . A 64 VAL HG22 . 36403 1
671 . 1 . 1 75 75 VAL HG23 H 1 0.878 0.006 . 2 . . . . A 64 VAL HG23 . 36403 1
672 . 1 . 1 75 75 VAL CA C 13 59.574 0.093 . 1 . . . . A 64 VAL CA . 36403 1
673 . 1 . 1 75 75 VAL CB C 13 35.091 0.063 . 1 . . . . A 64 VAL CB . 36403 1
674 . 1 . 1 75 75 VAL CG1 C 13 22.586 0.076 . 2 . . . . A 64 VAL CG1 . 36403 1
675 . 1 . 1 75 75 VAL CG2 C 13 19.066 0.085 . 2 . . . . A 64 VAL CG2 . 36403 1
676 . 1 . 1 75 75 VAL N N 15 116.071 0.061 . 1 . . . . A 64 VAL N . 36403 1
677 . 1 . 1 76 76 PHE H H 1 7.936 0.006 . 1 . . . . A 65 PHE H . 36403 1
678 . 1 . 1 76 76 PHE HA H 1 4.997 0.005 . 1 . . . . A 65 PHE HA . 36403 1
679 . 1 . 1 76 76 PHE HB2 H 1 3.168 0.007 . 2 . . . . A 65 PHE HB2 . 36403 1
680 . 1 . 1 76 76 PHE HB3 H 1 2.688 0.006 . 2 . . . . A 65 PHE HB3 . 36403 1
681 . 1 . 1 76 76 PHE HD1 H 1 6.923 0.015 . 3 . . . . A 65 PHE HD1 . 36403 1
682 . 1 . 1 76 76 PHE HD2 H 1 6.923 0.015 . 3 . . . . A 65 PHE HD2 . 36403 1
683 . 1 . 1 76 76 PHE CA C 13 55.929 0.080 . 1 . . . . A 65 PHE CA . 36403 1
684 . 1 . 1 76 76 PHE CB C 13 40.964 0.092 . 1 . . . . A 65 PHE CB . 36403 1
685 . 1 . 1 76 76 PHE N N 15 120.380 0.113 . 1 . . . . A 65 PHE N . 36403 1
686 . 1 . 1 77 77 THR H H 1 7.977 0.001 . 1 . . . . A 66 THR H . 36403 1
687 . 1 . 1 77 77 THR HA H 1 4.421 0.007 . 1 . . . . A 66 THR HA . 36403 1
688 . 1 . 1 77 77 THR HB H 1 4.261 0.009 . 1 . . . . A 66 THR HB . 36403 1
689 . 1 . 1 77 77 THR HG21 H 1 0.892 0.006 . 1 . . . . A 66 THR HG21 . 36403 1
690 . 1 . 1 77 77 THR HG22 H 1 0.892 0.006 . 1 . . . . A 66 THR HG22 . 36403 1
691 . 1 . 1 77 77 THR HG23 H 1 0.892 0.006 . 1 . . . . A 66 THR HG23 . 36403 1
692 . 1 . 1 77 77 THR CA C 13 61.959 0.015 . 1 . . . . A 66 THR CA . 36403 1
693 . 1 . 1 77 77 THR CB C 13 71.130 0.056 . 1 . . . . A 66 THR CB . 36403 1
694 . 1 . 1 77 77 THR CG2 C 13 22.042 0.077 . 1 . . . . A 66 THR CG2 . 36403 1
695 . 1 . 1 77 77 THR N N 15 118.280 0.096 . 1 . . . . A 66 THR N . 36403 1
stop_
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