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 15591
_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 '2D 1H-15N HSQC' . . . 15591 1
2 '3D 1H-15N TOCSY' . . . 15591 1
3 '3D 1H-15N NOESY' . . . 15591 1
4 '2D 1H-13C HSQC' . . . 15591 1
5 '3D HNCACB' . . . 15591 1
6 '3D CBCA(CO)NH' . . . 15591 1
7 '3D HCCH-TOCSY' . . . 15591 1
8 '3D 1H-13C NOESY' . . . 15591 1
9 '3D HNCO' . . . 15591 1
10 '3D HN(CA)CO' . . . 15591 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
3 $CcpNMR . . 15591 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 GLY HA2 H 1 3.867 0.000 . 1 . . . . 1 GLY HA2 . 15591 1
2 . 1 1 1 1 GLY CA C 13 43.484 0.000 . 1 . . . . 1 GLY CA . 15591 1
3 . 1 1 2 2 SER HA H 1 4.826 0.002 . 1 . . . . 2 SER HA . 15591 1
4 . 1 1 2 2 SER HB2 H 1 3.794 0.032 . 2 . . . . 2 SER HB2 . 15591 1
5 . 1 1 2 2 SER HB3 H 1 3.906 0.002 . 2 . . . . 2 SER HB3 . 15591 1
6 . 1 1 2 2 SER CA C 13 56.688 0.031 . 1 . . . . 2 SER CA . 15591 1
7 . 1 1 2 2 SER CB C 13 62.999 0.024 . 1 . . . . 2 SER CB . 15591 1
8 . 1 1 3 3 PRO HA H 1 4.749 0.007 . 1 . . . . 3 PRO HA . 15591 1
9 . 1 1 3 3 PRO HB2 H 1 1.970 0.014 . 2 . . . . 3 PRO HB2 . 15591 1
10 . 1 1 3 3 PRO HB3 H 1 2.381 0.018 . 2 . . . . 3 PRO HB3 . 15591 1
11 . 1 1 3 3 PRO HD2 H 1 3.828 0.008 . 2 . . . . 3 PRO HD2 . 15591 1
12 . 1 1 3 3 PRO HD3 H 1 3.950 0.004 . 2 . . . . 3 PRO HD3 . 15591 1
13 . 1 1 3 3 PRO HG2 H 1 2.060 0.009 . 1 . . . . 3 PRO HG2 . 15591 1
14 . 1 1 3 3 PRO CA C 13 61.476 0.067 . 1 . . . . 3 PRO CA . 15591 1
15 . 1 1 3 3 PRO CB C 13 31.354 0.581 . 1 . . . . 3 PRO CB . 15591 1
16 . 1 1 3 3 PRO CD C 13 50.894 0.171 . 1 . . . . 3 PRO CD . 15591 1
17 . 1 1 3 3 PRO CG C 13 27.314 0.275 . 1 . . . . 3 PRO CG . 15591 1
18 . 1 1 4 4 PRO HA H 1 4.416 0.006 . 1 . . . . 4 PRO HA . 15591 1
19 . 1 1 4 4 PRO HB2 H 1 1.943 0.010 . 2 . . . . 4 PRO HB2 . 15591 1
20 . 1 1 4 4 PRO HB3 H 1 2.342 0.032 . 2 . . . . 4 PRO HB3 . 15591 1
21 . 1 1 4 4 PRO HD2 H 1 3.739 0.028 . 2 . . . . 4 PRO HD2 . 15591 1
22 . 1 1 4 4 PRO HD3 H 1 3.883 0.006 . 2 . . . . 4 PRO HD3 . 15591 1
23 . 1 1 4 4 PRO HG2 H 1 2.061 0.003 . 1 . . . . 4 PRO HG2 . 15591 1
24 . 1 1 4 4 PRO C C 13 177.171 0.000 . 1 . . . . 4 PRO C . 15591 1
25 . 1 1 4 4 PRO CA C 13 63.211 0.136 . 1 . . . . 4 PRO CA . 15591 1
26 . 1 1 4 4 PRO CB C 13 31.682 0.366 . 1 . . . . 4 PRO CB . 15591 1
27 . 1 1 4 4 PRO CD C 13 50.338 0.285 . 1 . . . . 4 PRO CD . 15591 1
28 . 1 1 4 4 PRO CG C 13 27.249 0.096 . 1 . . . . 4 PRO CG . 15591 1
29 . 1 1 5 5 GLU H H 1 8.571 0.005 . 1 . . . . 5 GLU H . 15591 1
30 . 1 1 5 5 GLU HA H 1 4.209 0.002 . 1 . . . . 5 GLU HA . 15591 1
31 . 1 1 5 5 GLU HB2 H 1 1.942 0.006 . 2 . . . . 5 GLU HB2 . 15591 1
32 . 1 1 5 5 GLU HB3 H 1 2.039 0.009 . 2 . . . . 5 GLU HB3 . 15591 1
33 . 1 1 5 5 GLU HG2 H 1 2.288 0.009 . 1 . . . . 5 GLU HG2 . 15591 1
34 . 1 1 5 5 GLU C C 13 176.172 0.113 . 1 . . . . 5 GLU C . 15591 1
35 . 1 1 5 5 GLU CA C 13 56.520 0.076 . 1 . . . . 5 GLU CA . 15591 1
36 . 1 1 5 5 GLU CB C 13 29.828 0.171 . 1 . . . . 5 GLU CB . 15591 1
37 . 1 1 5 5 GLU CG C 13 36.220 0.000 . 1 . . . . 5 GLU CG . 15591 1
38 . 1 1 5 5 GLU N N 15 120.167 0.092 . 1 . . . . 5 GLU N . 15591 1
39 . 1 1 6 6 ALA H H 1 8.151 0.009 . 1 . . . . 6 ALA H . 15591 1
40 . 1 1 6 6 ALA HA H 1 4.301 0.003 . 1 . . . . 6 ALA HA . 15591 1
41 . 1 1 6 6 ALA HB1 H 1 1.325 0.008 . 1 . . . . 6 ALA HB1 . 15591 1
42 . 1 1 6 6 ALA HB2 H 1 1.325 0.008 . 1 . . . . 6 ALA HB2 . 15591 1
43 . 1 1 6 6 ALA HB3 H 1 1.325 0.008 . 1 . . . . 6 ALA HB3 . 15591 1
44 . 1 1 6 6 ALA C C 13 176.743 0.189 . 1 . . . . 6 ALA C . 15591 1
45 . 1 1 6 6 ALA CA C 13 51.482 0.144 . 1 . . . . 6 ALA CA . 15591 1
46 . 1 1 6 6 ALA CB C 13 19.509 0.240 . 1 . . . . 6 ALA CB . 15591 1
47 . 1 1 6 6 ALA N N 15 124.437 0.077 . 1 . . . . 6 ALA N . 15591 1
48 . 1 1 7 7 ASP H H 1 8.298 0.013 . 1 . . . . 7 ASP H . 15591 1
49 . 1 1 7 7 ASP HA H 1 4.736 0.008 . 1 . . . . 7 ASP HA . 15591 1
50 . 1 1 7 7 ASP HB2 H 1 2.594 0.008 . 1 . . . . 7 ASP HB2 . 15591 1
51 . 1 1 7 7 ASP C C 13 175.962 0.000 . 1 . . . . 7 ASP C . 15591 1
52 . 1 1 7 7 ASP CA C 13 51.861 0.135 . 1 . . . . 7 ASP CA . 15591 1
53 . 1 1 7 7 ASP CB C 13 42.560 0.232 . 1 . . . . 7 ASP CB . 15591 1
54 . 1 1 7 7 ASP N N 15 123.102 0.066 . 1 . . . . 7 ASP N . 15591 1
55 . 1 1 8 8 PRO HA H 1 4.215 0.005 . 1 . . . . 8 PRO HA . 15591 1
56 . 1 1 8 8 PRO HB2 H 1 1.962 0.012 . 2 . . . . 8 PRO HB2 . 15591 1
57 . 1 1 8 8 PRO HB3 H 1 2.384 0.011 . 2 . . . . 8 PRO HB3 . 15591 1
58 . 1 1 8 8 PRO HD2 H 1 3.691 0.007 . 2 . . . . 8 PRO HD2 . 15591 1
59 . 1 1 8 8 PRO HD3 H 1 3.823 0.006 . 2 . . . . 8 PRO HD3 . 15591 1
60 . 1 1 8 8 PRO HG2 H 1 2.059 0.008 . 1 . . . . 8 PRO HG2 . 15591 1
61 . 1 1 8 8 PRO C C 13 178.810 0.000 . 1 . . . . 8 PRO C . 15591 1
62 . 1 1 8 8 PRO CA C 13 64.888 0.111 . 1 . . . . 8 PRO CA . 15591 1
63 . 1 1 8 8 PRO CB C 13 31.863 0.211 . 1 . . . . 8 PRO CB . 15591 1
64 . 1 1 8 8 PRO CD C 13 50.751 0.226 . 1 . . . . 8 PRO CD . 15591 1
65 . 1 1 8 8 PRO CG C 13 27.513 0.112 . 1 . . . . 8 PRO CG . 15591 1
66 . 1 1 9 9 ARG H H 1 8.742 0.010 . 1 . . . . 9 ARG H . 15591 1
67 . 1 1 9 9 ARG HA H 1 4.004 0.005 . 1 . . . . 9 ARG HA . 15591 1
68 . 1 1 9 9 ARG HB2 H 1 1.097 0.014 . 2 . . . . 9 ARG HB2 . 15591 1
69 . 1 1 9 9 ARG HB3 H 1 1.402 0.011 . 2 . . . . 9 ARG HB3 . 15591 1
70 . 1 1 9 9 ARG HD2 H 1 3.128 0.029 . 2 . . . . 9 ARG HD2 . 15591 1
71 . 1 1 9 9 ARG HD3 H 1 3.288 0.002 . 2 . . . . 9 ARG HD3 . 15591 1
72 . 1 1 9 9 ARG HE H 1 7.502 0.001 . 1 . . . . 9 ARG HE . 15591 1
73 . 1 1 9 9 ARG HG2 H 1 1.636 0.015 . 1 . . . . 9 ARG HG2 . 15591 1
74 . 1 1 9 9 ARG C C 13 180.053 0.226 . 1 . . . . 9 ARG C . 15591 1
75 . 1 1 9 9 ARG CA C 13 58.086 0.016 . 1 . . . . 9 ARG CA . 15591 1
76 . 1 1 9 9 ARG CB C 13 29.791 0.180 . 1 . . . . 9 ARG CB . 15591 1
77 . 1 1 9 9 ARG CD C 13 43.371 0.302 . 1 . . . . 9 ARG CD . 15591 1
78 . 1 1 9 9 ARG CG C 13 26.510 0.260 . 1 . . . . 9 ARG CG . 15591 1
79 . 1 1 9 9 ARG N N 15 117.067 0.065 . 1 . . . . 9 ARG N . 15591 1
80 . 1 1 9 9 ARG NE N 15 124.722 0.041 . 1 . . . . 9 ARG NE . 15591 1
81 . 1 1 10 10 LEU H H 1 7.290 0.007 . 1 . . . . 10 LEU H . 15591 1
82 . 1 1 10 10 LEU HA H 1 3.885 0.011 . 1 . . . . 10 LEU HA . 15591 1
83 . 1 1 10 10 LEU HB2 H 1 1.505 0.007 . 2 . . . . 10 LEU HB2 . 15591 1
84 . 1 1 10 10 LEU HB3 H 1 2.062 0.003 . 2 . . . . 10 LEU HB3 . 15591 1
85 . 1 1 10 10 LEU HD11 H 1 1.078 0.023 . 2 . . . . 10 LEU HD11 . 15591 1
86 . 1 1 10 10 LEU HD12 H 1 1.078 0.023 . 2 . . . . 10 LEU HD12 . 15591 1
87 . 1 1 10 10 LEU HD13 H 1 1.078 0.023 . 2 . . . . 10 LEU HD13 . 15591 1
88 . 1 1 10 10 LEU HD21 H 1 1.095 0.010 . 2 . . . . 10 LEU HD21 . 15591 1
89 . 1 1 10 10 LEU HD22 H 1 1.095 0.010 . 2 . . . . 10 LEU HD22 . 15591 1
90 . 1 1 10 10 LEU HD23 H 1 1.095 0.010 . 2 . . . . 10 LEU HD23 . 15591 1
91 . 1 1 10 10 LEU HG H 1 1.590 0.017 . 1 . . . . 10 LEU HG . 15591 1
92 . 1 1 10 10 LEU C C 13 177.150 0.000 . 1 . . . . 10 LEU C . 15591 1
93 . 1 1 10 10 LEU CA C 13 57.535 0.208 . 1 . . . . 10 LEU CA . 15591 1
94 . 1 1 10 10 LEU CB C 13 40.286 0.139 . 1 . . . . 10 LEU CB . 15591 1
95 . 1 1 10 10 LEU CD1 C 13 23.128 0.194 . 2 . . . . 10 LEU CD1 . 15591 1
96 . 1 1 10 10 LEU CD2 C 13 25.997 0.237 . 2 . . . . 10 LEU CD2 . 15591 1
97 . 1 1 10 10 LEU CG C 13 27.483 0.162 . 1 . . . . 10 LEU CG . 15591 1
98 . 1 1 10 10 LEU N N 15 121.269 0.098 . 1 . . . . 10 LEU N . 15591 1
99 . 1 1 11 11 ILE H H 1 7.418 0.006 . 1 . . . . 11 ILE H . 15591 1
100 . 1 1 11 11 ILE HA H 1 3.588 0.010 . 1 . . . . 11 ILE HA . 15591 1
101 . 1 1 11 11 ILE HB H 1 1.883 0.008 . 1 . . . . 11 ILE HB . 15591 1
102 . 1 1 11 11 ILE HD11 H 1 0.783 0.011 . 1 . . . . 11 ILE HD11 . 15591 1
103 . 1 1 11 11 ILE HD12 H 1 0.783 0.011 . 1 . . . . 11 ILE HD12 . 15591 1
104 . 1 1 11 11 ILE HD13 H 1 0.783 0.011 . 1 . . . . 11 ILE HD13 . 15591 1
105 . 1 1 11 11 ILE HG12 H 1 1.252 0.013 . 2 . . . . 11 ILE HG12 . 15591 1
106 . 1 1 11 11 ILE HG13 H 1 1.489 0.007 . 2 . . . . 11 ILE HG13 . 15591 1
107 . 1 1 11 11 ILE HG21 H 1 0.913 0.010 . 1 . . . . 11 ILE HG21 . 15591 1
108 . 1 1 11 11 ILE HG22 H 1 0.913 0.010 . 1 . . . . 11 ILE HG22 . 15591 1
109 . 1 1 11 11 ILE HG23 H 1 0.913 0.010 . 1 . . . . 11 ILE HG23 . 15591 1
110 . 1 1 11 11 ILE C C 13 179.506 0.260 . 1 . . . . 11 ILE C . 15591 1
111 . 1 1 11 11 ILE CA C 13 64.085 0.046 . 1 . . . . 11 ILE CA . 15591 1
112 . 1 1 11 11 ILE CB C 13 37.269 0.197 . 1 . . . . 11 ILE CB . 15591 1
113 . 1 1 11 11 ILE CD1 C 13 11.587 0.067 . 1 . . . . 11 ILE CD1 . 15591 1
114 . 1 1 11 11 ILE CG1 C 13 28.306 0.298 . 1 . . . . 11 ILE CG1 . 15591 1
115 . 1 1 11 11 ILE CG2 C 13 16.964 0.059 . 1 . . . . 11 ILE CG2 . 15591 1
116 . 1 1 11 11 ILE N N 15 117.340 0.099 . 1 . . . . 11 ILE N . 15591 1
117 . 1 1 12 12 GLU H H 1 7.896 0.005 . 1 . . . . 12 GLU H . 15591 1
118 . 1 1 12 12 GLU HA H 1 4.141 0.006 . 1 . . . . 12 GLU HA . 15591 1
119 . 1 1 12 12 GLU HB2 H 1 2.026 0.010 . 2 . . . . 12 GLU HB2 . 15591 1
120 . 1 1 12 12 GLU HB3 H 1 2.067 0.023 . 2 . . . . 12 GLU HB3 . 15591 1
121 . 1 1 12 12 GLU HG2 H 1 2.298 0.007 . 1 . . . . 12 GLU HG2 . 15591 1
122 . 1 1 12 12 GLU C C 13 179.262 0.253 . 1 . . . . 12 GLU C . 15591 1
123 . 1 1 12 12 GLU CA C 13 59.180 0.145 . 1 . . . . 12 GLU CA . 15591 1
124 . 1 1 12 12 GLU CB C 13 29.752 0.273 . 1 . . . . 12 GLU CB . 15591 1
125 . 1 1 12 12 GLU CG C 13 35.763 0.120 . 1 . . . . 12 GLU CG . 15591 1
126 . 1 1 12 12 GLU N N 15 119.142 0.098 . 1 . . . . 12 GLU N . 15591 1
127 . 1 1 13 13 SER H H 1 7.939 0.002 . 1 . . . . 13 SER H . 15591 1
128 . 1 1 13 13 SER HA H 1 4.259 0.004 . 1 . . . . 13 SER HA . 15591 1
129 . 1 1 13 13 SER HB2 H 1 3.877 0.018 . 2 . . . . 13 SER HB2 . 15591 1
130 . 1 1 13 13 SER HB3 H 1 3.988 0.027 . 2 . . . . 13 SER HB3 . 15591 1
131 . 1 1 13 13 SER C C 13 176.629 0.000 . 1 . . . . 13 SER C . 15591 1
132 . 1 1 13 13 SER CA C 13 62.367 0.201 . 1 . . . . 13 SER CA . 15591 1
133 . 1 1 13 13 SER CB C 13 62.910 0.170 . 1 . . . . 13 SER CB . 15591 1
134 . 1 1 13 13 SER N N 15 116.264 0.051 . 1 . . . . 13 SER N . 15591 1
135 . 1 1 14 14 LEU H H 1 8.922 0.003 . 1 . . . . 14 LEU H . 15591 1
136 . 1 1 14 14 LEU HA H 1 3.727 0.006 . 1 . . . . 14 LEU HA . 15591 1
137 . 1 1 14 14 LEU HB2 H 1 1.468 0.006 . 2 . . . . 14 LEU HB2 . 15591 1
138 . 1 1 14 14 LEU HB3 H 1 1.667 0.007 . 2 . . . . 14 LEU HB3 . 15591 1
139 . 1 1 14 14 LEU HD11 H 1 0.627 0.020 . 2 . . . . 14 LEU HD11 . 15591 1
140 . 1 1 14 14 LEU HD12 H 1 0.627 0.020 . 2 . . . . 14 LEU HD12 . 15591 1
141 . 1 1 14 14 LEU HD13 H 1 0.627 0.020 . 2 . . . . 14 LEU HD13 . 15591 1
142 . 1 1 14 14 LEU HD21 H 1 0.667 0.023 . 2 . . . . 14 LEU HD21 . 15591 1
143 . 1 1 14 14 LEU HD22 H 1 0.667 0.023 . 2 . . . . 14 LEU HD22 . 15591 1
144 . 1 1 14 14 LEU HD23 H 1 0.667 0.023 . 2 . . . . 14 LEU HD23 . 15591 1
145 . 1 1 14 14 LEU HG H 1 1.460 0.011 . 1 . . . . 14 LEU HG . 15591 1
146 . 1 1 14 14 LEU C C 13 179.308 0.000 . 1 . . . . 14 LEU C . 15591 1
147 . 1 1 14 14 LEU CA C 13 58.320 0.074 . 1 . . . . 14 LEU CA . 15591 1
148 . 1 1 14 14 LEU CB C 13 42.068 0.074 . 1 . . . . 14 LEU CB . 15591 1
149 . 1 1 14 14 LEU CD1 C 13 24.188 0.043 . 2 . . . . 14 LEU CD1 . 15591 1
150 . 1 1 14 14 LEU CD2 C 13 24.619 0.000 . 2 . . . . 14 LEU CD2 . 15591 1
151 . 1 1 14 14 LEU CG C 13 26.852 0.131 . 1 . . . . 14 LEU CG . 15591 1
152 . 1 1 14 14 LEU N N 15 124.137 0.076 . 1 . . . . 14 LEU N . 15591 1
153 . 1 1 15 15 SER H H 1 7.958 0.005 . 1 . . . . 15 SER H . 15591 1
154 . 1 1 15 15 SER HA H 1 4.147 0.006 . 1 . . . . 15 SER HA . 15591 1
155 . 1 1 15 15 SER HB2 H 1 4.051 0.008 . 1 . . . . 15 SER HB2 . 15591 1
156 . 1 1 15 15 SER C C 13 177.814 0.000 . 1 . . . . 15 SER C . 15591 1
157 . 1 1 15 15 SER CA C 13 62.106 0.230 . 1 . . . . 15 SER CA . 15591 1
158 . 1 1 15 15 SER CB C 13 62.504 0.064 . 1 . . . . 15 SER CB . 15591 1
159 . 1 1 15 15 SER N N 15 113.682 0.103 . 1 . . . . 15 SER N . 15591 1
160 . 1 1 16 16 GLN H H 1 7.834 0.004 . 1 . . . . 16 GLN H . 15591 1
161 . 1 1 16 16 GLN HA H 1 4.159 0.009 . 1 . . . . 16 GLN HA . 15591 1
162 . 1 1 16 16 GLN HB2 H 1 2.093 0.009 . 2 . . . . 16 GLN HB2 . 15591 1
163 . 1 1 16 16 GLN HB3 H 1 2.272 0.013 . 2 . . . . 16 GLN HB3 . 15591 1
164 . 1 1 16 16 GLN HE21 H 1 6.804 0.001 . 1 . . . . 16 GLN HE21 . 15591 1
165 . 1 1 16 16 GLN HE22 H 1 7.443 0.004 . 1 . . . . 16 GLN HE22 . 15591 1
166 . 1 1 16 16 GLN HG2 H 1 2.427 0.006 . 2 . . . . 16 GLN HG2 . 15591 1
167 . 1 1 16 16 GLN HG3 H 1 2.555 0.005 . 2 . . . . 16 GLN HG3 . 15591 1
168 . 1 1 16 16 GLN C C 13 179.974 0.167 . 1 . . . . 16 GLN C . 15591 1
169 . 1 1 16 16 GLN CA C 13 59.027 0.147 . 1 . . . . 16 GLN CA . 15591 1
170 . 1 1 16 16 GLN CB C 13 28.304 0.164 . 1 . . . . 16 GLN CB . 15591 1
171 . 1 1 16 16 GLN CG C 13 32.712 0.054 . 1 . . . . 16 GLN CG . 15591 1
172 . 1 1 16 16 GLN N N 15 120.928 0.061 . 1 . . . . 16 GLN N . 15591 1
173 . 1 1 16 16 GLN NE2 N 15 111.086 0.084 . 1 . . . . 16 GLN NE2 . 15591 1
174 . 1 1 17 17 MET H H 1 8.176 0.004 . 1 . . . . 17 MET H . 15591 1
175 . 1 1 17 17 MET HA H 1 4.457 0.007 . 1 . . . . 17 MET HA . 15591 1
176 . 1 1 17 17 MET HB2 H 1 1.937 0.005 . 2 . . . . 17 MET HB2 . 15591 1
177 . 1 1 17 17 MET HB3 H 1 2.099 0.006 . 2 . . . . 17 MET HB3 . 15591 1
178 . 1 1 17 17 MET HE1 H 1 1.195 0.008 . 1 . . . . 17 MET HE1 . 15591 1
179 . 1 1 17 17 MET HE2 H 1 1.195 0.008 . 1 . . . . 17 MET HE2 . 15591 1
180 . 1 1 17 17 MET HE3 H 1 1.195 0.008 . 1 . . . . 17 MET HE3 . 15591 1
181 . 1 1 17 17 MET HG2 H 1 2.458 0.023 . 2 . . . . 17 MET HG2 . 15591 1
182 . 1 1 17 17 MET HG3 H 1 2.551 0.006 . 2 . . . . 17 MET HG3 . 15591 1
183 . 1 1 17 17 MET C C 13 179.920 0.255 . 1 . . . . 17 MET C . 15591 1
184 . 1 1 17 17 MET CA C 13 58.879 0.253 . 1 . . . . 17 MET CA . 15591 1
185 . 1 1 17 17 MET CB C 13 31.861 0.132 . 1 . . . . 17 MET CB . 15591 1
186 . 1 1 17 17 MET CE C 13 16.757 0.082 . 1 . . . . 17 MET CE . 15591 1
187 . 1 1 17 17 MET CG C 13 32.074 0.159 . 1 . . . . 17 MET CG . 15591 1
188 . 1 1 17 17 MET N N 15 118.418 0.054 . 1 . . . . 17 MET N . 15591 1
189 . 1 1 18 18 LEU H H 1 9.066 0.006 . 1 . . . . 18 LEU H . 15591 1
190 . 1 1 18 18 LEU HA H 1 4.566 0.005 . 1 . . . . 18 LEU HA . 15591 1
191 . 1 1 18 18 LEU HB2 H 1 1.785 0.027 . 2 . . . . 18 LEU HB2 . 15591 1
192 . 1 1 18 18 LEU HB3 H 1 1.843 0.022 . 2 . . . . 18 LEU HB3 . 15591 1
193 . 1 1 18 18 LEU HD11 H 1 0.840 0.008 . 2 . . . . 18 LEU HD11 . 15591 1
194 . 1 1 18 18 LEU HD12 H 1 0.840 0.008 . 2 . . . . 18 LEU HD12 . 15591 1
195 . 1 1 18 18 LEU HD13 H 1 0.840 0.008 . 2 . . . . 18 LEU HD13 . 15591 1
196 . 1 1 18 18 LEU HD21 H 1 0.851 0.008 . 2 . . . . 18 LEU HD21 . 15591 1
197 . 1 1 18 18 LEU HD22 H 1 0.851 0.008 . 2 . . . . 18 LEU HD22 . 15591 1
198 . 1 1 18 18 LEU HD23 H 1 0.851 0.008 . 2 . . . . 18 LEU HD23 . 15591 1
199 . 1 1 18 18 LEU HG H 1 1.800 0.008 . 1 . . . . 18 LEU HG . 15591 1
200 . 1 1 18 18 LEU C C 13 182.335 0.000 . 1 . . . . 18 LEU C . 15591 1
201 . 1 1 18 18 LEU CA C 13 58.059 0.222 . 1 . . . . 18 LEU CA . 15591 1
202 . 1 1 18 18 LEU CB C 13 40.553 0.192 . 1 . . . . 18 LEU CB . 15591 1
203 . 1 1 18 18 LEU CD1 C 13 24.063 0.082 . 2 . . . . 18 LEU CD1 . 15591 1
204 . 1 1 18 18 LEU CD2 C 13 24.077 0.000 . 2 . . . . 18 LEU CD2 . 15591 1
205 . 1 1 18 18 LEU CG C 13 27.472 0.135 . 1 . . . . 18 LEU CG . 15591 1
206 . 1 1 18 18 LEU N N 15 124.499 0.083 . 1 . . . . 18 LEU N . 15591 1
207 . 1 1 19 19 SER H H 1 7.849 0.004 . 1 . . . . 19 SER H . 15591 1
208 . 1 1 19 19 SER HA H 1 4.380 0.008 . 1 . . . . 19 SER HA . 15591 1
209 . 1 1 19 19 SER HB2 H 1 4.094 0.018 . 1 . . . . 19 SER HB2 . 15591 1
210 . 1 1 19 19 SER C C 13 175.295 0.000 . 1 . . . . 19 SER C . 15591 1
211 . 1 1 19 19 SER CA C 13 61.417 0.073 . 1 . . . . 19 SER CA . 15591 1
212 . 1 1 19 19 SER CB C 13 63.115 0.248 . 1 . . . . 19 SER CB . 15591 1
213 . 1 1 19 19 SER N N 15 116.388 0.134 . 1 . . . . 19 SER N . 15591 1
214 . 1 1 20 20 MET H H 1 7.468 0.006 . 1 . . . . 20 MET H . 15591 1
215 . 1 1 20 20 MET HA H 1 4.484 0.014 . 1 . . . . 20 MET HA . 15591 1
216 . 1 1 20 20 MET HB2 H 1 2.476 0.020 . 2 . . . . 20 MET HB2 . 15591 1
217 . 1 1 20 20 MET HB3 H 1 2.546 0.016 . 2 . . . . 20 MET HB3 . 15591 1
218 . 1 1 20 20 MET HE1 H 1 2.143 0.011 . 1 . . . . 20 MET HE1 . 15591 1
219 . 1 1 20 20 MET HE2 H 1 2.143 0.011 . 1 . . . . 20 MET HE2 . 15591 1
220 . 1 1 20 20 MET HE3 H 1 2.143 0.011 . 1 . . . . 20 MET HE3 . 15591 1
221 . 1 1 20 20 MET HG2 H 1 2.706 0.011 . 2 . . . . 20 MET HG2 . 15591 1
222 . 1 1 20 20 MET HG3 H 1 2.886 0.011 . 2 . . . . 20 MET HG3 . 15591 1
223 . 1 1 20 20 MET C C 13 176.012 0.108 . 1 . . . . 20 MET C . 15591 1
224 . 1 1 20 20 MET CA C 13 56.235 0.240 . 1 . . . . 20 MET CA . 15591 1
225 . 1 1 20 20 MET CB C 13 34.060 0.352 . 1 . . . . 20 MET CB . 15591 1
226 . 1 1 20 20 MET CE C 13 17.480 0.000 . 1 . . . . 20 MET CE . 15591 1
227 . 1 1 20 20 MET CG C 13 32.345 0.211 . 1 . . . . 20 MET CG . 15591 1
228 . 1 1 20 20 MET N N 15 118.770 0.098 . 1 . . . . 20 MET N . 15591 1
229 . 1 1 21 21 GLY H H 1 7.953 0.004 . 1 . . . . 21 GLY H . 15591 1
230 . 1 1 21 21 GLY HA2 H 1 3.720 0.008 . 2 . . . . 21 GLY HA2 . 15591 1
231 . 1 1 21 21 GLY HA3 H 1 4.202 0.007 . 2 . . . . 21 GLY HA3 . 15591 1
232 . 1 1 21 21 GLY C C 13 174.523 0.000 . 1 . . . . 21 GLY C . 15591 1
233 . 1 1 21 21 GLY CA C 13 44.990 0.096 . 1 . . . . 21 GLY CA . 15591 1
234 . 1 1 21 21 GLY N N 15 106.010 0.088 . 1 . . . . 21 GLY N . 15591 1
235 . 1 1 22 22 PHE H H 1 7.552 0.006 . 1 . . . . 22 PHE H . 15591 1
236 . 1 1 22 22 PHE HA H 1 5.045 0.011 . 1 . . . . 22 PHE HA . 15591 1
237 . 1 1 22 22 PHE HB2 H 1 2.598 0.009 . 2 . . . . 22 PHE HB2 . 15591 1
238 . 1 1 22 22 PHE HB3 H 1 3.211 0.007 . 2 . . . . 22 PHE HB3 . 15591 1
239 . 1 1 22 22 PHE HD1 H 1 7.680 0.011 . 3 . . . . 22 PHE HD1 . 15591 1
240 . 1 1 22 22 PHE HD2 H 1 7.680 0.011 . 3 . . . . 22 PHE HD2 . 15591 1
241 . 1 1 22 22 PHE HE1 H 1 7.126 0.007 . 3 . . . . 22 PHE HE1 . 15591 1
242 . 1 1 22 22 PHE HE2 H 1 7.126 0.007 . 3 . . . . 22 PHE HE2 . 15591 1
243 . 1 1 22 22 PHE HZ H 1 6.456 0.009 . 1 . . . . 22 PHE HZ . 15591 1
244 . 1 1 22 22 PHE C C 13 173.375 0.000 . 1 . . . . 22 PHE C . 15591 1
245 . 1 1 22 22 PHE CA C 13 58.204 0.110 . 1 . . . . 22 PHE CA . 15591 1
246 . 1 1 22 22 PHE CB C 13 40.218 0.204 . 1 . . . . 22 PHE CB . 15591 1
247 . 1 1 22 22 PHE CD1 C 13 131.648 0.080 . 3 . . . . 22 PHE CD1 . 15591 1
248 . 1 1 22 22 PHE CD2 C 13 131.648 0.080 . 3 . . . . 22 PHE CD2 . 15591 1
249 . 1 1 22 22 PHE CE1 C 13 131.495 0.291 . 3 . . . . 22 PHE CE1 . 15591 1
250 . 1 1 22 22 PHE CE2 C 13 131.495 0.291 . 3 . . . . 22 PHE CE2 . 15591 1
251 . 1 1 22 22 PHE CZ C 13 130.294 0.190 . 1 . . . . 22 PHE CZ . 15591 1
252 . 1 1 22 22 PHE N N 15 118.431 0.070 . 1 . . . . 22 PHE N . 15591 1
253 . 1 1 23 23 SER H H 1 8.506 0.007 . 1 . . . . 23 SER H . 15591 1
254 . 1 1 23 23 SER HA H 1 4.559 0.009 . 1 . . . . 23 SER HA . 15591 1
255 . 1 1 23 23 SER HB2 H 1 4.010 0.005 . 2 . . . . 23 SER HB2 . 15591 1
256 . 1 1 23 23 SER HB3 H 1 4.122 0.012 . 2 . . . . 23 SER HB3 . 15591 1
257 . 1 1 23 23 SER C C 13 171.767 0.135 . 1 . . . . 23 SER C . 15591 1
258 . 1 1 23 23 SER CA C 13 56.830 0.181 . 1 . . . . 23 SER CA . 15591 1
259 . 1 1 23 23 SER CB C 13 64.931 0.094 . 1 . . . . 23 SER CB . 15591 1
260 . 1 1 23 23 SER N N 15 114.987 0.104 . 1 . . . . 23 SER N . 15591 1
261 . 1 1 24 24 ASP H H 1 8.456 0.007 . 1 . . . . 24 ASP H . 15591 1
262 . 1 1 24 24 ASP HA H 1 4.825 0.011 . 1 . . . . 24 ASP HA . 15591 1
263 . 1 1 24 24 ASP HB2 H 1 1.873 0.010 . 2 . . . . 24 ASP HB2 . 15591 1
264 . 1 1 24 24 ASP HB3 H 1 2.609 0.013 . 2 . . . . 24 ASP HB3 . 15591 1
265 . 1 1 24 24 ASP C C 13 178.183 0.232 . 1 . . . . 24 ASP C . 15591 1
266 . 1 1 24 24 ASP CA C 13 52.217 0.370 . 1 . . . . 24 ASP CA . 15591 1
267 . 1 1 24 24 ASP CB C 13 42.107 0.186 . 1 . . . . 24 ASP CB . 15591 1
268 . 1 1 24 24 ASP N N 15 118.581 0.060 . 1 . . . . 24 ASP N . 15591 1
269 . 1 1 25 25 GLU H H 1 9.124 0.027 . 1 . . . . 25 GLU H . 15591 1
270 . 1 1 25 25 GLU HA H 1 4.220 0.014 . 1 . . . . 25 GLU HA . 15591 1
271 . 1 1 25 25 GLU HB2 H 1 2.142 0.014 . 2 . . . . 25 GLU HB2 . 15591 1
272 . 1 1 25 25 GLU HB3 H 1 2.156 0.008 . 2 . . . . 25 GLU HB3 . 15591 1
273 . 1 1 25 25 GLU HG2 H 1 2.415 0.020 . 2 . . . . 25 GLU HG2 . 15591 1
274 . 1 1 25 25 GLU HG3 H 1 2.434 0.013 . 2 . . . . 25 GLU HG3 . 15591 1
275 . 1 1 25 25 GLU C C 13 178.380 0.158 . 1 . . . . 25 GLU C . 15591 1
276 . 1 1 25 25 GLU CA C 13 58.209 0.054 . 1 . . . . 25 GLU CA . 15591 1
277 . 1 1 25 25 GLU CB C 13 29.094 0.252 . 1 . . . . 25 GLU CB . 15591 1
278 . 1 1 25 25 GLU CG C 13 35.990 0.382 . 1 . . . . 25 GLU CG . 15591 1
279 . 1 1 25 25 GLU N N 15 124.770 0.064 . 1 . . . . 25 GLU N . 15591 1
280 . 1 1 26 26 GLY H H 1 8.999 0.007 . 1 . . . . 26 GLY H . 15591 1
281 . 1 1 26 26 GLY HA2 H 1 3.854 0.009 . 2 . . . . 26 GLY HA2 . 15591 1
282 . 1 1 26 26 GLY HA3 H 1 4.414 0.018 . 2 . . . . 26 GLY HA3 . 15591 1
283 . 1 1 26 26 GLY C C 13 175.532 0.120 . 1 . . . . 26 GLY C . 15591 1
284 . 1 1 26 26 GLY CA C 13 45.977 0.175 . 1 . . . . 26 GLY CA . 15591 1
285 . 1 1 26 26 GLY N N 15 112.650 0.057 . 1 . . . . 26 GLY N . 15591 1
286 . 1 1 27 27 GLY H H 1 8.334 0.003 . 1 . . . . 27 GLY H . 15591 1
287 . 1 1 27 27 GLY HA2 H 1 4.009 0.022 . 2 . . . . 27 GLY HA2 . 15591 1
288 . 1 1 27 27 GLY HA3 H 1 4.223 0.028 . 2 . . . . 27 GLY HA3 . 15591 1
289 . 1 1 27 27 GLY C C 13 177.596 0.027 . 1 . . . . 27 GLY C . 15591 1
290 . 1 1 27 27 GLY CA C 13 46.400 0.069 . 1 . . . . 27 GLY CA . 15591 1
291 . 1 1 27 27 GLY N N 15 106.772 0.141 . 1 . . . . 27 GLY N . 15591 1
292 . 1 1 28 28 TRP H H 1 7.325 0.004 . 1 . . . . 28 TRP H . 15591 1
293 . 1 1 28 28 TRP HA H 1 4.158 0.011 . 1 . . . . 28 TRP HA . 15591 1
294 . 1 1 28 28 TRP HB2 H 1 2.938 0.008 . 2 . . . . 28 TRP HB2 . 15591 1
295 . 1 1 28 28 TRP HB3 H 1 4.121 0.012 . 2 . . . . 28 TRP HB3 . 15591 1
296 . 1 1 28 28 TRP HD1 H 1 8.550 0.011 . 1 . . . . 28 TRP HD1 . 15591 1
297 . 1 1 28 28 TRP HE1 H 1 10.157 0.011 . 1 . . . . 28 TRP HE1 . 15591 1
298 . 1 1 28 28 TRP HE3 H 1 7.655 0.009 . 1 . . . . 28 TRP HE3 . 15591 1
299 . 1 1 28 28 TRP HH2 H 1 6.805 0.010 . 1 . . . . 28 TRP HH2 . 15591 1
300 . 1 1 28 28 TRP HZ2 H 1 7.646 0.007 . 1 . . . . 28 TRP HZ2 . 15591 1
301 . 1 1 28 28 TRP HZ3 H 1 6.591 0.017 . 1 . . . . 28 TRP HZ3 . 15591 1
302 . 1 1 28 28 TRP C C 13 174.457 0.018 . 1 . . . . 28 TRP C . 15591 1
303 . 1 1 28 28 TRP CA C 13 60.276 0.127 . 1 . . . . 28 TRP CA . 15591 1
304 . 1 1 28 28 TRP CB C 13 27.977 0.133 . 1 . . . . 28 TRP CB . 15591 1
305 . 1 1 28 28 TRP CD1 C 13 128.139 0.162 . 1 . . . . 28 TRP CD1 . 15591 1
306 . 1 1 28 28 TRP CE3 C 13 120.642 0.203 . 1 . . . . 28 TRP CE3 . 15591 1
307 . 1 1 28 28 TRP CH2 C 13 123.260 0.233 . 1 . . . . 28 TRP CH2 . 15591 1
308 . 1 1 28 28 TRP CZ2 C 13 115.336 0.119 . 1 . . . . 28 TRP CZ2 . 15591 1
309 . 1 1 28 28 TRP CZ3 C 13 121.371 0.410 . 1 . . . . 28 TRP CZ3 . 15591 1
310 . 1 1 28 28 TRP N N 15 120.213 0.097 . 1 . . . . 28 TRP N . 15591 1
311 . 1 1 28 28 TRP NE1 N 15 132.141 0.072 . 1 . . . . 28 TRP NE1 . 15591 1
312 . 1 1 29 29 LEU H H 1 6.946 0.004 . 1 . . . . 29 LEU H . 15591 1
313 . 1 1 29 29 LEU HA H 1 3.229 0.005 . 1 . . . . 29 LEU HA . 15591 1
314 . 1 1 29 29 LEU HB2 H 1 -0.719 0.016 . 2 . . . . 29 LEU HB2 . 15591 1
315 . 1 1 29 29 LEU HB3 H 1 0.958 0.024 . 2 . . . . 29 LEU HB3 . 15591 1
316 . 1 1 29 29 LEU HD11 H 1 0.322 0.013 . 2 . . . . 29 LEU HD11 . 15591 1
317 . 1 1 29 29 LEU HD12 H 1 0.322 0.013 . 2 . . . . 29 LEU HD12 . 15591 1
318 . 1 1 29 29 LEU HD13 H 1 0.322 0.013 . 2 . . . . 29 LEU HD13 . 15591 1
319 . 1 1 29 29 LEU HD21 H 1 0.857 0.013 . 2 . . . . 29 LEU HD21 . 15591 1
320 . 1 1 29 29 LEU HD22 H 1 0.857 0.013 . 2 . . . . 29 LEU HD22 . 15591 1
321 . 1 1 29 29 LEU HD23 H 1 0.857 0.013 . 2 . . . . 29 LEU HD23 . 15591 1
322 . 1 1 29 29 LEU HG H 1 0.269 0.006 . 1 . . . . 29 LEU HG . 15591 1
323 . 1 1 29 29 LEU C C 13 179.216 0.000 . 1 . . . . 29 LEU C . 15591 1
324 . 1 1 29 29 LEU CA C 13 56.385 0.091 . 1 . . . . 29 LEU CA . 15591 1
325 . 1 1 29 29 LEU CB C 13 39.374 0.198 . 1 . . . . 29 LEU CB . 15591 1
326 . 1 1 29 29 LEU CD1 C 13 26.126 0.166 . 2 . . . . 29 LEU CD1 . 15591 1
327 . 1 1 29 29 LEU CD2 C 13 25.968 0.000 . 2 . . . . 29 LEU CD2 . 15591 1
328 . 1 1 29 29 LEU CG C 13 22.074 0.057 . 1 . . . . 29 LEU CG . 15591 1
329 . 1 1 29 29 LEU N N 15 128.340 0.108 . 1 . . . . 29 LEU N . 15591 1
330 . 1 1 30 30 THR H H 1 8.858 0.007 . 1 . . . . 30 THR H . 15591 1
331 . 1 1 30 30 THR HA H 1 3.507 0.005 . 1 . . . . 30 THR HA . 15591 1
332 . 1 1 30 30 THR HB H 1 4.047 0.010 . 1 . . . . 30 THR HB . 15591 1
333 . 1 1 30 30 THR HG21 H 1 1.113 0.007 . 1 . . . . 30 THR HG1 . 15591 1
334 . 1 1 30 30 THR HG22 H 1 1.113 0.007 . 1 . . . . 30 THR HG1 . 15591 1
335 . 1 1 30 30 THR HG23 H 1 1.113 0.007 . 1 . . . . 30 THR HG1 . 15591 1
336 . 1 1 30 30 THR C C 13 176.055 0.000 . 1 . . . . 30 THR C . 15591 1
337 . 1 1 30 30 THR CA C 13 68.968 0.203 . 1 . . . . 30 THR CA . 15591 1
338 . 1 1 30 30 THR CB C 13 67.660 0.281 . 1 . . . . 30 THR CB . 15591 1
339 . 1 1 30 30 THR CG2 C 13 21.190 0.127 . 1 . . . . 30 THR CG2 . 15591 1
340 . 1 1 30 30 THR N N 15 121.036 0.059 . 1 . . . . 30 THR N . 15591 1
341 . 1 1 31 31 ARG H H 1 7.701 0.007 . 1 . . . . 31 ARG H . 15591 1
342 . 1 1 31 31 ARG HA H 1 4.242 0.006 . 1 . . . . 31 ARG HA . 15591 1
343 . 1 1 31 31 ARG HB2 H 1 1.979 0.008 . 2 . . . . 31 ARG HB2 . 15591 1
344 . 1 1 31 31 ARG HB3 H 1 2.133 0.008 . 2 . . . . 31 ARG HB3 . 15591 1
345 . 1 1 31 31 ARG HD2 H 1 3.351 0.008 . 1 . . . . 31 ARG HD2 . 15591 1
346 . 1 1 31 31 ARG HG2 H 1 1.631 0.008 . 1 . . . . 31 ARG HG2 . 15591 1
347 . 1 1 31 31 ARG C C 13 179.335 0.103 . 1 . . . . 31 ARG C . 15591 1
348 . 1 1 31 31 ARG CA C 13 58.197 0.099 . 1 . . . . 31 ARG CA . 15591 1
349 . 1 1 31 31 ARG CB C 13 29.751 0.280 . 1 . . . . 31 ARG CB . 15591 1
350 . 1 1 31 31 ARG CD C 13 42.623 0.117 . 1 . . . . 31 ARG CD . 15591 1
351 . 1 1 31 31 ARG CG C 13 26.722 0.284 . 1 . . . . 31 ARG CG . 15591 1
352 . 1 1 31 31 ARG N N 15 118.178 0.129 . 1 . . . . 31 ARG N . 15591 1
353 . 1 1 32 32 LEU H H 1 8.297 0.009 . 1 . . . . 32 LEU H . 15591 1
354 . 1 1 32 32 LEU HA H 1 3.959 0.007 . 1 . . . . 32 LEU HA . 15591 1
355 . 1 1 32 32 LEU HB2 H 1 1.385 0.028 . 2 . . . . 32 LEU HB2 . 15591 1
356 . 1 1 32 32 LEU HB3 H 1 1.843 0.012 . 2 . . . . 32 LEU HB3 . 15591 1
357 . 1 1 32 32 LEU HD11 H 1 0.174 0.010 . 2 . . . . 32 LEU HD11 . 15591 1
358 . 1 1 32 32 LEU HD12 H 1 0.174 0.010 . 2 . . . . 32 LEU HD12 . 15591 1
359 . 1 1 32 32 LEU HD13 H 1 0.174 0.010 . 2 . . . . 32 LEU HD13 . 15591 1
360 . 1 1 32 32 LEU HD21 H 1 0.347 0.015 . 2 . . . . 32 LEU HD21 . 15591 1
361 . 1 1 32 32 LEU HD22 H 1 0.347 0.015 . 2 . . . . 32 LEU HD22 . 15591 1
362 . 1 1 32 32 LEU HD23 H 1 0.347 0.015 . 2 . . . . 32 LEU HD23 . 15591 1
363 . 1 1 32 32 LEU HG H 1 0.899 0.028 . 1 . . . . 32 LEU HG . 15591 1
364 . 1 1 32 32 LEU C C 13 178.217 0.148 . 1 . . . . 32 LEU C . 15591 1
365 . 1 1 32 32 LEU CA C 13 58.289 0.068 . 1 . . . . 32 LEU CA . 15591 1
366 . 1 1 32 32 LEU CB C 13 40.971 0.110 . 1 . . . . 32 LEU CB . 15591 1
367 . 1 1 32 32 LEU CD1 C 13 21.909 0.053 . 2 . . . . 32 LEU CD1 . 15591 1
368 . 1 1 32 32 LEU CD2 C 13 26.088 0.156 . 2 . . . . 32 LEU CD2 . 15591 1
369 . 1 1 32 32 LEU CG C 13 27.127 0.113 . 1 . . . . 32 LEU CG . 15591 1
370 . 1 1 32 32 LEU N N 15 123.069 0.083 . 1 . . . . 32 LEU N . 15591 1
371 . 1 1 33 33 LEU H H 1 8.802 0.005 . 1 . . . . 33 LEU H . 15591 1
372 . 1 1 33 33 LEU HA H 1 3.482 0.008 . 1 . . . . 33 LEU HA . 15591 1
373 . 1 1 33 33 LEU HB2 H 1 1.005 0.021 . 2 . . . . 33 LEU HB2 . 15591 1
374 . 1 1 33 33 LEU HB3 H 1 1.904 0.007 . 2 . . . . 33 LEU HB3 . 15591 1
375 . 1 1 33 33 LEU HD11 H 1 0.515 0.013 . 2 . . . . 33 LEU HD11 . 15591 1
376 . 1 1 33 33 LEU HD12 H 1 0.515 0.013 . 2 . . . . 33 LEU HD12 . 15591 1
377 . 1 1 33 33 LEU HD13 H 1 0.515 0.013 . 2 . . . . 33 LEU HD13 . 15591 1
378 . 1 1 33 33 LEU HD21 H 1 0.608 0.017 . 2 . . . . 33 LEU HD21 . 15591 1
379 . 1 1 33 33 LEU HD22 H 1 0.608 0.017 . 2 . . . . 33 LEU HD22 . 15591 1
380 . 1 1 33 33 LEU HD23 H 1 0.608 0.017 . 2 . . . . 33 LEU HD23 . 15591 1
381 . 1 1 33 33 LEU HG H 1 1.391 0.014 . 1 . . . . 33 LEU HG . 15591 1
382 . 1 1 33 33 LEU C C 13 179.626 0.000 . 1 . . . . 33 LEU C . 15591 1
383 . 1 1 33 33 LEU CA C 13 58.200 0.094 . 1 . . . . 33 LEU CA . 15591 1
384 . 1 1 33 33 LEU CB C 13 41.885 0.152 . 1 . . . . 33 LEU CB . 15591 1
385 . 1 1 33 33 LEU CD1 C 13 22.072 0.090 . 2 . . . . 33 LEU CD1 . 15591 1
386 . 1 1 33 33 LEU CD2 C 13 25.104 0.164 . 2 . . . . 33 LEU CD2 . 15591 1
387 . 1 1 33 33 LEU CG C 13 27.202 0.190 . 1 . . . . 33 LEU CG . 15591 1
388 . 1 1 33 33 LEU N N 15 117.854 0.081 . 1 . . . . 33 LEU N . 15591 1
389 . 1 1 34 34 GLN H H 1 8.507 0.003 . 1 . . . . 34 GLN H . 15591 1
390 . 1 1 34 34 GLN HA H 1 3.426 0.007 . 1 . . . . 34 GLN HA . 15591 1
391 . 1 1 34 34 GLN HB2 H 1 1.967 0.010 . 2 . . . . 34 GLN HB2 . 15591 1
392 . 1 1 34 34 GLN HB3 H 1 2.378 0.010 . 2 . . . . 34 GLN HB3 . 15591 1
393 . 1 1 34 34 GLN HE21 H 1 6.938 0.035 . 1 . . . . 34 GLN HE21 . 15591 1
394 . 1 1 34 34 GLN HE22 H 1 7.383 0.017 . 1 . . . . 34 GLN HE22 . 15591 1
395 . 1 1 34 34 GLN HG2 H 1 2.545 0.007 . 2 . . . . 34 GLN HG2 . 15591 1
396 . 1 1 34 34 GLN HG3 H 1 2.727 0.011 . 2 . . . . 34 GLN HG3 . 15591 1
397 . 1 1 34 34 GLN C C 13 180.096 0.000 . 1 . . . . 34 GLN C . 15591 1
398 . 1 1 34 34 GLN CA C 13 59.406 0.128 . 1 . . . . 34 GLN CA . 15591 1
399 . 1 1 34 34 GLN CB C 13 28.137 0.258 . 1 . . . . 34 GLN CB . 15591 1
400 . 1 1 34 34 GLN CG C 13 34.341 0.191 . 1 . . . . 34 GLN CG . 15591 1
401 . 1 1 34 34 GLN N N 15 118.030 0.076 . 1 . . . . 34 GLN N . 15591 1
402 . 1 1 34 34 GLN NE2 N 15 110.850 0.088 . 1 . . . . 34 GLN NE2 . 15591 1
403 . 1 1 35 35 THR H H 1 8.045 0.005 . 1 . . . . 35 THR H . 15591 1
404 . 1 1 35 35 THR HA H 1 4.021 0.008 . 1 . . . . 35 THR HA . 15591 1
405 . 1 1 35 35 THR HB H 1 4.350 0.003 . 1 . . . . 35 THR HB . 15591 1
406 . 1 1 35 35 THR HG21 H 1 1.311 0.008 . 1 . . . . 35 THR HG1 . 15591 1
407 . 1 1 35 35 THR HG22 H 1 1.311 0.008 . 1 . . . . 35 THR HG1 . 15591 1
408 . 1 1 35 35 THR HG23 H 1 1.311 0.008 . 1 . . . . 35 THR HG1 . 15591 1
409 . 1 1 35 35 THR C C 13 175.497 0.236 . 1 . . . . 35 THR C . 15591 1
410 . 1 1 35 35 THR CA C 13 66.116 0.135 . 1 . . . . 35 THR CA . 15591 1
411 . 1 1 35 35 THR CB C 13 69.052 0.050 . 1 . . . . 35 THR CB . 15591 1
412 . 1 1 35 35 THR CG2 C 13 20.585 0.264 . 1 . . . . 35 THR CG2 . 15591 1
413 . 1 1 35 35 THR N N 15 116.320 0.068 . 1 . . . . 35 THR N . 15591 1
414 . 1 1 36 36 LYS H H 1 7.427 0.005 . 1 . . . . 36 LYS H . 15591 1
415 . 1 1 36 36 LYS HA H 1 4.470 0.004 . 1 . . . . 36 LYS HA . 15591 1
416 . 1 1 36 36 LYS HB2 H 1 1.511 0.009 . 2 . . . . 36 LYS HB2 . 15591 1
417 . 1 1 36 36 LYS HB3 H 1 2.188 0.012 . 2 . . . . 36 LYS HB3 . 15591 1
418 . 1 1 36 36 LYS HD2 H 1 1.379 0.012 . 2 . . . . 36 LYS HD2 . 15591 1
419 . 1 1 36 36 LYS HD3 H 1 1.514 0.014 . 2 . . . . 36 LYS HD3 . 15591 1
420 . 1 1 36 36 LYS HE2 H 1 2.567 0.006 . 2 . . . . 36 LYS HE2 . 15591 1
421 . 1 1 36 36 LYS HE3 H 1 2.931 0.010 . 2 . . . . 36 LYS HE3 . 15591 1
422 . 1 1 36 36 LYS HG2 H 1 0.892 0.017 . 1 . . . . 36 LYS HG2 . 15591 1
423 . 1 1 36 36 LYS C C 13 176.278 0.094 . 1 . . . . 36 LYS C . 15591 1
424 . 1 1 36 36 LYS CA C 13 52.536 0.228 . 1 . . . . 36 LYS CA . 15591 1
425 . 1 1 36 36 LYS CB C 13 29.933 0.273 . 1 . . . . 36 LYS CB . 15591 1
426 . 1 1 36 36 LYS CD C 13 27.293 0.305 . 1 . . . . 36 LYS CD . 15591 1
427 . 1 1 36 36 LYS CE C 13 42.069 0.051 . 1 . . . . 36 LYS CE . 15591 1
428 . 1 1 36 36 LYS CG C 13 23.598 0.261 . 1 . . . . 36 LYS CG . 15591 1
429 . 1 1 36 36 LYS N N 15 117.159 0.096 . 1 . . . . 36 LYS N . 15591 1
430 . 1 1 37 37 ASN H H 1 7.714 0.003 . 1 . . . . 37 ASN H . 15591 1
431 . 1 1 37 37 ASN HA H 1 3.725 0.005 . 1 . . . . 37 ASN HA . 15591 1
432 . 1 1 37 37 ASN HB2 H 1 2.562 0.008 . 2 . . . . 37 ASN HB2 . 15591 1
433 . 1 1 37 37 ASN HB3 H 1 3.050 0.006 . 2 . . . . 37 ASN HB3 . 15591 1
434 . 1 1 37 37 ASN HD21 H 1 6.852 0.001 . 1 . . . . 37 ASN HD21 . 15591 1
435 . 1 1 37 37 ASN HD22 H 1 7.565 0.005 . 1 . . . . 37 ASN HD22 . 15591 1
436 . 1 1 37 37 ASN C C 13 174.334 0.085 . 1 . . . . 37 ASN C . 15591 1
437 . 1 1 37 37 ASN CA C 13 54.652 0.233 . 1 . . . . 37 ASN CA . 15591 1
438 . 1 1 37 37 ASN CB C 13 37.196 0.180 . 1 . . . . 37 ASN CB . 15591 1
439 . 1 1 37 37 ASN N N 15 118.722 0.121 . 1 . . . . 37 ASN N . 15591 1
440 . 1 1 37 37 ASN ND2 N 15 112.118 0.037 . 1 . . . . 37 ASN ND2 . 15591 1
441 . 1 1 38 38 TYR H H 1 8.496 0.004 . 1 . . . . 38 TYR H . 15591 1
442 . 1 1 38 38 TYR HA H 1 3.401 0.007 . 1 . . . . 38 TYR HA . 15591 1
443 . 1 1 38 38 TYR HB2 H 1 3.086 0.008 . 2 . . . . 38 TYR HB2 . 15591 1
444 . 1 1 38 38 TYR HB3 H 1 3.098 0.006 . 2 . . . . 38 TYR HB3 . 15591 1
445 . 1 1 38 38 TYR HD1 H 1 6.674 0.013 . 3 . . . . 38 TYR HD1 . 15591 1
446 . 1 1 38 38 TYR HD2 H 1 6.674 0.013 . 3 . . . . 38 TYR HD2 . 15591 1
447 . 1 1 38 38 TYR HE1 H 1 6.712 0.006 . 3 . . . . 38 TYR HE1 . 15591 1
448 . 1 1 38 38 TYR HE2 H 1 6.712 0.006 . 3 . . . . 38 TYR HE2 . 15591 1
449 . 1 1 38 38 TYR C C 13 173.110 0.199 . 1 . . . . 38 TYR C . 15591 1
450 . 1 1 38 38 TYR CA C 13 58.965 0.175 . 1 . . . . 38 TYR CA . 15591 1
451 . 1 1 38 38 TYR CB C 13 34.822 0.152 . 1 . . . . 38 TYR CB . 15591 1
452 . 1 1 38 38 TYR CD1 C 13 132.530 0.157 . 3 . . . . 38 TYR CD1 . 15591 1
453 . 1 1 38 38 TYR CD2 C 13 132.530 0.157 . 3 . . . . 38 TYR CD2 . 15591 1
454 . 1 1 38 38 TYR CE1 C 13 118.135 0.161 . 3 . . . . 38 TYR CE1 . 15591 1
455 . 1 1 38 38 TYR CE2 C 13 118.135 0.161 . 3 . . . . 38 TYR CE2 . 15591 1
456 . 1 1 38 38 TYR N N 15 107.424 0.119 . 1 . . . . 38 TYR N . 15591 1
457 . 1 1 39 39 ASP H H 1 7.105 0.006 . 1 . . . . 39 ASP H . 15591 1
458 . 1 1 39 39 ASP HA H 1 4.657 0.004 . 1 . . . . 39 ASP HA . 15591 1
459 . 1 1 39 39 ASP HB2 H 1 2.529 0.002 . 2 . . . . 39 ASP HB2 . 15591 1
460 . 1 1 39 39 ASP HB3 H 1 3.072 0.004 . 2 . . . . 39 ASP HB3 . 15591 1
461 . 1 1 39 39 ASP C C 13 175.825 0.176 . 1 . . . . 39 ASP C . 15591 1
462 . 1 1 39 39 ASP CA C 13 53.162 0.188 . 1 . . . . 39 ASP CA . 15591 1
463 . 1 1 39 39 ASP CB C 13 41.804 0.111 . 1 . . . . 39 ASP CB . 15591 1
464 . 1 1 39 39 ASP N N 15 119.972 0.093 . 1 . . . . 39 ASP N . 15591 1
465 . 1 1 40 40 ILE H H 1 8.453 0.009 . 1 . . . . 40 ILE H . 15591 1
466 . 1 1 40 40 ILE HA H 1 3.483 0.009 . 1 . . . . 40 ILE HA . 15591 1
467 . 1 1 40 40 ILE HB H 1 1.839 0.007 . 1 . . . . 40 ILE HB . 15591 1
468 . 1 1 40 40 ILE HD11 H 1 0.881 0.006 . 1 . . . . 40 ILE HD11 . 15591 1
469 . 1 1 40 40 ILE HD12 H 1 0.881 0.006 . 1 . . . . 40 ILE HD12 . 15591 1
470 . 1 1 40 40 ILE HD13 H 1 0.881 0.006 . 1 . . . . 40 ILE HD13 . 15591 1
471 . 1 1 40 40 ILE HG12 H 1 1.173 0.021 . 2 . . . . 40 ILE HG12 . 15591 1
472 . 1 1 40 40 ILE HG13 H 1 1.620 0.017 . 2 . . . . 40 ILE HG13 . 15591 1
473 . 1 1 40 40 ILE HG21 H 1 0.890 0.004 . 1 . . . . 40 ILE HG21 . 15591 1
474 . 1 1 40 40 ILE HG22 H 1 0.890 0.004 . 1 . . . . 40 ILE HG22 . 15591 1
475 . 1 1 40 40 ILE HG23 H 1 0.890 0.004 . 1 . . . . 40 ILE HG23 . 15591 1
476 . 1 1 40 40 ILE C C 13 177.707 0.301 . 1 . . . . 40 ILE C . 15591 1
477 . 1 1 40 40 ILE CA C 13 64.522 0.114 . 1 . . . . 40 ILE CA . 15591 1
478 . 1 1 40 40 ILE CB C 13 37.741 0.177 . 1 . . . . 40 ILE CB . 15591 1
479 . 1 1 40 40 ILE CD1 C 13 13.679 0.223 . 1 . . . . 40 ILE CD1 . 15591 1
480 . 1 1 40 40 ILE CG1 C 13 28.272 0.408 . 1 . . . . 40 ILE CG1 . 15591 1
481 . 1 1 40 40 ILE CG2 C 13 17.248 0.480 . 1 . . . . 40 ILE CG2 . 15591 1
482 . 1 1 40 40 ILE N N 15 127.273 0.102 . 1 . . . . 40 ILE N . 15591 1
483 . 1 1 41 41 GLY H H 1 8.188 0.007 . 1 . . . . 41 GLY H . 15591 1
484 . 1 1 41 41 GLY HA2 H 1 3.693 0.008 . 2 . . . . 41 GLY HA2 . 15591 1
485 . 1 1 41 41 GLY HA3 H 1 3.925 0.008 . 2 . . . . 41 GLY HA3 . 15591 1
486 . 1 1 41 41 GLY C C 13 176.818 0.286 . 1 . . . . 41 GLY C . 15591 1
487 . 1 1 41 41 GLY CA C 13 47.360 0.127 . 1 . . . . 41 GLY CA . 15591 1
488 . 1 1 41 41 GLY N N 15 107.627 0.112 . 1 . . . . 41 GLY N . 15591 1
489 . 1 1 42 42 ALA H H 1 8.053 0.003 . 1 . . . . 42 ALA H . 15591 1
490 . 1 1 42 42 ALA HA H 1 4.282 0.005 . 1 . . . . 42 ALA HA . 15591 1
491 . 1 1 42 42 ALA HB1 H 1 1.496 0.007 . 1 . . . . 42 ALA HB1 . 15591 1
492 . 1 1 42 42 ALA HB2 H 1 1.496 0.007 . 1 . . . . 42 ALA HB2 . 15591 1
493 . 1 1 42 42 ALA HB3 H 1 1.496 0.007 . 1 . . . . 42 ALA HB3 . 15591 1
494 . 1 1 42 42 ALA C C 13 181.824 0.340 . 1 . . . . 42 ALA C . 15591 1
495 . 1 1 42 42 ALA CA C 13 54.002 0.148 . 1 . . . . 42 ALA CA . 15591 1
496 . 1 1 42 42 ALA CB C 13 18.441 0.206 . 1 . . . . 42 ALA CB . 15591 1
497 . 1 1 42 42 ALA N N 15 124.159 0.110 . 1 . . . . 42 ALA N . 15591 1
498 . 1 1 43 43 ALA H H 1 8.265 0.004 . 1 . . . . 43 ALA H . 15591 1
499 . 1 1 43 43 ALA HA H 1 3.651 0.005 . 1 . . . . 43 ALA HA . 15591 1
500 . 1 1 43 43 ALA HB1 H 1 1.136 0.007 . 1 . . . . 43 ALA HB1 . 15591 1
501 . 1 1 43 43 ALA HB2 H 1 1.136 0.007 . 1 . . . . 43 ALA HB2 . 15591 1
502 . 1 1 43 43 ALA HB3 H 1 1.136 0.007 . 1 . . . . 43 ALA HB3 . 15591 1
503 . 1 1 43 43 ALA C C 13 178.537 0.000 . 1 . . . . 43 ALA C . 15591 1
504 . 1 1 43 43 ALA CA C 13 55.937 0.244 . 1 . . . . 43 ALA CA . 15591 1
505 . 1 1 43 43 ALA CB C 13 17.149 0.325 . 1 . . . . 43 ALA CB . 15591 1
506 . 1 1 43 43 ALA N N 15 123.552 0.124 . 1 . . . . 43 ALA N . 15591 1
507 . 1 1 44 44 LEU H H 1 8.651 0.009 . 1 . . . . 44 LEU H . 15591 1
508 . 1 1 44 44 LEU HA H 1 3.928 0.015 . 1 . . . . 44 LEU HA . 15591 1
509 . 1 1 44 44 LEU HB2 H 1 1.577 0.011 . 2 . . . . 44 LEU HB2 . 15591 1
510 . 1 1 44 44 LEU HB3 H 1 2.058 0.004 . 2 . . . . 44 LEU HB3 . 15591 1
511 . 1 1 44 44 LEU HD11 H 1 0.453 0.010 . 2 . . . . 44 LEU HD11 . 15591 1
512 . 1 1 44 44 LEU HD12 H 1 0.453 0.010 . 2 . . . . 44 LEU HD12 . 15591 1
513 . 1 1 44 44 LEU HD13 H 1 0.453 0.010 . 2 . . . . 44 LEU HD13 . 15591 1
514 . 1 1 44 44 LEU HD21 H 1 0.823 0.017 . 2 . . . . 44 LEU HD21 . 15591 1
515 . 1 1 44 44 LEU HD22 H 1 0.823 0.017 . 2 . . . . 44 LEU HD22 . 15591 1
516 . 1 1 44 44 LEU HD23 H 1 0.823 0.017 . 2 . . . . 44 LEU HD23 . 15591 1
517 . 1 1 44 44 LEU HG H 1 1.887 0.005 . 1 . . . . 44 LEU HG . 15591 1
518 . 1 1 44 44 LEU C C 13 179.422 0.000 . 1 . . . . 44 LEU C . 15591 1
519 . 1 1 44 44 LEU CA C 13 57.403 0.187 . 1 . . . . 44 LEU CA . 15591 1
520 . 1 1 44 44 LEU CB C 13 40.626 0.204 . 1 . . . . 44 LEU CB . 15591 1
521 . 1 1 44 44 LEU CD1 C 13 22.256 0.069 . 2 . . . . 44 LEU CD1 . 15591 1
522 . 1 1 44 44 LEU CD2 C 13 25.688 0.096 . 2 . . . . 44 LEU CD2 . 15591 1
523 . 1 1 44 44 LEU CG C 13 26.076 0.214 . 1 . . . . 44 LEU CG . 15591 1
524 . 1 1 44 44 LEU N N 15 116.856 0.053 . 1 . . . . 44 LEU N . 15591 1
525 . 1 1 45 45 ASP H H 1 8.065 0.006 . 1 . . . . 45 ASP H . 15591 1
526 . 1 1 45 45 ASP HA H 1 4.571 0.005 . 1 . . . . 45 ASP HA . 15591 1
527 . 1 1 45 45 ASP HB2 H 1 2.763 0.039 . 2 . . . . 45 ASP HB2 . 15591 1
528 . 1 1 45 45 ASP HB3 H 1 2.848 0.025 . 2 . . . . 45 ASP HB3 . 15591 1
529 . 1 1 45 45 ASP C C 13 180.665 0.000 . 1 . . . . 45 ASP C . 15591 1
530 . 1 1 45 45 ASP CA C 13 57.218 0.189 . 1 . . . . 45 ASP CA . 15591 1
531 . 1 1 45 45 ASP CB C 13 40.536 0.101 . 1 . . . . 45 ASP CB . 15591 1
532 . 1 1 45 45 ASP N N 15 118.683 0.092 . 1 . . . . 45 ASP N . 15591 1
533 . 1 1 46 46 THR H H 1 7.970 0.004 . 1 . . . . 46 THR H . 15591 1
534 . 1 1 46 46 THR HA H 1 4.074 0.012 . 1 . . . . 46 THR HA . 15591 1
535 . 1 1 46 46 THR HB H 1 4.245 0.004 . 1 . . . . 46 THR HB . 15591 1
536 . 1 1 46 46 THR HG21 H 1 1.271 0.017 . 1 . . . . 46 THR HG1 . 15591 1
537 . 1 1 46 46 THR HG22 H 1 1.271 0.017 . 1 . . . . 46 THR HG1 . 15591 1
538 . 1 1 46 46 THR HG23 H 1 1.271 0.017 . 1 . . . . 46 THR HG1 . 15591 1
539 . 1 1 46 46 THR C C 13 175.947 0.148 . 1 . . . . 46 THR C . 15591 1
540 . 1 1 46 46 THR CA C 13 67.480 0.125 . 1 . . . . 46 THR CA . 15591 1
541 . 1 1 46 46 THR CB C 13 68.727 0.162 . 1 . . . . 46 THR CB . 15591 1
542 . 1 1 46 46 THR CG2 C 13 21.995 0.154 . 1 . . . . 46 THR CG2 . 15591 1
543 . 1 1 46 46 THR N N 15 119.655 0.064 . 1 . . . . 46 THR N . 15591 1
544 . 1 1 47 47 ILE H H 1 7.326 0.003 . 1 . . . . 47 ILE H . 15591 1
545 . 1 1 47 47 ILE HA H 1 4.759 0.004 . 1 . . . . 47 ILE HA . 15591 1
546 . 1 1 47 47 ILE HB H 1 2.548 0.009 . 1 . . . . 47 ILE HB . 15591 1
547 . 1 1 47 47 ILE HD11 H 1 0.702 0.005 . 1 . . . . 47 ILE HD11 . 15591 1
548 . 1 1 47 47 ILE HD12 H 1 0.702 0.005 . 1 . . . . 47 ILE HD12 . 15591 1
549 . 1 1 47 47 ILE HD13 H 1 0.702 0.005 . 1 . . . . 47 ILE HD13 . 15591 1
550 . 1 1 47 47 ILE HG12 H 1 1.558 0.011 . 2 . . . . 47 ILE HG12 . 15591 1
551 . 1 1 47 47 ILE HG13 H 1 1.587 0.024 . 2 . . . . 47 ILE HG13 . 15591 1
552 . 1 1 47 47 ILE HG21 H 1 0.553 0.006 . 1 . . . . 47 ILE HG21 . 15591 1
553 . 1 1 47 47 ILE HG22 H 1 0.553 0.006 . 1 . . . . 47 ILE HG22 . 15591 1
554 . 1 1 47 47 ILE HG23 H 1 0.553 0.006 . 1 . . . . 47 ILE HG23 . 15591 1
555 . 1 1 47 47 ILE C C 13 174.272 0.400 . 1 . . . . 47 ILE C . 15591 1
556 . 1 1 47 47 ILE CA C 13 61.807 0.099 . 1 . . . . 47 ILE CA . 15591 1
557 . 1 1 47 47 ILE CB C 13 36.976 0.194 . 1 . . . . 47 ILE CB . 15591 1
558 . 1 1 47 47 ILE CD1 C 13 14.845 0.068 . 1 . . . . 47 ILE CD1 . 15591 1
559 . 1 1 47 47 ILE CG1 C 13 26.610 0.132 . 1 . . . . 47 ILE CG1 . 15591 1
560 . 1 1 47 47 ILE CG2 C 13 18.206 0.109 . 1 . . . . 47 ILE CG2 . 15591 1
561 . 1 1 47 47 ILE N N 15 110.755 0.116 . 1 . . . . 47 ILE N . 15591 1
562 . 1 1 48 48 GLN H H 1 7.856 0.003 . 1 . . . . 48 GLN H . 15591 1
563 . 1 1 48 48 GLN HA H 1 4.032 0.005 . 1 . . . . 48 GLN HA . 15591 1
564 . 1 1 48 48 GLN HB2 H 1 2.374 0.007 . 2 . . . . 48 GLN HB2 . 15591 1
565 . 1 1 48 48 GLN HB3 H 1 2.587 0.011 . 2 . . . . 48 GLN HB3 . 15591 1
566 . 1 1 48 48 GLN HE21 H 1 4.541 0.004 . 1 . . . . 48 GLN HE21 . 15591 1
567 . 1 1 48 48 GLN HE22 H 1 6.204 0.003 . 1 . . . . 48 GLN HE22 . 15591 1
568 . 1 1 48 48 GLN HG2 H 1 2.006 0.020 . 2 . . . . 48 GLN HG2 . 15591 1
569 . 1 1 48 48 GLN HG3 H 1 2.075 0.001 . 2 . . . . 48 GLN HG3 . 15591 1
570 . 1 1 48 48 GLN C C 13 174.955 0.000 . 1 . . . . 48 GLN C . 15591 1
571 . 1 1 48 48 GLN CA C 13 57.094 0.339 . 1 . . . . 48 GLN CA . 15591 1
572 . 1 1 48 48 GLN CB C 13 26.066 0.225 . 1 . . . . 48 GLN CB . 15591 1
573 . 1 1 48 48 GLN CG C 13 34.760 0.105 . 1 . . . . 48 GLN CG . 15591 1
574 . 1 1 48 48 GLN N N 15 115.695 0.148 . 1 . . . . 48 GLN N . 15591 1
575 . 1 1 48 48 GLN NE2 N 15 107.602 0.193 . 1 . . . . 48 GLN NE2 . 15591 1
576 . 1 1 49 49 TYR H H 1 8.447 0.007 . 1 . . . . 49 TYR H . 15591 1
577 . 1 1 49 49 TYR HA H 1 4.875 0.019 . 1 . . . . 49 TYR HA . 15591 1
578 . 1 1 49 49 TYR HB2 H 1 2.913 0.007 . 2 . . . . 49 TYR HB2 . 15591 1
579 . 1 1 49 49 TYR HB3 H 1 3.217 0.006 . 2 . . . . 49 TYR HB3 . 15591 1
580 . 1 1 49 49 TYR HD1 H 1 7.318 0.008 . 3 . . . . 49 TYR HD1 . 15591 1
581 . 1 1 49 49 TYR HD2 H 1 7.318 0.008 . 3 . . . . 49 TYR HD2 . 15591 1
582 . 1 1 49 49 TYR HE1 H 1 6.897 0.006 . 3 . . . . 49 TYR HE1 . 15591 1
583 . 1 1 49 49 TYR HE2 H 1 6.897 0.006 . 3 . . . . 49 TYR HE2 . 15591 1
584 . 1 1 49 49 TYR C C 13 176.516 0.000 . 1 . . . . 49 TYR C . 15591 1
585 . 1 1 49 49 TYR CA C 13 59.081 0.193 . 1 . . . . 49 TYR CA . 15591 1
586 . 1 1 49 49 TYR CB C 13 40.160 0.109 . 1 . . . . 49 TYR CB . 15591 1
587 . 1 1 49 49 TYR CD1 C 13 133.646 0.202 . 3 . . . . 49 TYR CD1 . 15591 1
588 . 1 1 49 49 TYR CD2 C 13 133.646 0.202 . 3 . . . . 49 TYR CD2 . 15591 1
589 . 1 1 49 49 TYR CE1 C 13 118.226 0.139 . 3 . . . . 49 TYR CE1 . 15591 1
590 . 1 1 49 49 TYR CE2 C 13 118.226 0.139 . 3 . . . . 49 TYR CE2 . 15591 1
591 . 1 1 49 49 TYR N N 15 119.449 0.169 . 1 . . . . 49 TYR N . 15591 1
592 . 1 1 50 50 SER H H 1 8.037 0.010 . 1 . . . . 50 SER H . 15591 1
593 . 1 1 50 50 SER HA H 1 4.353 0.003 . 1 . . . . 50 SER HA . 15591 1
594 . 1 1 50 50 SER HB2 H 1 3.690 0.005 . 1 . . . . 50 SER HB2 . 15591 1
595 . 1 1 50 50 SER C C 13 173.557 0.192 . 1 . . . . 50 SER C . 15591 1
596 . 1 1 50 50 SER CA C 13 57.455 0.111 . 1 . . . . 50 SER CA . 15591 1
597 . 1 1 50 50 SER CB C 13 64.067 0.194 . 1 . . . . 50 SER CB . 15591 1
598 . 1 1 50 50 SER N N 15 120.808 0.074 . 1 . . . . 50 SER N . 15591 1
599 . 1 1 51 51 LYS H H 1 7.895 0.022 . 1 . . . . 51 LYS H . 15591 1
600 . 1 1 51 51 LYS HA H 1 4.210 0.006 . 1 . . . . 51 LYS HA . 15591 1
601 . 1 1 51 51 LYS HB2 H 1 1.663 0.012 . 2 . . . . 51 LYS HB2 . 15591 1
602 . 1 1 51 51 LYS HB3 H 1 1.823 0.005 . 2 . . . . 51 LYS HB3 . 15591 1
603 . 1 1 51 51 LYS HD2 H 1 1.700 0.014 . 1 . . . . 51 LYS HD2 . 15591 1
604 . 1 1 51 51 LYS HE2 H 1 3.013 0.008 . 1 . . . . 51 LYS HE2 . 15591 1
605 . 1 1 51 51 LYS HG2 H 1 1.405 0.011 . 1 . . . . 51 LYS HG2 . 15591 1
606 . 1 1 51 51 LYS C C 13 175.487 0.000 . 1 . . . . 51 LYS C . 15591 1
607 . 1 1 51 51 LYS CA C 13 56.445 0.273 . 1 . . . . 51 LYS CA . 15591 1
608 . 1 1 51 51 LYS CB C 13 32.924 0.205 . 1 . . . . 51 LYS CB . 15591 1
609 . 1 1 51 51 LYS CD C 13 29.058 0.063 . 1 . . . . 51 LYS CD . 15591 1
610 . 1 1 51 51 LYS CE C 13 42.236 0.318 . 1 . . . . 51 LYS CE . 15591 1
611 . 1 1 51 51 LYS CG C 13 24.659 0.039 . 1 . . . . 51 LYS CG . 15591 1
612 . 1 1 51 51 LYS N N 15 123.797 0.090 . 1 . . . . 51 LYS N . 15591 1
613 . 1 1 52 52 HIS H H 1 8.042 0.026 . 1 . . . . 52 HIS H . 15591 1
614 . 1 1 52 52 HIS HA H 1 4.465 0.005 . 1 . . . . 52 HIS HA . 15591 1
615 . 1 1 52 52 HIS HB2 H 1 3.093 0.032 . 2 . . . . 52 HIS HB2 . 15591 1
616 . 1 1 52 52 HIS HB3 H 1 3.213 0.024 . 2 . . . . 52 HIS HB3 . 15591 1
617 . 1 1 52 52 HIS HD2 H 1 7.143 0.000 . 1 . . . . 52 HIS HD2 . 15591 1
618 . 1 1 52 52 HIS HE1 H 1 8.367 0.000 . 1 . . . . 52 HIS HE1 . 15591 1
619 . 1 1 52 52 HIS C C 13 179.642 0.000 . 1 . . . . 52 HIS C . 15591 1
620 . 1 1 52 52 HIS CA C 13 56.756 0.105 . 1 . . . . 52 HIS CA . 15591 1
621 . 1 1 52 52 HIS CB C 13 30.375 0.204 . 1 . . . . 52 HIS CB . 15591 1
622 . 1 1 52 52 HIS CD2 C 13 119.918 0.000 . 1 . . . . 52 HIS CD2 . 15591 1
623 . 1 1 52 52 HIS CE1 C 13 136.426 0.000 . 1 . . . . 52 HIS CE1 . 15591 1
624 . 1 1 52 52 HIS N N 15 125.500 0.110 . 1 . . . . 52 HIS N . 15591 1
stop_
save_