Content for NMR-STAR saveframe, "chemical_shift_1"
save_chemical_shift_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_1
_Assigned_chem_shift_list.Entry_ID 11297
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11297 1
2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11297 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $XWINNMR . . 11297 1
2 $NMRPipe . . 11297 1
3 $NMRVIEW . . 11297 1
4 $Kujira . . 11297 1
5 $CYANA . . 11297 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 7 7 GLY HA2 H 1 3.946 0.030 . 1 . . . . 7 GLY HA2 . 11297 1
2 . 1 1 7 7 GLY HA3 H 1 3.946 0.030 . 1 . . . . 7 GLY HA3 . 11297 1
3 . 1 1 7 7 GLY CA C 13 45.169 0.300 . 1 . . . . 7 GLY CA . 11297 1
4 . 1 1 8 8 MET H H 1 8.145 0.030 . 1 . . . . 8 MET H . 11297 1
5 . 1 1 8 8 MET HA H 1 4.814 0.030 . 1 . . . . 8 MET HA . 11297 1
6 . 1 1 8 8 MET HB2 H 1 2.049 0.030 . 2 . . . . 8 MET HB2 . 11297 1
7 . 1 1 8 8 MET HB3 H 1 1.939 0.030 . 2 . . . . 8 MET HB3 . 11297 1
8 . 1 1 8 8 MET HE1 H 1 2.109 0.030 . 1 . . . . 8 MET HE . 11297 1
9 . 1 1 8 8 MET HE2 H 1 2.109 0.030 . 1 . . . . 8 MET HE . 11297 1
10 . 1 1 8 8 MET HE3 H 1 2.109 0.030 . 1 . . . . 8 MET HE . 11297 1
11 . 1 1 8 8 MET HG2 H 1 2.626 0.030 . 2 . . . . 8 MET HG2 . 11297 1
12 . 1 1 8 8 MET HG3 H 1 2.539 0.030 . 2 . . . . 8 MET HG3 . 11297 1
13 . 1 1 8 8 MET CA C 13 53.250 0.300 . 1 . . . . 8 MET CA . 11297 1
14 . 1 1 8 8 MET CB C 13 32.270 0.300 . 1 . . . . 8 MET CB . 11297 1
15 . 1 1 8 8 MET CE C 13 17.112 0.300 . 1 . . . . 8 MET CE . 11297 1
16 . 1 1 8 8 MET CG C 13 32.192 0.300 . 1 . . . . 8 MET CG . 11297 1
17 . 1 1 8 8 MET N N 15 120.979 0.300 . 1 . . . . 8 MET N . 11297 1
18 . 1 1 9 9 PRO HA H 1 4.453 0.030 . 1 . . . . 9 PRO HA . 11297 1
19 . 1 1 9 9 PRO HB2 H 1 2.303 0.030 . 2 . . . . 9 PRO HB2 . 11297 1
20 . 1 1 9 9 PRO HB3 H 1 1.915 0.030 . 2 . . . . 9 PRO HB3 . 11297 1
21 . 1 1 9 9 PRO HD2 H 1 3.848 0.030 . 2 . . . . 9 PRO HD2 . 11297 1
22 . 1 1 9 9 PRO HD3 H 1 3.669 0.030 . 2 . . . . 9 PRO HD3 . 11297 1
23 . 1 1 9 9 PRO HG2 H 1 2.023 0.030 . 1 . . . . 9 PRO HG2 . 11297 1
24 . 1 1 9 9 PRO HG3 H 1 2.023 0.030 . 1 . . . . 9 PRO HG3 . 11297 1
25 . 1 1 9 9 PRO C C 13 176.860 0.300 . 1 . . . . 9 PRO C . 11297 1
26 . 1 1 9 9 PRO CA C 13 63.132 0.300 . 1 . . . . 9 PRO CA . 11297 1
27 . 1 1 9 9 PRO CB C 13 32.119 0.300 . 1 . . . . 9 PRO CB . 11297 1
28 . 1 1 9 9 PRO CD C 13 50.682 0.300 . 1 . . . . 9 PRO CD . 11297 1
29 . 1 1 9 9 PRO CG C 13 27.436 0.300 . 1 . . . . 9 PRO CG . 11297 1
30 . 1 1 10 10 SER H H 1 8.444 0.030 . 1 . . . . 10 SER H . 11297 1
31 . 1 1 10 10 SER HA H 1 4.377 0.030 . 1 . . . . 10 SER HA . 11297 1
32 . 1 1 10 10 SER HB2 H 1 3.797 0.030 . 1 . . . . 10 SER HB2 . 11297 1
33 . 1 1 10 10 SER HB3 H 1 3.797 0.030 . 1 . . . . 10 SER HB3 . 11297 1
34 . 1 1 10 10 SER C C 13 174.226 0.300 . 1 . . . . 10 SER C . 11297 1
35 . 1 1 10 10 SER CA C 13 58.140 0.300 . 1 . . . . 10 SER CA . 11297 1
36 . 1 1 10 10 SER CB C 13 63.927 0.300 . 1 . . . . 10 SER CB . 11297 1
37 . 1 1 10 10 SER N N 15 116.757 0.300 . 1 . . . . 10 SER N . 11297 1
38 . 1 1 11 11 ARG H H 1 8.142 0.030 . 1 . . . . 11 ARG H . 11297 1
39 . 1 1 11 11 ARG HA H 1 4.140 0.030 . 1 . . . . 11 ARG HA . 11297 1
40 . 1 1 11 11 ARG HB2 H 1 1.544 0.030 . 2 . . . . 11 ARG HB2 . 11297 1
41 . 1 1 11 11 ARG HB3 H 1 1.361 0.030 . 2 . . . . 11 ARG HB3 . 11297 1
42 . 1 1 11 11 ARG HD2 H 1 2.948 0.030 . 2 . . . . 11 ARG HD2 . 11297 1
43 . 1 1 11 11 ARG HD3 H 1 2.906 0.030 . 2 . . . . 11 ARG HD3 . 11297 1
44 . 1 1 11 11 ARG HE H 1 6.558 0.030 . 1 . . . . 11 ARG HE . 11297 1
45 . 1 1 11 11 ARG HG2 H 1 1.285 0.030 . 2 . . . . 11 ARG HG2 . 11297 1
46 . 1 1 11 11 ARG HG3 H 1 1.219 0.030 . 2 . . . . 11 ARG HG3 . 11297 1
47 . 1 1 11 11 ARG C C 13 176.047 0.300 . 1 . . . . 11 ARG C . 11297 1
48 . 1 1 11 11 ARG CA C 13 55.497 0.300 . 1 . . . . 11 ARG CA . 11297 1
49 . 1 1 11 11 ARG CB C 13 30.533 0.300 . 1 . . . . 11 ARG CB . 11297 1
50 . 1 1 11 11 ARG CD C 13 43.777 0.300 . 1 . . . . 11 ARG CD . 11297 1
51 . 1 1 11 11 ARG CG C 13 25.184 0.300 . 1 . . . . 11 ARG CG . 11297 1
52 . 1 1 11 11 ARG N N 15 121.178 0.300 . 1 . . . . 11 ARG N . 11297 1
53 . 1 1 11 11 ARG NE N 15 84.336 0.300 . 1 . . . . 11 ARG NE . 11297 1
54 . 1 1 12 12 LYS H H 1 7.963 0.030 . 1 . . . . 12 LYS H . 11297 1
55 . 1 1 12 12 LYS HA H 1 3.775 0.030 . 1 . . . . 12 LYS HA . 11297 1
56 . 1 1 12 12 LYS HB2 H 1 1.170 0.030 . 2 . . . . 12 LYS HB2 . 11297 1
57 . 1 1 12 12 LYS HB3 H 1 0.867 0.030 . 2 . . . . 12 LYS HB3 . 11297 1
58 . 1 1 12 12 LYS HD2 H 1 1.336 0.030 . 1 . . . . 12 LYS HD2 . 11297 1
59 . 1 1 12 12 LYS HD3 H 1 1.336 0.030 . 1 . . . . 12 LYS HD3 . 11297 1
60 . 1 1 12 12 LYS HE2 H 1 2.800 0.030 . 1 . . . . 12 LYS HE2 . 11297 1
61 . 1 1 12 12 LYS HE3 H 1 2.800 0.030 . 1 . . . . 12 LYS HE3 . 11297 1
62 . 1 1 12 12 LYS HG2 H 1 0.940 0.030 . 2 . . . . 12 LYS HG2 . 11297 1
63 . 1 1 12 12 LYS HG3 H 1 0.465 0.030 . 2 . . . . 12 LYS HG3 . 11297 1
64 . 1 1 12 12 LYS C C 13 175.890 0.300 . 1 . . . . 12 LYS C . 11297 1
65 . 1 1 12 12 LYS CA C 13 58.204 0.300 . 1 . . . . 12 LYS CA . 11297 1
66 . 1 1 12 12 LYS CB C 13 33.803 0.300 . 1 . . . . 12 LYS CB . 11297 1
67 . 1 1 12 12 LYS CD C 13 29.189 0.300 . 1 . . . . 12 LYS CD . 11297 1
68 . 1 1 12 12 LYS CE C 13 41.940 0.300 . 1 . . . . 12 LYS CE . 11297 1
69 . 1 1 12 12 LYS CG C 13 24.848 0.300 . 1 . . . . 12 LYS CG . 11297 1
70 . 1 1 12 12 LYS N N 15 123.100 0.300 . 1 . . . . 12 LYS N . 11297 1
71 . 1 1 13 13 PHE H H 1 7.352 0.030 . 1 . . . . 13 PHE H . 11297 1
72 . 1 1 13 13 PHE HA H 1 4.927 0.030 . 1 . . . . 13 PHE HA . 11297 1
73 . 1 1 13 13 PHE HB2 H 1 2.760 0.030 . 2 . . . . 13 PHE HB2 . 11297 1
74 . 1 1 13 13 PHE HB3 H 1 2.349 0.030 . 2 . . . . 13 PHE HB3 . 11297 1
75 . 1 1 13 13 PHE HD1 H 1 6.828 0.030 . 1 . . . . 13 PHE HD1 . 11297 1
76 . 1 1 13 13 PHE HD2 H 1 6.828 0.030 . 1 . . . . 13 PHE HD2 . 11297 1
77 . 1 1 13 13 PHE HE1 H 1 7.156 0.030 . 1 . . . . 13 PHE HE1 . 11297 1
78 . 1 1 13 13 PHE HE2 H 1 7.156 0.030 . 1 . . . . 13 PHE HE2 . 11297 1
79 . 1 1 13 13 PHE HZ H 1 7.079 0.030 . 1 . . . . 13 PHE HZ . 11297 1
80 . 1 1 13 13 PHE C C 13 174.967 0.300 . 1 . . . . 13 PHE C . 11297 1
81 . 1 1 13 13 PHE CA C 13 55.875 0.300 . 1 . . . . 13 PHE CA . 11297 1
82 . 1 1 13 13 PHE CB C 13 41.426 0.300 . 1 . . . . 13 PHE CB . 11297 1
83 . 1 1 13 13 PHE CD1 C 13 132.071 0.300 . 1 . . . . 13 PHE CD1 . 11297 1
84 . 1 1 13 13 PHE CD2 C 13 132.071 0.300 . 1 . . . . 13 PHE CD2 . 11297 1
85 . 1 1 13 13 PHE CE1 C 13 131.001 0.300 . 1 . . . . 13 PHE CE1 . 11297 1
86 . 1 1 13 13 PHE CE2 C 13 131.001 0.300 . 1 . . . . 13 PHE CE2 . 11297 1
87 . 1 1 13 13 PHE CZ C 13 129.868 0.300 . 1 . . . . 13 PHE CZ . 11297 1
88 . 1 1 13 13 PHE N N 15 115.020 0.300 . 1 . . . . 13 PHE N . 11297 1
89 . 1 1 14 14 ALA H H 1 9.420 0.030 . 1 . . . . 14 ALA H . 11297 1
90 . 1 1 14 14 ALA HA H 1 4.320 0.030 . 1 . . . . 14 ALA HA . 11297 1
91 . 1 1 14 14 ALA HB1 H 1 1.431 0.030 . 1 . . . . 14 ALA HB . 11297 1
92 . 1 1 14 14 ALA HB2 H 1 1.431 0.030 . 1 . . . . 14 ALA HB . 11297 1
93 . 1 1 14 14 ALA HB3 H 1 1.431 0.030 . 1 . . . . 14 ALA HB . 11297 1
94 . 1 1 14 14 ALA C C 13 176.715 0.300 . 1 . . . . 14 ALA C . 11297 1
95 . 1 1 14 14 ALA CA C 13 51.364 0.300 . 1 . . . . 14 ALA CA . 11297 1
96 . 1 1 14 14 ALA CB C 13 20.786 0.300 . 1 . . . . 14 ALA CB . 11297 1
97 . 1 1 14 14 ALA N N 15 129.147 0.300 . 1 . . . . 14 ALA N . 11297 1
98 . 1 1 15 15 ASP H H 1 8.535 0.030 . 1 . . . . 15 ASP H . 11297 1
99 . 1 1 15 15 ASP HA H 1 4.072 0.030 . 1 . . . . 15 ASP HA . 11297 1
100 . 1 1 15 15 ASP HB2 H 1 2.626 0.030 . 2 . . . . 15 ASP HB2 . 11297 1
101 . 1 1 15 15 ASP HB3 H 1 2.508 0.030 . 2 . . . . 15 ASP HB3 . 11297 1
102 . 1 1 15 15 ASP C C 13 178.026 0.300 . 1 . . . . 15 ASP C . 11297 1
103 . 1 1 15 15 ASP CA C 13 56.130 0.300 . 1 . . . . 15 ASP CA . 11297 1
104 . 1 1 15 15 ASP CB C 13 39.324 0.300 . 1 . . . . 15 ASP CB . 11297 1
105 . 1 1 15 15 ASP N N 15 120.762 0.300 . 1 . . . . 15 ASP N . 11297 1
106 . 1 1 16 16 GLY H H 1 9.227 0.030 . 1 . . . . 16 GLY H . 11297 1
107 . 1 1 16 16 GLY HA2 H 1 4.283 0.030 . 2 . . . . 16 GLY HA2 . 11297 1
108 . 1 1 16 16 GLY HA3 H 1 3.873 0.030 . 2 . . . . 16 GLY HA3 . 11297 1
109 . 1 1 16 16 GLY C C 13 174.044 0.300 . 1 . . . . 16 GLY C . 11297 1
110 . 1 1 16 16 GLY CA C 13 45.122 0.300 . 1 . . . . 16 GLY CA . 11297 1
111 . 1 1 16 16 GLY N N 15 112.694 0.300 . 1 . . . . 16 GLY N . 11297 1
112 . 1 1 17 17 GLU H H 1 7.860 0.030 . 1 . . . . 17 GLU H . 11297 1
113 . 1 1 17 17 GLU HA H 1 4.124 0.030 . 1 . . . . 17 GLU HA . 11297 1
114 . 1 1 17 17 GLU HB2 H 1 2.094 0.030 . 2 . . . . 17 GLU HB2 . 11297 1
115 . 1 1 17 17 GLU HB3 H 1 2.033 0.030 . 2 . . . . 17 GLU HB3 . 11297 1
116 . 1 1 17 17 GLU HG2 H 1 2.455 0.030 . 2 . . . . 17 GLU HG2 . 11297 1
117 . 1 1 17 17 GLU HG3 H 1 2.202 0.030 . 2 . . . . 17 GLU HG3 . 11297 1
118 . 1 1 17 17 GLU C C 13 175.052 0.300 . 1 . . . . 17 GLU C . 11297 1
119 . 1 1 17 17 GLU CA C 13 58.100 0.300 . 1 . . . . 17 GLU CA . 11297 1
120 . 1 1 17 17 GLU CB C 13 31.312 0.300 . 1 . . . . 17 GLU CB . 11297 1
121 . 1 1 17 17 GLU CG C 13 37.676 0.300 . 1 . . . . 17 GLU CG . 11297 1
122 . 1 1 17 17 GLU N N 15 121.714 0.300 . 1 . . . . 17 GLU N . 11297 1
123 . 1 1 18 18 VAL H H 1 8.393 0.030 . 1 . . . . 18 VAL H . 11297 1
124 . 1 1 18 18 VAL HA H 1 4.736 0.030 . 1 . . . . 18 VAL HA . 11297 1
125 . 1 1 18 18 VAL HB H 1 1.951 0.030 . 1 . . . . 18 VAL HB . 11297 1
126 . 1 1 18 18 VAL HG11 H 1 0.957 0.030 . 1 . . . . 18 VAL HG1 . 11297 1
127 . 1 1 18 18 VAL HG12 H 1 0.957 0.030 . 1 . . . . 18 VAL HG1 . 11297 1
128 . 1 1 18 18 VAL HG13 H 1 0.957 0.030 . 1 . . . . 18 VAL HG1 . 11297 1
129 . 1 1 18 18 VAL HG21 H 1 0.889 0.030 . 1 . . . . 18 VAL HG2 . 11297 1
130 . 1 1 18 18 VAL HG22 H 1 0.889 0.030 . 1 . . . . 18 VAL HG2 . 11297 1
131 . 1 1 18 18 VAL HG23 H 1 0.889 0.030 . 1 . . . . 18 VAL HG2 . 11297 1
132 . 1 1 18 18 VAL C C 13 176.654 0.300 . 1 . . . . 18 VAL C . 11297 1
133 . 1 1 18 18 VAL CA C 13 62.697 0.300 . 1 . . . . 18 VAL CA . 11297 1
134 . 1 1 18 18 VAL CB C 13 31.440 0.300 . 1 . . . . 18 VAL CB . 11297 1
135 . 1 1 18 18 VAL CG1 C 13 21.223 0.300 . 2 . . . . 18 VAL CG1 . 11297 1
136 . 1 1 18 18 VAL CG2 C 13 21.333 0.300 . 2 . . . . 18 VAL CG2 . 11297 1
137 . 1 1 18 18 VAL N N 15 124.831 0.300 . 1 . . . . 18 VAL N . 11297 1
138 . 1 1 19 19 VAL H H 1 8.798 0.030 . 1 . . . . 19 VAL H . 11297 1
139 . 1 1 19 19 VAL HA H 1 4.656 0.030 . 1 . . . . 19 VAL HA . 11297 1
140 . 1 1 19 19 VAL HB H 1 2.001 0.030 . 1 . . . . 19 VAL HB . 11297 1
141 . 1 1 19 19 VAL HG11 H 1 0.502 0.030 . 1 . . . . 19 VAL HG1 . 11297 1
142 . 1 1 19 19 VAL HG12 H 1 0.502 0.030 . 1 . . . . 19 VAL HG1 . 11297 1
143 . 1 1 19 19 VAL HG13 H 1 0.502 0.030 . 1 . . . . 19 VAL HG1 . 11297 1
144 . 1 1 19 19 VAL HG21 H 1 0.188 0.030 . 1 . . . . 19 VAL HG2 . 11297 1
145 . 1 1 19 19 VAL HG22 H 1 0.188 0.030 . 1 . . . . 19 VAL HG2 . 11297 1
146 . 1 1 19 19 VAL HG23 H 1 0.188 0.030 . 1 . . . . 19 VAL HG2 . 11297 1
147 . 1 1 19 19 VAL C C 13 174.190 0.300 . 1 . . . . 19 VAL C . 11297 1
148 . 1 1 19 19 VAL CA C 13 59.005 0.300 . 1 . . . . 19 VAL CA . 11297 1
149 . 1 1 19 19 VAL CB C 13 34.051 0.300 . 1 . . . . 19 VAL CB . 11297 1
150 . 1 1 19 19 VAL CG1 C 13 22.225 0.300 . 2 . . . . 19 VAL CG1 . 11297 1
151 . 1 1 19 19 VAL CG2 C 13 18.797 0.300 . 2 . . . . 19 VAL CG2 . 11297 1
152 . 1 1 19 19 VAL N N 15 122.720 0.300 . 1 . . . . 19 VAL N . 11297 1
153 . 1 1 20 20 ARG H H 1 8.497 0.030 . 1 . . . . 20 ARG H . 11297 1
154 . 1 1 20 20 ARG HA H 1 5.249 0.030 . 1 . . . . 20 ARG HA . 11297 1
155 . 1 1 20 20 ARG HB2 H 1 1.631 0.030 . 2 . . . . 20 ARG HB2 . 11297 1
156 . 1 1 20 20 ARG HB3 H 1 1.483 0.030 . 2 . . . . 20 ARG HB3 . 11297 1
157 . 1 1 20 20 ARG HD2 H 1 2.974 0.030 . 1 . . . . 20 ARG HD2 . 11297 1
158 . 1 1 20 20 ARG HD3 H 1 2.974 0.030 . 1 . . . . 20 ARG HD3 . 11297 1
159 . 1 1 20 20 ARG HG2 H 1 1.564 0.030 . 2 . . . . 20 ARG HG2 . 11297 1
160 . 1 1 20 20 ARG HG3 H 1 1.430 0.030 . 2 . . . . 20 ARG HG3 . 11297 1
161 . 1 1 20 20 ARG C C 13 174.906 0.300 . 1 . . . . 20 ARG C . 11297 1
162 . 1 1 20 20 ARG CA C 13 54.161 0.300 . 1 . . . . 20 ARG CA . 11297 1
163 . 1 1 20 20 ARG CB C 13 32.194 0.300 . 1 . . . . 20 ARG CB . 11297 1
164 . 1 1 20 20 ARG CD C 13 43.335 0.300 . 1 . . . . 20 ARG CD . 11297 1
165 . 1 1 20 20 ARG CG C 13 27.313 0.300 . 1 . . . . 20 ARG CG . 11297 1
166 . 1 1 20 20 ARG N N 15 118.450 0.300 . 1 . . . . 20 ARG N . 11297 1
167 . 1 1 21 21 GLY H H 1 9.563 0.030 . 1 . . . . 21 GLY H . 11297 1
168 . 1 1 21 21 GLY HA2 H 1 5.194 0.030 . 2 . . . . 21 GLY HA2 . 11297 1
169 . 1 1 21 21 GLY HA3 H 1 3.056 0.030 . 2 . . . . 21 GLY HA3 . 11297 1
170 . 1 1 21 21 GLY C C 13 172.199 0.300 . 1 . . . . 21 GLY C . 11297 1
171 . 1 1 21 21 GLY CA C 13 43.876 0.300 . 1 . . . . 21 GLY CA . 11297 1
172 . 1 1 21 21 GLY N N 15 109.453 0.300 . 1 . . . . 21 GLY N . 11297 1
173 . 1 1 22 22 ARG H H 1 8.479 0.030 . 1 . . . . 22 ARG H . 11297 1
174 . 1 1 22 22 ARG HA H 1 3.903 0.030 . 1 . . . . 22 ARG HA . 11297 1
175 . 1 1 22 22 ARG HB2 H 1 1.393 0.030 . 2 . . . . 22 ARG HB2 . 11297 1
176 . 1 1 22 22 ARG HB3 H 1 0.982 0.030 . 2 . . . . 22 ARG HB3 . 11297 1
177 . 1 1 22 22 ARG HD2 H 1 3.188 0.030 . 2 . . . . 22 ARG HD2 . 11297 1
178 . 1 1 22 22 ARG HD3 H 1 2.836 0.030 . 2 . . . . 22 ARG HD3 . 11297 1
179 . 1 1 22 22 ARG HE H 1 7.258 0.030 . 1 . . . . 22 ARG HE . 11297 1
180 . 1 1 22 22 ARG HG2 H 1 1.203 0.030 . 2 . . . . 22 ARG HG2 . 11297 1
181 . 1 1 22 22 ARG HG3 H 1 0.801 0.030 . 2 . . . . 22 ARG HG3 . 11297 1
182 . 1 1 22 22 ARG C C 13 175.513 0.300 . 1 . . . . 22 ARG C . 11297 1
183 . 1 1 22 22 ARG CA C 13 55.791 0.300 . 1 . . . . 22 ARG CA . 11297 1
184 . 1 1 22 22 ARG CB C 13 31.263 0.300 . 1 . . . . 22 ARG CB . 11297 1
185 . 1 1 22 22 ARG CD C 13 43.692 0.300 . 1 . . . . 22 ARG CD . 11297 1
186 . 1 1 22 22 ARG CG C 13 26.864 0.300 . 1 . . . . 22 ARG CG . 11297 1
187 . 1 1 22 22 ARG N N 15 127.008 0.300 . 1 . . . . 22 ARG N . 11297 1
188 . 1 1 22 22 ARG NE N 15 84.169 0.300 . 1 . . . . 22 ARG NE . 11297 1
189 . 1 1 23 23 TRP H H 1 8.442 0.030 . 1 . . . . 23 TRP H . 11297 1
190 . 1 1 23 23 TRP HA H 1 4.772 0.030 . 1 . . . . 23 TRP HA . 11297 1
191 . 1 1 23 23 TRP HB2 H 1 3.151 0.030 . 2 . . . . 23 TRP HB2 . 11297 1
192 . 1 1 23 23 TRP HB3 H 1 2.894 0.030 . 2 . . . . 23 TRP HB3 . 11297 1
193 . 1 1 23 23 TRP HD1 H 1 7.065 0.030 . 1 . . . . 23 TRP HD1 . 11297 1
194 . 1 1 23 23 TRP HE1 H 1 9.881 0.030 . 1 . . . . 23 TRP HE1 . 11297 1
195 . 1 1 23 23 TRP HE3 H 1 6.850 0.030 . 1 . . . . 23 TRP HE3 . 11297 1
196 . 1 1 23 23 TRP HH2 H 1 6.829 0.030 . 1 . . . . 23 TRP HH2 . 11297 1
197 . 1 1 23 23 TRP HZ2 H 1 7.224 0.030 . 1 . . . . 23 TRP HZ2 . 11297 1
198 . 1 1 23 23 TRP HZ3 H 1 6.045 0.030 . 1 . . . . 23 TRP HZ3 . 11297 1
199 . 1 1 23 23 TRP C C 13 174.554 0.300 . 1 . . . . 23 TRP C . 11297 1
200 . 1 1 23 23 TRP CA C 13 54.372 0.300 . 1 . . . . 23 TRP CA . 11297 1
201 . 1 1 23 23 TRP CB C 13 29.518 0.300 . 1 . . . . 23 TRP CB . 11297 1
202 . 1 1 23 23 TRP CD1 C 13 127.220 0.300 . 1 . . . . 23 TRP CD1 . 11297 1
203 . 1 1 23 23 TRP CE3 C 13 120.486 0.300 . 1 . . . . 23 TRP CE3 . 11297 1
204 . 1 1 23 23 TRP CH2 C 13 123.908 0.300 . 1 . . . . 23 TRP CH2 . 11297 1
205 . 1 1 23 23 TRP CZ2 C 13 114.251 0.300 . 1 . . . . 23 TRP CZ2 . 11297 1
206 . 1 1 23 23 TRP CZ3 C 13 120.888 0.300 . 1 . . . . 23 TRP CZ3 . 11297 1
207 . 1 1 23 23 TRP N N 15 129.779 0.300 . 1 . . . . 23 TRP N . 11297 1
208 . 1 1 23 23 TRP NE1 N 15 128.503 0.300 . 1 . . . . 23 TRP NE1 . 11297 1
209 . 1 1 24 24 PRO HA H 1 4.095 0.030 . 1 . . . . 24 PRO HA . 11297 1
210 . 1 1 24 24 PRO HB2 H 1 2.097 0.030 . 2 . . . . 24 PRO HB2 . 11297 1
211 . 1 1 24 24 PRO HB3 H 1 1.583 0.030 . 2 . . . . 24 PRO HB3 . 11297 1
212 . 1 1 24 24 PRO HD2 H 1 3.491 0.030 . 2 . . . . 24 PRO HD2 . 11297 1
213 . 1 1 24 24 PRO HD3 H 1 2.240 0.030 . 2 . . . . 24 PRO HD3 . 11297 1
214 . 1 1 24 24 PRO HG2 H 1 1.673 0.030 . 2 . . . . 24 PRO HG2 . 11297 1
215 . 1 1 24 24 PRO HG3 H 1 1.635 0.030 . 2 . . . . 24 PRO HG3 . 11297 1
216 . 1 1 24 24 PRO CA C 13 64.153 0.300 . 1 . . . . 24 PRO CA . 11297 1
217 . 1 1 24 24 PRO CB C 13 31.543 0.300 . 1 . . . . 24 PRO CB . 11297 1
218 . 1 1 24 24 PRO CD C 13 50.744 0.300 . 1 . . . . 24 PRO CD . 11297 1
219 . 1 1 24 24 PRO CG C 13 27.429 0.300 . 1 . . . . 24 PRO CG . 11297 1
220 . 1 1 25 25 GLY H H 1 8.594 0.030 . 1 . . . . 25 GLY H . 11297 1
221 . 1 1 25 25 GLY HA2 H 1 4.116 0.030 . 2 . . . . 25 GLY HA2 . 11297 1
222 . 1 1 25 25 GLY HA3 H 1 3.704 0.030 . 2 . . . . 25 GLY HA3 . 11297 1
223 . 1 1 25 25 GLY CA C 13 45.388 0.300 . 1 . . . . 25 GLY CA . 11297 1
224 . 1 1 25 25 GLY N N 15 111.074 0.300 . 1 . . . . 25 GLY N . 11297 1
225 . 1 1 26 26 SER H H 1 8.274 0.030 . 1 . . . . 26 SER H . 11297 1
226 . 1 1 26 26 SER HA H 1 4.980 0.030 . 1 . . . . 26 SER HA . 11297 1
227 . 1 1 26 26 SER HB2 H 1 4.061 0.030 . 2 . . . . 26 SER HB2 . 11297 1
228 . 1 1 26 26 SER HB3 H 1 3.929 0.030 . 2 . . . . 26 SER HB3 . 11297 1
229 . 1 1 26 26 SER CA C 13 56.677 0.300 . 1 . . . . 26 SER CA . 11297 1
230 . 1 1 26 26 SER CB C 13 66.886 0.300 . 1 . . . . 26 SER CB . 11297 1
231 . 1 1 26 26 SER N N 15 116.052 0.300 . 1 . . . . 26 SER N . 11297 1
232 . 1 1 27 27 SER HA H 1 4.568 0.030 . 1 . . . . 27 SER HA . 11297 1
233 . 1 1 27 27 SER HB2 H 1 3.988 0.030 . 2 . . . . 27 SER HB2 . 11297 1
234 . 1 1 27 27 SER HB3 H 1 3.961 0.030 . 2 . . . . 27 SER HB3 . 11297 1
235 . 1 1 27 27 SER C C 13 173.826 0.300 . 1 . . . . 27 SER C . 11297 1
236 . 1 1 27 27 SER CA C 13 57.744 0.300 . 1 . . . . 27 SER CA . 11297 1
237 . 1 1 27 27 SER CB C 13 63.700 0.300 . 1 . . . . 27 SER CB . 11297 1
238 . 1 1 28 28 LEU H H 1 8.295 0.030 . 1 . . . . 28 LEU H . 11297 1
239 . 1 1 28 28 LEU HA H 1 4.445 0.030 . 1 . . . . 28 LEU HA . 11297 1
240 . 1 1 28 28 LEU HB2 H 1 1.690 0.030 . 2 . . . . 28 LEU HB2 . 11297 1
241 . 1 1 28 28 LEU HB3 H 1 1.173 0.030 . 2 . . . . 28 LEU HB3 . 11297 1
242 . 1 1 28 28 LEU HD11 H 1 0.911 0.030 . 1 . . . . 28 LEU HD1 . 11297 1
243 . 1 1 28 28 LEU HD12 H 1 0.911 0.030 . 1 . . . . 28 LEU HD1 . 11297 1
244 . 1 1 28 28 LEU HD13 H 1 0.911 0.030 . 1 . . . . 28 LEU HD1 . 11297 1
245 . 1 1 28 28 LEU HD21 H 1 0.819 0.030 . 1 . . . . 28 LEU HD2 . 11297 1
246 . 1 1 28 28 LEU HD22 H 1 0.819 0.030 . 1 . . . . 28 LEU HD2 . 11297 1
247 . 1 1 28 28 LEU HD23 H 1 0.819 0.030 . 1 . . . . 28 LEU HD2 . 11297 1
248 . 1 1 28 28 LEU HG H 1 1.587 0.030 . 1 . . . . 28 LEU HG . 11297 1
249 . 1 1 28 28 LEU C C 13 175.027 0.300 . 1 . . . . 28 LEU C . 11297 1
250 . 1 1 28 28 LEU CA C 13 54.499 0.300 . 1 . . . . 28 LEU CA . 11297 1
251 . 1 1 28 28 LEU CB C 13 43.557 0.300 . 1 . . . . 28 LEU CB . 11297 1
252 . 1 1 28 28 LEU CD1 C 13 25.184 0.300 . 2 . . . . 28 LEU CD1 . 11297 1
253 . 1 1 28 28 LEU CD2 C 13 23.007 0.300 . 2 . . . . 28 LEU CD2 . 11297 1
254 . 1 1 28 28 LEU CG C 13 27.050 0.300 . 1 . . . . 28 LEU CG . 11297 1
255 . 1 1 28 28 LEU N N 15 123.176 0.300 . 1 . . . . 28 LEU N . 11297 1
256 . 1 1 29 29 TYR H H 1 8.281 0.030 . 1 . . . . 29 TYR H . 11297 1
257 . 1 1 29 29 TYR HA H 1 4.883 0.030 . 1 . . . . 29 TYR HA . 11297 1
258 . 1 1 29 29 TYR HB2 H 1 2.821 0.030 . 2 . . . . 29 TYR HB2 . 11297 1
259 . 1 1 29 29 TYR HB3 H 1 2.367 0.030 . 2 . . . . 29 TYR HB3 . 11297 1
260 . 1 1 29 29 TYR HD1 H 1 6.849 0.030 . 1 . . . . 29 TYR HD1 . 11297 1
261 . 1 1 29 29 TYR HD2 H 1 6.849 0.030 . 1 . . . . 29 TYR HD2 . 11297 1
262 . 1 1 29 29 TYR HE1 H 1 6.642 0.030 . 1 . . . . 29 TYR HE1 . 11297 1
263 . 1 1 29 29 TYR HE2 H 1 6.642 0.030 . 1 . . . . 29 TYR HE2 . 11297 1
264 . 1 1 29 29 TYR C C 13 175.926 0.300 . 1 . . . . 29 TYR C . 11297 1
265 . 1 1 29 29 TYR CA C 13 57.041 0.300 . 1 . . . . 29 TYR CA . 11297 1
266 . 1 1 29 29 TYR CB C 13 40.841 0.300 . 1 . . . . 29 TYR CB . 11297 1
267 . 1 1 29 29 TYR CD1 C 13 132.804 0.300 . 1 . . . . 29 TYR CD1 . 11297 1
268 . 1 1 29 29 TYR CD2 C 13 132.804 0.300 . 1 . . . . 29 TYR CD2 . 11297 1
269 . 1 1 29 29 TYR CE1 C 13 118.249 0.300 . 1 . . . . 29 TYR CE1 . 11297 1
270 . 1 1 29 29 TYR CE2 C 13 118.249 0.300 . 1 . . . . 29 TYR CE2 . 11297 1
271 . 1 1 29 29 TYR N N 15 118.089 0.300 . 1 . . . . 29 TYR N . 11297 1
272 . 1 1 30 30 TYR H H 1 8.910 0.030 . 1 . . . . 30 TYR H . 11297 1
273 . 1 1 30 30 TYR HA H 1 4.896 0.030 . 1 . . . . 30 TYR HA . 11297 1
274 . 1 1 30 30 TYR HB2 H 1 3.301 0.030 . 2 . . . . 30 TYR HB2 . 11297 1
275 . 1 1 30 30 TYR HB3 H 1 2.708 0.030 . 2 . . . . 30 TYR HB3 . 11297 1
276 . 1 1 30 30 TYR HD1 H 1 6.956 0.030 . 1 . . . . 30 TYR HD1 . 11297 1
277 . 1 1 30 30 TYR HD2 H 1 6.956 0.030 . 1 . . . . 30 TYR HD2 . 11297 1
278 . 1 1 30 30 TYR HE1 H 1 6.367 0.030 . 1 . . . . 30 TYR HE1 . 11297 1
279 . 1 1 30 30 TYR HE2 H 1 6.367 0.030 . 1 . . . . 30 TYR HE2 . 11297 1
280 . 1 1 30 30 TYR C C 13 175.003 0.300 . 1 . . . . 30 TYR C . 11297 1
281 . 1 1 30 30 TYR CA C 13 55.719 0.300 . 1 . . . . 30 TYR CA . 11297 1
282 . 1 1 30 30 TYR CB C 13 42.191 0.300 . 1 . . . . 30 TYR CB . 11297 1
283 . 1 1 30 30 TYR CD1 C 13 132.527 0.300 . 1 . . . . 30 TYR CD1 . 11297 1
284 . 1 1 30 30 TYR CD2 C 13 132.527 0.300 . 1 . . . . 30 TYR CD2 . 11297 1
285 . 1 1 30 30 TYR CE1 C 13 117.791 0.300 . 1 . . . . 30 TYR CE1 . 11297 1
286 . 1 1 30 30 TYR CE2 C 13 117.791 0.300 . 1 . . . . 30 TYR CE2 . 11297 1
287 . 1 1 30 30 TYR N N 15 120.921 0.300 . 1 . . . . 30 TYR N . 11297 1
288 . 1 1 31 31 GLU H H 1 8.957 0.030 . 1 . . . . 31 GLU H . 11297 1
289 . 1 1 31 31 GLU HA H 1 4.707 0.030 . 1 . . . . 31 GLU HA . 11297 1
290 . 1 1 31 31 GLU HB2 H 1 2.036 0.030 . 2 . . . . 31 GLU HB2 . 11297 1
291 . 1 1 31 31 GLU HB3 H 1 1.959 0.030 . 2 . . . . 31 GLU HB3 . 11297 1
292 . 1 1 31 31 GLU HG2 H 1 2.249 0.030 . 2 . . . . 31 GLU HG2 . 11297 1
293 . 1 1 31 31 GLU HG3 H 1 2.054 0.030 . 2 . . . . 31 GLU HG3 . 11297 1
294 . 1 1 31 31 GLU C C 13 175.962 0.300 . 1 . . . . 31 GLU C . 11297 1
295 . 1 1 31 31 GLU CA C 13 57.774 0.300 . 1 . . . . 31 GLU CA . 11297 1
296 . 1 1 31 31 GLU CB C 13 30.431 0.300 . 1 . . . . 31 GLU CB . 11297 1
297 . 1 1 31 31 GLU CG C 13 37.594 0.300 . 1 . . . . 31 GLU CG . 11297 1
298 . 1 1 31 31 GLU N N 15 122.612 0.300 . 1 . . . . 31 GLU N . 11297 1
299 . 1 1 32 32 VAL H H 1 8.872 0.030 . 1 . . . . 32 VAL H . 11297 1
300 . 1 1 32 32 VAL HA H 1 4.947 0.030 . 1 . . . . 32 VAL HA . 11297 1
301 . 1 1 32 32 VAL HB H 1 1.575 0.030 . 1 . . . . 32 VAL HB . 11297 1
302 . 1 1 32 32 VAL HG11 H 1 0.393 0.030 . 1 . . . . 32 VAL HG1 . 11297 1
303 . 1 1 32 32 VAL HG12 H 1 0.393 0.030 . 1 . . . . 32 VAL HG1 . 11297 1
304 . 1 1 32 32 VAL HG13 H 1 0.393 0.030 . 1 . . . . 32 VAL HG1 . 11297 1
305 . 1 1 32 32 VAL HG21 H 1 0.344 0.030 . 1 . . . . 32 VAL HG2 . 11297 1
306 . 1 1 32 32 VAL HG22 H 1 0.344 0.030 . 1 . . . . 32 VAL HG2 . 11297 1
307 . 1 1 32 32 VAL HG23 H 1 0.344 0.030 . 1 . . . . 32 VAL HG2 . 11297 1
308 . 1 1 32 32 VAL C C 13 172.915 0.300 . 1 . . . . 32 VAL C . 11297 1
309 . 1 1 32 32 VAL CA C 13 58.480 0.300 . 1 . . . . 32 VAL CA . 11297 1
310 . 1 1 32 32 VAL CB C 13 36.927 0.300 . 1 . . . . 32 VAL CB . 11297 1
311 . 1 1 32 32 VAL CG1 C 13 21.797 0.300 . 2 . . . . 32 VAL CG1 . 11297 1
312 . 1 1 32 32 VAL CG2 C 13 18.204 0.300 . 2 . . . . 32 VAL CG2 . 11297 1
313 . 1 1 32 32 VAL N N 15 118.386 0.300 . 1 . . . . 32 VAL N . 11297 1
314 . 1 1 33 33 GLU H H 1 8.244 0.030 . 1 . . . . 33 GLU H . 11297 1
315 . 1 1 33 33 GLU HA H 1 5.066 0.030 . 1 . . . . 33 GLU HA . 11297 1
316 . 1 1 33 33 GLU HB2 H 1 1.867 0.030 . 2 . . . . 33 GLU HB2 . 11297 1
317 . 1 1 33 33 GLU HB3 H 1 1.807 0.030 . 2 . . . . 33 GLU HB3 . 11297 1
318 . 1 1 33 33 GLU HG2 H 1 2.004 0.030 . 2 . . . . 33 GLU HG2 . 11297 1
319 . 1 1 33 33 GLU HG3 H 1 1.925 0.030 . 2 . . . . 33 GLU HG3 . 11297 1
320 . 1 1 33 33 GLU C C 13 177.067 0.300 . 1 . . . . 33 GLU C . 11297 1
321 . 1 1 33 33 GLU CA C 13 53.505 0.300 . 1 . . . . 33 GLU CA . 11297 1
322 . 1 1 33 33 GLU CB C 13 33.252 0.300 . 1 . . . . 33 GLU CB . 11297 1
323 . 1 1 33 33 GLU CG C 13 36.177 0.300 . 1 . . . . 33 GLU CG . 11297 1
324 . 1 1 33 33 GLU N N 15 119.943 0.300 . 1 . . . . 33 GLU N . 11297 1
325 . 1 1 34 34 ILE H H 1 8.728 0.030 . 1 . . . . 34 ILE H . 11297 1
326 . 1 1 34 34 ILE HA H 1 3.946 0.030 . 1 . . . . 34 ILE HA . 11297 1
327 . 1 1 34 34 ILE HB H 1 2.526 0.030 . 1 . . . . 34 ILE HB . 11297 1
328 . 1 1 34 34 ILE HD11 H 1 0.300 0.030 . 1 . . . . 34 ILE HD1 . 11297 1
329 . 1 1 34 34 ILE HD12 H 1 0.300 0.030 . 1 . . . . 34 ILE HD1 . 11297 1
330 . 1 1 34 34 ILE HD13 H 1 0.300 0.030 . 1 . . . . 34 ILE HD1 . 11297 1
331 . 1 1 34 34 ILE HG12 H 1 1.442 0.030 . 2 . . . . 34 ILE HG12 . 11297 1
332 . 1 1 34 34 ILE HG13 H 1 1.290 0.030 . 2 . . . . 34 ILE HG13 . 11297 1
333 . 1 1 34 34 ILE HG21 H 1 0.953 0.030 . 1 . . . . 34 ILE HG2 . 11297 1
334 . 1 1 34 34 ILE HG22 H 1 0.953 0.030 . 1 . . . . 34 ILE HG2 . 11297 1
335 . 1 1 34 34 ILE HG23 H 1 0.953 0.030 . 1 . . . . 34 ILE HG2 . 11297 1
336 . 1 1 34 34 ILE C C 13 176.702 0.300 . 1 . . . . 34 ILE C . 11297 1
337 . 1 1 34 34 ILE CA C 13 61.045 0.300 . 1 . . . . 34 ILE CA . 11297 1
338 . 1 1 34 34 ILE CB C 13 36.111 0.300 . 1 . . . . 34 ILE CB . 11297 1
339 . 1 1 34 34 ILE CD1 C 13 11.075 0.300 . 1 . . . . 34 ILE CD1 . 11297 1
340 . 1 1 34 34 ILE CG1 C 13 26.614 0.300 . 1 . . . . 34 ILE CG1 . 11297 1
341 . 1 1 34 34 ILE CG2 C 13 19.068 0.300 . 1 . . . . 34 ILE CG2 . 11297 1
342 . 1 1 34 34 ILE N N 15 124.194 0.300 . 1 . . . . 34 ILE N . 11297 1
343 . 1 1 35 35 LEU H H 1 9.640 0.030 . 1 . . . . 35 LEU H . 11297 1
344 . 1 1 35 35 LEU HA H 1 4.560 0.030 . 1 . . . . 35 LEU HA . 11297 1
345 . 1 1 35 35 LEU HB2 H 1 1.604 0.030 . 2 . . . . 35 LEU HB2 . 11297 1
346 . 1 1 35 35 LEU HB3 H 1 1.469 0.030 . 2 . . . . 35 LEU HB3 . 11297 1
347 . 1 1 35 35 LEU HD11 H 1 0.814 0.030 . 1 . . . . 35 LEU HD1 . 11297 1
348 . 1 1 35 35 LEU HD12 H 1 0.814 0.030 . 1 . . . . 35 LEU HD1 . 11297 1
349 . 1 1 35 35 LEU HD13 H 1 0.814 0.030 . 1 . . . . 35 LEU HD1 . 11297 1
350 . 1 1 35 35 LEU HD21 H 1 0.749 0.030 . 1 . . . . 35 LEU HD2 . 11297 1
351 . 1 1 35 35 LEU HD22 H 1 0.749 0.030 . 1 . . . . 35 LEU HD2 . 11297 1
352 . 1 1 35 35 LEU HD23 H 1 0.749 0.030 . 1 . . . . 35 LEU HD2 . 11297 1
353 . 1 1 35 35 LEU HG H 1 1.565 0.030 . 1 . . . . 35 LEU HG . 11297 1
354 . 1 1 35 35 LEU C C 13 176.630 0.300 . 1 . . . . 35 LEU C . 11297 1
355 . 1 1 35 35 LEU CA C 13 56.036 0.300 . 1 . . . . 35 LEU CA . 11297 1
356 . 1 1 35 35 LEU CB C 13 42.970 0.300 . 1 . . . . 35 LEU CB . 11297 1
357 . 1 1 35 35 LEU CD1 C 13 25.854 0.300 . 2 . . . . 35 LEU CD1 . 11297 1
358 . 1 1 35 35 LEU CD2 C 13 22.260 0.300 . 2 . . . . 35 LEU CD2 . 11297 1
359 . 1 1 35 35 LEU CG C 13 26.657 0.300 . 1 . . . . 35 LEU CG . 11297 1
360 . 1 1 35 35 LEU N N 15 130.068 0.300 . 1 . . . . 35 LEU N . 11297 1
361 . 1 1 36 36 SER H H 1 7.863 0.030 . 1 . . . . 36 SER H . 11297 1
362 . 1 1 36 36 SER HA H 1 4.949 0.030 . 1 . . . . 36 SER HA . 11297 1
363 . 1 1 36 36 SER HB2 H 1 3.932 0.030 . 2 . . . . 36 SER HB2 . 11297 1
364 . 1 1 36 36 SER HB3 H 1 3.908 0.030 . 2 . . . . 36 SER HB3 . 11297 1
365 . 1 1 36 36 SER C C 13 172.405 0.300 . 1 . . . . 36 SER C . 11297 1
366 . 1 1 36 36 SER CA C 13 57.920 0.300 . 1 . . . . 36 SER CA . 11297 1
367 . 1 1 36 36 SER CB C 13 64.127 0.300 . 1 . . . . 36 SER CB . 11297 1
368 . 1 1 36 36 SER N N 15 109.068 0.300 . 1 . . . . 36 SER N . 11297 1
369 . 1 1 37 37 HIS H H 1 8.692 0.030 . 1 . . . . 37 HIS H . 11297 1
370 . 1 1 37 37 HIS HA H 1 4.765 0.030 . 1 . . . . 37 HIS HA . 11297 1
371 . 1 1 37 37 HIS HB2 H 1 2.729 0.030 . 2 . . . . 37 HIS HB2 . 11297 1
372 . 1 1 37 37 HIS HB3 H 1 2.687 0.030 . 2 . . . . 37 HIS HB3 . 11297 1
373 . 1 1 37 37 HIS HE1 H 1 7.346 0.030 . 1 . . . . 37 HIS HE1 . 11297 1
374 . 1 1 37 37 HIS C C 13 172.818 0.300 . 1 . . . . 37 HIS C . 11297 1
375 . 1 1 37 37 HIS CA C 13 56.318 0.300 . 1 . . . . 37 HIS CA . 11297 1
376 . 1 1 37 37 HIS CB C 13 33.680 0.300 . 1 . . . . 37 HIS CB . 11297 1
377 . 1 1 37 37 HIS CE1 C 13 136.655 0.300 . 1 . . . . 37 HIS CE1 . 11297 1
378 . 1 1 37 37 HIS N N 15 119.724 0.300 . 1 . . . . 37 HIS N . 11297 1
379 . 1 1 38 38 ASP H H 1 7.355 0.030 . 1 . . . . 38 ASP H . 11297 1
380 . 1 1 38 38 ASP HA H 1 4.795 0.030 . 1 . . . . 38 ASP HA . 11297 1
381 . 1 1 38 38 ASP HB2 H 1 2.873 0.030 . 2 . . . . 38 ASP HB2 . 11297 1
382 . 1 1 38 38 ASP HB3 H 1 2.325 0.030 . 2 . . . . 38 ASP HB3 . 11297 1
383 . 1 1 38 38 ASP C C 13 175.938 0.300 . 1 . . . . 38 ASP C . 11297 1
384 . 1 1 38 38 ASP CA C 13 52.213 0.300 . 1 . . . . 38 ASP CA . 11297 1
385 . 1 1 38 38 ASP CB C 13 42.867 0.300 . 1 . . . . 38 ASP CB . 11297 1
386 . 1 1 38 38 ASP N N 15 126.569 0.300 . 1 . . . . 38 ASP N . 11297 1
387 . 1 1 39 39 SER H H 1 8.797 0.030 . 1 . . . . 39 SER H . 11297 1
388 . 1 1 39 39 SER HA H 1 3.948 0.030 . 1 . . . . 39 SER HA . 11297 1
389 . 1 1 39 39 SER HB2 H 1 4.022 0.030 . 2 . . . . 39 SER HB2 . 11297 1
390 . 1 1 39 39 SER HB3 H 1 3.976 0.030 . 2 . . . . 39 SER HB3 . 11297 1
391 . 1 1 39 39 SER C C 13 175.440 0.300 . 1 . . . . 39 SER C . 11297 1
392 . 1 1 39 39 SER CA C 13 60.528 0.300 . 1 . . . . 39 SER CA . 11297 1
393 . 1 1 39 39 SER CB C 13 63.205 0.300 . 1 . . . . 39 SER CB . 11297 1
394 . 1 1 39 39 SER N N 15 120.521 0.300 . 1 . . . . 39 SER N . 11297 1
395 . 1 1 40 40 THR H H 1 8.551 0.030 . 1 . . . . 40 THR H . 11297 1
396 . 1 1 40 40 THR HA H 1 4.146 0.030 . 1 . . . . 40 THR HA . 11297 1
397 . 1 1 40 40 THR HB H 1 4.284 0.030 . 1 . . . . 40 THR HB . 11297 1
398 . 1 1 40 40 THR HG21 H 1 1.190 0.030 . 1 . . . . 40 THR HG2 . 11297 1
399 . 1 1 40 40 THR HG22 H 1 1.190 0.030 . 1 . . . . 40 THR HG2 . 11297 1
400 . 1 1 40 40 THR HG23 H 1 1.190 0.030 . 1 . . . . 40 THR HG2 . 11297 1
401 . 1 1 40 40 THR C C 13 175.513 0.300 . 1 . . . . 40 THR C . 11297 1
402 . 1 1 40 40 THR CA C 13 65.489 0.300 . 1 . . . . 40 THR CA . 11297 1
403 . 1 1 40 40 THR CB C 13 68.185 0.300 . 1 . . . . 40 THR CB . 11297 1
404 . 1 1 40 40 THR CG2 C 13 21.682 0.300 . 1 . . . . 40 THR CG2 . 11297 1
405 . 1 1 40 40 THR N N 15 118.226 0.300 . 1 . . . . 40 THR N . 11297 1
406 . 1 1 41 41 SER H H 1 7.987 0.030 . 1 . . . . 41 SER H . 11297 1
407 . 1 1 41 41 SER HA H 1 4.265 0.030 . 1 . . . . 41 SER HA . 11297 1
408 . 1 1 41 41 SER HB2 H 1 3.811 0.030 . 2 . . . . 41 SER HB2 . 11297 1
409 . 1 1 41 41 SER HB3 H 1 3.695 0.030 . 2 . . . . 41 SER HB3 . 11297 1
410 . 1 1 41 41 SER C C 13 175.125 0.300 . 1 . . . . 41 SER C . 11297 1
411 . 1 1 41 41 SER CA C 13 58.442 0.300 . 1 . . . . 41 SER CA . 11297 1
412 . 1 1 41 41 SER CB C 13 64.359 0.300 . 1 . . . . 41 SER CB . 11297 1
413 . 1 1 41 41 SER N N 15 116.406 0.300 . 1 . . . . 41 SER N . 11297 1
414 . 1 1 42 42 GLN H H 1 7.956 0.030 . 1 . . . . 42 GLN H . 11297 1
415 . 1 1 42 42 GLN HA H 1 3.540 0.030 . 1 . . . . 42 GLN HA . 11297 1
416 . 1 1 42 42 GLN HB2 H 1 2.419 0.030 . 1 . . . . 42 GLN HB2 . 11297 1
417 . 1 1 42 42 GLN HB3 H 1 2.419 0.030 . 1 . . . . 42 GLN HB3 . 11297 1
418 . 1 1 42 42 GLN HE21 H 1 7.659 0.030 . 2 . . . . 42 GLN HE21 . 11297 1
419 . 1 1 42 42 GLN HE22 H 1 6.993 0.030 . 2 . . . . 42 GLN HE22 . 11297 1
420 . 1 1 42 42 GLN HG2 H 1 2.280 0.030 . 2 . . . . 42 GLN HG2 . 11297 1
421 . 1 1 42 42 GLN HG3 H 1 2.203 0.030 . 2 . . . . 42 GLN HG3 . 11297 1
422 . 1 1 42 42 GLN C C 13 174.505 0.300 . 1 . . . . 42 GLN C . 11297 1
423 . 1 1 42 42 GLN CA C 13 57.335 0.300 . 1 . . . . 42 GLN CA . 11297 1
424 . 1 1 42 42 GLN CB C 13 25.432 0.300 . 1 . . . . 42 GLN CB . 11297 1
425 . 1 1 42 42 GLN CG C 13 34.039 0.300 . 1 . . . . 42 GLN CG . 11297 1
426 . 1 1 42 42 GLN N N 15 115.332 0.300 . 1 . . . . 42 GLN N . 11297 1
427 . 1 1 42 42 GLN NE2 N 15 113.734 0.300 . 1 . . . . 42 GLN NE2 . 11297 1
428 . 1 1 43 43 LEU H H 1 7.258 0.030 . 1 . . . . 43 LEU H . 11297 1
429 . 1 1 43 43 LEU HA H 1 4.768 0.030 . 1 . . . . 43 LEU HA . 11297 1
430 . 1 1 43 43 LEU HB2 H 1 1.532 0.030 . 2 . . . . 43 LEU HB2 . 11297 1
431 . 1 1 43 43 LEU HB3 H 1 1.032 0.030 . 2 . . . . 43 LEU HB3 . 11297 1
432 . 1 1 43 43 LEU HD11 H 1 0.754 0.030 . 1 . . . . 43 LEU HD1 . 11297 1
433 . 1 1 43 43 LEU HD12 H 1 0.754 0.030 . 1 . . . . 43 LEU HD1 . 11297 1
434 . 1 1 43 43 LEU HD13 H 1 0.754 0.030 . 1 . . . . 43 LEU HD1 . 11297 1
435 . 1 1 43 43 LEU HD21 H 1 0.727 0.030 . 1 . . . . 43 LEU HD2 . 11297 1
436 . 1 1 43 43 LEU HD22 H 1 0.727 0.030 . 1 . . . . 43 LEU HD2 . 11297 1
437 . 1 1 43 43 LEU HD23 H 1 0.727 0.030 . 1 . . . . 43 LEU HD2 . 11297 1
438 . 1 1 43 43 LEU HG H 1 1.432 0.030 . 1 . . . . 43 LEU HG . 11297 1
439 . 1 1 43 43 LEU C C 13 178.256 0.300 . 1 . . . . 43 LEU C . 11297 1
440 . 1 1 43 43 LEU CA C 13 53.948 0.300 . 1 . . . . 43 LEU CA . 11297 1
441 . 1 1 43 43 LEU CB C 13 43.979 0.300 . 1 . . . . 43 LEU CB . 11297 1
442 . 1 1 43 43 LEU CD1 C 13 25.059 0.300 . 2 . . . . 43 LEU CD1 . 11297 1
443 . 1 1 43 43 LEU CD2 C 13 23.829 0.300 . 2 . . . . 43 LEU CD2 . 11297 1
444 . 1 1 43 43 LEU CG C 13 26.027 0.300 . 1 . . . . 43 LEU CG . 11297 1
445 . 1 1 43 43 LEU N N 15 117.183 0.300 . 1 . . . . 43 LEU N . 11297 1
446 . 1 1 44 44 TYR H H 1 9.596 0.030 . 1 . . . . 44 TYR H . 11297 1
447 . 1 1 44 44 TYR HA H 1 5.108 0.030 . 1 . . . . 44 TYR HA . 11297 1
448 . 1 1 44 44 TYR HB2 H 1 2.857 0.030 . 2 . . . . 44 TYR HB2 . 11297 1
449 . 1 1 44 44 TYR HB3 H 1 2.757 0.030 . 2 . . . . 44 TYR HB3 . 11297 1
450 . 1 1 44 44 TYR HD1 H 1 7.253 0.030 . 1 . . . . 44 TYR HD1 . 11297 1
451 . 1 1 44 44 TYR HD2 H 1 7.253 0.030 . 1 . . . . 44 TYR HD2 . 11297 1
452 . 1 1 44 44 TYR HE1 H 1 7.053 0.030 . 1 . . . . 44 TYR HE1 . 11297 1
453 . 1 1 44 44 TYR HE2 H 1 7.053 0.030 . 1 . . . . 44 TYR HE2 . 11297 1
454 . 1 1 44 44 TYR C C 13 176.508 0.300 . 1 . . . . 44 TYR C . 11297 1
455 . 1 1 44 44 TYR CA C 13 57.976 0.300 . 1 . . . . 44 TYR CA . 11297 1
456 . 1 1 44 44 TYR CB C 13 40.159 0.300 . 1 . . . . 44 TYR CB . 11297 1
457 . 1 1 44 44 TYR CD1 C 13 133.904 0.300 . 1 . . . . 44 TYR CD1 . 11297 1
458 . 1 1 44 44 TYR CD2 C 13 133.904 0.300 . 1 . . . . 44 TYR CD2 . 11297 1
459 . 1 1 44 44 TYR CE1 C 13 118.197 0.300 . 1 . . . . 44 TYR CE1 . 11297 1
460 . 1 1 44 44 TYR CE2 C 13 118.197 0.300 . 1 . . . . 44 TYR CE2 . 11297 1
461 . 1 1 44 44 TYR N N 15 123.383 0.300 . 1 . . . . 44 TYR N . 11297 1
462 . 1 1 45 45 THR H H 1 8.941 0.030 . 1 . . . . 45 THR H . 11297 1
463 . 1 1 45 45 THR HA H 1 4.970 0.030 . 1 . . . . 45 THR HA . 11297 1
464 . 1 1 45 45 THR HB H 1 4.118 0.030 . 1 . . . . 45 THR HB . 11297 1
465 . 1 1 45 45 THR HG21 H 1 1.130 0.030 . 1 . . . . 45 THR HG2 . 11297 1
466 . 1 1 45 45 THR HG22 H 1 1.130 0.030 . 1 . . . . 45 THR HG2 . 11297 1
467 . 1 1 45 45 THR HG23 H 1 1.130 0.030 . 1 . . . . 45 THR HG2 . 11297 1
468 . 1 1 45 45 THR C C 13 174.190 0.300 . 1 . . . . 45 THR C . 11297 1
469 . 1 1 45 45 THR CA C 13 63.476 0.300 . 1 . . . . 45 THR CA . 11297 1
470 . 1 1 45 45 THR CB C 13 68.479 0.300 . 1 . . . . 45 THR CB . 11297 1
471 . 1 1 45 45 THR CG2 C 13 21.328 0.300 . 1 . . . . 45 THR CG2 . 11297 1
472 . 1 1 45 45 THR N N 15 119.729 0.300 . 1 . . . . 45 THR N . 11297 1
473 . 1 1 46 46 VAL H H 1 9.347 0.030 . 1 . . . . 46 VAL H . 11297 1
474 . 1 1 46 46 VAL HA H 1 5.423 0.030 . 1 . . . . 46 VAL HA . 11297 1
475 . 1 1 46 46 VAL HB H 1 1.735 0.030 . 1 . . . . 46 VAL HB . 11297 1
476 . 1 1 46 46 VAL HG11 H 1 0.688 0.030 . 1 . . . . 46 VAL HG1 . 11297 1
477 . 1 1 46 46 VAL HG12 H 1 0.688 0.030 . 1 . . . . 46 VAL HG1 . 11297 1
478 . 1 1 46 46 VAL HG13 H 1 0.688 0.030 . 1 . . . . 46 VAL HG1 . 11297 1
479 . 1 1 46 46 VAL HG21 H 1 0.679 0.030 . 1 . . . . 46 VAL HG2 . 11297 1
480 . 1 1 46 46 VAL HG22 H 1 0.679 0.030 . 1 . . . . 46 VAL HG2 . 11297 1
481 . 1 1 46 46 VAL HG23 H 1 0.679 0.030 . 1 . . . . 46 VAL HG2 . 11297 1
482 . 1 1 46 46 VAL C C 13 172.952 0.300 . 1 . . . . 46 VAL C . 11297 1
483 . 1 1 46 46 VAL CA C 13 57.951 0.300 . 1 . . . . 46 VAL CA . 11297 1
484 . 1 1 46 46 VAL CB C 13 34.247 0.300 . 1 . . . . 46 VAL CB . 11297 1
485 . 1 1 46 46 VAL CG1 C 13 21.575 0.300 . 2 . . . . 46 VAL CG1 . 11297 1
486 . 1 1 46 46 VAL CG2 C 13 18.849 0.300 . 2 . . . . 46 VAL CG2 . 11297 1
487 . 1 1 46 46 VAL N N 15 121.222 0.300 . 1 . . . . 46 VAL N . 11297 1
488 . 1 1 47 47 LYS H H 1 8.826 0.030 . 1 . . . . 47 LYS H . 11297 1
489 . 1 1 47 47 LYS HA H 1 5.457 0.030 . 1 . . . . 47 LYS HA . 11297 1
490 . 1 1 47 47 LYS HB2 H 1 1.821 0.030 . 2 . . . . 47 LYS HB2 . 11297 1
491 . 1 1 47 47 LYS HB3 H 1 1.587 0.030 . 2 . . . . 47 LYS HB3 . 11297 1
492 . 1 1 47 47 LYS HD2 H 1 1.751 0.030 . 2 . . . . 47 LYS HD2 . 11297 1
493 . 1 1 47 47 LYS HD3 H 1 1.708 0.030 . 2 . . . . 47 LYS HD3 . 11297 1
494 . 1 1 47 47 LYS HE2 H 1 2.974 0.030 . 1 . . . . 47 LYS HE2 . 11297 1
495 . 1 1 47 47 LYS HE3 H 1 2.974 0.030 . 1 . . . . 47 LYS HE3 . 11297 1
496 . 1 1 47 47 LYS HG2 H 1 1.597 0.030 . 2 . . . . 47 LYS HG2 . 11297 1
497 . 1 1 47 47 LYS HG3 H 1 1.392 0.030 . 2 . . . . 47 LYS HG3 . 11297 1
498 . 1 1 47 47 LYS C C 13 176.873 0.300 . 1 . . . . 47 LYS C . 11297 1
499 . 1 1 47 47 LYS CA C 13 54.390 0.300 . 1 . . . . 47 LYS CA . 11297 1
500 . 1 1 47 47 LYS CB C 13 36.987 0.300 . 1 . . . . 47 LYS CB . 11297 1
501 . 1 1 47 47 LYS CD C 13 29.963 0.300 . 1 . . . . 47 LYS CD . 11297 1
502 . 1 1 47 47 LYS CE C 13 41.961 0.300 . 1 . . . . 47 LYS CE . 11297 1
503 . 1 1 47 47 LYS CG C 13 24.505 0.300 . 1 . . . . 47 LYS CG . 11297 1
504 . 1 1 47 47 LYS N N 15 120.157 0.300 . 1 . . . . 47 LYS N . 11297 1
505 . 1 1 48 48 TYR H H 1 9.346 0.030 . 1 . . . . 48 TYR H . 11297 1
506 . 1 1 48 48 TYR HA H 1 4.944 0.030 . 1 . . . . 48 TYR HA . 11297 1
507 . 1 1 48 48 TYR HB2 H 1 3.263 0.030 . 2 . . . . 48 TYR HB2 . 11297 1
508 . 1 1 48 48 TYR HB3 H 1 3.153 0.030 . 2 . . . . 48 TYR HB3 . 11297 1
509 . 1 1 48 48 TYR HD1 H 1 7.428 0.030 . 1 . . . . 48 TYR HD1 . 11297 1
510 . 1 1 48 48 TYR HD2 H 1 7.428 0.030 . 1 . . . . 48 TYR HD2 . 11297 1
511 . 1 1 48 48 TYR HE1 H 1 6.710 0.030 . 1 . . . . 48 TYR HE1 . 11297 1
512 . 1 1 48 48 TYR HE2 H 1 6.710 0.030 . 1 . . . . 48 TYR HE2 . 11297 1
513 . 1 1 48 48 TYR C C 13 177.431 0.300 . 1 . . . . 48 TYR C . 11297 1
514 . 1 1 48 48 TYR CA C 13 57.144 0.300 . 1 . . . . 48 TYR CA . 11297 1
515 . 1 1 48 48 TYR CB C 13 40.067 0.300 . 1 . . . . 48 TYR CB . 11297 1
516 . 1 1 48 48 TYR CD1 C 13 133.451 0.300 . 1 . . . . 48 TYR CD1 . 11297 1
517 . 1 1 48 48 TYR CD2 C 13 133.451 0.300 . 1 . . . . 48 TYR CD2 . 11297 1
518 . 1 1 48 48 TYR CE1 C 13 118.682 0.300 . 1 . . . . 48 TYR CE1 . 11297 1
519 . 1 1 48 48 TYR CE2 C 13 118.682 0.300 . 1 . . . . 48 TYR CE2 . 11297 1
520 . 1 1 48 48 TYR N N 15 128.177 0.300 . 1 . . . . 48 TYR N . 11297 1
521 . 1 1 49 49 LYS H H 1 8.278 0.030 . 1 . . . . 49 LYS H . 11297 1
522 . 1 1 49 49 LYS HA H 1 4.042 0.030 . 1 . . . . 49 LYS HA . 11297 1
523 . 1 1 49 49 LYS HB2 H 1 1.825 0.030 . 2 . . . . 49 LYS HB2 . 11297 1
524 . 1 1 49 49 LYS HB3 H 1 1.759 0.030 . 2 . . . . 49 LYS HB3 . 11297 1
525 . 1 1 49 49 LYS HD2 H 1 1.628 0.030 . 1 . . . . 49 LYS HD2 . 11297 1
526 . 1 1 49 49 LYS HD3 H 1 1.628 0.030 . 1 . . . . 49 LYS HD3 . 11297 1
527 . 1 1 49 49 LYS HE2 H 1 2.941 0.030 . 1 . . . . 49 LYS HE2 . 11297 1
528 . 1 1 49 49 LYS HE3 H 1 2.941 0.030 . 1 . . . . 49 LYS HE3 . 11297 1
529 . 1 1 49 49 LYS HG2 H 1 1.302 0.030 . 2 . . . . 49 LYS HG2 . 11297 1
530 . 1 1 49 49 LYS HG3 H 1 1.108 0.030 . 2 . . . . 49 LYS HG3 . 11297 1
531 . 1 1 49 49 LYS C C 13 176.860 0.300 . 1 . . . . 49 LYS C . 11297 1
532 . 1 1 49 49 LYS CA C 13 58.974 0.300 . 1 . . . . 49 LYS CA . 11297 1
533 . 1 1 49 49 LYS CB C 13 31.743 0.300 . 1 . . . . 49 LYS CB . 11297 1
534 . 1 1 49 49 LYS CD C 13 28.856 0.300 . 1 . . . . 49 LYS CD . 11297 1
535 . 1 1 49 49 LYS CE C 13 41.965 0.300 . 1 . . . . 49 LYS CE . 11297 1
536 . 1 1 49 49 LYS CG C 13 24.031 0.300 . 1 . . . . 49 LYS CG . 11297 1
537 . 1 1 49 49 LYS N N 15 122.895 0.300 . 1 . . . . 49 LYS N . 11297 1
538 . 1 1 50 50 ASP H H 1 7.448 0.030 . 1 . . . . 50 ASP H . 11297 1
539 . 1 1 50 50 ASP HA H 1 4.514 0.030 . 1 . . . . 50 ASP HA . 11297 1
540 . 1 1 50 50 ASP HB2 H 1 3.100 0.030 . 2 . . . . 50 ASP HB2 . 11297 1
541 . 1 1 50 50 ASP HB3 H 1 2.542 0.030 . 2 . . . . 50 ASP HB3 . 11297 1
542 . 1 1 50 50 ASP C C 13 176.873 0.300 . 1 . . . . 50 ASP C . 11297 1
543 . 1 1 50 50 ASP CA C 13 53.505 0.300 . 1 . . . . 50 ASP CA . 11297 1
544 . 1 1 50 50 ASP CB C 13 39.942 0.300 . 1 . . . . 50 ASP CB . 11297 1
545 . 1 1 50 50 ASP N N 15 116.864 0.300 . 1 . . . . 50 ASP N . 11297 1
546 . 1 1 51 51 GLY H H 1 8.399 0.030 . 1 . . . . 51 GLY H . 11297 1
547 . 1 1 51 51 GLY HA2 H 1 4.510 0.030 . 2 . . . . 51 GLY HA2 . 11297 1
548 . 1 1 51 51 GLY HA3 H 1 3.502 0.030 . 2 . . . . 51 GLY HA3 . 11297 1
549 . 1 1 51 51 GLY C C 13 174.736 0.300 . 1 . . . . 51 GLY C . 11297 1
550 . 1 1 51 51 GLY CA C 13 44.896 0.300 . 1 . . . . 51 GLY CA . 11297 1
551 . 1 1 51 51 GLY N N 15 108.854 0.300 . 1 . . . . 51 GLY N . 11297 1
552 . 1 1 52 52 THR H H 1 8.344 0.030 . 1 . . . . 52 THR H . 11297 1
553 . 1 1 52 52 THR HA H 1 3.960 0.030 . 1 . . . . 52 THR HA . 11297 1
554 . 1 1 52 52 THR HB H 1 4.212 0.030 . 1 . . . . 52 THR HB . 11297 1
555 . 1 1 52 52 THR HG21 H 1 1.212 0.030 . 1 . . . . 52 THR HG2 . 11297 1
556 . 1 1 52 52 THR HG22 H 1 1.212 0.030 . 1 . . . . 52 THR HG2 . 11297 1
557 . 1 1 52 52 THR HG23 H 1 1.212 0.030 . 1 . . . . 52 THR HG2 . 11297 1
558 . 1 1 52 52 THR C C 13 173.158 0.300 . 1 . . . . 52 THR C . 11297 1
559 . 1 1 52 52 THR CA C 13 65.513 0.300 . 1 . . . . 52 THR CA . 11297 1
560 . 1 1 52 52 THR CB C 13 69.123 0.300 . 1 . . . . 52 THR CB . 11297 1
561 . 1 1 52 52 THR CG2 C 13 21.523 0.300 . 1 . . . . 52 THR CG2 . 11297 1
562 . 1 1 52 52 THR N N 15 119.716 0.300 . 1 . . . . 52 THR N . 11297 1
563 . 1 1 53 53 GLU H H 1 8.513 0.030 . 1 . . . . 53 GLU H . 11297 1
564 . 1 1 53 53 GLU HA H 1 5.773 0.030 . 1 . . . . 53 GLU HA . 11297 1
565 . 1 1 53 53 GLU HB2 H 1 1.825 0.030 . 1 . . . . 53 GLU HB2 . 11297 1
566 . 1 1 53 53 GLU HB3 H 1 1.825 0.030 . 1 . . . . 53 GLU HB3 . 11297 1
567 . 1 1 53 53 GLU HG2 H 1 2.400 0.030 . 2 . . . . 53 GLU HG2 . 11297 1
568 . 1 1 53 53 GLU HG3 H 1 2.005 0.030 . 2 . . . . 53 GLU HG3 . 11297 1
569 . 1 1 53 53 GLU C C 13 176.095 0.300 . 1 . . . . 53 GLU C . 11297 1
570 . 1 1 53 53 GLU CA C 13 54.387 0.300 . 1 . . . . 53 GLU CA . 11297 1
571 . 1 1 53 53 GLU CB C 13 32.002 0.300 . 1 . . . . 53 GLU CB . 11297 1
572 . 1 1 53 53 GLU CG C 13 36.523 0.300 . 1 . . . . 53 GLU CG . 11297 1
573 . 1 1 53 53 GLU N N 15 126.023 0.300 . 1 . . . . 53 GLU N . 11297 1
574 . 1 1 54 54 LEU H H 1 8.531 0.030 . 1 . . . . 54 LEU H . 11297 1
575 . 1 1 54 54 LEU HA H 1 4.718 0.030 . 1 . . . . 54 LEU HA . 11297 1
576 . 1 1 54 54 LEU HB2 H 1 1.536 0.030 . 2 . . . . 54 LEU HB2 . 11297 1
577 . 1 1 54 54 LEU HB3 H 1 1.428 0.030 . 2 . . . . 54 LEU HB3 . 11297 1
578 . 1 1 54 54 LEU HD11 H 1 0.453 0.030 . 1 . . . . 54 LEU HD1 . 11297 1
579 . 1 1 54 54 LEU HD12 H 1 0.453 0.030 . 1 . . . . 54 LEU HD1 . 11297 1
580 . 1 1 54 54 LEU HD13 H 1 0.453 0.030 . 1 . . . . 54 LEU HD1 . 11297 1
581 . 1 1 54 54 LEU HD21 H 1 0.330 0.030 . 1 . . . . 54 LEU HD2 . 11297 1
582 . 1 1 54 54 LEU HD22 H 1 0.330 0.030 . 1 . . . . 54 LEU HD2 . 11297 1
583 . 1 1 54 54 LEU HD23 H 1 0.330 0.030 . 1 . . . . 54 LEU HD2 . 11297 1
584 . 1 1 54 54 LEU HG H 1 1.313 0.030 . 1 . . . . 54 LEU HG . 11297 1
585 . 1 1 54 54 LEU C C 13 174.991 0.300 . 1 . . . . 54 LEU C . 11297 1
586 . 1 1 54 54 LEU CA C 13 53.832 0.300 . 1 . . . . 54 LEU CA . 11297 1
587 . 1 1 54 54 LEU CB C 13 45.802 0.300 . 1 . . . . 54 LEU CB . 11297 1
588 . 1 1 54 54 LEU CD1 C 13 24.519 0.300 . 2 . . . . 54 LEU CD1 . 11297 1
589 . 1 1 54 54 LEU CD2 C 13 24.734 0.300 . 2 . . . . 54 LEU CD2 . 11297 1
590 . 1 1 54 54 LEU CG C 13 26.520 0.300 . 1 . . . . 54 LEU CG . 11297 1
591 . 1 1 54 54 LEU N N 15 121.229 0.300 . 1 . . . . 54 LEU N . 11297 1
592 . 1 1 55 55 GLU H H 1 8.101 0.030 . 1 . . . . 55 GLU H . 11297 1
593 . 1 1 55 55 GLU HA H 1 5.616 0.030 . 1 . . . . 55 GLU HA . 11297 1
594 . 1 1 55 55 GLU HB2 H 1 1.941 0.030 . 2 . . . . 55 GLU HB2 . 11297 1
595 . 1 1 55 55 GLU HB3 H 1 1.783 0.030 . 2 . . . . 55 GLU HB3 . 11297 1
596 . 1 1 55 55 GLU HG2 H 1 2.197 0.030 . 2 . . . . 55 GLU HG2 . 11297 1
597 . 1 1 55 55 GLU HG3 H 1 2.100 0.030 . 2 . . . . 55 GLU HG3 . 11297 1
598 . 1 1 55 55 GLU C C 13 175.962 0.300 . 1 . . . . 55 GLU C . 11297 1
599 . 1 1 55 55 GLU CA C 13 54.726 0.300 . 1 . . . . 55 GLU CA . 11297 1
600 . 1 1 55 55 GLU CB C 13 32.114 0.300 . 1 . . . . 55 GLU CB . 11297 1
601 . 1 1 55 55 GLU CG C 13 37.178 0.300 . 1 . . . . 55 GLU CG . 11297 1
602 . 1 1 55 55 GLU N N 15 118.897 0.300 . 1 . . . . 55 GLU N . 11297 1
603 . 1 1 56 56 LEU H H 1 9.280 0.030 . 1 . . . . 56 LEU H . 11297 1
604 . 1 1 56 56 LEU HA H 1 4.897 0.030 . 1 . . . . 56 LEU HA . 11297 1
605 . 1 1 56 56 LEU HB2 H 1 1.723 0.030 . 2 . . . . 56 LEU HB2 . 11297 1
606 . 1 1 56 56 LEU HB3 H 1 1.488 0.030 . 2 . . . . 56 LEU HB3 . 11297 1
607 . 1 1 56 56 LEU HD11 H 1 0.950 0.030 . 1 . . . . 56 LEU HD1 . 11297 1
608 . 1 1 56 56 LEU HD12 H 1 0.950 0.030 . 1 . . . . 56 LEU HD1 . 11297 1
609 . 1 1 56 56 LEU HD13 H 1 0.950 0.030 . 1 . . . . 56 LEU HD1 . 11297 1
610 . 1 1 56 56 LEU HD21 H 1 0.763 0.030 . 1 . . . . 56 LEU HD2 . 11297 1
611 . 1 1 56 56 LEU HD22 H 1 0.763 0.030 . 1 . . . . 56 LEU HD2 . 11297 1
612 . 1 1 56 56 LEU HD23 H 1 0.763 0.030 . 1 . . . . 56 LEU HD2 . 11297 1
613 . 1 1 56 56 LEU HG H 1 1.511 0.030 . 1 . . . . 56 LEU HG . 11297 1
614 . 1 1 56 56 LEU C C 13 176.642 0.300 . 1 . . . . 56 LEU C . 11297 1
615 . 1 1 56 56 LEU CA C 13 53.309 0.300 . 1 . . . . 56 LEU CA . 11297 1
616 . 1 1 56 56 LEU CB C 13 47.143 0.300 . 1 . . . . 56 LEU CB . 11297 1
617 . 1 1 56 56 LEU CD1 C 13 23.372 0.300 . 2 . . . . 56 LEU CD1 . 11297 1
618 . 1 1 56 56 LEU CD2 C 13 26.523 0.300 . 2 . . . . 56 LEU CD2 . 11297 1
619 . 1 1 56 56 LEU CG C 13 27.138 0.300 . 1 . . . . 56 LEU CG . 11297 1
620 . 1 1 56 56 LEU N N 15 122.750 0.300 . 1 . . . . 56 LEU N . 11297 1
621 . 1 1 57 57 LYS H H 1 9.032 0.030 . 1 . . . . 57 LYS H . 11297 1
622 . 1 1 57 57 LYS HA H 1 4.718 0.030 . 1 . . . . 57 LYS HA . 11297 1
623 . 1 1 57 57 LYS HB2 H 1 2.136 0.030 . 2 . . . . 57 LYS HB2 . 11297 1
624 . 1 1 57 57 LYS HB3 H 1 1.887 0.030 . 2 . . . . 57 LYS HB3 . 11297 1
625 . 1 1 57 57 LYS HD2 H 1 1.824 0.030 . 2 . . . . 57 LYS HD2 . 11297 1
626 . 1 1 57 57 LYS HD3 H 1 1.779 0.030 . 2 . . . . 57 LYS HD3 . 11297 1
627 . 1 1 57 57 LYS HE2 H 1 3.078 0.030 . 2 . . . . 57 LYS HE2 . 11297 1
628 . 1 1 57 57 LYS HE3 H 1 3.059 0.030 . 2 . . . . 57 LYS HE3 . 11297 1
629 . 1 1 57 57 LYS HG2 H 1 1.626 0.030 . 2 . . . . 57 LYS HG2 . 11297 1
630 . 1 1 57 57 LYS HG3 H 1 1.581 0.030 . 2 . . . . 57 LYS HG3 . 11297 1
631 . 1 1 57 57 LYS C C 13 178.390 0.300 . 1 . . . . 57 LYS C . 11297 1
632 . 1 1 57 57 LYS CA C 13 55.675 0.300 . 1 . . . . 57 LYS CA . 11297 1
633 . 1 1 57 57 LYS CB C 13 33.803 0.300 . 1 . . . . 57 LYS CB . 11297 1
634 . 1 1 57 57 LYS CD C 13 29.356 0.300 . 1 . . . . 57 LYS CD . 11297 1
635 . 1 1 57 57 LYS CE C 13 41.992 0.300 . 1 . . . . 57 LYS CE . 11297 1
636 . 1 1 57 57 LYS CG C 13 25.552 0.300 . 1 . . . . 57 LYS CG . 11297 1
637 . 1 1 57 57 LYS N N 15 120.740 0.300 . 1 . . . . 57 LYS N . 11297 1
638 . 1 1 58 58 GLU H H 1 9.616 0.030 . 1 . . . . 58 GLU H . 11297 1
639 . 1 1 58 58 GLU HA H 1 4.050 0.030 . 1 . . . . 58 GLU HA . 11297 1
640 . 1 1 58 58 GLU HB2 H 1 2.634 0.030 . 2 . . . . 58 GLU HB2 . 11297 1
641 . 1 1 58 58 GLU HB3 H 1 2.379 0.030 . 2 . . . . 58 GLU HB3 . 11297 1
642 . 1 1 58 58 GLU HG2 H 1 2.551 0.030 . 2 . . . . 58 GLU HG2 . 11297 1
643 . 1 1 58 58 GLU HG3 H 1 2.466 0.030 . 2 . . . . 58 GLU HG3 . 11297 1
644 . 1 1 58 58 GLU C C 13 177.528 0.300 . 1 . . . . 58 GLU C . 11297 1
645 . 1 1 58 58 GLU CA C 13 60.843 0.300 . 1 . . . . 58 GLU CA . 11297 1
646 . 1 1 58 58 GLU CB C 13 31.122 0.300 . 1 . . . . 58 GLU CB . 11297 1
647 . 1 1 58 58 GLU CG C 13 38.435 0.300 . 1 . . . . 58 GLU CG . 11297 1
648 . 1 1 58 58 GLU N N 15 121.276 0.300 . 1 . . . . 58 GLU N . 11297 1
649 . 1 1 59 59 ASN H H 1 8.307 0.030 . 1 . . . . 59 ASN H . 11297 1
650 . 1 1 59 59 ASN HA H 1 4.730 0.030 . 1 . . . . 59 ASN HA . 11297 1
651 . 1 1 59 59 ASN HB2 H 1 2.875 0.030 . 1 . . . . 59 ASN HB2 . 11297 1
652 . 1 1 59 59 ASN HB3 H 1 2.875 0.030 . 1 . . . . 59 ASN HB3 . 11297 1
653 . 1 1 59 59 ASN HD21 H 1 7.641 0.030 . 2 . . . . 59 ASN HD21 . 11297 1
654 . 1 1 59 59 ASN HD22 H 1 6.925 0.030 . 2 . . . . 59 ASN HD22 . 11297 1
655 . 1 1 59 59 ASN C C 13 175.780 0.300 . 1 . . . . 59 ASN C . 11297 1
656 . 1 1 59 59 ASN CA C 13 54.734 0.300 . 1 . . . . 59 ASN CA . 11297 1
657 . 1 1 59 59 ASN CB C 13 37.759 0.300 . 1 . . . . 59 ASN CB . 11297 1
658 . 1 1 59 59 ASN N N 15 110.718 0.300 . 1 . . . . 59 ASN N . 11297 1
659 . 1 1 59 59 ASN ND2 N 15 112.628 0.300 . 1 . . . . 59 ASN ND2 . 11297 1
660 . 1 1 60 60 ASP H H 1 7.995 0.030 . 1 . . . . 60 ASP H . 11297 1
661 . 1 1 60 60 ASP HA H 1 5.003 0.030 . 1 . . . . 60 ASP HA . 11297 1
662 . 1 1 60 60 ASP HB2 H 1 3.168 0.030 . 2 . . . . 60 ASP HB2 . 11297 1
663 . 1 1 60 60 ASP HB3 H 1 2.913 0.030 . 2 . . . . 60 ASP HB3 . 11297 1
664 . 1 1 60 60 ASP C C 13 173.000 0.300 . 1 . . . . 60 ASP C . 11297 1
665 . 1 1 60 60 ASP CA C 13 54.826 0.300 . 1 . . . . 60 ASP CA . 11297 1
666 . 1 1 60 60 ASP CB C 13 42.833 0.300 . 1 . . . . 60 ASP CB . 11297 1
667 . 1 1 60 60 ASP N N 15 119.829 0.300 . 1 . . . . 60 ASP N . 11297 1
668 . 1 1 61 61 ILE H H 1 7.568 0.030 . 1 . . . . 61 ILE H . 11297 1
669 . 1 1 61 61 ILE HA H 1 4.890 0.030 . 1 . . . . 61 ILE HA . 11297 1
670 . 1 1 61 61 ILE HB H 1 1.469 0.030 . 1 . . . . 61 ILE HB . 11297 1
671 . 1 1 61 61 ILE HD11 H 1 0.134 0.030 . 1 . . . . 61 ILE HD1 . 11297 1
672 . 1 1 61 61 ILE HD12 H 1 0.134 0.030 . 1 . . . . 61 ILE HD1 . 11297 1
673 . 1 1 61 61 ILE HD13 H 1 0.134 0.030 . 1 . . . . 61 ILE HD1 . 11297 1
674 . 1 1 61 61 ILE HG12 H 1 1.508 0.030 . 2 . . . . 61 ILE HG12 . 11297 1
675 . 1 1 61 61 ILE HG13 H 1 0.393 0.030 . 2 . . . . 61 ILE HG13 . 11297 1
676 . 1 1 61 61 ILE HG21 H 1 -0.224 0.030 . 1 . . . . 61 ILE HG2 . 11297 1
677 . 1 1 61 61 ILE HG22 H 1 -0.224 0.030 . 1 . . . . 61 ILE HG2 . 11297 1
678 . 1 1 61 61 ILE HG23 H 1 -0.224 0.030 . 1 . . . . 61 ILE HG2 . 11297 1
679 . 1 1 61 61 ILE C C 13 174.967 0.300 . 1 . . . . 61 ILE C . 11297 1
680 . 1 1 61 61 ILE CA C 13 60.169 0.300 . 1 . . . . 61 ILE CA . 11297 1
681 . 1 1 61 61 ILE CB C 13 40.049 0.300 . 1 . . . . 61 ILE CB . 11297 1
682 . 1 1 61 61 ILE CD1 C 13 13.896 0.300 . 1 . . . . 61 ILE CD1 . 11297 1
683 . 1 1 61 61 ILE CG1 C 13 28.035 0.300 . 1 . . . . 61 ILE CG1 . 11297 1
684 . 1 1 61 61 ILE CG2 C 13 18.185 0.300 . 1 . . . . 61 ILE CG2 . 11297 1
685 . 1 1 61 61 ILE N N 15 119.804 0.300 . 1 . . . . 61 ILE N . 11297 1
686 . 1 1 62 62 LYS H H 1 9.100 0.030 . 1 . . . . 62 LYS H . 11297 1
687 . 1 1 62 62 LYS HA H 1 4.767 0.030 . 1 . . . . 62 LYS HA . 11297 1
688 . 1 1 62 62 LYS HB2 H 1 1.703 0.030 . 2 . . . . 62 LYS HB2 . 11297 1
689 . 1 1 62 62 LYS HB3 H 1 1.430 0.030 . 2 . . . . 62 LYS HB3 . 11297 1
690 . 1 1 62 62 LYS HD2 H 1 1.212 0.030 . 2 . . . . 62 LYS HD2 . 11297 1
691 . 1 1 62 62 LYS HD3 H 1 1.050 0.030 . 2 . . . . 62 LYS HD3 . 11297 1
692 . 1 1 62 62 LYS HE2 H 1 2.423 0.030 . 2 . . . . 62 LYS HE2 . 11297 1
693 . 1 1 62 62 LYS HE3 H 1 2.190 0.030 . 2 . . . . 62 LYS HE3 . 11297 1
694 . 1 1 62 62 LYS HG2 H 1 1.150 0.030 . 2 . . . . 62 LYS HG2 . 11297 1
695 . 1 1 62 62 LYS HG3 H 1 1.069 0.030 . 2 . . . . 62 LYS HG3 . 11297 1
696 . 1 1 62 62 LYS C C 13 175.137 0.300 . 1 . . . . 62 LYS C . 11297 1
697 . 1 1 62 62 LYS CA C 13 54.443 0.300 . 1 . . . . 62 LYS CA . 11297 1
698 . 1 1 62 62 LYS CB C 13 36.148 0.300 . 1 . . . . 62 LYS CB . 11297 1
699 . 1 1 62 62 LYS CD C 13 29.227 0.300 . 1 . . . . 62 LYS CD . 11297 1
700 . 1 1 62 62 LYS CE C 13 41.610 0.300 . 1 . . . . 62 LYS CE . 11297 1
701 . 1 1 62 62 LYS CG C 13 24.599 0.300 . 1 . . . . 62 LYS CG . 11297 1
702 . 1 1 62 62 LYS N N 15 124.462 0.300 . 1 . . . . 62 LYS N . 11297 1
703 . 1 1 63 63 SER H H 1 8.601 0.030 . 1 . . . . 63 SER H . 11297 1
704 . 1 1 63 63 SER HA H 1 4.454 0.030 . 1 . . . . 63 SER HA . 11297 1
705 . 1 1 63 63 SER HB2 H 1 3.980 0.030 . 1 . . . . 63 SER HB2 . 11297 1
706 . 1 1 63 63 SER HB3 H 1 3.980 0.030 . 1 . . . . 63 SER HB3 . 11297 1
707 . 1 1 63 63 SER CA C 13 58.800 0.300 . 1 . . . . 63 SER CA . 11297 1
708 . 1 1 63 63 SER CB C 13 64.359 0.300 . 1 . . . . 63 SER CB . 11297 1
709 . 1 1 63 63 SER N N 15 115.706 0.300 . 1 . . . . 63 SER N . 11297 1
710 . 1 1 64 64 GLY H H 1 8.666 0.030 . 1 . . . . 64 GLY H . 11297 1
711 . 1 1 64 64 GLY HA2 H 1 4.094 0.030 . 2 . . . . 64 GLY HA2 . 11297 1
712 . 1 1 64 64 GLY HA3 H 1 4.035 0.030 . 2 . . . . 64 GLY HA3 . 11297 1
713 . 1 1 64 64 GLY CA C 13 44.598 0.300 . 1 . . . . 64 GLY CA . 11297 1
714 . 1 1 64 64 GLY N N 15 109.853 0.300 . 1 . . . . 64 GLY N . 11297 1
715 . 1 1 65 65 PRO HA H 1 4.426 0.030 . 1 . . . . 65 PRO HA . 11297 1
716 . 1 1 65 65 PRO HB2 H 1 2.224 0.030 . 2 . . . . 65 PRO HB2 . 11297 1
717 . 1 1 65 65 PRO HB3 H 1 1.964 0.030 . 2 . . . . 65 PRO HB3 . 11297 1
718 . 1 1 65 65 PRO HD2 H 1 3.578 0.030 . 2 . . . . 65 PRO HD2 . 11297 1
719 . 1 1 65 65 PRO HD3 H 1 3.477 0.030 . 2 . . . . 65 PRO HD3 . 11297 1
720 . 1 1 65 65 PRO HG2 H 1 1.961 0.030 . 1 . . . . 65 PRO HG2 . 11297 1
721 . 1 1 65 65 PRO HG3 H 1 1.961 0.030 . 1 . . . . 65 PRO HG3 . 11297 1
722 . 1 1 65 65 PRO CA C 13 63.153 0.300 . 1 . . . . 65 PRO CA . 11297 1
723 . 1 1 65 65 PRO CB C 13 32.222 0.300 . 1 . . . . 65 PRO CB . 11297 1
724 . 1 1 65 65 PRO CD C 13 49.692 0.300 . 1 . . . . 65 PRO CD . 11297 1
725 . 1 1 65 65 PRO CG C 13 27.050 0.300 . 1 . . . . 65 PRO CG . 11297 1
stop_
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