Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50300
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assignments
_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 $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.2
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_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' . . . 50300 1
2 '3D CBCA(CO)NH' . . . 50300 1
3 '3D HNCACB' . . . 50300 1
4 '3D HNCO' . . . 50300 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 $software_1 . . 50300 1
2 $software_2 . . 50300 1
3 $software_3 . . 50300 1
4 $software_4 . . 50300 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 7 7 LEU C C 13 176.714 0.000 . 1 . . . . . 7 LEU C . 50300 1
2 . 1 . 1 8 8 ASP H H 1 8.418 0.003 . 1 . . . . . 8 ASP H . 50300 1
3 . 1 . 1 8 8 ASP C C 13 175.897 0.000 . 1 . . . . . 8 ASP C . 50300 1
4 . 1 . 1 8 8 ASP CA C 13 54.316 0.022 . 1 . . . . . 8 ASP CA . 50300 1
5 . 1 . 1 8 8 ASP CB C 13 41.347 0.009 . 1 . . . . . 8 ASP CB . 50300 1
6 . 1 . 1 8 8 ASP N N 15 121.383 0.019 . 1 . . . . . 8 ASP N . 50300 1
7 . 1 . 1 9 9 ASP H H 1 8.252 0.008 . 1 . . . . . 9 ASP H . 50300 1
8 . 1 . 1 9 9 ASP C C 13 176.800 0.000 . 1 . . . . . 9 ASP C . 50300 1
9 . 1 . 1 9 9 ASP CA C 13 54.579 0.034 . 1 . . . . . 9 ASP CA . 50300 1
10 . 1 . 1 9 9 ASP CB C 13 41.219 0.041 . 1 . . . . . 9 ASP CB . 50300 1
11 . 1 . 1 9 9 ASP N N 15 121.059 0.077 . 1 . . . . . 9 ASP N . 50300 1
12 . 1 . 1 10 10 GLY H H 1 8.355 0.003 . 1 . . . . . 10 GLY H . 50300 1
13 . 1 . 1 10 10 GLY C C 13 173.676 0.000 . 1 . . . . . 10 GLY C . 50300 1
14 . 1 . 1 10 10 GLY CA C 13 47.000 3.012 . 1 . . . . . 10 GLY CA . 50300 1
15 . 1 . 1 10 10 GLY N N 15 108.765 0.011 . 1 . . . . . 10 GLY N . 50300 1
16 . 1 . 1 11 11 ASP H H 1 8.121 0.008 . 1 . . . . . 11 ASP H . 50300 1
17 . 1 . 1 11 11 ASP CA C 13 52.432 0.000 . 1 . . . . . 11 ASP CA . 50300 1
18 . 1 . 1 11 11 ASP CB C 13 41.313 0.000 . 1 . . . . . 11 ASP CB . 50300 1
19 . 1 . 1 11 11 ASP N N 15 121.573 0.021 . 1 . . . . . 11 ASP N . 50300 1
20 . 1 . 1 12 12 PRO C C 13 177.666 0.000 . 1 . . . . . 12 PRO C . 50300 1
21 . 1 . 1 12 12 PRO CA C 13 63.953 0.024 . 1 . . . . . 12 PRO CA . 50300 1
22 . 1 . 1 12 12 PRO CB C 13 32.129 0.000 . 1 . . . . . 12 PRO CB . 50300 1
23 . 1 . 1 13 13 LYS H H 1 8.399 0.004 . 1 . . . . . 13 LYS H . 50300 1
24 . 1 . 1 13 13 LYS C C 13 176.768 0.000 . 1 . . . . . 13 LYS C . 50300 1
25 . 1 . 1 13 13 LYS CA C 13 56.487 0.032 . 1 . . . . . 13 LYS CA . 50300 1
26 . 1 . 1 13 13 LYS CB C 13 32.346 0.030 . 1 . . . . . 13 LYS CB . 50300 1
27 . 1 . 1 13 13 LYS N N 15 119.704 0.035 . 1 . . . . . 13 LYS N . 50300 1
28 . 1 . 1 14 14 ALA H H 1 7.991 0.003 . 1 . . . . . 14 ALA H . 50300 1
29 . 1 . 1 14 14 ALA C C 13 177.758 0.000 . 1 . . . . . 14 ALA C . 50300 1
30 . 1 . 1 14 14 ALA CA C 13 52.731 0.041 . 1 . . . . . 14 ALA CA . 50300 1
31 . 1 . 1 14 14 ALA CB C 13 19.224 0.012 . 1 . . . . . 14 ALA CB . 50300 1
32 . 1 . 1 14 14 ALA N N 15 123.674 0.019 . 1 . . . . . 14 ALA N . 50300 1
33 . 1 . 1 15 15 GLN H H 1 8.220 0.013 . 1 . . . . . 15 GLN H . 50300 1
34 . 1 . 1 15 15 GLN C C 13 175.533 0.000 . 1 . . . . . 15 GLN C . 50300 1
35 . 1 . 1 15 15 GLN CA C 13 55.671 0.003 . 1 . . . . . 15 GLN CA . 50300 1
36 . 1 . 1 15 15 GLN CB C 13 29.467 0.019 . 1 . . . . . 15 GLN CB . 50300 1
37 . 1 . 1 15 15 GLN N N 15 119.029 0.072 . 1 . . . . . 15 GLN N . 50300 1
38 . 1 . 1 16 16 THR H H 1 7.933 0.009 . 1 . . . . . 16 THR H . 50300 1
39 . 1 . 1 16 16 THR C C 13 174.541 0.000 . 1 . . . . . 16 THR C . 50300 1
40 . 1 . 1 16 16 THR CA C 13 60.655 0.037 . 1 . . . . . 16 THR CA . 50300 1
41 . 1 . 1 16 16 THR CB C 13 71.098 0.007 . 1 . . . . . 16 THR CB . 50300 1
42 . 1 . 1 16 16 THR N N 15 111.930 0.046 . 1 . . . . . 16 THR N . 50300 1
43 . 1 . 1 17 17 GLY H H 1 8.667 0.004 . 1 . . . . . 17 GLY H . 50300 1
44 . 1 . 1 17 17 GLY C C 13 173.345 0.000 . 1 . . . . . 17 GLY C . 50300 1
45 . 1 . 1 17 17 GLY CA C 13 44.432 0.018 . 1 . . . . . 17 GLY CA . 50300 1
46 . 1 . 1 17 17 GLY N N 15 109.725 0.018 . 1 . . . . . 17 GLY N . 50300 1
47 . 1 . 1 18 18 PHE H H 1 8.850 0.003 . 1 . . . . . 18 PHE H . 50300 1
48 . 1 . 1 18 18 PHE C C 13 175.233 0.000 . 1 . . . . . 18 PHE C . 50300 1
49 . 1 . 1 18 18 PHE CA C 13 58.939 0.030 . 1 . . . . . 18 PHE CA . 50300 1
50 . 1 . 1 18 18 PHE CB C 13 40.679 0.036 . 1 . . . . . 18 PHE CB . 50300 1
51 . 1 . 1 18 18 PHE N N 15 121.726 0.021 . 1 . . . . . 18 PHE N . 50300 1
52 . 1 . 1 19 19 ASP H H 1 8.384 0.003 . 1 . . . . . 19 ASP H . 50300 1
53 . 1 . 1 19 19 ASP C C 13 176.003 0.000 . 1 . . . . . 19 ASP C . 50300 1
54 . 1 . 1 19 19 ASP CA C 13 52.716 0.015 . 1 . . . . . 19 ASP CA . 50300 1
55 . 1 . 1 19 19 ASP CB C 13 40.362 0.094 . 1 . . . . . 19 ASP CB . 50300 1
56 . 1 . 1 19 19 ASP N N 15 125.639 0.012 . 1 . . . . . 19 ASP N . 50300 1
57 . 1 . 1 20 20 LEU H H 1 8.368 0.004 . 1 . . . . . 20 LEU H . 50300 1
58 . 1 . 1 20 20 LEU C C 13 178.787 0.000 . 1 . . . . . 20 LEU C . 50300 1
59 . 1 . 1 20 20 LEU CA C 13 57.563 0.006 . 1 . . . . . 20 LEU CA . 50300 1
60 . 1 . 1 20 20 LEU CB C 13 42.137 0.054 . 1 . . . . . 20 LEU CB . 50300 1
61 . 1 . 1 20 20 LEU N N 15 127.972 0.023 . 1 . . . . . 20 LEU N . 50300 1
62 . 1 . 1 21 21 SER H H 1 8.247 0.004 . 1 . . . . . 21 SER H . 50300 1
63 . 1 . 1 21 21 SER C C 13 175.583 0.000 . 1 . . . . . 21 SER C . 50300 1
64 . 1 . 1 21 21 SER CA C 13 61.545 0.051 . 1 . . . . . 21 SER CA . 50300 1
65 . 1 . 1 21 21 SER CB C 13 63.208 0.091 . 1 . . . . . 21 SER CB . 50300 1
66 . 1 . 1 21 21 SER N N 15 113.977 0.018 . 1 . . . . . 21 SER N . 50300 1
67 . 1 . 1 22 22 THR H H 1 6.844 0.003 . 1 . . . . . 22 THR H . 50300 1
68 . 1 . 1 22 22 THR C C 13 174.009 0.000 . 1 . . . . . 22 THR C . 50300 1
69 . 1 . 1 22 22 THR CA C 13 60.382 0.036 . 1 . . . . . 22 THR CA . 50300 1
70 . 1 . 1 22 22 THR CB C 13 69.447 0.057 . 1 . . . . . 22 THR CB . 50300 1
71 . 1 . 1 22 22 THR N N 15 111.580 7.928 . 1 . . . . . 22 THR N . 50300 1
72 . 1 . 1 23 23 ALA H H 1 6.996 0.003 . 1 . . . . . 23 ALA H . 50300 1
73 . 1 . 1 23 23 ALA C C 13 177.791 0.000 . 1 . . . . . 23 ALA C . 50300 1
74 . 1 . 1 23 23 ALA CA C 13 52.446 0.015 . 1 . . . . . 23 ALA CA . 50300 1
75 . 1 . 1 23 23 ALA CB C 13 21.718 0.013 . 1 . . . . . 23 ALA CB . 50300 1
76 . 1 . 1 23 23 ALA N N 15 125.214 0.016 . 1 . . . . . 23 ALA N . 50300 1
77 . 1 . 1 24 24 THR H H 1 9.314 0.002 . 1 . . . . . 24 THR H . 50300 1
78 . 1 . 1 24 24 THR C C 13 174.339 0.000 . 1 . . . . . 24 THR C . 50300 1
79 . 1 . 1 24 24 THR CA C 13 61.960 0.032 . 1 . . . . . 24 THR CA . 50300 1
80 . 1 . 1 24 24 THR CB C 13 70.902 0.000 . 1 . . . . . 24 THR CB . 50300 1
81 . 1 . 1 24 24 THR N N 15 118.757 0.018 . 1 . . . . . 24 THR N . 50300 1
82 . 1 . 1 25 25 THR H H 1 9.165 0.001 . 1 . . . . . 25 THR H . 50300 1
83 . 1 . 1 25 25 THR C C 13 174.219 0.000 . 1 . . . . . 25 THR C . 50300 1
84 . 1 . 1 25 25 THR CA C 13 63.779 0.032 . 1 . . . . . 25 THR CA . 50300 1
85 . 1 . 1 25 25 THR CB C 13 69.007 0.000 . 1 . . . . . 25 THR CB . 50300 1
86 . 1 . 1 25 25 THR N N 15 123.923 0.005 . 1 . . . . . 25 THR N . 50300 1
87 . 1 . 1 26 26 LEU H H 1 9.178 0.003 . 1 . . . . . 26 LEU H . 50300 1
88 . 1 . 1 26 26 LEU C C 13 176.502 0.000 . 1 . . . . . 26 LEU C . 50300 1
89 . 1 . 1 26 26 LEU CA C 13 55.166 0.043 . 1 . . . . . 26 LEU CA . 50300 1
90 . 1 . 1 26 26 LEU CB C 13 44.634 0.003 . 1 . . . . . 26 LEU CB . 50300 1
91 . 1 . 1 26 26 LEU N N 15 127.775 0.022 . 1 . . . . . 26 LEU N . 50300 1
92 . 1 . 1 27 27 PHE H H 1 7.478 0.003 . 1 . . . . . 27 PHE H . 50300 1
93 . 1 . 1 27 27 PHE C C 13 173.550 0.000 . 1 . . . . . 27 PHE C . 50300 1
94 . 1 . 1 27 27 PHE CA C 13 57.882 0.005 . 1 . . . . . 27 PHE CA . 50300 1
95 . 1 . 1 27 27 PHE CB C 13 43.774 0.025 . 1 . . . . . 27 PHE CB . 50300 1
96 . 1 . 1 27 27 PHE N N 15 119.007 0.015 . 1 . . . . . 27 PHE N . 50300 1
97 . 1 . 1 28 28 TRP H H 1 8.809 0.004 . 1 . . . . . 28 TRP H . 50300 1
98 . 1 . 1 28 28 TRP C C 13 173.741 0.000 . 1 . . . . . 28 TRP C . 50300 1
99 . 1 . 1 28 28 TRP CA C 13 54.677 0.003 . 1 . . . . . 28 TRP CA . 50300 1
100 . 1 . 1 28 28 TRP CB C 13 28.703 0.026 . 1 . . . . . 28 TRP CB . 50300 1
101 . 1 . 1 28 28 TRP N N 15 131.837 0.030 . 1 . . . . . 28 TRP N . 50300 1
102 . 1 . 1 29 29 ARG H H 1 8.323 0.004 . 1 . . . . . 29 ARG H . 50300 1
103 . 1 . 1 29 29 ARG CA C 13 54.660 0.000 . 1 . . . . . 29 ARG CA . 50300 1
104 . 1 . 1 29 29 ARG CB C 13 33.197 0.000 . 1 . . . . . 29 ARG CB . 50300 1
105 . 1 . 1 29 29 ARG N N 15 123.354 0.011 . 1 . . . . . 29 ARG N . 50300 1
106 . 1 . 1 30 30 PRO C C 13 176.534 0.000 . 1 . . . . . 30 PRO C . 50300 1
107 . 1 . 1 30 30 PRO CA C 13 61.774 0.025 . 1 . . . . . 30 PRO CA . 50300 1
108 . 1 . 1 30 30 PRO CB C 13 32.390 0.014 . 1 . . . . . 30 PRO CB . 50300 1
109 . 1 . 1 31 31 VAL H H 1 9.402 0.006 . 1 . . . . . 31 VAL H . 50300 1
110 . 1 . 1 31 31 VAL CA C 13 58.868 0.000 . 1 . . . . . 31 VAL CA . 50300 1
111 . 1 . 1 31 31 VAL CB C 13 37.774 0.000 . 1 . . . . . 31 VAL CB . 50300 1
112 . 1 . 1 31 31 VAL N N 15 123.177 0.019 . 1 . . . . . 31 VAL N . 50300 1
113 . 1 . 1 32 32 PRO C C 13 176.265 0.000 . 1 . . . . . 32 PRO C . 50300 1
114 . 1 . 1 32 32 PRO CA C 13 62.932 0.003 . 1 . . . . . 32 PRO CA . 50300 1
115 . 1 . 1 32 32 PRO CB C 13 31.572 0.001 . 1 . . . . . 32 PRO CB . 50300 1
116 . 1 . 1 33 33 VAL H H 1 9.175 0.005 . 1 . . . . . 33 VAL H . 50300 1
117 . 1 . 1 33 33 VAL C C 13 174.220 0.000 . 1 . . . . . 33 VAL C . 50300 1
118 . 1 . 1 33 33 VAL CA C 13 61.031 0.045 . 1 . . . . . 33 VAL CA . 50300 1
119 . 1 . 1 33 33 VAL CB C 13 36.043 0.018 . 1 . . . . . 33 VAL CB . 50300 1
120 . 1 . 1 33 33 VAL N N 15 126.068 0.020 . 1 . . . . . 33 VAL N . 50300 1
121 . 1 . 1 34 34 HIS H H 1 9.023 0.003 . 1 . . . . . 34 HIS H . 50300 1
122 . 1 . 1 34 34 HIS C C 13 173.788 0.000 . 1 . . . . . 34 HIS C . 50300 1
123 . 1 . 1 34 34 HIS CA C 13 56.041 0.007 . 1 . . . . . 34 HIS CA . 50300 1
124 . 1 . 1 34 34 HIS CB C 13 30.160 0.027 . 1 . . . . . 34 HIS CB . 50300 1
125 . 1 . 1 34 34 HIS N N 15 127.786 0.016 . 1 . . . . . 34 HIS N . 50300 1
126 . 1 . 1 35 35 VAL H H 1 9.458 0.003 . 1 . . . . . 35 VAL H . 50300 1
127 . 1 . 1 35 35 VAL C C 13 176.260 0.000 . 1 . . . . . 35 VAL C . 50300 1
128 . 1 . 1 35 35 VAL CA C 13 62.632 0.049 . 1 . . . . . 35 VAL CA . 50300 1
129 . 1 . 1 35 35 VAL CB C 13 32.328 0.037 . 1 . . . . . 35 VAL CB . 50300 1
130 . 1 . 1 35 35 VAL N N 15 128.609 0.013 . 1 . . . . . 35 VAL N . 50300 1
131 . 1 . 1 36 36 LYS H H 1 9.308 0.005 . 1 . . . . . 36 LYS H . 50300 1
132 . 1 . 1 36 36 LYS C C 13 174.764 0.000 . 1 . . . . . 36 LYS C . 50300 1
133 . 1 . 1 36 36 LYS CA C 13 54.975 0.020 . 1 . . . . . 36 LYS CA . 50300 1
134 . 1 . 1 36 36 LYS CB C 13 34.215 0.044 . 1 . . . . . 36 LYS CB . 50300 1
135 . 1 . 1 36 36 LYS N N 15 130.787 0.012 . 1 . . . . . 36 LYS N . 50300 1
136 . 1 . 1 37 37 GLN H H 1 8.932 0.002 . 1 . . . . . 37 GLN H . 50300 1
137 . 1 . 1 37 37 GLN C C 13 174.637 0.000 . 1 . . . . . 37 GLN C . 50300 1
138 . 1 . 1 37 37 GLN CA C 13 54.948 0.031 . 1 . . . . . 37 GLN CA . 50300 1
139 . 1 . 1 37 37 GLN CB C 13 32.173 0.048 . 1 . . . . . 37 GLN CB . 50300 1
140 . 1 . 1 37 37 GLN N N 15 122.997 0.015 . 1 . . . . . 37 GLN N . 50300 1
141 . 1 . 1 38 38 GLN H H 1 8.600 0.004 . 1 . . . . . 38 GLN H . 50300 1
142 . 1 . 1 38 38 GLN C C 13 175.860 0.000 . 1 . . . . . 38 GLN C . 50300 1
143 . 1 . 1 38 38 GLN CA C 13 57.782 0.012 . 1 . . . . . 38 GLN CA . 50300 1
144 . 1 . 1 38 38 GLN CB C 13 28.849 0.026 . 1 . . . . . 38 GLN CB . 50300 1
145 . 1 . 1 38 38 GLN N N 15 122.951 0.036 . 1 . . . . . 38 GLN N . 50300 1
146 . 1 . 1 39 39 ASP H H 1 8.878 0.002 . 1 . . . . . 39 ASP H . 50300 1
147 . 1 . 1 39 39 ASP C C 13 174.765 0.000 . 1 . . . . . 39 ASP C . 50300 1
148 . 1 . 1 39 39 ASP CA C 13 55.802 0.024 . 1 . . . . . 39 ASP CA . 50300 1
149 . 1 . 1 39 39 ASP CB C 13 39.864 0.011 . 1 . . . . . 39 ASP CB . 50300 1
150 . 1 . 1 39 39 ASP N N 15 118.639 0.012 . 1 . . . . . 39 ASP N . 50300 1
151 . 1 . 1 40 40 ARG H H 1 7.888 0.003 . 1 . . . . . 40 ARG H . 50300 1
152 . 1 . 1 40 40 ARG C C 13 176.273 0.000 . 1 . . . . . 40 ARG C . 50300 1
153 . 1 . 1 40 40 ARG CA C 13 54.377 0.034 . 1 . . . . . 40 ARG CA . 50300 1
154 . 1 . 1 40 40 ARG CB C 13 33.183 0.041 . 1 . . . . . 40 ARG CB . 50300 1
155 . 1 . 1 40 40 ARG N N 15 117.373 0.018 . 1 . . . . . 40 ARG N . 50300 1
156 . 1 . 1 41 41 GLU H H 1 8.589 0.003 . 1 . . . . . 41 GLU H . 50300 1
157 . 1 . 1 41 41 GLU C C 13 176.751 0.000 . 1 . . . . . 41 GLU C . 50300 1
158 . 1 . 1 41 41 GLU CA C 13 56.501 0.027 . 1 . . . . . 41 GLU CA . 50300 1
159 . 1 . 1 41 41 GLU CB C 13 30.102 0.015 . 1 . . . . . 41 GLU CB . 50300 1
160 . 1 . 1 41 41 GLU N N 15 122.130 0.028 . 1 . . . . . 41 GLU N . 50300 1
161 . 1 . 1 42 42 ASP H H 1 8.738 0.002 . 1 . . . . . 42 ASP H . 50300 1
162 . 1 . 1 42 42 ASP C C 13 175.863 0.000 . 1 . . . . . 42 ASP C . 50300 1
163 . 1 . 1 42 42 ASP CA C 13 55.456 0.077 . 1 . . . . . 42 ASP CA . 50300 1
164 . 1 . 1 42 42 ASP CB C 13 40.991 0.032 . 1 . . . . . 42 ASP CB . 50300 1
165 . 1 . 1 42 42 ASP N N 15 124.270 0.009 . 1 . . . . . 42 ASP N . 50300 1
166 . 1 . 1 43 43 VAL H H 1 8.224 0.003 . 1 . . . . . 43 VAL H . 50300 1
167 . 1 . 1 43 43 VAL C C 13 173.265 0.000 . 1 . . . . . 43 VAL C . 50300 1
168 . 1 . 1 43 43 VAL CA C 13 60.527 0.034 . 1 . . . . . 43 VAL CA . 50300 1
169 . 1 . 1 43 43 VAL CB C 13 35.917 0.032 . 1 . . . . . 43 VAL CB . 50300 1
170 . 1 . 1 43 43 VAL N N 15 118.838 0.070 . 1 . . . . . 43 VAL N . 50300 1
171 . 1 . 1 44 44 LEU H H 1 8.310 0.004 . 1 . . . . . 44 LEU H . 50300 1
172 . 1 . 1 44 44 LEU C C 13 175.803 0.000 . 1 . . . . . 44 LEU C . 50300 1
173 . 1 . 1 44 44 LEU CA C 13 54.055 0.050 . 1 . . . . . 44 LEU CA . 50300 1
174 . 1 . 1 44 44 LEU CB C 13 42.567 0.024 . 1 . . . . . 44 LEU CB . 50300 1
175 . 1 . 1 44 44 LEU N N 15 128.154 0.012 . 1 . . . . . 44 LEU N . 50300 1
176 . 1 . 1 45 45 GLU H H 1 9.009 0.003 . 1 . . . . . 45 GLU H . 50300 1
177 . 1 . 1 45 45 GLU C C 13 174.877 0.000 . 1 . . . . . 45 GLU C . 50300 1
178 . 1 . 1 45 45 GLU CA C 13 54.301 0.000 . 1 . . . . . 45 GLU CA . 50300 1
179 . 1 . 1 45 45 GLU CB C 13 33.839 0.020 . 1 . . . . . 45 GLU CB . 50300 1
180 . 1 . 1 45 45 GLU N N 15 127.331 0.017 . 1 . . . . . 45 GLU N . 50300 1
181 . 1 . 1 46 46 GLU H H 1 8.726 0.003 . 1 . . . . . 46 GLU H . 50300 1
182 . 1 . 1 46 46 GLU C C 13 175.770 0.000 . 1 . . . . . 46 GLU C . 50300 1
183 . 1 . 1 46 46 GLU CA C 13 56.075 0.023 . 1 . . . . . 46 GLU CA . 50300 1
184 . 1 . 1 46 46 GLU CB C 13 29.486 0.163 . 1 . . . . . 46 GLU CB . 50300 1
185 . 1 . 1 46 46 GLU N N 15 122.497 0.062 . 1 . . . . . 46 GLU N . 50300 1
186 . 1 . 1 47 47 LEU H H 1 8.580 0.005 . 1 . . . . . 47 LEU H . 50300 1
187 . 1 . 1 47 47 LEU C C 13 176.110 0.000 . 1 . . . . . 47 LEU C . 50300 1
188 . 1 . 1 47 47 LEU CA C 13 53.252 0.045 . 1 . . . . . 47 LEU CA . 50300 1
189 . 1 . 1 47 47 LEU CB C 13 43.639 0.060 . 1 . . . . . 47 LEU CB . 50300 1
190 . 1 . 1 47 47 LEU N N 15 127.435 0.017 . 1 . . . . . 47 LEU N . 50300 1
191 . 1 . 1 48 48 THR H H 1 8.944 0.007 . 1 . . . . . 48 THR H . 50300 1
192 . 1 . 1 48 48 THR C C 13 173.371 0.000 . 1 . . . . . 48 THR C . 50300 1
193 . 1 . 1 48 48 THR CA C 13 64.428 0.006 . 1 . . . . . 48 THR CA . 50300 1
194 . 1 . 1 48 48 THR CB C 13 68.602 0.004 . 1 . . . . . 48 THR CB . 50300 1
195 . 1 . 1 48 48 THR N N 15 120.168 0.024 . 1 . . . . . 48 THR N . 50300 1
196 . 1 . 1 49 49 PHE H H 1 8.673 0.003 . 1 . . . . . 49 PHE H . 50300 1
197 . 1 . 1 49 49 PHE C C 13 174.498 0.000 . 1 . . . . . 49 PHE C . 50300 1
198 . 1 . 1 49 49 PHE CA C 13 56.946 0.014 . 1 . . . . . 49 PHE CA . 50300 1
199 . 1 . 1 49 49 PHE CB C 13 42.630 0.048 . 1 . . . . . 49 PHE CB . 50300 1
200 . 1 . 1 49 49 PHE N N 15 128.557 0.020 . 1 . . . . . 49 PHE N . 50300 1
201 . 1 . 1 50 50 ARG H H 1 8.944 0.004 . 1 . . . . . 50 ARG H . 50300 1
202 . 1 . 1 50 50 ARG C C 13 175.021 0.000 . 1 . . . . . 50 ARG C . 50300 1
203 . 1 . 1 50 50 ARG CA C 13 54.766 0.022 . 1 . . . . . 50 ARG CA . 50300 1
204 . 1 . 1 50 50 ARG CB C 13 34.245 0.015 . 1 . . . . . 50 ARG CB . 50300 1
205 . 1 . 1 50 50 ARG N N 15 122.552 0.121 . 1 . . . . . 50 ARG N . 50300 1
206 . 1 . 1 51 51 ILE H H 1 9.068 0.006 . 1 . . . . . 51 ILE H . 50300 1
207 . 1 . 1 51 51 ILE C C 13 174.272 0.000 . 1 . . . . . 51 ILE C . 50300 1
208 . 1 . 1 51 51 ILE CA C 13 60.967 0.022 . 1 . . . . . 51 ILE CA . 50300 1
209 . 1 . 1 51 51 ILE CB C 13 39.320 0.126 . 1 . . . . . 51 ILE CB . 50300 1
210 . 1 . 1 51 51 ILE N N 15 125.333 0.025 . 1 . . . . . 51 ILE N . 50300 1
211 . 1 . 1 52 52 LEU H H 1 9.621 0.004 . 1 . . . . . 52 LEU H . 50300 1
212 . 1 . 1 52 52 LEU C C 13 175.313 0.000 . 1 . . . . . 52 LEU C . 50300 1
213 . 1 . 1 52 52 LEU CA C 13 54.206 0.049 . 1 . . . . . 52 LEU CA . 50300 1
214 . 1 . 1 52 52 LEU CB C 13 46.925 0.014 . 1 . . . . . 52 LEU CB . 50300 1
215 . 1 . 1 52 52 LEU N N 15 128.297 0.014 . 1 . . . . . 52 LEU N . 50300 1
216 . 1 . 1 53 53 THR H H 1 8.875 0.003 . 1 . . . . . 53 THR H . 50300 1
217 . 1 . 1 53 53 THR C C 13 173.546 0.000 . 1 . . . . . 53 THR C . 50300 1
218 . 1 . 1 53 53 THR CA C 13 59.036 0.031 . 1 . . . . . 53 THR CA . 50300 1
219 . 1 . 1 53 53 THR CB C 13 71.444 0.029 . 1 . . . . . 53 THR CB . 50300 1
220 . 1 . 1 53 53 THR N N 15 111.254 0.014 . 1 . . . . . 53 THR N . 50300 1
221 . 1 . 1 54 54 GLY H H 1 8.639 0.004 . 1 . . . . . 54 GLY H . 50300 1
222 . 1 . 1 54 54 GLY C C 13 172.530 0.000 . 1 . . . . . 54 GLY C . 50300 1
223 . 1 . 1 54 54 GLY CA C 13 45.955 0.026 . 1 . . . . . 54 GLY CA . 50300 1
224 . 1 . 1 54 54 GLY N N 15 111.479 0.020 . 1 . . . . . 54 GLY N . 50300 1
225 . 1 . 1 55 55 VAL H H 1 9.100 0.004 . 1 . . . . . 55 VAL H . 50300 1
226 . 1 . 1 55 55 VAL C C 13 174.574 0.000 . 1 . . . . . 55 VAL C . 50300 1
227 . 1 . 1 55 55 VAL CA C 13 58.687 0.037 . 1 . . . . . 55 VAL CA . 50300 1
228 . 1 . 1 55 55 VAL CB C 13 36.019 0.007 . 1 . . . . . 55 VAL CB . 50300 1
229 . 1 . 1 55 55 VAL N N 15 118.010 0.015 . 1 . . . . . 55 VAL N . 50300 1
230 . 1 . 1 56 56 ALA H H 1 7.749 0.007 . 1 . . . . . 56 ALA H . 50300 1
231 . 1 . 1 56 56 ALA C C 13 178.691 0.000 . 1 . . . . . 56 ALA C . 50300 1
232 . 1 . 1 56 56 ALA CA C 13 51.119 0.017 . 1 . . . . . 56 ALA CA . 50300 1
233 . 1 . 1 56 56 ALA CB C 13 19.215 0.015 . 1 . . . . . 56 ALA CB . 50300 1
234 . 1 . 1 56 56 ALA N N 15 122.204 0.023 . 1 . . . . . 56 ALA N . 50300 1
235 . 1 . 1 57 57 LYS H H 1 9.048 0.003 . 1 . . . . . 57 LYS H . 50300 1
236 . 1 . 1 57 57 LYS C C 13 178.014 0.000 . 1 . . . . . 57 LYS C . 50300 1
237 . 1 . 1 57 57 LYS CA C 13 59.428 0.043 . 1 . . . . . 57 LYS CA . 50300 1
238 . 1 . 1 57 57 LYS CB C 13 33.414 0.011 . 1 . . . . . 57 LYS CB . 50300 1
239 . 1 . 1 57 57 LYS N N 15 122.665 0.013 . 1 . . . . . 57 LYS N . 50300 1
240 . 1 . 1 58 58 GLN H H 1 8.981 0.003 . 1 . . . . . 58 GLN H . 50300 1
241 . 1 . 1 58 58 GLN C C 13 175.600 0.000 . 1 . . . . . 58 GLN C . 50300 1
242 . 1 . 1 58 58 GLN CA C 13 55.863 0.019 . 1 . . . . . 58 GLN CA . 50300 1
243 . 1 . 1 58 58 GLN CB C 13 27.648 0.013 . 1 . . . . . 58 GLN CB . 50300 1
244 . 1 . 1 58 58 GLN N N 15 113.832 0.024 . 1 . . . . . 58 GLN N . 50300 1
245 . 1 . 1 59 59 ASN H H 1 7.135 0.004 . 1 . . . . . 59 ASN H . 50300 1
246 . 1 . 1 59 59 ASN CA C 13 53.199 0.000 . 1 . . . . . 59 ASN CA . 50300 1
247 . 1 . 1 59 59 ASN CB C 13 38.190 0.000 . 1 . . . . . 59 ASN CB . 50300 1
248 . 1 . 1 59 59 ASN N N 15 116.157 0.057 . 1 . . . . . 59 ASN N . 50300 1
249 . 1 . 1 60 60 HIS C C 13 174.269 0.000 . 1 . . . . . 60 HIS C . 50300 1
250 . 1 . 1 60 60 HIS CA C 13 57.051 0.058 . 1 . . . . . 60 HIS CA . 50300 1
251 . 1 . 1 60 60 HIS CB C 13 29.364 0.007 . 1 . . . . . 60 HIS CB . 50300 1
252 . 1 . 1 61 61 ASN H H 1 7.975 0.006 . 1 . . . . . 61 ASN H . 50300 1
253 . 1 . 1 61 61 ASN C C 13 174.234 0.000 . 1 . . . . . 61 ASN C . 50300 1
254 . 1 . 1 61 61 ASN CA C 13 53.446 0.002 . 1 . . . . . 61 ASN CA . 50300 1
255 . 1 . 1 61 61 ASN CB C 13 39.209 0.042 . 1 . . . . . 61 ASN CB . 50300 1
256 . 1 . 1 61 61 ASN N N 15 114.514 0.013 . 1 . . . . . 61 ASN N . 50300 1
257 . 1 . 1 62 62 LEU H H 1 7.755 0.003 . 1 . . . . . 62 LEU H . 50300 1
258 . 1 . 1 62 62 LEU C C 13 174.023 0.000 . 1 . . . . . 62 LEU C . 50300 1
259 . 1 . 1 62 62 LEU CA C 13 54.222 0.035 . 1 . . . . . 62 LEU CA . 50300 1
260 . 1 . 1 62 62 LEU CB C 13 42.504 0.026 . 1 . . . . . 62 LEU CB . 50300 1
261 . 1 . 1 62 62 LEU N N 15 124.355 0.013 . 1 . . . . . 62 LEU N . 50300 1
262 . 1 . 1 63 63 ARG H H 1 8.645 0.005 . 1 . . . . . 63 ARG H . 50300 1
263 . 1 . 1 63 63 ARG C C 13 176.140 0.000 . 1 . . . . . 63 ARG C . 50300 1
264 . 1 . 1 63 63 ARG CA C 13 56.381 0.054 . 1 . . . . . 63 ARG CA . 50300 1
265 . 1 . 1 63 63 ARG CB C 13 31.873 0.027 . 1 . . . . . 63 ARG CB . 50300 1
266 . 1 . 1 63 63 ARG N N 15 125.091 0.018 . 1 . . . . . 63 ARG N . 50300 1
267 . 1 . 1 64 64 ILE H H 1 8.813 0.003 . 1 . . . . . 64 ILE H . 50300 1
268 . 1 . 1 64 64 ILE C C 13 173.636 0.000 . 1 . . . . . 64 ILE C . 50300 1
269 . 1 . 1 64 64 ILE CA C 13 60.771 0.043 . 1 . . . . . 64 ILE CA . 50300 1
270 . 1 . 1 64 64 ILE CB C 13 43.473 0.026 . 1 . . . . . 64 ILE CB . 50300 1
271 . 1 . 1 64 64 ILE N N 15 120.747 0.016 . 1 . . . . . 64 ILE N . 50300 1
272 . 1 . 1 65 65 LEU H H 1 8.890 0.003 . 1 . . . . . 65 LEU H . 50300 1
273 . 1 . 1 65 65 LEU C C 13 173.867 0.000 . 1 . . . . . 65 LEU C . 50300 1
274 . 1 . 1 65 65 LEU CA C 13 53.329 0.001 . 1 . . . . . 65 LEU CA . 50300 1
275 . 1 . 1 65 65 LEU CB C 13 45.321 0.023 . 1 . . . . . 65 LEU CB . 50300 1
276 . 1 . 1 65 65 LEU N N 15 128.582 0.013 . 1 . . . . . 65 LEU N . 50300 1
277 . 1 . 1 66 66 ARG H H 1 9.185 0.003 . 1 . . . . . 66 ARG H . 50300 1
278 . 1 . 1 66 66 ARG C C 13 174.235 0.000 . 1 . . . . . 66 ARG C . 50300 1
279 . 1 . 1 66 66 ARG CA C 13 53.918 0.076 . 1 . . . . . 66 ARG CA . 50300 1
280 . 1 . 1 66 66 ARG CB C 13 34.915 0.064 . 1 . . . . . 66 ARG CB . 50300 1
281 . 1 . 1 66 66 ARG N N 15 126.814 0.016 . 1 . . . . . 66 ARG N . 50300 1
282 . 1 . 1 67 67 ILE H H 1 9.072 0.007 . 1 . . . . . 67 ILE H . 50300 1
283 . 1 . 1 67 67 ILE C C 13 174.139 0.000 . 1 . . . . . 67 ILE C . 50300 1
284 . 1 . 1 67 67 ILE CA C 13 60.367 0.000 . 1 . . . . . 67 ILE CA . 50300 1
285 . 1 . 1 67 67 ILE N N 15 122.115 0.051 . 1 . . . . . 67 ILE N . 50300 1
286 . 1 . 1 69 69 ILE C C 13 174.333 0.000 . 1 . . . . . 69 ILE C . 50300 1
287 . 1 . 1 69 69 ILE CA C 13 60.498 0.000 . 1 . . . . . 69 ILE CA . 50300 1
288 . 1 . 1 69 69 ILE CB C 13 39.662 0.000 . 1 . . . . . 69 ILE CB . 50300 1
289 . 1 . 1 70 70 SER H H 1 9.125 0.012 . 1 . . . . . 70 SER H . 50300 1
290 . 1 . 1 70 70 SER C C 13 172.481 0.000 . 1 . . . . . 70 SER C . 50300 1
291 . 1 . 1 70 70 SER CA C 13 56.946 0.006 . 1 . . . . . 70 SER CA . 50300 1
292 . 1 . 1 70 70 SER CB C 13 66.446 0.016 . 1 . . . . . 70 SER CB . 50300 1
293 . 1 . 1 70 70 SER N N 15 120.663 0.022 . 1 . . . . . 70 SER N . 50300 1
294 . 1 . 1 71 71 SER H H 1 8.963 0.004 . 1 . . . . . 71 SER H . 50300 1
295 . 1 . 1 71 71 SER C C 13 175.403 0.000 . 1 . . . . . 71 SER C . 50300 1
296 . 1 . 1 71 71 SER CA C 13 55.847 0.065 . 1 . . . . . 71 SER CA . 50300 1
297 . 1 . 1 71 71 SER CB C 13 64.840 0.043 . 1 . . . . . 71 SER CB . 50300 1
298 . 1 . 1 71 71 SER N N 15 113.122 0.020 . 1 . . . . . 71 SER N . 50300 1
299 . 1 . 1 72 72 ASP H H 1 9.104 0.003 . 1 . . . . . 72 ASP H . 50300 1
300 . 1 . 1 72 72 ASP C C 13 176.421 0.000 . 1 . . . . . 72 ASP C . 50300 1
301 . 1 . 1 72 72 ASP CA C 13 55.972 0.044 . 1 . . . . . 72 ASP CA . 50300 1
302 . 1 . 1 72 72 ASP CB C 13 40.667 0.066 . 1 . . . . . 72 ASP CB . 50300 1
303 . 1 . 1 72 72 ASP N N 15 127.529 0.010 . 1 . . . . . 72 ASP N . 50300 1
304 . 1 . 1 73 73 SER H H 1 8.131 0.003 . 1 . . . . . 73 SER H . 50300 1
305 . 1 . 1 73 73 SER C C 13 174.005 0.000 . 1 . . . . . 73 SER C . 50300 1
306 . 1 . 1 73 73 SER CA C 13 58.514 0.036 . 1 . . . . . 73 SER CA . 50300 1
307 . 1 . 1 73 73 SER CB C 13 64.079 0.010 . 1 . . . . . 73 SER CB . 50300 1
308 . 1 . 1 73 73 SER N N 15 112.653 0.054 . 1 . . . . . 73 SER N . 50300 1
309 . 1 . 1 74 74 ASP H H 1 7.475 0.007 . 1 . . . . . 74 ASP H . 50300 1
310 . 1 . 1 74 74 ASP N N 15 121.000 0.034 . 1 . . . . . 74 ASP N . 50300 1
311 . 1 . 1 80 80 THR C C 13 172.293 0.000 . 1 . . . . . 80 THR C . 50300 1
312 . 1 . 1 81 81 LEU H H 1 8.815 0.004 . 1 . . . . . 81 LEU H . 50300 1
313 . 1 . 1 81 81 LEU C C 13 174.194 0.000 . 1 . . . . . 81 LEU C . 50300 1
314 . 1 . 1 81 81 LEU CA C 13 54.189 0.029 . 1 . . . . . 81 LEU CA . 50300 1
315 . 1 . 1 81 81 LEU CB C 13 44.887 0.045 . 1 . . . . . 81 LEU CB . 50300 1
316 . 1 . 1 81 81 LEU N N 15 126.846 0.023 . 1 . . . . . 81 LEU N . 50300 1
317 . 1 . 1 82 82 GLU H H 1 8.556 0.005 . 1 . . . . . 82 GLU H . 50300 1
318 . 1 . 1 82 82 GLU C C 13 174.888 0.000 . 1 . . . . . 82 GLU C . 50300 1
319 . 1 . 1 82 82 GLU CA C 13 55.417 0.025 . 1 . . . . . 82 GLU CA . 50300 1
320 . 1 . 1 82 82 GLU CB C 13 33.085 0.041 . 1 . . . . . 82 GLU CB . 50300 1
321 . 1 . 1 82 82 GLU N N 15 126.427 0.016 . 1 . . . . . 82 GLU N . 50300 1
322 . 1 . 1 83 83 VAL H H 1 9.303 0.003 . 1 . . . . . 83 VAL H . 50300 1
323 . 1 . 1 83 83 VAL C C 13 174.125 0.000 . 1 . . . . . 83 VAL C . 50300 1
324 . 1 . 1 83 83 VAL CA C 13 60.333 0.004 . 1 . . . . . 83 VAL CA . 50300 1
325 . 1 . 1 83 83 VAL CB C 13 35.614 0.012 . 1 . . . . . 83 VAL CB . 50300 1
326 . 1 . 1 83 83 VAL N N 15 124.564 0.025 . 1 . . . . . 83 VAL N . 50300 1
327 . 1 . 1 84 84 SER H H 1 9.707 0.003 . 1 . . . . . 84 SER H . 50300 1
328 . 1 . 1 84 84 SER C C 13 175.640 0.000 . 1 . . . . . 84 SER C . 50300 1
329 . 1 . 1 84 84 SER CA C 13 56.472 0.042 . 1 . . . . . 84 SER CA . 50300 1
330 . 1 . 1 84 84 SER CB C 13 66.408 0.006 . 1 . . . . . 84 SER CB . 50300 1
331 . 1 . 1 84 84 SER N N 15 124.481 0.014 . 1 . . . . . 84 SER N . 50300 1
332 . 1 . 1 85 85 GLU H H 1 8.442 0.003 . 1 . . . . . 85 GLU H . 50300 1
333 . 1 . 1 85 85 GLU C C 13 178.021 0.000 . 1 . . . . . 85 GLU C . 50300 1
334 . 1 . 1 85 85 GLU CA C 13 59.889 0.009 . 1 . . . . . 85 GLU CA . 50300 1
335 . 1 . 1 85 85 GLU CB C 13 29.630 0.003 . 1 . . . . . 85 GLU CB . 50300 1
336 . 1 . 1 85 85 GLU N N 15 120.551 0.023 . 1 . . . . . 85 GLU N . 50300 1
337 . 1 . 1 86 86 GLU H H 1 7.459 0.003 . 1 . . . . . 86 GLU H . 50300 1
338 . 1 . 1 86 86 GLU C C 13 178.966 0.000 . 1 . . . . . 86 GLU C . 50300 1
339 . 1 . 1 86 86 GLU CA C 13 58.726 0.017 . 1 . . . . . 86 GLU CA . 50300 1
340 . 1 . 1 86 86 GLU CB C 13 29.821 0.024 . 1 . . . . . 86 GLU CB . 50300 1
341 . 1 . 1 86 86 GLU N N 15 116.760 0.014 . 1 . . . . . 86 GLU N . 50300 1
342 . 1 . 1 87 87 ASP H H 1 7.700 0.003 . 1 . . . . . 87 ASP H . 50300 1
343 . 1 . 1 87 87 ASP C C 13 178.523 0.000 . 1 . . . . . 87 ASP C . 50300 1
344 . 1 . 1 87 87 ASP CA C 13 56.389 0.039 . 1 . . . . . 87 ASP CA . 50300 1
345 . 1 . 1 87 87 ASP CB C 13 41.039 0.068 . 1 . . . . . 87 ASP CB . 50300 1
346 . 1 . 1 87 87 ASP N N 15 121.127 0.013 . 1 . . . . . 87 ASP N . 50300 1
347 . 1 . 1 88 88 PHE H H 1 8.324 0.004 . 1 . . . . . 88 PHE H . 50300 1
348 . 1 . 1 88 88 PHE C C 13 175.441 0.000 . 1 . . . . . 88 PHE C . 50300 1
349 . 1 . 1 88 88 PHE CA C 13 61.117 0.033 . 1 . . . . . 88 PHE CA . 50300 1
350 . 1 . 1 88 88 PHE CB C 13 39.842 0.013 . 1 . . . . . 88 PHE CB . 50300 1
351 . 1 . 1 88 88 PHE N N 15 120.278 0.059 . 1 . . . . . 88 PHE N . 50300 1
352 . 1 . 1 89 89 GLN H H 1 7.729 0.006 . 1 . . . . . 89 GLN H . 50300 1
353 . 1 . 1 89 89 GLN C C 13 177.576 0.000 . 1 . . . . . 89 GLN C . 50300 1
354 . 1 . 1 89 89 GLN CA C 13 58.670 0.074 . 1 . . . . . 89 GLN CA . 50300 1
355 . 1 . 1 89 89 GLN CB C 13 27.891 0.038 . 1 . . . . . 89 GLN CB . 50300 1
356 . 1 . 1 89 89 GLN N N 15 115.792 0.012 . 1 . . . . . 89 GLN N . 50300 1
357 . 1 . 1 90 90 SER H H 1 7.530 0.004 . 1 . . . . . 90 SER H . 50300 1
358 . 1 . 1 90 90 SER C C 13 175.658 0.000 . 1 . . . . . 90 SER C . 50300 1
359 . 1 . 1 90 90 SER CA C 13 60.736 0.034 . 1 . . . . . 90 SER CA . 50300 1
360 . 1 . 1 90 90 SER CB C 13 62.994 0.042 . 1 . . . . . 90 SER CB . 50300 1
361 . 1 . 1 90 90 SER N N 15 112.406 0.014 . 1 . . . . . 90 SER N . 50300 1
362 . 1 . 1 91 91 LEU H H 1 7.283 0.003 . 1 . . . . . 91 LEU H . 50300 1
363 . 1 . 1 91 91 LEU C C 13 178.711 0.000 . 1 . . . . . 91 LEU C . 50300 1
364 . 1 . 1 91 91 LEU CA C 13 57.495 0.050 . 1 . . . . . 91 LEU CA . 50300 1
365 . 1 . 1 91 91 LEU CB C 13 42.395 0.028 . 1 . . . . . 91 LEU CB . 50300 1
366 . 1 . 1 91 91 LEU N N 15 122.930 0.021 . 1 . . . . . 91 LEU N . 50300 1
367 . 1 . 1 92 92 LYS H H 1 8.084 0.003 . 1 . . . . . 92 LYS H . 50300 1
368 . 1 . 1 92 92 LYS C C 13 178.199 0.000 . 1 . . . . . 92 LYS C . 50300 1
369 . 1 . 1 92 92 LYS CA C 13 59.246 0.007 . 1 . . . . . 92 LYS CA . 50300 1
370 . 1 . 1 92 92 LYS CB C 13 31.601 0.003 . 1 . . . . . 92 LYS CB . 50300 1
371 . 1 . 1 92 92 LYS N N 15 118.773 0.024 . 1 . . . . . 92 LYS N . 50300 1
372 . 1 . 1 93 93 ASN H H 1 7.692 0.003 . 1 . . . . . 93 ASN H . 50300 1
373 . 1 . 1 93 93 ASN C C 13 176.554 0.000 . 1 . . . . . 93 ASN C . 50300 1
374 . 1 . 1 93 93 ASN CA C 13 55.010 0.031 . 1 . . . . . 93 ASN CA . 50300 1
375 . 1 . 1 93 93 ASN CB C 13 38.569 0.028 . 1 . . . . . 93 ASN CB . 50300 1
376 . 1 . 1 93 93 ASN N N 15 117.057 0.016 . 1 . . . . . 93 ASN N . 50300 1
377 . 1 . 1 94 94 ASP H H 1 8.053 0.004 . 1 . . . . . 94 ASP H . 50300 1
378 . 1 . 1 94 94 ASP C C 13 177.282 0.000 . 1 . . . . . 94 ASP C . 50300 1
379 . 1 . 1 94 94 ASP CA C 13 56.179 0.031 . 1 . . . . . 94 ASP CA . 50300 1
380 . 1 . 1 94 94 ASP CB C 13 41.425 0.020 . 1 . . . . . 94 ASP CB . 50300 1
381 . 1 . 1 94 94 ASP N N 15 118.980 0.022 . 1 . . . . . 94 ASP N . 50300 1
382 . 1 . 1 95 95 GLN H H 1 7.833 0.004 . 1 . . . . . 95 GLN H . 50300 1
383 . 1 . 1 95 95 GLN C C 13 176.253 0.000 . 1 . . . . . 95 GLN C . 50300 1
384 . 1 . 1 95 95 GLN CA C 13 54.905 0.011 . 1 . . . . . 95 GLN CA . 50300 1
385 . 1 . 1 95 95 GLN CB C 13 29.368 0.013 . 1 . . . . . 95 GLN CB . 50300 1
386 . 1 . 1 95 95 GLN N N 15 114.443 0.024 . 1 . . . . . 95 GLN N . 50300 1
387 . 1 . 1 96 96 GLY H H 1 7.912 0.004 . 1 . . . . . 96 GLY H . 50300 1
388 . 1 . 1 96 96 GLY C C 13 174.349 0.000 . 1 . . . . . 96 GLY C . 50300 1
389 . 1 . 1 96 96 GLY CA C 13 46.655 0.026 . 1 . . . . . 96 GLY CA . 50300 1
390 . 1 . 1 96 96 GLY N N 15 110.197 0.053 . 1 . . . . . 96 GLY N . 50300 1
391 . 1 . 1 97 97 ILE H H 1 7.470 0.002 . 1 . . . . . 97 ILE H . 50300 1
392 . 1 . 1 97 97 ILE C C 13 175.313 0.000 . 1 . . . . . 97 ILE C . 50300 1
393 . 1 . 1 97 97 ILE CA C 13 60.819 0.000 . 1 . . . . . 97 ILE CA . 50300 1
394 . 1 . 1 97 97 ILE CB C 13 39.562 0.000 . 1 . . . . . 97 ILE CB . 50300 1
395 . 1 . 1 97 97 ILE N N 15 117.194 0.026 . 1 . . . . . 97 ILE N . 50300 1
396 . 1 . 1 98 98 LEU C C 13 177.287 0.000 . 1 . . . . . 98 LEU C . 50300 1
397 . 1 . 1 98 98 LEU CA C 13 55.509 0.000 . 1 . . . . . 98 LEU CA . 50300 1
398 . 1 . 1 98 98 LEU CB C 13 42.236 0.062 . 1 . . . . . 98 LEU CB . 50300 1
399 . 1 . 1 99 99 VAL H H 1 7.432 0.003 . 1 . . . . . 99 VAL H . 50300 1
400 . 1 . 1 99 99 VAL C C 13 173.913 0.000 . 1 . . . . . 99 VAL C . 50300 1
401 . 1 . 1 99 99 VAL CA C 13 60.247 0.024 . 1 . . . . . 99 VAL CA . 50300 1
402 . 1 . 1 99 99 VAL CB C 13 34.140 0.010 . 1 . . . . . 99 VAL CB . 50300 1
403 . 1 . 1 99 99 VAL N N 15 115.304 0.013 . 1 . . . . . 99 VAL N . 50300 1
404 . 1 . 1 100 100 ASP H H 1 7.933 0.003 . 1 . . . . . 100 ASP H . 50300 1
405 . 1 . 1 100 100 ASP C C 13 175.807 0.000 . 1 . . . . . 100 ASP C . 50300 1
406 . 1 . 1 100 100 ASP CA C 13 52.570 0.006 . 1 . . . . . 100 ASP CA . 50300 1
407 . 1 . 1 100 100 ASP CB C 13 42.161 0.040 . 1 . . . . . 100 ASP CB . 50300 1
408 . 1 . 1 100 100 ASP N N 15 118.472 0.009 . 1 . . . . . 100 ASP N . 50300 1
409 . 1 . 1 101 101 PHE H H 1 8.790 0.003 . 1 . . . . . 101 PHE H . 50300 1
410 . 1 . 1 101 101 PHE C C 13 177.838 0.000 . 1 . . . . . 101 PHE C . 50300 1
411 . 1 . 1 101 101 PHE CA C 13 61.659 0.012 . 1 . . . . . 101 PHE CA . 50300 1
412 . 1 . 1 101 101 PHE CB C 13 39.094 0.046 . 1 . . . . . 101 PHE CB . 50300 1
413 . 1 . 1 101 101 PHE N N 15 120.795 0.026 . 1 . . . . . 101 PHE N . 50300 1
414 . 1 . 1 102 102 ALA H H 1 8.407 0.003 . 1 . . . . . 102 ALA H . 50300 1
415 . 1 . 1 102 102 ALA C C 13 180.086 0.000 . 1 . . . . . 102 ALA C . 50300 1
416 . 1 . 1 102 102 ALA CA C 13 54.625 0.006 . 1 . . . . . 102 ALA CA . 50300 1
417 . 1 . 1 102 102 ALA CB C 13 18.259 0.012 . 1 . . . . . 102 ALA CB . 50300 1
418 . 1 . 1 102 102 ALA N N 15 118.884 0.016 . 1 . . . . . 102 ALA N . 50300 1
419 . 1 . 1 103 103 SER H H 1 7.825 0.003 . 1 . . . . . 103 SER H . 50300 1
420 . 1 . 1 103 103 SER C C 13 174.777 0.000 . 1 . . . . . 103 SER C . 50300 1
421 . 1 . 1 103 103 SER CA C 13 59.318 0.016 . 1 . . . . . 103 SER CA . 50300 1
422 . 1 . 1 103 103 SER CB C 13 63.773 0.005 . 1 . . . . . 103 SER CB . 50300 1
423 . 1 . 1 103 103 SER N N 15 111.688 0.019 . 1 . . . . . 103 SER N . 50300 1
424 . 1 . 1 104 104 PHE H H 1 7.789 0.002 . 1 . . . . . 104 PHE H . 50300 1
425 . 1 . 1 104 104 PHE CA C 13 61.217 0.000 . 1 . . . . . 104 PHE CA . 50300 1
426 . 1 . 1 104 104 PHE CB C 13 37.200 0.000 . 1 . . . . . 104 PHE CB . 50300 1
427 . 1 . 1 104 104 PHE N N 15 123.326 0.020 . 1 . . . . . 104 PHE N . 50300 1
428 . 1 . 1 105 105 PRO C C 13 177.626 0.000 . 1 . . . . . 105 PRO C . 50300 1
429 . 1 . 1 105 105 PRO CA C 13 66.441 0.020 . 1 . . . . . 105 PRO CA . 50300 1
430 . 1 . 1 105 105 PRO CB C 13 29.846 0.014 . 1 . . . . . 105 PRO CB . 50300 1
431 . 1 . 1 106 106 GLY H H 1 8.050 0.004 . 1 . . . . . 106 GLY H . 50300 1
432 . 1 . 1 106 106 GLY C C 13 176.580 0.000 . 1 . . . . . 106 GLY C . 50300 1
433 . 1 . 1 106 106 GLY CA C 13 46.825 0.027 . 1 . . . . . 106 GLY CA . 50300 1
434 . 1 . 1 106 106 GLY N N 15 103.462 0.015 . 1 . . . . . 106 GLY N . 50300 1
435 . 1 . 1 107 107 LYS H H 1 7.744 0.003 . 1 . . . . . 107 LYS H . 50300 1
436 . 1 . 1 107 107 LYS C C 13 178.642 0.000 . 1 . . . . . 107 LYS C . 50300 1
437 . 1 . 1 107 107 LYS CA C 13 58.294 0.013 . 1 . . . . . 107 LYS CA . 50300 1
438 . 1 . 1 107 107 LYS CB C 13 31.602 0.034 . 1 . . . . . 107 LYS CB . 50300 1
439 . 1 . 1 107 107 LYS N N 15 123.036 0.022 . 1 . . . . . 107 LYS N . 50300 1
440 . 1 . 1 108 108 ILE H H 1 7.768 0.008 . 1 . . . . . 108 ILE H . 50300 1
441 . 1 . 1 108 108 ILE C C 13 177.106 0.000 . 1 . . . . . 108 ILE C . 50300 1
442 . 1 . 1 108 108 ILE CA C 13 65.191 0.044 . 1 . . . . . 108 ILE CA . 50300 1
443 . 1 . 1 108 108 ILE CB C 13 37.273 0.053 . 1 . . . . . 108 ILE CB . 50300 1
444 . 1 . 1 108 108 ILE N N 15 118.431 0.045 . 1 . . . . . 108 ILE N . 50300 1
445 . 1 . 1 109 109 ILE H H 1 8.423 0.002 . 1 . . . . . 109 ILE H . 50300 1
446 . 1 . 1 109 109 ILE C C 13 176.846 0.000 . 1 . . . . . 109 ILE C . 50300 1
447 . 1 . 1 109 109 ILE CA C 13 66.593 0.024 . 1 . . . . . 109 ILE CA . 50300 1
448 . 1 . 1 109 109 ILE CB C 13 37.983 0.070 . 1 . . . . . 109 ILE CB . 50300 1
449 . 1 . 1 109 109 ILE N N 15 120.566 0.027 . 1 . . . . . 109 ILE N . 50300 1
450 . 1 . 1 110 110 SER H H 1 7.853 0.004 . 1 . . . . . 110 SER H . 50300 1
451 . 1 . 1 110 110 SER C C 13 177.380 0.000 . 1 . . . . . 110 SER C . 50300 1
452 . 1 . 1 110 110 SER CA C 13 61.604 0.027 . 1 . . . . . 110 SER CA . 50300 1
453 . 1 . 1 110 110 SER CB C 13 62.674 0.116 . 1 . . . . . 110 SER CB . 50300 1
454 . 1 . 1 110 110 SER N N 15 113.519 0.006 . 1 . . . . . 110 SER N . 50300 1
455 . 1 . 1 111 111 LEU H H 1 7.405 0.005 . 1 . . . . . 111 LEU H . 50300 1
456 . 1 . 1 111 111 LEU C C 13 179.336 0.000 . 1 . . . . . 111 LEU C . 50300 1
457 . 1 . 1 111 111 LEU CA C 13 57.669 0.013 . 1 . . . . . 111 LEU CA . 50300 1
458 . 1 . 1 111 111 LEU CB C 13 42.825 0.099 . 1 . . . . . 111 LEU CB . 50300 1
459 . 1 . 1 111 111 LEU N N 15 120.789 0.017 . 1 . . . . . 111 LEU N . 50300 1
460 . 1 . 1 112 112 LEU H H 1 8.629 0.007 . 1 . . . . . 112 LEU H . 50300 1
461 . 1 . 1 112 112 LEU C C 13 180.077 0.000 . 1 . . . . . 112 LEU C . 50300 1
462 . 1 . 1 112 112 LEU CA C 13 58.720 0.113 . 1 . . . . . 112 LEU CA . 50300 1
463 . 1 . 1 112 112 LEU CB C 13 40.757 0.030 . 1 . . . . . 112 LEU CB . 50300 1
464 . 1 . 1 112 112 LEU N N 15 121.933 0.041 . 1 . . . . . 112 LEU N . 50300 1
465 . 1 . 1 113 113 GLU H H 1 8.596 0.005 . 1 . . . . . 113 GLU H . 50300 1
466 . 1 . 1 113 113 GLU C C 13 179.528 0.000 . 1 . . . . . 113 GLU C . 50300 1
467 . 1 . 1 113 113 GLU CA C 13 60.329 0.009 . 1 . . . . . 113 GLU CA . 50300 1
468 . 1 . 1 113 113 GLU CB C 13 29.255 0.032 . 1 . . . . . 113 GLU CB . 50300 1
469 . 1 . 1 113 113 GLU N N 15 118.047 0.016 . 1 . . . . . 113 GLU N . 50300 1
470 . 1 . 1 114 114 LYS H H 1 7.313 0.003 . 1 . . . . . 114 LYS H . 50300 1
471 . 1 . 1 114 114 LYS C C 13 180.002 0.000 . 1 . . . . . 114 LYS C . 50300 1
472 . 1 . 1 114 114 LYS CA C 13 59.835 0.048 . 1 . . . . . 114 LYS CA . 50300 1
473 . 1 . 1 114 114 LYS CB C 13 31.960 0.070 . 1 . . . . . 114 LYS CB . 50300 1
474 . 1 . 1 114 114 LYS N N 15 117.609 0.021 . 1 . . . . . 114 LYS N . 50300 1
475 . 1 . 1 115 115 CYS H H 1 7.718 0.003 . 1 . . . . . 115 CYS H . 50300 1
476 . 1 . 1 115 115 CYS C C 13 177.687 0.000 . 1 . . . . . 115 CYS C . 50300 1
477 . 1 . 1 115 115 CYS CA C 13 63.301 0.042 . 1 . . . . . 115 CYS CA . 50300 1
478 . 1 . 1 115 115 CYS CB C 13 26.580 0.031 . 1 . . . . . 115 CYS CB . 50300 1
479 . 1 . 1 115 115 CYS N N 15 118.433 0.018 . 1 . . . . . 115 CYS N . 50300 1
480 . 1 . 1 116 116 ILE H H 1 8.113 0.003 . 1 . . . . . 116 ILE H . 50300 1
481 . 1 . 1 116 116 ILE C C 13 177.263 0.000 . 1 . . . . . 116 ILE C . 50300 1
482 . 1 . 1 116 116 ILE CA C 13 65.985 0.025 . 1 . . . . . 116 ILE CA . 50300 1
483 . 1 . 1 116 116 ILE CB C 13 38.767 0.002 . 1 . . . . . 116 ILE CB . 50300 1
484 . 1 . 1 116 116 ILE N N 15 120.851 0.025 . 1 . . . . . 116 ILE N . 50300 1
485 . 1 . 1 117 117 LEU H H 1 7.489 0.002 . 1 . . . . . 117 LEU H . 50300 1
486 . 1 . 1 117 117 LEU C C 13 177.506 0.000 . 1 . . . . . 117 LEU C . 50300 1
487 . 1 . 1 117 117 LEU CA C 13 55.518 0.032 . 1 . . . . . 117 LEU CA . 50300 1
488 . 1 . 1 117 117 LEU CB C 13 43.186 0.034 . 1 . . . . . 117 LEU CB . 50300 1
489 . 1 . 1 117 117 LEU N N 15 116.590 0.027 . 1 . . . . . 117 LEU N . 50300 1
490 . 1 . 1 118 118 ALA H H 1 7.159 0.002 . 1 . . . . . 118 ALA H . 50300 1
491 . 1 . 1 118 118 ALA C C 13 177.389 0.000 . 1 . . . . . 118 ALA C . 50300 1
492 . 1 . 1 118 118 ALA CA C 13 54.109 0.072 . 1 . . . . . 118 ALA CA . 50300 1
493 . 1 . 1 118 118 ALA CB C 13 20.609 0.006 . 1 . . . . . 118 ALA CB . 50300 1
494 . 1 . 1 118 118 ALA N N 15 122.474 0.014 . 1 . . . . . 118 ALA N . 50300 1
495 . 1 . 1 119 119 GLN H H 1 8.725 0.004 . 1 . . . . . 119 GLN H . 50300 1
496 . 1 . 1 119 119 GLN CA C 13 52.686 0.000 . 1 . . . . . 119 GLN CA . 50300 1
497 . 1 . 1 119 119 GLN N N 15 122.656 0.065 . 1 . . . . . 119 GLN N . 50300 1
498 . 1 . 1 120 120 PRO C C 13 177.805 0.000 . 1 . . . . . 120 PRO C . 50300 1
499 . 1 . 1 120 120 PRO CA C 13 62.697 0.008 . 1 . . . . . 120 PRO CA . 50300 1
500 . 1 . 1 120 120 PRO CB C 13 31.973 0.044 . 1 . . . . . 120 PRO CB . 50300 1
501 . 1 . 1 121 121 GLY H H 1 8.231 0.003 . 1 . . . . . 121 GLY H . 50300 1
502 . 1 . 1 121 121 GLY C C 13 174.657 0.000 . 1 . . . . . 121 GLY C . 50300 1
503 . 1 . 1 121 121 GLY CA C 13 44.977 0.037 . 1 . . . . . 121 GLY CA . 50300 1
504 . 1 . 1 121 121 GLY N N 15 110.745 0.012 . 1 . . . . . 121 GLY N . 50300 1
505 . 1 . 1 122 122 ASP H H 1 7.706 0.002 . 1 . . . . . 122 ASP H . 50300 1
506 . 1 . 1 122 122 ASP C C 13 175.950 0.000 . 1 . . . . . 122 ASP C . 50300 1
507 . 1 . 1 122 122 ASP CA C 13 55.243 0.072 . 1 . . . . . 122 ASP CA . 50300 1
508 . 1 . 1 122 122 ASP CB C 13 41.542 0.038 . 1 . . . . . 122 ASP CB . 50300 1
509 . 1 . 1 122 122 ASP N N 15 122.048 0.017 . 1 . . . . . 122 ASP N . 50300 1
510 . 1 . 1 123 123 SER H H 1 8.323 0.002 . 1 . . . . . 123 SER H . 50300 1
511 . 1 . 1 123 123 SER CB C 13 64.676 0.000 . 1 . . . . . 123 SER CB . 50300 1
512 . 1 . 1 123 123 SER N N 15 114.775 0.013 . 1 . . . . . 123 SER N . 50300 1
513 . 1 . 1 124 124 PRO C C 13 175.382 0.000 . 1 . . . . . 124 PRO C . 50300 1
514 . 1 . 1 124 124 PRO CA C 13 63.358 0.029 . 1 . . . . . 124 PRO CA . 50300 1
515 . 1 . 1 124 124 PRO CB C 13 35.709 0.035 . 1 . . . . . 124 PRO CB . 50300 1
516 . 1 . 1 125 125 ARG H H 1 8.440 0.004 . 1 . . . . . 125 ARG H . 50300 1
517 . 1 . 1 125 125 ARG C C 13 173.839 0.000 . 1 . . . . . 125 ARG C . 50300 1
518 . 1 . 1 125 125 ARG CA C 13 54.595 0.018 . 1 . . . . . 125 ARG CA . 50300 1
519 . 1 . 1 125 125 ARG CB C 13 33.086 0.027 . 1 . . . . . 125 ARG CB . 50300 1
520 . 1 . 1 125 125 ARG N N 15 117.955 0.016 . 1 . . . . . 125 ARG N . 50300 1
521 . 1 . 1 126 126 PHE H H 1 8.076 0.003 . 1 . . . . . 126 PHE H . 50300 1
522 . 1 . 1 126 126 PHE C C 13 174.902 0.000 . 1 . . . . . 126 PHE C . 50300 1
523 . 1 . 1 126 126 PHE CA C 13 57.426 0.015 . 1 . . . . . 126 PHE CA . 50300 1
524 . 1 . 1 126 126 PHE CB C 13 41.810 0.010 . 1 . . . . . 126 PHE CB . 50300 1
525 . 1 . 1 126 126 PHE N N 15 123.272 0.029 . 1 . . . . . 126 PHE N . 50300 1
526 . 1 . 1 127 127 GLN H H 1 9.046 0.003 . 1 . . . . . 127 GLN H . 50300 1
527 . 1 . 1 127 127 GLN C C 13 172.041 0.000 . 1 . . . . . 127 GLN C . 50300 1
528 . 1 . 1 127 127 GLN CA C 13 54.678 0.034 . 1 . . . . . 127 GLN CA . 50300 1
529 . 1 . 1 127 127 GLN CB C 13 33.622 0.012 . 1 . . . . . 127 GLN CB . 50300 1
530 . 1 . 1 127 127 GLN N N 15 120.183 0.036 . 1 . . . . . 127 GLN N . 50300 1
531 . 1 . 1 128 128 ALA H H 1 9.781 0.003 . 1 . . . . . 128 ALA H . 50300 1
532 . 1 . 1 128 128 ALA C C 13 176.359 0.000 . 1 . . . . . 128 ALA C . 50300 1
533 . 1 . 1 128 128 ALA CA C 13 50.401 0.025 . 1 . . . . . 128 ALA CA . 50300 1
534 . 1 . 1 128 128 ALA CB C 13 20.146 0.008 . 1 . . . . . 128 ALA CB . 50300 1
535 . 1 . 1 128 128 ALA N N 15 129.090 0.015 . 1 . . . . . 128 ALA N . 50300 1
536 . 1 . 1 129 129 VAL H H 1 9.050 0.003 . 1 . . . . . 129 VAL H . 50300 1
537 . 1 . 1 129 129 VAL C C 13 173.657 0.000 . 1 . . . . . 129 VAL C . 50300 1
538 . 1 . 1 129 129 VAL CA C 13 60.659 0.054 . 1 . . . . . 129 VAL CA . 50300 1
539 . 1 . 1 129 129 VAL CB C 13 35.666 0.011 . 1 . . . . . 129 VAL CB . 50300 1
540 . 1 . 1 129 129 VAL N N 15 123.145 0.026 . 1 . . . . . 129 VAL N . 50300 1
541 . 1 . 1 130 130 LEU H H 1 9.085 0.004 . 1 . . . . . 130 LEU H . 50300 1
542 . 1 . 1 130 130 LEU C C 13 173.946 0.000 . 1 . . . . . 130 LEU C . 50300 1
543 . 1 . 1 130 130 LEU CA C 13 53.127 0.021 . 1 . . . . . 130 LEU CA . 50300 1
544 . 1 . 1 130 130 LEU CB C 13 47.609 0.046 . 1 . . . . . 130 LEU CB . 50300 1
545 . 1 . 1 130 130 LEU N N 15 129.264 0.016 . 1 . . . . . 130 LEU N . 50300 1
546 . 1 . 1 131 131 THR H H 1 9.179 0.005 . 1 . . . . . 131 THR H . 50300 1
547 . 1 . 1 131 131 THR C C 13 174.447 0.000 . 1 . . . . . 131 THR C . 50300 1
548 . 1 . 1 131 131 THR CA C 13 61.718 0.017 . 1 . . . . . 131 THR CA . 50300 1
549 . 1 . 1 131 131 THR CB C 13 69.433 0.028 . 1 . . . . . 131 THR CB . 50300 1
550 . 1 . 1 131 131 THR N N 15 123.887 0.018 . 1 . . . . . 131 THR N . 50300 1
551 . 1 . 1 132 132 ILE H H 1 8.970 0.004 . 1 . . . . . 132 ILE H . 50300 1
552 . 1 . 1 132 132 ILE C C 13 175.679 0.000 . 1 . . . . . 132 ILE C . 50300 1
553 . 1 . 1 132 132 ILE CA C 13 61.432 0.066 . 1 . . . . . 132 ILE CA . 50300 1
554 . 1 . 1 132 132 ILE CB C 13 39.059 0.208 . 1 . . . . . 132 ILE CB . 50300 1
555 . 1 . 1 132 132 ILE N N 15 128.976 0.012 . 1 . . . . . 132 ILE N . 50300 1
556 . 1 . 1 133 133 ARG H H 1 8.501 0.004 . 1 . . . . . 133 ARG H . 50300 1
557 . 1 . 1 133 133 ARG C C 13 175.882 0.000 . 1 . . . . . 133 ARG C . 50300 1
558 . 1 . 1 133 133 ARG CA C 13 55.177 0.008 . 1 . . . . . 133 ARG CA . 50300 1
559 . 1 . 1 133 133 ARG CB C 13 32.214 0.012 . 1 . . . . . 133 ARG CB . 50300 1
560 . 1 . 1 133 133 ARG N N 15 128.148 0.034 . 1 . . . . . 133 ARG N . 50300 1
561 . 1 . 1 134 134 GLY H H 1 8.812 0.007 . 1 . . . . . 134 GLY H . 50300 1
562 . 1 . 1 134 134 GLY C C 13 175.222 0.000 . 1 . . . . . 134 GLY C . 50300 1
563 . 1 . 1 134 134 GLY CA C 13 47.279 0.009 . 1 . . . . . 134 GLY CA . 50300 1
564 . 1 . 1 134 134 GLY N N 15 112.483 0.016 . 1 . . . . . 134 GLY N . 50300 1
565 . 1 . 1 135 135 GLY H H 1 8.773 0.015 . 1 . . . . . 135 GLY H . 50300 1
566 . 1 . 1 135 135 GLY C C 13 173.107 0.000 . 1 . . . . . 135 GLY C . 50300 1
567 . 1 . 1 135 135 GLY CA C 13 45.760 0.042 . 1 . . . . . 135 GLY CA . 50300 1
568 . 1 . 1 135 135 GLY N N 15 112.406 0.040 . 1 . . . . . 135 GLY N . 50300 1
569 . 1 . 1 136 136 GLU H H 1 7.681 0.002 . 1 . . . . . 136 GLU H . 50300 1
570 . 1 . 1 136 136 GLU CA C 13 55.581 0.000 . 1 . . . . . 136 GLU CA . 50300 1
571 . 1 . 1 136 136 GLU CB C 13 32.938 0.000 . 1 . . . . . 136 GLU CB . 50300 1
572 . 1 . 1 136 136 GLU N N 15 118.263 0.016 . 1 . . . . . 136 GLU N . 50300 1
573 . 1 . 1 137 137 SER C C 13 173.445 0.000 . 1 . . . . . 137 SER C . 50300 1
574 . 1 . 1 137 137 SER CB C 13 65.188 0.000 . 1 . . . . . 137 SER CB . 50300 1
575 . 1 . 1 138 138 VAL H H 1 8.924 0.004 . 1 . . . . . 138 VAL H . 50300 1
576 . 1 . 1 138 138 VAL C C 13 174.843 0.000 . 1 . . . . . 138 VAL C . 50300 1
577 . 1 . 1 138 138 VAL CA C 13 62.438 0.044 . 1 . . . . . 138 VAL CA . 50300 1
578 . 1 . 1 138 138 VAL CB C 13 34.218 0.000 . 1 . . . . . 138 VAL CB . 50300 1
579 . 1 . 1 138 138 VAL N N 15 122.884 0.015 . 1 . . . . . 138 VAL N . 50300 1
580 . 1 . 1 139 139 PHE H H 1 10.021 0.006 . 1 . . . . . 139 PHE H . 50300 1
581 . 1 . 1 139 139 PHE C C 13 173.001 0.000 . 1 . . . . . 139 PHE C . 50300 1
582 . 1 . 1 139 139 PHE CA C 13 55.663 0.035 . 1 . . . . . 139 PHE CA . 50300 1
583 . 1 . 1 139 139 PHE CB C 13 43.475 0.046 . 1 . . . . . 139 PHE CB . 50300 1
584 . 1 . 1 139 139 PHE N N 15 108.905 0.017 . 1 . . . . . 139 PHE N . 50300 1
585 . 1 . 1 140 140 LYS H H 1 8.954 0.003 . 1 . . . . . 140 LYS H . 50300 1
586 . 1 . 1 140 140 LYS C C 13 174.534 0.000 . 1 . . . . . 140 LYS C . 50300 1
587 . 1 . 1 140 140 LYS CA C 13 53.922 0.048 . 1 . . . . . 140 LYS CA . 50300 1
588 . 1 . 1 140 140 LYS CB C 13 37.720 0.035 . 1 . . . . . 140 LYS CB . 50300 1
589 . 1 . 1 140 140 LYS N N 15 124.924 0.012 . 1 . . . . . 140 LYS N . 50300 1
590 . 1 . 1 141 141 ILE H H 1 7.593 0.004 . 1 . . . . . 141 ILE H . 50300 1
591 . 1 . 1 141 141 ILE C C 13 175.396 0.000 . 1 . . . . . 141 ILE C . 50300 1
592 . 1 . 1 141 141 ILE CA C 13 60.792 0.021 . 1 . . . . . 141 ILE CA . 50300 1
593 . 1 . 1 141 141 ILE CB C 13 39.945 0.028 . 1 . . . . . 141 ILE CB . 50300 1
594 . 1 . 1 141 141 ILE N N 15 117.862 0.028 . 1 . . . . . 141 ILE N . 50300 1
595 . 1 . 1 142 142 VAL H H 1 9.304 0.004 . 1 . . . . . 142 VAL H . 50300 1
596 . 1 . 1 142 142 VAL C C 13 172.864 0.000 . 1 . . . . . 142 VAL C . 50300 1
597 . 1 . 1 142 142 VAL CA C 13 59.030 0.033 . 1 . . . . . 142 VAL CA . 50300 1
598 . 1 . 1 142 142 VAL CB C 13 35.167 0.033 . 1 . . . . . 142 VAL CB . 50300 1
599 . 1 . 1 142 142 VAL N N 15 123.860 0.010 . 1 . . . . . 142 VAL N . 50300 1
600 . 1 . 1 143 143 GLU H H 1 8.724 0.005 . 1 . . . . . 143 GLU H . 50300 1
601 . 1 . 1 143 143 GLU C C 13 175.110 0.000 . 1 . . . . . 143 GLU C . 50300 1
602 . 1 . 1 143 143 GLU CA C 13 53.832 0.028 . 1 . . . . . 143 GLU CA . 50300 1
603 . 1 . 1 143 143 GLU CB C 13 32.194 0.047 . 1 . . . . . 143 GLU CB . 50300 1
604 . 1 . 1 143 143 GLU N N 15 124.851 0.027 . 1 . . . . . 143 GLU N . 50300 1
605 . 1 . 1 144 144 ILE H H 1 9.168 0.003 . 1 . . . . . 144 ILE H . 50300 1
606 . 1 . 1 144 144 ILE C C 13 175.582 0.000 . 1 . . . . . 144 ILE C . 50300 1
607 . 1 . 1 144 144 ILE CA C 13 60.651 0.031 . 1 . . . . . 144 ILE CA . 50300 1
608 . 1 . 1 144 144 ILE CB C 13 39.269 0.062 . 1 . . . . . 144 ILE CB . 50300 1
609 . 1 . 1 144 144 ILE N N 15 128.103 0.015 . 1 . . . . . 144 ILE N . 50300 1
610 . 1 . 1 145 145 ASN H H 1 8.469 0.004 . 1 . . . . . 145 ASN H . 50300 1
611 . 1 . 1 145 145 ASN C C 13 174.472 0.000 . 1 . . . . . 145 ASN C . 50300 1
612 . 1 . 1 145 145 ASN CA C 13 52.198 0.047 . 1 . . . . . 145 ASN CA . 50300 1
613 . 1 . 1 145 145 ASN CB C 13 40.522 0.031 . 1 . . . . . 145 ASN CB . 50300 1
614 . 1 . 1 145 145 ASN N N 15 126.184 0.018 . 1 . . . . . 145 ASN N . 50300 1
615 . 1 . 1 146 146 ASP H H 1 8.890 0.004 . 1 . . . . . 146 ASP H . 50300 1
616 . 1 . 1 146 146 ASP C C 13 175.378 0.000 . 1 . . . . . 146 ASP C . 50300 1
617 . 1 . 1 146 146 ASP CA C 13 56.642 0.031 . 1 . . . . . 146 ASP CA . 50300 1
618 . 1 . 1 146 146 ASP CB C 13 39.601 0.013 . 1 . . . . . 146 ASP CB . 50300 1
619 . 1 . 1 146 146 ASP N N 15 123.103 0.044 . 1 . . . . . 146 ASP N . 50300 1
620 . 1 . 1 147 147 GLU H H 1 8.579 0.002 . 1 . . . . . 147 GLU H . 50300 1
621 . 1 . 1 147 147 GLU C C 13 175.897 0.000 . 1 . . . . . 147 GLU C . 50300 1
622 . 1 . 1 147 147 GLU CA C 13 57.416 0.030 . 1 . . . . . 147 GLU CA . 50300 1
623 . 1 . 1 147 147 GLU CB C 13 29.822 0.023 . 1 . . . . . 147 GLU CB . 50300 1
624 . 1 . 1 147 147 GLU N N 15 116.642 0.010 . 1 . . . . . 147 GLU N . 50300 1
625 . 1 . 1 148 148 LYS H H 1 8.093 0.004 . 1 . . . . . 148 LYS H . 50300 1
626 . 1 . 1 148 148 LYS C C 13 174.833 0.000 . 1 . . . . . 148 LYS C . 50300 1
627 . 1 . 1 148 148 LYS CA C 13 55.753 0.002 . 1 . . . . . 148 LYS CA . 50300 1
628 . 1 . 1 148 148 LYS CB C 13 34.231 0.019 . 1 . . . . . 148 LYS CB . 50300 1
629 . 1 . 1 148 148 LYS N N 15 120.882 0.028 . 1 . . . . . 148 LYS N . 50300 1
630 . 1 . 1 149 149 GLN H H 1 8.379 0.003 . 1 . . . . . 149 GLN H . 50300 1
631 . 1 . 1 149 149 GLN C C 13 175.014 0.000 . 1 . . . . . 149 GLN C . 50300 1
632 . 1 . 1 149 149 GLN CA C 13 54.713 0.015 . 1 . . . . . 149 GLN CA . 50300 1
633 . 1 . 1 149 149 GLN CB C 13 30.106 0.019 . 1 . . . . . 149 GLN CB . 50300 1
634 . 1 . 1 149 149 GLN N N 15 120.113 0.020 . 1 . . . . . 149 GLN N . 50300 1
635 . 1 . 1 150 150 LEU H H 1 9.011 0.004 . 1 . . . . . 150 LEU H . 50300 1
636 . 1 . 1 150 150 LEU CA C 13 51.902 0.000 . 1 . . . . . 150 LEU CA . 50300 1
637 . 1 . 1 150 150 LEU CB C 13 44.351 0.000 . 1 . . . . . 150 LEU CB . 50300 1
638 . 1 . 1 150 150 LEU N N 15 126.205 0.017 . 1 . . . . . 150 LEU N . 50300 1
639 . 1 . 1 151 151 PRO C C 13 176.800 0.000 . 1 . . . . . 151 PRO C . 50300 1
640 . 1 . 1 151 151 PRO CA C 13 62.503 0.031 . 1 . . . . . 151 PRO CA . 50300 1
641 . 1 . 1 151 151 PRO CB C 13 31.150 0.021 . 1 . . . . . 151 PRO CB . 50300 1
642 . 1 . 1 152 152 HIS H H 1 9.258 0.004 . 1 . . . . . 152 HIS H . 50300 1
643 . 1 . 1 152 152 HIS C C 13 175.697 0.000 . 1 . . . . . 152 HIS C . 50300 1
644 . 1 . 1 152 152 HIS CA C 13 59.313 0.015 . 1 . . . . . 152 HIS CA . 50300 1
645 . 1 . 1 152 152 HIS CB C 13 34.790 0.031 . 1 . . . . . 152 HIS CB . 50300 1
646 . 1 . 1 152 152 HIS N N 15 124.655 0.019 . 1 . . . . . 152 HIS N . 50300 1
647 . 1 . 1 153 153 ILE H H 1 7.304 0.003 . 1 . . . . . 153 ILE H . 50300 1
648 . 1 . 1 153 153 ILE C C 13 173.579 0.000 . 1 . . . . . 153 ILE C . 50300 1
649 . 1 . 1 153 153 ILE CA C 13 58.989 0.057 . 1 . . . . . 153 ILE CA . 50300 1
650 . 1 . 1 153 153 ILE CB C 13 41.660 0.050 . 1 . . . . . 153 ILE CB . 50300 1
651 . 1 . 1 153 153 ILE N N 15 114.170 0.030 . 1 . . . . . 153 ILE N . 50300 1
652 . 1 . 1 154 154 THR H H 1 8.555 0.003 . 1 . . . . . 154 THR H . 50300 1
653 . 1 . 1 154 154 THR C C 13 173.844 0.000 . 1 . . . . . 154 THR C . 50300 1
654 . 1 . 1 154 154 THR CA C 13 62.484 0.028 . 1 . . . . . 154 THR CA . 50300 1
655 . 1 . 1 154 154 THR CB C 13 71.559 0.021 . 1 . . . . . 154 THR CB . 50300 1
656 . 1 . 1 154 154 THR N N 15 121.997 0.032 . 1 . . . . . 154 THR N . 50300 1
657 . 1 . 1 155 155 LEU H H 1 9.928 0.003 . 1 . . . . . 155 LEU H . 50300 1
658 . 1 . 1 155 155 LEU C C 13 174.331 0.000 . 1 . . . . . 155 LEU C . 50300 1
659 . 1 . 1 155 155 LEU CA C 13 53.602 0.105 . 1 . . . . . 155 LEU CA . 50300 1
660 . 1 . 1 155 155 LEU CB C 13 48.231 0.042 . 1 . . . . . 155 LEU CB . 50300 1
661 . 1 . 1 155 155 LEU N N 15 126.893 0.019 . 1 . . . . . 155 LEU N . 50300 1
662 . 1 . 1 156 156 ALA H H 1 8.998 0.004 . 1 . . . . . 156 ALA H . 50300 1
663 . 1 . 1 156 156 ALA CA C 13 51.630 0.000 . 1 . . . . . 156 ALA CA . 50300 1
664 . 1 . 1 156 156 ALA CB C 13 19.459 0.000 . 1 . . . . . 156 ALA CB . 50300 1
665 . 1 . 1 156 156 ALA N N 15 126.970 0.046 . 1 . . . . . 156 ALA N . 50300 1
666 . 1 . 1 159 159 PRO C C 13 177.729 0.000 . 1 . . . . . 159 PRO C . 50300 1
667 . 1 . 1 159 159 PRO CA C 13 64.727 0.000 . 1 . . . . . 159 PRO CA . 50300 1
668 . 1 . 1 159 159 PRO CB C 13 31.794 0.029 . 1 . . . . . 159 PRO CB . 50300 1
669 . 1 . 1 160 160 GLY H H 1 8.441 0.007 . 1 . . . . . 160 GLY H . 50300 1
670 . 1 . 1 160 160 GLY C C 13 172.470 0.000 . 1 . . . . . 160 GLY C . 50300 1
671 . 1 . 1 160 160 GLY CA C 13 44.962 0.047 . 1 . . . . . 160 GLY CA . 50300 1
672 . 1 . 1 160 160 GLY N N 15 107.803 0.020 . 1 . . . . . 160 GLY N . 50300 1
673 . 1 . 1 161 161 ASN H H 1 7.886 0.003 . 1 . . . . . 161 ASN H . 50300 1
674 . 1 . 1 161 161 ASN CA C 13 54.589 0.000 . 1 . . . . . 161 ASN CA . 50300 1
675 . 1 . 1 161 161 ASN CB C 13 40.671 0.000 . 1 . . . . . 161 ASN CB . 50300 1
676 . 1 . 1 161 161 ASN N N 15 123.007 0.010 . 1 . . . . . 161 ASN N . 50300 1
stop_
save_