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 50801
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 15N-HSQC
_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 .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 50801 1
2 '3D CBCACONH' . . . 50801 1
3 '3D HNCACB' . . . 50801 1
4 '3D HNCA' . . . 50801 1
5 '3D HNCO' . . . 50801 1
6 '3D HN(CO)CA' . . . 50801 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 . . 50801 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 2 2 PRO C C 13 176.495 0.000 . . . . . . . 24 PRO C . 50801 1
2 . 1 . 1 2 2 PRO CA C 13 62.789 0.000 . . . . . . . 24 PRO CA . 50801 1
3 . 1 . 1 2 2 PRO CB C 13 32.261 0.000 . . . . . . . 24 PRO CB . 50801 1
4 . 1 . 1 3 3 GLU H H 1 8.683 0.000 . . . . . . . 25 GLU H . 50801 1
5 . 1 . 1 3 3 GLU C C 13 176.523 0.000 . . . . . . . 25 GLU C . 50801 1
6 . 1 . 1 3 3 GLU CA C 13 56.697 0.000 . . . . . . . 25 GLU CA . 50801 1
7 . 1 . 1 3 3 GLU CB C 13 29.859 0.000 . . . . . . . 25 GLU CB . 50801 1
8 . 1 . 1 3 3 GLU N N 15 121.332 0.000 . . . . . . . 25 GLU N . 50801 1
9 . 1 . 1 4 4 VAL H H 1 8.367 0.000 . . . . . . . 26 VAL H . 50801 1
10 . 1 . 1 4 4 VAL C C 13 174.906 0.000 . . . . . . . 26 VAL C . 50801 1
11 . 1 . 1 4 4 VAL CA C 13 61.395 0.000 . . . . . . . 26 VAL CA . 50801 1
12 . 1 . 1 4 4 VAL CB C 13 32.614 0.000 . . . . . . . 26 VAL CB . 50801 1
13 . 1 . 1 4 4 VAL N N 15 116.950 0.000 . . . . . . . 26 VAL N . 50801 1
14 . 1 . 1 5 5 SER H H 1 7.819 0.000 . . . . . . . 27 SER H . 50801 1
15 . 1 . 1 5 5 SER C C 13 173.677 0.000 . . . . . . . 27 SER C . 50801 1
16 . 1 . 1 5 5 SER CA C 13 57.563 0.000 . . . . . . . 27 SER CA . 50801 1
17 . 1 . 1 5 5 SER CB C 13 64.342 0.000 . . . . . . . 27 SER CB . 50801 1
18 . 1 . 1 5 5 SER N N 15 116.670 0.000 . . . . . . . 27 SER N . 50801 1
19 . 1 . 1 6 6 ASN H H 1 8.897 0.000 . . . . . . . 28 ASN H . 50801 1
20 . 1 . 1 6 6 ASN CA C 13 51.416 0.000 . . . . . . . 28 ASN CA . 50801 1
21 . 1 . 1 6 6 ASN CB C 13 39.358 0.000 . . . . . . . 28 ASN CB . 50801 1
22 . 1 . 1 6 6 ASN N N 15 121.129 0.000 . . . . . . . 28 ASN N . 50801 1
23 . 1 . 1 7 7 PRO C C 13 177.269 0.000 . . . . . . . 29 PRO C . 50801 1
24 . 1 . 1 7 7 PRO CA C 13 64.030 0.000 . . . . . . . 29 PRO CA . 50801 1
25 . 1 . 1 7 7 PRO CB C 13 32.306 0.000 . . . . . . . 29 PRO CB . 50801 1
26 . 1 . 1 8 8 SER H H 1 8.196 0.000 . . . . . . . 30 SER H . 50801 1
27 . 1 . 1 8 8 SER CA C 13 58.607 0.000 . . . . . . . 30 SER CA . 50801 1
28 . 1 . 1 8 8 SER CB C 13 63.901 0.000 . . . . . . . 30 SER CB . 50801 1
29 . 1 . 1 8 8 SER N N 15 114.048 0.000 . . . . . . . 30 SER N . 50801 1
30 . 1 . 1 9 9 LYS H H 1 7.806 0.000 . . . . . . . 31 LYS H . 50801 1
31 . 1 . 1 9 9 LYS CA C 13 53.699 0.000 . . . . . . . 31 LYS CA . 50801 1
32 . 1 . 1 9 9 LYS CB C 13 33.705 0.000 . . . . . . . 31 LYS CB . 50801 1
33 . 1 . 1 9 9 LYS N N 15 124.737 0.000 . . . . . . . 31 LYS N . 50801 1
34 . 1 . 1 10 10 PRO C C 13 176.375 0.000 . . . . . . . 32 PRO C . 50801 1
35 . 1 . 1 10 10 PRO CA C 13 63.650 0.000 . . . . . . . 32 PRO CA . 50801 1
36 . 1 . 1 10 10 PRO CB C 13 32.398 0.000 . . . . . . . 32 PRO CB . 50801 1
37 . 1 . 1 11 11 GLY H H 1 8.129 0.000 . . . . . . . 33 GLY H . 50801 1
38 . 1 . 1 11 11 GLY C C 13 173.255 0.000 . . . . . . . 33 GLY C . 50801 1
39 . 1 . 1 11 11 GLY CA C 13 44.769 0.000 . . . . . . . 33 GLY CA . 50801 1
40 . 1 . 1 11 11 GLY N N 15 109.427 0.000 . . . . . . . 33 GLY N . 50801 1
41 . 1 . 1 12 12 ARG H H 1 8.332 0.000 . . . . . . . 34 ARG H . 50801 1
42 . 1 . 1 12 12 ARG C C 13 173.996 0.000 . . . . . . . 34 ARG C . 50801 1
43 . 1 . 1 12 12 ARG CA C 13 55.428 0.000 . . . . . . . 34 ARG CA . 50801 1
44 . 1 . 1 12 12 ARG CB C 13 31.963 0.000 . . . . . . . 34 ARG CB . 50801 1
45 . 1 . 1 12 12 ARG N N 15 118.085 0.000 . . . . . . . 34 ARG N . 50801 1
46 . 1 . 1 13 13 LYS H H 1 8.134 0.000 . . . . . . . 35 LYS H . 50801 1
47 . 1 . 1 13 13 LYS C C 13 176.736 0.000 . . . . . . . 35 LYS C . 50801 1
48 . 1 . 1 13 13 LYS CA C 13 55.842 0.000 . . . . . . . 35 LYS CA . 50801 1
49 . 1 . 1 13 13 LYS CB C 13 32.801 0.000 . . . . . . . 35 LYS CB . 50801 1
50 . 1 . 1 13 13 LYS N N 15 119.693 0.000 . . . . . . . 35 LYS N . 50801 1
51 . 1 . 1 14 14 THR H H 1 7.104 0.000 . . . . . . . 36 THR H . 50801 1
52 . 1 . 1 14 14 THR C C 13 175.141 0.000 . . . . . . . 36 THR C . 50801 1
53 . 1 . 1 14 14 THR CA C 13 60.865 0.000 . . . . . . . 36 THR CA . 50801 1
54 . 1 . 1 14 14 THR CB C 13 71.567 0.000 . . . . . . . 36 THR CB . 50801 1
55 . 1 . 1 14 14 THR N N 15 112.800 0.000 . . . . . . . 36 THR N . 50801 1
56 . 1 . 1 15 15 ASN H H 1 9.691 0.000 . . . . . . . 37 ASN H . 50801 1
57 . 1 . 1 15 15 ASN C C 13 178.965 0.000 . . . . . . . 37 ASN C . 50801 1
58 . 1 . 1 15 15 ASN CA C 13 56.754 0.000 . . . . . . . 37 ASN CA . 50801 1
59 . 1 . 1 15 15 ASN CB C 13 37.086 0.000 . . . . . . . 37 ASN CB . 50801 1
60 . 1 . 1 15 15 ASN N N 15 122.498 0.000 . . . . . . . 37 ASN N . 50801 1
61 . 1 . 1 16 16 GLN H H 1 8.361 0.000 . . . . . . . 38 GLN H . 50801 1
62 . 1 . 1 16 16 GLN C C 13 178.762 0.000 . . . . . . . 38 GLN C . 50801 1
63 . 1 . 1 16 16 GLN CA C 13 59.775 0.000 . . . . . . . 38 GLN CA . 50801 1
64 . 1 . 1 16 16 GLN CB C 13 29.663 0.000 . . . . . . . 38 GLN CB . 50801 1
65 . 1 . 1 16 16 GLN N N 15 120.131 0.000 . . . . . . . 38 GLN N . 50801 1
66 . 1 . 1 17 17 LEU H H 1 7.905 0.000 . . . . . . . 39 LEU H . 50801 1
67 . 1 . 1 17 17 LEU CA C 13 58.677 0.000 . . . . . . . 39 LEU CA . 50801 1
68 . 1 . 1 17 17 LEU CB C 13 41.678 0.000 . . . . . . . 39 LEU CB . 50801 1
69 . 1 . 1 17 17 LEU N N 15 121.603 0.000 . . . . . . . 39 LEU N . 50801 1
70 . 1 . 1 18 18 GLN H H 1 8.574 0.000 . . . . . . . 40 GLN H . 50801 1
71 . 1 . 1 18 18 GLN C C 13 177.819 0.000 . . . . . . . 40 GLN C . 50801 1
72 . 1 . 1 18 18 GLN CA C 13 59.636 0.000 . . . . . . . 40 GLN CA . 50801 1
73 . 1 . 1 18 18 GLN CB C 13 28.644 0.000 . . . . . . . 40 GLN CB . 50801 1
74 . 1 . 1 18 18 GLN N N 15 120.786 0.000 . . . . . . . 40 GLN N . 50801 1
75 . 1 . 1 19 19 TYR H H 1 7.808 0.000 . . . . . . . 41 TYR H . 50801 1
76 . 1 . 1 19 19 TYR C C 13 179.112 0.000 . . . . . . . 41 TYR C . 50801 1
77 . 1 . 1 19 19 TYR CA C 13 61.859 0.000 . . . . . . . 41 TYR CA . 50801 1
78 . 1 . 1 19 19 TYR CB C 13 38.112 0.000 . . . . . . . 41 TYR CB . 50801 1
79 . 1 . 1 19 19 TYR N N 15 121.822 0.000 . . . . . . . 41 TYR N . 50801 1
80 . 1 . 1 20 20 MET H H 1 8.579 0.000 . . . . . . . 42 MET H . 50801 1
81 . 1 . 1 20 20 MET C C 13 177.040 0.000 . . . . . . . 42 MET C . 50801 1
82 . 1 . 1 20 20 MET CA C 13 57.213 0.000 . . . . . . . 42 MET CA . 50801 1
83 . 1 . 1 20 20 MET CB C 13 30.580 0.000 . . . . . . . 42 MET CB . 50801 1
84 . 1 . 1 20 20 MET N N 15 119.591 0.000 . . . . . . . 42 MET N . 50801 1
85 . 1 . 1 21 21 GLN H H 1 8.131 0.000 . . . . . . . 43 GLN H . 50801 1
86 . 1 . 1 21 21 GLN C C 13 176.882 0.000 . . . . . . . 43 GLN C . 50801 1
87 . 1 . 1 21 21 GLN CA C 13 59.731 0.000 . . . . . . . 43 GLN CA . 50801 1
88 . 1 . 1 21 21 GLN CB C 13 30.039 0.000 . . . . . . . 43 GLN CB . 50801 1
89 . 1 . 1 21 21 GLN N N 15 118.149 0.000 . . . . . . . 43 GLN N . 50801 1
90 . 1 . 1 22 22 ASN H H 1 8.964 0.000 . . . . . . . 44 ASN H . 50801 1
91 . 1 . 1 22 22 ASN C C 13 175.371 0.000 . . . . . . . 44 ASN C . 50801 1
92 . 1 . 1 22 22 ASN CA C 13 55.015 0.000 . . . . . . . 44 ASN CA . 50801 1
93 . 1 . 1 22 22 ASN CB C 13 38.711 0.000 . . . . . . . 44 ASN CB . 50801 1
94 . 1 . 1 22 22 ASN N N 15 114.908 0.000 . . . . . . . 44 ASN N . 50801 1
95 . 1 . 1 23 23 VAL H H 1 8.132 0.000 . . . . . . . 45 VAL H . 50801 1
96 . 1 . 1 23 23 VAL C C 13 177.906 0.000 . . . . . . . 45 VAL C . 50801 1
97 . 1 . 1 23 23 VAL CA C 13 64.624 0.000 . . . . . . . 45 VAL CA . 50801 1
98 . 1 . 1 23 23 VAL CB C 13 32.291 0.000 . . . . . . . 45 VAL CB . 50801 1
99 . 1 . 1 23 23 VAL N N 15 116.882 0.000 . . . . . . . 45 VAL N . 50801 1
100 . 1 . 1 24 24 VAL H H 1 7.484 0.000 . . . . . . . 46 VAL H . 50801 1
101 . 1 . 1 24 24 VAL C C 13 176.826 0.000 . . . . . . . 46 VAL C . 50801 1
102 . 1 . 1 24 24 VAL CA C 13 69.188 0.000 . . . . . . . 46 VAL CA . 50801 1
103 . 1 . 1 24 24 VAL CB C 13 30.759 0.000 . . . . . . . 46 VAL CB . 50801 1
104 . 1 . 1 24 24 VAL N N 15 120.581 0.000 . . . . . . . 46 VAL N . 50801 1
105 . 1 . 1 25 25 VAL H H 1 9.225 0.000 . . . . . . . 47 VAL H . 50801 1
106 . 1 . 1 25 25 VAL C C 13 177.365 0.000 . . . . . . . 47 VAL C . 50801 1
107 . 1 . 1 25 25 VAL CA C 13 67.881 0.000 . . . . . . . 47 VAL CA . 50801 1
108 . 1 . 1 25 25 VAL CB C 13 31.129 0.000 . . . . . . . 47 VAL CB . 50801 1
109 . 1 . 1 25 25 VAL N N 15 118.248 0.000 . . . . . . . 47 VAL N . 50801 1
110 . 1 . 1 26 26 LYS H H 1 6.265 0.000 . . . . . . . 48 LYS H . 50801 1
111 . 1 . 1 26 26 LYS CA C 13 59.965 0.000 . . . . . . . 48 LYS CA . 50801 1
112 . 1 . 1 26 26 LYS CB C 13 32.929 0.000 . . . . . . . 48 LYS CB . 50801 1
113 . 1 . 1 26 26 LYS N N 15 115.211 0.000 . . . . . . . 48 LYS N . 50801 1
114 . 1 . 1 27 27 THR H H 1 7.377 0.000 . . . . . . . 49 THR H . 50801 1
115 . 1 . 1 27 27 THR C C 13 176.583 0.000 . . . . . . . 49 THR C . 50801 1
116 . 1 . 1 27 27 THR CA C 13 66.959 0.000 . . . . . . . 49 THR CA . 50801 1
117 . 1 . 1 27 27 THR CB C 13 68.782 0.000 . . . . . . . 49 THR CB . 50801 1
118 . 1 . 1 27 27 THR N N 15 111.942 0.000 . . . . . . . 49 THR N . 50801 1
119 . 1 . 1 28 28 LEU H H 1 8.210 0.000 . . . . . . . 50 LEU H . 50801 1
120 . 1 . 1 28 28 LEU C C 13 178.341 0.000 . . . . . . . 50 LEU C . 50801 1
121 . 1 . 1 28 28 LEU CA C 13 58.638 0.000 . . . . . . . 50 LEU CA . 50801 1
122 . 1 . 1 28 28 LEU CB C 13 42.372 0.000 . . . . . . . 50 LEU CB . 50801 1
123 . 1 . 1 28 28 LEU N N 15 121.272 0.000 . . . . . . . 50 LEU N . 50801 1
124 . 1 . 1 29 29 TRP H H 1 9.088 0.000 . . . . . . . 51 TRP H . 50801 1
125 . 1 . 1 29 29 TRP C C 13 177.020 0.000 . . . . . . . 51 TRP C . 50801 1
126 . 1 . 1 29 29 TRP CA C 13 60.780 0.000 . . . . . . . 51 TRP CA . 50801 1
127 . 1 . 1 29 29 TRP CB C 13 28.846 0.000 . . . . . . . 51 TRP CB . 50801 1
128 . 1 . 1 29 29 TRP N N 15 116.828 0.000 . . . . . . . 51 TRP N . 50801 1
129 . 1 . 1 30 30 LYS H H 1 7.029 0.000 . . . . . . . 52 LYS H . 50801 1
130 . 1 . 1 30 30 LYS C C 13 176.405 0.000 . . . . . . . 52 LYS C . 50801 1
131 . 1 . 1 30 30 LYS CA C 13 55.885 0.000 . . . . . . . 52 LYS CA . 50801 1
132 . 1 . 1 30 30 LYS CB C 13 33.091 0.000 . . . . . . . 52 LYS CB . 50801 1
133 . 1 . 1 30 30 LYS N N 15 110.690 0.000 . . . . . . . 52 LYS N . 50801 1
134 . 1 . 1 31 31 HIS H H 1 7.752 0.000 . . . . . . . 53 HIS H . 50801 1
135 . 1 . 1 31 31 HIS C C 13 177.043 0.000 . . . . . . . 53 HIS C . 50801 1
136 . 1 . 1 31 31 HIS CA C 13 59.327 0.000 . . . . . . . 53 HIS CA . 50801 1
137 . 1 . 1 31 31 HIS CB C 13 32.328 0.000 . . . . . . . 53 HIS CB . 50801 1
138 . 1 . 1 31 31 HIS N N 15 123.457 0.000 . . . . . . . 53 HIS N . 50801 1
139 . 1 . 1 32 32 GLN H H 1 8.424 0.000 . . . . . . . 54 GLN H . 50801 1
140 . 1 . 1 32 32 GLN C C 13 177.073 0.000 . . . . . . . 54 GLN C . 50801 1
141 . 1 . 1 32 32 GLN CA C 13 58.940 0.000 . . . . . . . 54 GLN CA . 50801 1
142 . 1 . 1 32 32 GLN CB C 13 27.980 0.000 . . . . . . . 54 GLN CB . 50801 1
143 . 1 . 1 32 32 GLN N N 15 128.006 0.000 . . . . . . . 54 GLN N . 50801 1
144 . 1 . 1 33 33 PHE H H 1 11.386 0.000 . . . . . . . 55 PHE H . 50801 1
145 . 1 . 1 33 33 PHE C C 13 174.330 0.000 . . . . . . . 55 PHE C . 50801 1
146 . 1 . 1 33 33 PHE CA C 13 53.059 0.000 . . . . . . . 55 PHE CA . 50801 1
147 . 1 . 1 33 33 PHE CB C 13 37.720 0.000 . . . . . . . 55 PHE CB . 50801 1
148 . 1 . 1 33 33 PHE N N 15 121.226 0.000 . . . . . . . 55 PHE N . 50801 1
149 . 1 . 1 34 34 ALA H H 1 7.728 0.000 . . . . . . . 56 ALA H . 50801 1
150 . 1 . 1 34 34 ALA C C 13 177.839 0.000 . . . . . . . 56 ALA C . 50801 1
151 . 1 . 1 34 34 ALA CA C 13 54.267 0.000 . . . . . . . 56 ALA CA . 50801 1
152 . 1 . 1 34 34 ALA CB C 13 20.955 0.000 . . . . . . . 56 ALA CB . 50801 1
153 . 1 . 1 34 34 ALA N N 15 116.847 0.000 . . . . . . . 56 ALA N . 50801 1
154 . 1 . 1 35 35 TRP H H 1 6.880 0.000 . . . . . . . 57 TRP H . 50801 1
155 . 1 . 1 35 35 TRP CA C 13 58.809 0.000 . . . . . . . 57 TRP CA . 50801 1
156 . 1 . 1 35 35 TRP CB C 13 27.407 0.000 . . . . . . . 57 TRP CB . 50801 1
157 . 1 . 1 35 35 TRP N N 15 115.317 0.000 . . . . . . . 57 TRP N . 50801 1
158 . 1 . 1 36 36 PRO CA C 13 64.557 0.000 . . . . . . . 58 PRO CA . 50801 1
159 . 1 . 1 36 36 PRO CB C 13 30.456 0.000 . . . . . . . 58 PRO CB . 50801 1
160 . 1 . 1 37 37 PHE H H 1 7.909 0.000 . . . . . . . 59 PHE H . 50801 1
161 . 1 . 1 37 37 PHE C C 13 176.091 0.000 . . . . . . . 59 PHE C . 50801 1
162 . 1 . 1 37 37 PHE CA C 13 56.816 0.000 . . . . . . . 59 PHE CA . 50801 1
163 . 1 . 1 37 37 PHE CB C 13 38.826 0.000 . . . . . . . 59 PHE CB . 50801 1
164 . 1 . 1 37 37 PHE N N 15 111.924 0.000 . . . . . . . 59 PHE N . 50801 1
165 . 1 . 1 38 38 TYR H H 1 7.016 0.000 . . . . . . . 60 TYR H . 50801 1
166 . 1 . 1 38 38 TYR C C 13 174.580 0.000 . . . . . . . 60 TYR C . 50801 1
167 . 1 . 1 38 38 TYR CA C 13 57.007 0.000 . . . . . . . 60 TYR CA . 50801 1
168 . 1 . 1 38 38 TYR CB C 13 37.710 0.000 . . . . . . . 60 TYR CB . 50801 1
169 . 1 . 1 38 38 TYR N N 15 117.825 0.000 . . . . . . . 60 TYR N . 50801 1
170 . 1 . 1 39 39 GLN H H 1 7.391 0.000 . . . . . . . 61 GLN H . 50801 1
171 . 1 . 1 39 39 GLN CA C 13 52.819 0.000 . . . . . . . 61 GLN CA . 50801 1
172 . 1 . 1 39 39 GLN CB C 13 29.791 0.000 . . . . . . . 61 GLN CB . 50801 1
173 . 1 . 1 39 39 GLN N N 15 112.594 0.000 . . . . . . . 61 GLN N . 50801 1
174 . 1 . 1 40 40 PRO CA C 13 62.700 0.000 . . . . . . . 62 PRO CA . 50801 1
175 . 1 . 1 40 40 PRO CB C 13 32.600 0.000 . . . . . . . 62 PRO CB . 50801 1
176 . 1 . 1 41 41 VAL CA C 13 64.734 0.000 . . . . . . . 63 VAL CA . 50801 1
177 . 1 . 1 41 41 VAL CB C 13 32.328 0.000 . . . . . . . 63 VAL CB . 50801 1
178 . 1 . 1 42 42 ASP C C 13 177.097 0.000 . . . . . . . 64 ASP C . 50801 1
179 . 1 . 1 42 42 ASP CA C 13 52.129 0.000 . . . . . . . 64 ASP CA . 50801 1
180 . 1 . 1 42 42 ASP CB C 13 40.456 0.000 . . . . . . . 64 ASP CB . 50801 1
181 . 1 . 1 43 43 ALA H H 1 8.597 0.000 . . . . . . . 65 ALA H . 50801 1
182 . 1 . 1 43 43 ALA C C 13 178.971 0.000 . . . . . . . 65 ALA C . 50801 1
183 . 1 . 1 43 43 ALA CA C 13 54.542 0.000 . . . . . . . 65 ALA CA . 50801 1
184 . 1 . 1 43 43 ALA CB C 13 19.363 0.000 . . . . . . . 65 ALA CB . 50801 1
185 . 1 . 1 43 43 ALA N N 15 125.200 0.000 . . . . . . . 65 ALA N . 50801 1
186 . 1 . 1 44 44 ILE H H 1 7.868 0.000 . . . . . . . 66 ILE H . 50801 1
187 . 1 . 1 44 44 ILE C C 13 179.076 0.000 . . . . . . . 66 ILE C . 50801 1
188 . 1 . 1 44 44 ILE CA C 13 63.188 0.000 . . . . . . . 66 ILE CA . 50801 1
189 . 1 . 1 44 44 ILE CB C 13 36.934 0.000 . . . . . . . 66 ILE CB . 50801 1
190 . 1 . 1 44 44 ILE N N 15 117.989 0.000 . . . . . . . 66 ILE N . 50801 1
191 . 1 . 1 45 45 LYS H H 1 7.812 0.000 . . . . . . . 67 LYS H . 50801 1
192 . 1 . 1 45 45 LYS C C 13 178.490 0.000 . . . . . . . 67 LYS C . 50801 1
193 . 1 . 1 45 45 LYS CA C 13 58.868 0.000 . . . . . . . 67 LYS CA . 50801 1
194 . 1 . 1 45 45 LYS CB C 13 32.682 0.000 . . . . . . . 67 LYS CB . 50801 1
195 . 1 . 1 45 45 LYS N N 15 122.915 0.000 . . . . . . . 67 LYS N . 50801 1
196 . 1 . 1 46 46 LEU H H 1 7.798 0.000 . . . . . . . 68 LEU H . 50801 1
197 . 1 . 1 46 46 LEU C C 13 176.001 0.000 . . . . . . . 68 LEU C . 50801 1
198 . 1 . 1 46 46 LEU CA C 13 54.828 0.000 . . . . . . . 68 LEU CA . 50801 1
199 . 1 . 1 46 46 LEU CB C 13 42.091 0.000 . . . . . . . 68 LEU CB . 50801 1
200 . 1 . 1 46 46 LEU N N 15 114.406 0.000 . . . . . . . 68 LEU N . 50801 1
201 . 1 . 1 47 47 ASN H H 1 7.434 0.000 . . . . . . . 69 ASN H . 50801 1
202 . 1 . 1 47 47 ASN C C 13 172.990 0.000 . . . . . . . 69 ASN C . 50801 1
203 . 1 . 1 47 47 ASN CA C 13 54.012 0.000 . . . . . . . 69 ASN CA . 50801 1
204 . 1 . 1 47 47 ASN CB C 13 36.900 0.000 . . . . . . . 69 ASN CB . 50801 1
205 . 1 . 1 47 47 ASN N N 15 116.535 0.000 . . . . . . . 69 ASN N . 50801 1
206 . 1 . 1 48 48 LEU H H 1 8.223 0.000 . . . . . . . 70 LEU H . 50801 1
207 . 1 . 1 48 48 LEU CA C 13 51.283 0.000 . . . . . . . 70 LEU CA . 50801 1
208 . 1 . 1 48 48 LEU CB C 13 42.229 0.000 . . . . . . . 70 LEU CB . 50801 1
209 . 1 . 1 48 48 LEU N N 15 118.517 0.000 . . . . . . . 70 LEU N . 50801 1
210 . 1 . 1 49 49 PRO C C 13 177.917 0.000 . . . . . . . 71 PRO C . 50801 1
211 . 1 . 1 49 49 PRO CA C 13 64.698 0.000 . . . . . . . 71 PRO CA . 50801 1
212 . 1 . 1 49 49 PRO CB C 13 31.901 0.000 . . . . . . . 71 PRO CB . 50801 1
213 . 1 . 1 50 50 ASP H H 1 8.702 0.000 . . . . . . . 72 ASP H . 50801 1
214 . 1 . 1 50 50 ASP C C 13 180.739 0.000 . . . . . . . 72 ASP C . 50801 1
215 . 1 . 1 50 50 ASP CA C 13 54.128 0.000 . . . . . . . 72 ASP CA . 50801 1
216 . 1 . 1 50 50 ASP CB C 13 40.409 0.000 . . . . . . . 72 ASP CB . 50801 1
217 . 1 . 1 50 50 ASP N N 15 116.699 0.000 . . . . . . . 72 ASP N . 50801 1
218 . 1 . 1 51 51 TYR H H 1 7.623 0.000 . . . . . . . 73 TYR H . 50801 1
219 . 1 . 1 51 51 TYR C C 13 176.293 0.000 . . . . . . . 73 TYR C . 50801 1
220 . 1 . 1 51 51 TYR CA C 13 63.994 0.000 . . . . . . . 73 TYR CA . 50801 1
221 . 1 . 1 51 51 TYR CB C 13 39.575 0.000 . . . . . . . 73 TYR CB . 50801 1
222 . 1 . 1 51 51 TYR N N 15 122.702 0.000 . . . . . . . 73 TYR N . 50801 1
223 . 1 . 1 52 52 HIS H H 1 8.287 0.000 . . . . . . . 74 HIS H . 50801 1
224 . 1 . 1 52 52 HIS C C 13 175.649 0.000 . . . . . . . 74 HIS C . 50801 1
225 . 1 . 1 52 52 HIS CA C 13 57.642 0.000 . . . . . . . 74 HIS CA . 50801 1
226 . 1 . 1 52 52 HIS CB C 13 28.800 0.000 . . . . . . . 74 HIS CB . 50801 1
227 . 1 . 1 52 52 HIS N N 15 112.433 0.000 . . . . . . . 74 HIS N . 50801 1
228 . 1 . 1 53 53 LYS H H 1 7.190 0.000 . . . . . . . 75 LYS H . 50801 1
229 . 1 . 1 53 53 LYS CA C 13 57.589 0.000 . . . . . . . 75 LYS CA . 50801 1
230 . 1 . 1 53 53 LYS CB C 13 32.738 0.000 . . . . . . . 75 LYS CB . 50801 1
231 . 1 . 1 53 53 LYS N N 15 118.005 0.000 . . . . . . . 75 LYS N . 50801 1
232 . 1 . 1 54 54 ILE H H 1 7.125 0.000 . . . . . . . 76 ILE H . 50801 1
233 . 1 . 1 54 54 ILE C C 13 175.564 0.000 . . . . . . . 76 ILE C . 50801 1
234 . 1 . 1 54 54 ILE CA C 13 62.287 0.000 . . . . . . . 76 ILE CA . 50801 1
235 . 1 . 1 54 54 ILE CB C 13 39.797 0.000 . . . . . . . 76 ILE CB . 50801 1
236 . 1 . 1 54 54 ILE N N 15 118.765 0.000 . . . . . . . 76 ILE N . 50801 1
237 . 1 . 1 55 55 ILE H H 1 8.307 0.000 . . . . . . . 77 ILE H . 50801 1
238 . 1 . 1 55 55 ILE C C 13 174.031 0.000 . . . . . . . 77 ILE C . 50801 1
239 . 1 . 1 55 55 ILE CA C 13 57.230 0.000 . . . . . . . 77 ILE CA . 50801 1
240 . 1 . 1 55 55 ILE CB C 13 34.060 0.000 . . . . . . . 77 ILE CB . 50801 1
241 . 1 . 1 55 55 ILE N N 15 121.706 0.000 . . . . . . . 77 ILE N . 50801 1
242 . 1 . 1 56 56 LYS H H 1 7.726 0.000 . . . . . . . 78 LYS H . 50801 1
243 . 1 . 1 56 56 LYS C C 13 176.590 0.000 . . . . . . . 78 LYS C . 50801 1
244 . 1 . 1 56 56 LYS CA C 13 56.716 0.000 . . . . . . . 78 LYS CA . 50801 1
245 . 1 . 1 56 56 LYS CB C 13 32.837 0.000 . . . . . . . 78 LYS CB . 50801 1
246 . 1 . 1 56 56 LYS N N 15 124.268 0.000 . . . . . . . 78 LYS N . 50801 1
247 . 1 . 1 57 57 ASN H H 1 8.304 0.000 . . . . . . . 79 ASN H . 50801 1
248 . 1 . 1 57 57 ASN CA C 13 50.382 0.000 . . . . . . . 79 ASN CA . 50801 1
249 . 1 . 1 57 57 ASN CB C 13 39.308 0.000 . . . . . . . 79 ASN CB . 50801 1
250 . 1 . 1 57 57 ASN N N 15 116.529 0.000 . . . . . . . 79 ASN N . 50801 1
251 . 1 . 1 58 58 PRO C C 13 178.195 0.000 . . . . . . . 80 PRO C . 50801 1
252 . 1 . 1 58 58 PRO CA C 13 63.354 0.000 . . . . . . . 80 PRO CA . 50801 1
253 . 1 . 1 58 58 PRO CB C 13 38.656 0.000 . . . . . . . 80 PRO CB . 50801 1
254 . 1 . 1 59 59 MET H H 1 7.962 0.000 . . . . . . . 81 MET H . 50801 1
255 . 1 . 1 59 59 MET C C 13 172.312 0.000 . . . . . . . 81 MET C . 50801 1
256 . 1 . 1 59 59 MET CA C 13 53.980 0.000 . . . . . . . 81 MET CA . 50801 1
257 . 1 . 1 59 59 MET CB C 13 31.951 0.000 . . . . . . . 81 MET CB . 50801 1
258 . 1 . 1 59 59 MET N N 15 117.992 0.000 . . . . . . . 81 MET N . 50801 1
259 . 1 . 1 60 60 ASP H H 1 7.290 0.000 . . . . . . . 82 ASP H . 50801 1
260 . 1 . 1 60 60 ASP C C 13 173.049 0.000 . . . . . . . 82 ASP C . 50801 1
261 . 1 . 1 60 60 ASP CA C 13 52.990 0.000 . . . . . . . 82 ASP CA . 50801 1
262 . 1 . 1 60 60 ASP CB C 13 44.358 0.000 . . . . . . . 82 ASP CB . 50801 1
263 . 1 . 1 60 60 ASP N N 15 119.734 0.000 . . . . . . . 82 ASP N . 50801 1
264 . 1 . 1 61 61 MET H H 1 8.952 0.000 . . . . . . . 83 MET H . 50801 1
265 . 1 . 1 61 61 MET C C 13 176.404 0.000 . . . . . . . 83 MET C . 50801 1
266 . 1 . 1 61 61 MET CA C 13 59.497 0.000 . . . . . . . 83 MET CA . 50801 1
267 . 1 . 1 61 61 MET CB C 13 35.220 0.000 . . . . . . . 83 MET CB . 50801 1
268 . 1 . 1 61 61 MET N N 15 120.808 0.000 . . . . . . . 83 MET N . 50801 1
269 . 1 . 1 62 62 GLY H H 1 8.545 0.000 . . . . . . . 84 GLY H . 50801 1
270 . 1 . 1 62 62 GLY C C 13 177.740 0.000 . . . . . . . 84 GLY C . 50801 1
271 . 1 . 1 62 62 GLY CA C 13 47.987 0.000 . . . . . . . 84 GLY CA . 50801 1
272 . 1 . 1 62 62 GLY N N 15 113.233 0.000 . . . . . . . 84 GLY N . 50801 1
273 . 1 . 1 63 63 THR H H 1 8.508 0.000 . . . . . . . 85 THR H . 50801 1
274 . 1 . 1 63 63 THR C C 13 175.901 0.000 . . . . . . . 85 THR C . 50801 1
275 . 1 . 1 63 63 THR CA C 13 67.299 0.000 . . . . . . . 85 THR CA . 50801 1
276 . 1 . 1 63 63 THR CB C 13 67.480 0.000 . . . . . . . 85 THR CB . 50801 1
277 . 1 . 1 63 63 THR N N 15 124.098 0.000 . . . . . . . 85 THR N . 50801 1
278 . 1 . 1 64 64 ILE H H 1 7.119 0.000 . . . . . . . 86 ILE H . 50801 1
279 . 1 . 1 64 64 ILE C C 13 177.152 0.000 . . . . . . . 86 ILE C . 50801 1
280 . 1 . 1 64 64 ILE CA C 13 65.863 0.000 . . . . . . . 86 ILE CA . 50801 1
281 . 1 . 1 64 64 ILE CB C 13 39.010 0.000 . . . . . . . 86 ILE CB . 50801 1
282 . 1 . 1 64 64 ILE N N 15 122.009 0.000 . . . . . . . 86 ILE N . 50801 1
283 . 1 . 1 65 65 LYS H H 1 8.456 0.000 . . . . . . . 87 LYS H . 50801 1
284 . 1 . 1 65 65 LYS CA C 13 61.162 0.000 . . . . . . . 87 LYS CA . 50801 1
285 . 1 . 1 65 65 LYS CB C 13 33.203 0.000 . . . . . . . 87 LYS CB . 50801 1
286 . 1 . 1 65 65 LYS N N 15 119.706 0.000 . . . . . . . 87 LYS N . 50801 1
287 . 1 . 1 66 66 LYS H H 1 7.999 0.000 . . . . . . . 88 LYS H . 50801 1
288 . 1 . 1 66 66 LYS CA C 13 59.049 0.000 . . . . . . . 88 LYS CA . 50801 1
289 . 1 . 1 66 66 LYS CB C 13 32.560 0.000 . . . . . . . 88 LYS CB . 50801 1
290 . 1 . 1 66 66 LYS N N 15 118.420 0.000 . . . . . . . 88 LYS N . 50801 1
291 . 1 . 1 67 67 ARG H H 1 8.266 0.000 . . . . . . . 89 ARG H . 50801 1
292 . 1 . 1 67 67 ARG C C 13 179.526 0.000 . . . . . . . 89 ARG C . 50801 1
293 . 1 . 1 67 67 ARG CA C 13 58.071 0.000 . . . . . . . 89 ARG CA . 50801 1
294 . 1 . 1 67 67 ARG CB C 13 29.559 0.000 . . . . . . . 89 ARG CB . 50801 1
295 . 1 . 1 67 67 ARG N N 15 119.569 0.000 . . . . . . . 89 ARG N . 50801 1
296 . 1 . 1 68 68 LEU H H 1 8.390 0.000 . . . . . . . 90 LEU H . 50801 1
297 . 1 . 1 68 68 LEU C C 13 180.624 0.000 . . . . . . . 90 LEU C . 50801 1
298 . 1 . 1 68 68 LEU CA C 13 58.444 0.000 . . . . . . . 90 LEU CA . 50801 1
299 . 1 . 1 68 68 LEU CB C 13 41.923 0.000 . . . . . . . 90 LEU CB . 50801 1
300 . 1 . 1 68 68 LEU N N 15 120.420 0.000 . . . . . . . 90 LEU N . 50801 1
301 . 1 . 1 69 69 GLU H H 1 8.256 0.000 . . . . . . . 91 GLU H . 50801 1
302 . 1 . 1 69 69 GLU C C 13 177.842 0.000 . . . . . . . 91 GLU C . 50801 1
303 . 1 . 1 69 69 GLU CA C 13 58.973 0.000 . . . . . . . 91 GLU CA . 50801 1
304 . 1 . 1 69 69 GLU CB C 13 29.442 0.000 . . . . . . . 91 GLU CB . 50801 1
305 . 1 . 1 69 69 GLU N N 15 119.994 0.000 . . . . . . . 91 GLU N . 50801 1
306 . 1 . 1 70 70 ASN H H 1 7.972 0.000 . . . . . . . 92 ASN H . 50801 1
307 . 1 . 1 70 70 ASN CA C 13 52.715 0.000 . . . . . . . 92 ASN CA . 50801 1
308 . 1 . 1 70 70 ASN CB C 13 38.663 0.000 . . . . . . . 92 ASN CB . 50801 1
309 . 1 . 1 70 70 ASN N N 15 115.065 0.000 . . . . . . . 92 ASN N . 50801 1
310 . 1 . 1 71 71 ASN H H 1 7.823 0.000 . . . . . . . 93 ASN H . 50801 1
311 . 1 . 1 71 71 ASN CA C 13 54.511 0.000 . . . . . . . 93 ASN CA . 50801 1
312 . 1 . 1 71 71 ASN CB C 13 36.245 0.000 . . . . . . . 93 ASN CB . 50801 1
313 . 1 . 1 71 71 ASN N N 15 116.248 0.000 . . . . . . . 93 ASN N . 50801 1
314 . 1 . 1 72 72 TYR H H 1 8.486 0.000 . . . . . . . 94 TYR H . 50801 1
315 . 1 . 1 72 72 TYR C C 13 177.010 0.000 . . . . . . . 94 TYR C . 50801 1
316 . 1 . 1 72 72 TYR CA C 13 60.465 0.000 . . . . . . . 94 TYR CA . 50801 1
317 . 1 . 1 72 72 TYR CB C 13 40.682 0.000 . . . . . . . 94 TYR CB . 50801 1
318 . 1 . 1 72 72 TYR N N 15 115.915 0.000 . . . . . . . 94 TYR N . 50801 1
319 . 1 . 1 73 73 TYR H H 1 7.819 0.000 . . . . . . . 95 TYR H . 50801 1
320 . 1 . 1 73 73 TYR C C 13 175.696 0.000 . . . . . . . 95 TYR C . 50801 1
321 . 1 . 1 73 73 TYR CA C 13 57.322 0.000 . . . . . . . 95 TYR CA . 50801 1
322 . 1 . 1 73 73 TYR CB C 13 39.056 0.000 . . . . . . . 95 TYR CB . 50801 1
323 . 1 . 1 73 73 TYR N N 15 114.602 0.000 . . . . . . . 95 TYR N . 50801 1
324 . 1 . 1 74 74 TRP H H 1 9.716 0.000 . . . . . . . 96 TRP H . 50801 1
325 . 1 . 1 74 74 TRP C C 13 175.365 0.000 . . . . . . . 96 TRP C . 50801 1
326 . 1 . 1 74 74 TRP CA C 13 58.457 0.000 . . . . . . . 96 TRP CA . 50801 1
327 . 1 . 1 74 74 TRP CB C 13 30.724 0.000 . . . . . . . 96 TRP CB . 50801 1
328 . 1 . 1 74 74 TRP N N 15 121.715 0.000 . . . . . . . 96 TRP N . 50801 1
329 . 1 . 1 75 75 SER H H 1 7.723 0.000 . . . . . . . 97 SER H . 50801 1
330 . 1 . 1 75 75 SER C C 13 174.848 0.000 . . . . . . . 97 SER C . 50801 1
331 . 1 . 1 75 75 SER CA C 13 55.984 0.000 . . . . . . . 97 SER CA . 50801 1
332 . 1 . 1 75 75 SER CB C 13 66.731 0.000 . . . . . . . 97 SER CB . 50801 1
333 . 1 . 1 75 75 SER N N 15 108.571 0.000 . . . . . . . 97 SER N . 50801 1
334 . 1 . 1 76 76 ALA H H 1 9.215 0.000 . . . . . . . 98 ALA H . 50801 1
335 . 1 . 1 76 76 ALA CA C 13 55.226 0.000 . . . . . . . 98 ALA CA . 50801 1
336 . 1 . 1 76 76 ALA CB C 13 18.171 0.000 . . . . . . . 98 ALA CB . 50801 1
337 . 1 . 1 76 76 ALA N N 15 125.154 0.000 . . . . . . . 98 ALA N . 50801 1
338 . 1 . 1 77 77 SER H H 1 8.583 0.000 . . . . . . . 99 SER H . 50801 1
339 . 1 . 1 77 77 SER C C 13 176.973 0.000 . . . . . . . 99 SER C . 50801 1
340 . 1 . 1 77 77 SER CA C 13 61.999 0.000 . . . . . . . 99 SER CA . 50801 1
341 . 1 . 1 77 77 SER CB C 13 62.211 0.000 . . . . . . . 99 SER CB . 50801 1
342 . 1 . 1 77 77 SER N N 15 114.981 0.000 . . . . . . . 99 SER N . 50801 1
343 . 1 . 1 78 78 GLU H H 1 7.448 0.000 . . . . . . . 100 GLU H . 50801 1
344 . 1 . 1 78 78 GLU C C 13 177.991 0.000 . . . . . . . 100 GLU C . 50801 1
345 . 1 . 1 78 78 GLU CA C 13 59.167 0.000 . . . . . . . 100 GLU CA . 50801 1
346 . 1 . 1 78 78 GLU CB C 13 31.605 0.000 . . . . . . . 100 GLU CB . 50801 1
347 . 1 . 1 78 78 GLU N N 15 122.096 0.000 . . . . . . . 100 GLU N . 50801 1
348 . 1 . 1 79 79 CYS H H 1 6.509 0.000 . . . . . . . 101 CYS H . 50801 1
349 . 1 . 1 79 79 CYS C C 13 176.526 0.000 . . . . . . . 101 CYS C . 50801 1
350 . 1 . 1 79 79 CYS CA C 13 62.011 0.000 . . . . . . . 101 CYS CA . 50801 1
351 . 1 . 1 79 79 CYS CB C 13 26.462 0.000 . . . . . . . 101 CYS CB . 50801 1
352 . 1 . 1 79 79 CYS N N 15 119.732 0.000 . . . . . . . 101 CYS N . 50801 1
353 . 1 . 1 80 80 MET H H 1 8.595 0.000 . . . . . . . 102 MET H . 50801 1
354 . 1 . 1 80 80 MET CA C 13 60.439 0.000 . . . . . . . 102 MET CA . 50801 1
355 . 1 . 1 80 80 MET CB C 13 32.640 0.000 . . . . . . . 102 MET CB . 50801 1
356 . 1 . 1 80 80 MET N N 15 117.591 0.000 . . . . . . . 102 MET N . 50801 1
357 . 1 . 1 81 81 GLN H H 1 7.903 0.000 . . . . . . . 103 GLN H . 50801 1
358 . 1 . 1 81 81 GLN C C 13 178.213 0.000 . . . . . . . 103 GLN C . 50801 1
359 . 1 . 1 81 81 GLN CA C 13 59.091 0.000 . . . . . . . 103 GLN CA . 50801 1
360 . 1 . 1 81 81 GLN CB C 13 28.182 0.000 . . . . . . . 103 GLN CB . 50801 1
361 . 1 . 1 81 81 GLN N N 15 118.215 0.000 . . . . . . . 103 GLN N . 50801 1
362 . 1 . 1 82 82 ASP H H 1 7.452 0.000 . . . . . . . 104 ASP H . 50801 1
363 . 1 . 1 82 82 ASP CA C 13 58.110 0.000 . . . . . . . 104 ASP CA . 50801 1
364 . 1 . 1 82 82 ASP CB C 13 39.635 0.000 . . . . . . . 104 ASP CB . 50801 1
365 . 1 . 1 82 82 ASP N N 15 121.326 0.000 . . . . . . . 104 ASP N . 50801 1
366 . 1 . 1 83 83 PHE H H 1 7.869 0.000 . . . . . . . 105 PHE H . 50801 1
367 . 1 . 1 83 83 PHE C C 13 176.754 0.000 . . . . . . . 105 PHE C . 50801 1
368 . 1 . 1 83 83 PHE CA C 13 63.629 0.000 . . . . . . . 105 PHE CA . 50801 1
369 . 1 . 1 83 83 PHE CB C 13 39.767 0.000 . . . . . . . 105 PHE CB . 50801 1
370 . 1 . 1 83 83 PHE N N 15 119.671 0.000 . . . . . . . 105 PHE N . 50801 1
371 . 1 . 1 84 84 ASN H H 1 8.324 0.000 . . . . . . . 106 ASN H . 50801 1
372 . 1 . 1 84 84 ASN C C 13 178.947 0.000 . . . . . . . 106 ASN C . 50801 1
373 . 1 . 1 84 84 ASN CA C 13 57.550 0.000 . . . . . . . 106 ASN CA . 50801 1
374 . 1 . 1 84 84 ASN CB C 13 38.689 0.000 . . . . . . . 106 ASN CB . 50801 1
375 . 1 . 1 84 84 ASN N N 15 116.137 0.000 . . . . . . . 106 ASN N . 50801 1
376 . 1 . 1 85 85 THR H H 1 8.860 0.000 . . . . . . . 107 THR H . 50801 1
377 . 1 . 1 85 85 THR C C 13 173.989 0.000 . . . . . . . 107 THR C . 50801 1
378 . 1 . 1 85 85 THR CA C 13 66.621 0.000 . . . . . . . 107 THR CA . 50801 1
379 . 1 . 1 85 85 THR CB C 13 68.776 0.000 . . . . . . . 107 THR CB . 50801 1
380 . 1 . 1 85 85 THR N N 15 121.087 0.000 . . . . . . . 107 THR N . 50801 1
381 . 1 . 1 86 86 MET H H 1 7.655 0.000 . . . . . . . 108 MET H . 50801 1
382 . 1 . 1 86 86 MET C C 13 178.713 0.000 . . . . . . . 108 MET C . 50801 1
383 . 1 . 1 86 86 MET CA C 13 60.185 0.000 . . . . . . . 108 MET CA . 50801 1
384 . 1 . 1 86 86 MET CB C 13 34.394 0.000 . . . . . . . 108 MET CB . 50801 1
385 . 1 . 1 86 86 MET N N 15 120.382 0.000 . . . . . . . 108 MET N . 50801 1
386 . 1 . 1 87 87 PHE H H 1 7.917 0.000 . . . . . . . 109 PHE H . 50801 1
387 . 1 . 1 87 87 PHE C C 13 176.339 0.000 . . . . . . . 109 PHE C . 50801 1
388 . 1 . 1 87 87 PHE CA C 13 61.403 0.000 . . . . . . . 109 PHE CA . 50801 1
389 . 1 . 1 87 87 PHE CB C 13 38.017 0.000 . . . . . . . 109 PHE CB . 50801 1
390 . 1 . 1 87 87 PHE N N 15 116.521 0.000 . . . . . . . 109 PHE N . 50801 1
391 . 1 . 1 88 88 THR H H 1 8.528 0.000 . . . . . . . 110 THR H . 50801 1
392 . 1 . 1 88 88 THR C C 13 176.430 0.000 . . . . . . . 110 THR C . 50801 1
393 . 1 . 1 88 88 THR CA C 13 67.148 0.000 . . . . . . . 110 THR CA . 50801 1
394 . 1 . 1 88 88 THR CB C 13 68.971 0.000 . . . . . . . 110 THR CB . 50801 1
395 . 1 . 1 88 88 THR N N 15 112.671 0.000 . . . . . . . 110 THR N . 50801 1
396 . 1 . 1 89 89 ASN H H 1 8.668 0.000 . . . . . . . 111 ASN H . 50801 1
397 . 1 . 1 89 89 ASN C C 13 176.699 0.000 . . . . . . . 111 ASN C . 50801 1
398 . 1 . 1 89 89 ASN CA C 13 55.154 0.000 . . . . . . . 111 ASN CA . 50801 1
399 . 1 . 1 89 89 ASN CB C 13 38.020 0.000 . . . . . . . 111 ASN CB . 50801 1
400 . 1 . 1 89 89 ASN N N 15 119.203 0.000 . . . . . . . 111 ASN N . 50801 1
401 . 1 . 1 90 90 CYS H H 1 6.868 0.000 . . . . . . . 112 CYS H . 50801 1
402 . 1 . 1 90 90 CYS C C 13 176.935 0.000 . . . . . . . 112 CYS C . 50801 1
403 . 1 . 1 90 90 CYS CA C 13 62.221 0.000 . . . . . . . 112 CYS CA . 50801 1
404 . 1 . 1 90 90 CYS CB C 13 25.999 0.000 . . . . . . . 112 CYS CB . 50801 1
405 . 1 . 1 90 90 CYS N N 15 117.925 0.000 . . . . . . . 112 CYS N . 50801 1
406 . 1 . 1 91 91 TYR H H 1 7.494 0.000 . . . . . . . 113 TYR H . 50801 1
407 . 1 . 1 91 91 TYR CA C 13 56.669 0.000 . . . . . . . 113 TYR CA . 50801 1
408 . 1 . 1 91 91 TYR CB C 13 36.322 0.000 . . . . . . . 113 TYR CB . 50801 1
409 . 1 . 1 91 91 TYR N N 15 118.434 0.000 . . . . . . . 113 TYR N . 50801 1
410 . 1 . 1 92 92 ILE H H 1 8.572 0.000 . . . . . . . 114 ILE H . 50801 1
411 . 1 . 1 92 92 ILE C C 13 178.022 0.000 . . . . . . . 114 ILE C . 50801 1
412 . 1 . 1 92 92 ILE CA C 13 63.602 0.000 . . . . . . . 114 ILE CA . 50801 1
413 . 1 . 1 92 92 ILE CB C 13 38.467 0.000 . . . . . . . 114 ILE CB . 50801 1
414 . 1 . 1 92 92 ILE N N 15 117.151 0.000 . . . . . . . 114 ILE N . 50801 1
415 . 1 . 1 93 93 TYR H H 1 7.969 0.000 . . . . . . . 115 TYR H . 50801 1
416 . 1 . 1 93 93 TYR C C 13 175.403 0.000 . . . . . . . 115 TYR C . 50801 1
417 . 1 . 1 93 93 TYR CA C 13 62.103 0.000 . . . . . . . 115 TYR CA . 50801 1
418 . 1 . 1 93 93 TYR CB C 13 40.412 0.000 . . . . . . . 115 TYR CB . 50801 1
419 . 1 . 1 93 93 TYR N N 15 117.639 0.000 . . . . . . . 115 TYR N . 50801 1
420 . 1 . 1 94 94 ASN H H 1 7.423 0.000 . . . . . . . 116 ASN H . 50801 1
421 . 1 . 1 94 94 ASN C C 13 174.179 0.000 . . . . . . . 116 ASN C . 50801 1
422 . 1 . 1 94 94 ASN CA C 13 53.352 0.000 . . . . . . . 116 ASN CA . 50801 1
423 . 1 . 1 94 94 ASN CB C 13 41.611 0.000 . . . . . . . 116 ASN CB . 50801 1
424 . 1 . 1 94 94 ASN N N 15 113.607 0.000 . . . . . . . 116 ASN N . 50801 1
425 . 1 . 1 95 95 LYS H H 1 8.513 0.000 . . . . . . . 117 LYS H . 50801 1
426 . 1 . 1 95 95 LYS CA C 13 54.716 0.000 . . . . . . . 117 LYS CA . 50801 1
427 . 1 . 1 95 95 LYS CB C 13 31.794 0.000 . . . . . . . 117 LYS CB . 50801 1
428 . 1 . 1 95 95 LYS N N 15 120.511 0.000 . . . . . . . 117 LYS N . 50801 1
429 . 1 . 1 96 96 PRO C C 13 176.300 0.000 . . . . . . . 118 PRO C . 50801 1
430 . 1 . 1 96 96 PRO CA C 13 65.013 0.000 . . . . . . . 118 PRO CA . 50801 1
431 . 1 . 1 96 96 PRO CB C 13 32.290 0.000 . . . . . . . 118 PRO CB . 50801 1
432 . 1 . 1 97 97 THR H H 1 6.707 0.000 . . . . . . . 119 THR H . 50801 1
433 . 1 . 1 97 97 THR CA C 13 60.382 0.000 . . . . . . . 119 THR CA . 50801 1
434 . 1 . 1 97 97 THR CB C 13 69.046 0.000 . . . . . . . 119 THR CB . 50801 1
435 . 1 . 1 97 97 THR N N 15 100.525 0.000 . . . . . . . 119 THR N . 50801 1
436 . 1 . 1 98 98 ASP H H 1 7.814 0.000 . . . . . . . 120 ASP H . 50801 1
437 . 1 . 1 98 98 ASP C C 13 177.437 0.000 . . . . . . . 120 ASP C . 50801 1
438 . 1 . 1 98 98 ASP CA C 13 55.125 0.000 . . . . . . . 120 ASP CA . 50801 1
439 . 1 . 1 98 98 ASP CB C 13 41.457 0.000 . . . . . . . 120 ASP CB . 50801 1
440 . 1 . 1 98 98 ASP N N 15 124.109 0.000 . . . . . . . 120 ASP N . 50801 1
441 . 1 . 1 99 99 ASP H H 1 8.760 0.000 . . . . . . . 121 ASP H . 50801 1
442 . 1 . 1 99 99 ASP C C 13 178.566 0.000 . . . . . . . 121 ASP C . 50801 1
443 . 1 . 1 99 99 ASP CA C 13 57.911 0.000 . . . . . . . 121 ASP CA . 50801 1
444 . 1 . 1 99 99 ASP CB C 13 40.134 0.000 . . . . . . . 121 ASP CB . 50801 1
445 . 1 . 1 99 99 ASP N N 15 123.752 0.000 . . . . . . . 121 ASP N . 50801 1
446 . 1 . 1 100 100 ILE H H 1 8.614 0.000 . . . . . . . 122 ILE H . 50801 1
447 . 1 . 1 100 100 ILE C C 13 175.985 0.000 . . . . . . . 122 ILE C . 50801 1
448 . 1 . 1 100 100 ILE CA C 13 62.548 0.000 . . . . . . . 122 ILE CA . 50801 1
449 . 1 . 1 100 100 ILE CB C 13 37.503 0.000 . . . . . . . 122 ILE CB . 50801 1
450 . 1 . 1 100 100 ILE N N 15 116.608 0.000 . . . . . . . 122 ILE N . 50801 1
451 . 1 . 1 101 101 VAL H H 1 6.974 0.000 . . . . . . . 123 VAL H . 50801 1
452 . 1 . 1 101 101 VAL C C 13 177.412 0.000 . . . . . . . 123 VAL C . 50801 1
453 . 1 . 1 101 101 VAL CA C 13 67.099 0.000 . . . . . . . 123 VAL CA . 50801 1
454 . 1 . 1 101 101 VAL CB C 13 31.277 0.000 . . . . . . . 123 VAL CB . 50801 1
455 . 1 . 1 101 101 VAL N N 15 122.912 0.000 . . . . . . . 123 VAL N . 50801 1
456 . 1 . 1 102 102 LEU H H 1 7.119 0.000 . . . . . . . 124 LEU H . 50801 1
457 . 1 . 1 102 102 LEU C C 13 181.160 0.000 . . . . . . . 124 LEU C . 50801 1
458 . 1 . 1 102 102 LEU CA C 13 58.173 0.000 . . . . . . . 124 LEU CA . 50801 1
459 . 1 . 1 102 102 LEU CB C 13 40.770 0.000 . . . . . . . 124 LEU CB . 50801 1
460 . 1 . 1 102 102 LEU N N 15 120.643 0.000 . . . . . . . 124 LEU N . 50801 1
461 . 1 . 1 103 103 MET H H 1 8.076 0.000 . . . . . . . 125 MET H . 50801 1
462 . 1 . 1 103 103 MET C C 13 177.205 0.000 . . . . . . . 125 MET C . 50801 1
463 . 1 . 1 103 103 MET CA C 13 59.836 0.000 . . . . . . . 125 MET CA . 50801 1
464 . 1 . 1 103 103 MET CB C 13 34.004 0.000 . . . . . . . 125 MET CB . 50801 1
465 . 1 . 1 103 103 MET N N 15 119.557 0.000 . . . . . . . 125 MET N . 50801 1
466 . 1 . 1 104 104 ALA H H 1 8.501 0.000 . . . . . . . 126 ALA H . 50801 1
467 . 1 . 1 104 104 ALA C C 13 178.648 0.000 . . . . . . . 126 ALA C . 50801 1
468 . 1 . 1 104 104 ALA CA C 13 55.917 0.000 . . . . . . . 126 ALA CA . 50801 1
469 . 1 . 1 104 104 ALA CB C 13 19.521 0.000 . . . . . . . 126 ALA CB . 50801 1
470 . 1 . 1 104 104 ALA N N 15 121.600 0.000 . . . . . . . 126 ALA N . 50801 1
471 . 1 . 1 105 105 GLN H H 1 8.779 0.000 . . . . . . . 127 GLN H . 50801 1
472 . 1 . 1 105 105 GLN C C 13 179.976 0.000 . . . . . . . 127 GLN C . 50801 1
473 . 1 . 1 105 105 GLN CA C 13 58.841 0.000 . . . . . . . 127 GLN CA . 50801 1
474 . 1 . 1 105 105 GLN CB C 13 28.614 0.000 . . . . . . . 127 GLN CB . 50801 1
475 . 1 . 1 105 105 GLN N N 15 115.721 0.000 . . . . . . . 127 GLN N . 50801 1
476 . 1 . 1 106 106 ALA H H 1 7.604 0.000 . . . . . . . 128 ALA H . 50801 1
477 . 1 . 1 106 106 ALA C C 13 180.867 0.000 . . . . . . . 128 ALA C . 50801 1
478 . 1 . 1 106 106 ALA CA C 13 54.965 0.000 . . . . . . . 128 ALA CA . 50801 1
479 . 1 . 1 106 106 ALA CB C 13 18.178 0.000 . . . . . . . 128 ALA CB . 50801 1
480 . 1 . 1 106 106 ALA N N 15 121.924 0.000 . . . . . . . 128 ALA N . 50801 1
481 . 1 . 1 107 107 LEU H H 1 7.870 0.000 . . . . . . . 129 LEU H . 50801 1
482 . 1 . 1 107 107 LEU CA C 13 57.531 0.000 . . . . . . . 129 LEU CA . 50801 1
483 . 1 . 1 107 107 LEU CB C 13 42.477 0.000 . . . . . . . 129 LEU CB . 50801 1
484 . 1 . 1 107 107 LEU N N 15 119.305 0.000 . . . . . . . 129 LEU N . 50801 1
485 . 1 . 1 108 108 GLU H H 1 8.942 0.000 . . . . . . . 130 GLU H . 50801 1
486 . 1 . 1 108 108 GLU C C 13 177.962 0.000 . . . . . . . 130 GLU C . 50801 1
487 . 1 . 1 108 108 GLU CA C 13 59.274 0.000 . . . . . . . 130 GLU CA . 50801 1
488 . 1 . 1 108 108 GLU CB C 13 28.598 0.000 . . . . . . . 130 GLU CB . 50801 1
489 . 1 . 1 108 108 GLU N N 15 121.905 0.000 . . . . . . . 130 GLU N . 50801 1
490 . 1 . 1 109 109 LYS H H 1 7.515 0.000 . . . . . . . 131 LYS H . 50801 1
491 . 1 . 1 109 109 LYS C C 13 179.463 0.000 . . . . . . . 131 LYS C . 50801 1
492 . 1 . 1 109 109 LYS CA C 13 60.303 0.000 . . . . . . . 131 LYS CA . 50801 1
493 . 1 . 1 109 109 LYS CB C 13 32.488 0.000 . . . . . . . 131 LYS CB . 50801 1
494 . 1 . 1 109 109 LYS N N 15 117.497 0.000 . . . . . . . 131 LYS N . 50801 1
495 . 1 . 1 110 110 ILE H H 1 7.001 0.000 . . . . . . . 132 ILE H . 50801 1
496 . 1 . 1 110 110 ILE C C 13 177.788 0.000 . . . . . . . 132 ILE C . 50801 1
497 . 1 . 1 110 110 ILE CA C 13 64.217 0.000 . . . . . . . 132 ILE CA . 50801 1
498 . 1 . 1 110 110 ILE CB C 13 37.570 0.000 . . . . . . . 132 ILE CB . 50801 1
499 . 1 . 1 110 110 ILE N N 15 119.425 0.000 . . . . . . . 132 ILE N . 50801 1
500 . 1 . 1 111 111 PHE H H 1 8.622 0.000 . . . . . . . 133 PHE H . 50801 1
501 . 1 . 1 111 111 PHE C C 13 176.019 0.000 . . . . . . . 133 PHE C . 50801 1
502 . 1 . 1 111 111 PHE CA C 13 61.776 0.000 . . . . . . . 133 PHE CA . 50801 1
503 . 1 . 1 111 111 PHE CB C 13 38.853 0.000 . . . . . . . 133 PHE CB . 50801 1
504 . 1 . 1 111 111 PHE N N 15 121.565 0.000 . . . . . . . 133 PHE N . 50801 1
505 . 1 . 1 112 112 LEU H H 1 8.693 0.000 . . . . . . . 134 LEU H . 50801 1
506 . 1 . 1 112 112 LEU CA C 13 57.780 0.000 . . . . . . . 134 LEU CA . 50801 1
507 . 1 . 1 112 112 LEU CB C 13 41.546 0.000 . . . . . . . 134 LEU CB . 50801 1
508 . 1 . 1 112 112 LEU N N 15 118.393 0.000 . . . . . . . 134 LEU N . 50801 1
509 . 1 . 1 113 113 GLN H H 1 7.701 0.000 . . . . . . . 135 GLN H . 50801 1
510 . 1 . 1 113 113 GLN C C 13 179.090 0.000 . . . . . . . 135 GLN C . 50801 1
511 . 1 . 1 113 113 GLN CA C 13 58.966 0.000 . . . . . . . 135 GLN CA . 50801 1
512 . 1 . 1 113 113 GLN CB C 13 28.488 0.000 . . . . . . . 135 GLN CB . 50801 1
513 . 1 . 1 113 113 GLN N N 15 119.535 0.000 . . . . . . . 135 GLN N . 50801 1
514 . 1 . 1 114 114 LYS H H 1 8.328 0.000 . . . . . . . 136 LYS H . 50801 1
515 . 1 . 1 114 114 LYS C C 13 182.023 0.000 . . . . . . . 136 LYS C . 50801 1
516 . 1 . 1 114 114 LYS CA C 13 56.726 0.000 . . . . . . . 136 LYS CA . 50801 1
517 . 1 . 1 114 114 LYS CB C 13 32.078 0.000 . . . . . . . 136 LYS CB . 50801 1
518 . 1 . 1 114 114 LYS N N 15 115.028 0.000 . . . . . . . 136 LYS N . 50801 1
519 . 1 . 1 115 115 VAL H H 1 8.820 0.000 . . . . . . . 137 VAL H . 50801 1
520 . 1 . 1 115 115 VAL C C 13 177.777 0.000 . . . . . . . 137 VAL C . 50801 1
521 . 1 . 1 115 115 VAL CA C 13 66.640 0.000 . . . . . . . 137 VAL CA . 50801 1
522 . 1 . 1 115 115 VAL CB C 13 31.155 0.000 . . . . . . . 137 VAL CB . 50801 1
523 . 1 . 1 115 115 VAL N N 15 121.855 0.000 . . . . . . . 137 VAL N . 50801 1
524 . 1 . 1 116 116 ALA H H 1 7.410 0.000 . . . . . . . 138 ALA H . 50801 1
525 . 1 . 1 116 116 ALA C C 13 178.311 0.000 . . . . . . . 138 ALA C . 50801 1
526 . 1 . 1 116 116 ALA CA C 13 54.131 0.000 . . . . . . . 138 ALA CA . 50801 1
527 . 1 . 1 116 116 ALA CB C 13 18.028 0.000 . . . . . . . 138 ALA CB . 50801 1
528 . 1 . 1 116 116 ALA N N 15 122.913 0.000 . . . . . . . 138 ALA N . 50801 1
529 . 1 . 1 117 117 GLN H H 1 6.801 0.000 . . . . . . . 139 GLN H . 50801 1
530 . 1 . 1 117 117 GLN C C 13 174.169 0.000 . . . . . . . 139 GLN C . 50801 1
531 . 1 . 1 117 117 GLN CA C 13 54.454 0.000 . . . . . . . 139 GLN CA . 50801 1
532 . 1 . 1 117 117 GLN CB C 13 29.081 0.000 . . . . . . . 139 GLN CB . 50801 1
533 . 1 . 1 117 117 GLN N N 15 113.435 0.000 . . . . . . . 139 GLN N . 50801 1
534 . 1 . 1 118 118 MET H H 1 7.033 0.000 . . . . . . . 140 MET H . 50801 1
535 . 1 . 1 118 118 MET CA C 13 54.015 0.000 . . . . . . . 140 MET CA . 50801 1
536 . 1 . 1 118 118 MET CB C 13 34.819 0.000 . . . . . . . 140 MET CB . 50801 1
537 . 1 . 1 118 118 MET N N 15 121.870 0.000 . . . . . . . 140 MET N . 50801 1
538 . 1 . 1 119 119 PRO C C 13 176.118 0.000 . . . . . . . 141 PRO C . 50801 1
539 . 1 . 1 119 119 PRO CA C 13 62.659 0.000 . . . . . . . 141 PRO CA . 50801 1
540 . 1 . 1 119 119 PRO CB C 13 32.144 0.000 . . . . . . . 141 PRO CB . 50801 1
541 . 1 . 1 120 120 GLN H H 1 8.335 0.000 . . . . . . . 142 GLN H . 50801 1
542 . 1 . 1 120 120 GLN C C 13 176.046 0.000 . . . . . . . 142 GLN C . 50801 1
543 . 1 . 1 120 120 GLN CA C 13 55.880 0.000 . . . . . . . 142 GLN CA . 50801 1
544 . 1 . 1 120 120 GLN CB C 13 29.390 0.000 . . . . . . . 142 GLN CB . 50801 1
545 . 1 . 1 120 120 GLN N N 15 119.590 0.000 . . . . . . . 142 GLN N . 50801 1
546 . 1 . 1 121 121 GLU H H 1 8.399 0.000 . . . . . . . 143 GLU H . 50801 1
547 . 1 . 1 121 121 GLU C C 13 175.377 0.000 . . . . . . . 143 GLU C . 50801 1
548 . 1 . 1 121 121 GLU CA C 13 57.194 0.000 . . . . . . . 143 GLU CA . 50801 1
549 . 1 . 1 121 121 GLU CB C 13 30.814 0.000 . . . . . . . 143 GLU CB . 50801 1
550 . 1 . 1 121 121 GLU N N 15 123.217 0.000 . . . . . . . 143 GLU N . 50801 1
551 . 1 . 1 122 122 GLU H H 1 8.048 0.000 . . . . . . . 144 GLU H . 50801 1
552 . 1 . 1 122 122 GLU CA C 13 58.100 0.000 . . . . . . . 144 GLU CA . 50801 1
553 . 1 . 1 122 122 GLU CB C 13 31.800 0.000 . . . . . . . 144 GLU CB . 50801 1
554 . 1 . 1 122 122 GLU N N 15 128.618 0.000 . . . . . . . 144 GLU N . 50801 1
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