Content for NMR-STAR saveframe, "chem_shift_list_1"
save_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 6722
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing
_Assigned_chem_shift_list.Chem_shift_1H_err 0.05
_Assigned_chem_shift_list.Chem_shift_13C_err 0.5
_Assigned_chem_shift_list.Chem_shift_15N_err 0.5
_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 1H15N_HSQC 1 $sample_1 isotropic 6722 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 . . 6722 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 3 3 MET H H 1 8.424 0.05 . 1 . . . . 1 MET H . 6722 1
2 . 1 1 3 3 MET C C 13 175.161 0.5 . 1 . . . . 1 MET C . 6722 1
3 . 1 1 3 3 MET CA C 13 55.132 0.5 . 1 . . . . 1 MET CA . 6722 1
4 . 1 1 3 3 MET CB C 13 32.199 0.5 . 1 . . . . 1 MET CB . 6722 1
5 . 1 1 3 3 MET N N 15 122.095 0.5 . 1 . . . . 1 MET N . 6722 1
6 . 1 1 4 4 SER H H 1 8.325 0.05 . 1 . . . . 2 SER H . 6722 1
7 . 1 1 4 4 SER C C 13 173.139 0.5 . 1 . . . . 2 SER C . 6722 1
8 . 1 1 4 4 SER CA C 13 57.959 0.5 . 1 . . . . 2 SER CA . 6722 1
9 . 1 1 4 4 SER CB C 13 63.506 0.5 . 1 . . . . 2 SER CB . 6722 1
10 . 1 1 4 4 SER N N 15 116.586 0.5 . 1 . . . . 2 SER N . 6722 1
11 . 1 1 5 5 ASP H H 1 8.268 0.05 . 1 . . . . 3 ASP H . 6722 1
12 . 1 1 5 5 ASP CA C 13 52.373 0.5 . 1 . . . . 3 ASP CA . 6722 1
13 . 1 1 5 5 ASP CB C 13 39.944 0.5 . 1 . . . . 3 ASP CB . 6722 1
14 . 1 1 5 5 ASP N N 15 122.988 0.5 . 1 . . . . 3 ASP N . 6722 1
15 . 1 1 6 6 PRO C C 13 176.593 0.5 . 1 . . . . 4 PRO C . 6722 1
16 . 1 1 6 6 PRO CA C 13 62.339 0.5 . 1 . . . . 4 PRO CA . 6722 1
17 . 1 1 6 6 PRO CB C 13 31.065 0.5 . 1 . . . . 4 PRO CB . 6722 1
18 . 1 1 7 7 LEU H H 1 7.644 0.05 . 1 . . . . 5 LEU H . 6722 1
19 . 1 1 7 7 LEU C C 13 174.508 0.5 . 1 . . . . 5 LEU C . 6722 1
20 . 1 1 7 7 LEU CA C 13 54.718 0.5 . 1 . . . . 5 LEU CA . 6722 1
21 . 1 1 7 7 LEU CB C 13 43.817 0.5 . 1 . . . . 5 LEU CB . 6722 1
22 . 1 1 7 7 LEU N N 15 123.005 0.5 . 1 . . . . 5 LEU N . 6722 1
23 . 1 1 8 8 HIS H H 1 10.071 0.05 . 1 . . . . 6 HIS H . 6722 1
24 . 1 1 8 8 HIS C C 13 173.708 0.5 . 1 . . . . 6 HIS C . 6722 1
25 . 1 1 8 8 HIS CA C 13 52.304 0.5 . 1 . . . . 6 HIS CA . 6722 1
26 . 1 1 8 8 HIS CB C 13 31.349 0.5 . 1 . . . . 6 HIS CB . 6722 1
27 . 1 1 8 8 HIS N N 15 126.927 0.5 . 1 . . . . 6 HIS N . 6722 1
28 . 1 1 9 9 VAL H H 1 8.907 0.05 . 1 . . . . 7 VAL H . 6722 1
29 . 1 1 9 9 VAL C C 13 171.602 0.5 . 1 . . . . 7 VAL C . 6722 1
30 . 1 1 9 9 VAL CA C 13 60.305 0.5 . 1 . . . . 7 VAL CA . 6722 1
31 . 1 1 9 9 VAL CB C 13 34.038 0.5 . 1 . . . . 7 VAL CB . 6722 1
32 . 1 1 9 9 VAL N N 15 128.347 0.5 . 1 . . . . 7 VAL N . 6722 1
33 . 1 1 10 10 THR H H 1 7.95 0.05 . 1 . . . . 8 THR H . 6722 1
34 . 1 1 10 10 THR C C 13 171.244 0.5 . 1 . . . . 8 THR C . 6722 1
35 . 1 1 10 10 THR CA C 13 57.959 0.5 . 1 . . . . 8 THR CA . 6722 1
36 . 1 1 10 10 THR CB C 13 70.36 0.5 . 1 . . . . 8 THR CB . 6722 1
37 . 1 1 10 10 THR N N 15 121.205 0.5 . 1 . . . . 8 THR N . 6722 1
38 . 1 1 11 11 PHE H H 1 8.142 0.05 . 1 . . . . 9 PHE H . 6722 1
39 . 1 1 11 11 PHE C C 13 174.087 0.5 . 1 . . . . 9 PHE C . 6722 1
40 . 1 1 11 11 PHE CA C 13 55.787 0.5 . 1 . . . . 9 PHE CA . 6722 1
41 . 1 1 11 11 PHE CB C 13 42.211 0.5 . 1 . . . . 9 PHE CB . 6722 1
42 . 1 1 11 11 PHE N N 15 125.01 0.5 . 1 . . . . 9 PHE N . 6722 1
43 . 1 1 12 12 VAL H H 1 8.683 0.05 . 1 . . . . 10 VAL H . 6722 1
44 . 1 1 12 12 VAL CA C 13 59.994 0.5 . 1 . . . . 10 VAL CA . 6722 1
45 . 1 1 12 12 VAL CB C 13 34.985 0.5 . 1 . . . . 10 VAL CB . 6722 1
46 . 1 1 12 12 VAL N N 15 120.641 0.5 . 1 . . . . 10 VAL N . 6722 1
47 . 1 1 13 13 CYS H H 1 7.83 0.05 . 1 . . . . 11 CYS H . 6722 1
48 . 1 1 13 13 CYS CA C 13 57.063 0.5 . 1 . . . . 11 CYS CA . 6722 1
49 . 1 1 13 13 CYS CB C 13 29.723 0.5 . 1 . . . . 11 CYS CB . 6722 1
50 . 1 1 13 13 CYS N N 15 122.867 0.5 . 1 . . . . 11 CYS N . 6722 1
51 . 1 1 14 14 THR C C 13 180.762 0.5 . 1 . . . . 12 THR C . 6722 1
52 . 1 1 15 15 GLY H H 1 7.487 0.05 . 1 . . . . 13 GLY H . 6722 1
53 . 1 1 15 15 GLY C C 13 172.761 0.5 . 1 . . . . 13 GLY C . 6722 1
54 . 1 1 15 15 GLY CA C 13 43.732 0.5 . 1 . . . . 13 GLY CA . 6722 1
55 . 1 1 15 15 GLY N N 15 117.618 0.5 . 1 . . . . 13 GLY N . 6722 1
56 . 1 1 16 16 ASN H H 1 9.239 0.05 . 1 . . . . 14 ASN H . 6722 1
57 . 1 1 16 16 ASN C C 13 178.278 0.5 . 1 . . . . 14 ASN C . 6722 1
58 . 1 1 16 16 ASN CA C 13 53.809 0.5 . 1 . . . . 14 ASN CA . 6722 1
59 . 1 1 16 16 ASN CB C 13 39.874 0.5 . 1 . . . . 14 ASN CB . 6722 1
60 . 1 1 16 16 ASN N N 15 119.457 0.5 . 1 . . . . 14 ASN N . 6722 1
61 . 1 1 17 17 ILE H H 1 7.837 0.05 . 1 . . . . 15 ILE H . 6722 1
62 . 1 1 17 17 ILE C C 13 178.299 0.5 . 1 . . . . 15 ILE C . 6722 1
63 . 1 1 17 17 ILE CA C 13 62.408 0.5 . 1 . . . . 15 ILE CA . 6722 1
64 . 1 1 17 17 ILE CB C 13 38.756 0.5 . 1 . . . . 15 ILE CB . 6722 1
65 . 1 1 17 17 ILE N N 15 118.642 0.5 . 1 . . . . 15 ILE N . 6722 1
66 . 1 1 18 18 CYS H H 1 8.154 0.05 . 1 . . . . 16 CYS H . 6722 1
67 . 1 1 18 18 CYS C C 13 178.636 0.5 . 1 . . . . 16 CYS C . 6722 1
68 . 1 1 18 18 CYS CA C 13 59.032 0.5 . 1 . . . . 16 CYS CA . 6722 1
69 . 1 1 18 18 CYS CB C 13 28.305 0.5 . 1 . . . . 16 CYS CB . 6722 1
70 . 1 1 18 18 CYS N N 15 121.009 0.5 . 1 . . . . 16 CYS N . 6722 1
71 . 1 1 19 19 ARG H H 1 7.863 0.05 . 1 . . . . 17 ARG H . 6722 1
72 . 1 1 19 19 ARG C C 13 178.068 0.5 . 1 . . . . 17 ARG C . 6722 1
73 . 1 1 19 19 ARG CA C 13 58.891 0.5 . 1 . . . . 17 ARG CA . 6722 1
74 . 1 1 19 19 ARG CB C 13 28.231 0.5 . 1 . . . . 17 ARG CB . 6722 1
75 . 1 1 19 19 ARG N N 15 121.215 0.5 . 1 . . . . 17 ARG N . 6722 1
76 . 1 1 20 20 SER H H 1 7.759 0.05 . 1 . . . . 18 SER H . 6722 1
77 . 1 1 20 20 SER CA C 13 66.616 0.5 . 1 . . . . 18 SER CA . 6722 1
78 . 1 1 20 20 SER CB C 13 66.084 0.5 . 1 . . . . 18 SER CB . 6722 1
79 . 1 1 20 20 SER N N 15 119.664 0.5 . 1 . . . . 18 SER N . 6722 1
80 . 1 1 21 21 PRO C C 13 177.625 0.5 . 1 . . . . 19 PRO C . 6722 1
81 . 1 1 21 21 PRO CA C 13 64.477 0.5 . 1 . . . . 19 PRO CA . 6722 1
82 . 1 1 21 21 PRO CB C 13 27.356 0.5 . 1 . . . . 19 PRO CB . 6722 1
83 . 1 1 22 22 MET H H 1 6.328 0.05 . 1 . . . . 20 MET H . 6722 1
84 . 1 1 22 22 MET C C 13 175.161 0.5 . 1 . . . . 20 MET C . 6722 1
85 . 1 1 22 22 MET CA C 13 59.684 0.5 . 1 . . . . 20 MET CA . 6722 1
86 . 1 1 22 22 MET CB C 13 32.577 0.5 . 1 . . . . 20 MET CB . 6722 1
87 . 1 1 22 22 MET N N 15 112.253 0.5 . 1 . . . . 20 MET N . 6722 1
88 . 1 1 23 23 ALA H H 1 6.579 0.05 . 1 . . . . 21 ALA H . 6722 1
89 . 1 1 23 23 ALA C C 13 176.193 0.5 . 1 . . . . 21 ALA C . 6722 1
90 . 1 1 23 23 ALA CA C 13 54.442 0.5 . 1 . . . . 21 ALA CA . 6722 1
91 . 1 1 23 23 ALA CB C 13 15.952 0.5 . 1 . . . . 21 ALA CB . 6722 1
92 . 1 1 23 23 ALA N N 15 117.422 0.5 . 1 . . . . 21 ALA N . 6722 1
93 . 1 1 24 24 GLU H H 1 7.745 0.05 . 1 . . . . 22 GLU H . 6722 1
94 . 1 1 24 24 GLU C C 13 177.141 0.5 . 1 . . . . 22 GLU C . 6722 1
95 . 1 1 24 24 GLU CA C 13 59.029 0.5 . 1 . . . . 22 GLU CA . 6722 1
96 . 1 1 24 24 GLU CB C 13 29.306 0.5 . 1 . . . . 22 GLU CB . 6722 1
97 . 1 1 24 24 GLU N N 15 115.182 0.5 . 1 . . . . 22 GLU N . 6722 1
98 . 1 1 25 25 LYS H H 1 8.071 0.05 . 1 . . . . 23 LYS H . 6722 1
99 . 1 1 25 25 LYS C C 13 180.532 0.5 . 1 . . . . 23 LYS C . 6722 1
100 . 1 1 25 25 LYS CA C 13 57.132 0.5 . 1 . . . . 23 LYS CA . 6722 1
101 . 1 1 25 25 LYS CB C 13 29.554 0.5 . 1 . . . . 23 LYS CB . 6722 1
102 . 1 1 25 25 LYS N N 15 113.765 0.5 . 1 . . . . 23 LYS N . 6722 1
103 . 1 1 26 26 MET H H 1 7.575 0.05 . 1 . . . . 24 MET H . 6722 1
104 . 1 1 26 26 MET C C 13 179.837 0.5 . 1 . . . . 24 MET C . 6722 1
105 . 1 1 26 26 MET CA C 13 57.373 0.5 . 1 . . . . 24 MET CA . 6722 1
106 . 1 1 26 26 MET CB C 13 34.844 0.5 . 1 . . . . 24 MET CB . 6722 1
107 . 1 1 26 26 MET N N 15 114.92 0.5 . 1 . . . . 24 MET N . 6722 1
108 . 1 1 27 27 PHE H H 1 8.555 0.05 . 1 . . . . 25 PHE H . 6722 1
109 . 1 1 27 27 PHE C C 13 177.225 0.5 . 1 . . . . 25 PHE C . 6722 1
110 . 1 1 27 27 PHE CA C 13 59.58 0.5 . 1 . . . . 25 PHE CA . 6722 1
111 . 1 1 27 27 PHE CB C 13 38.792 0.5 . 1 . . . . 25 PHE CB . 6722 1
112 . 1 1 27 27 PHE N N 15 118.75 0.5 . 1 . . . . 25 PHE N . 6722 1
113 . 1 1 28 28 ALA H H 1 8.793 0.05 . 1 . . . . 26 ALA H . 6722 1
114 . 1 1 28 28 ALA C C 13 179.984 0.5 . 1 . . . . 26 ALA C . 6722 1
115 . 1 1 28 28 ALA CA C 13 55.545 0.5 . 1 . . . . 26 ALA CA . 6722 1
116 . 1 1 28 28 ALA CB C 13 17.771 0.5 . 1 . . . . 26 ALA CB . 6722 1
117 . 1 1 28 28 ALA N N 15 117.477 0.5 . 1 . . . . 26 ALA N . 6722 1
118 . 1 1 29 29 GLN H H 1 7.66 0.05 . 1 . . . . 27 GLN H . 6722 1
119 . 1 1 29 29 GLN C C 13 177.057 0.5 . 1 . . . . 27 GLN C . 6722 1
120 . 1 1 29 29 GLN CA C 13 59.132 0.5 . 1 . . . . 27 GLN CA . 6722 1
121 . 1 1 29 29 GLN CB C 13 27.948 0.5 . 1 . . . . 27 GLN CB . 6722 1
122 . 1 1 29 29 GLN N N 15 117.227 0.5 . 1 . . . . 27 GLN N . 6722 1
123 . 1 1 30 30 GLN H H 1 8.184 0.05 . 1 . . . . 28 GLN H . 6722 1
124 . 1 1 30 30 GLN C C 13 179.963 0.5 . 1 . . . . 28 GLN C . 6722 1
125 . 1 1 30 30 GLN CA C 13 58.58 0.5 . 1 . . . . 28 GLN CA . 6722 1
126 . 1 1 30 30 GLN CB C 13 26.346 0.5 . 1 . . . . 28 GLN CB . 6722 1
127 . 1 1 30 30 GLN N N 15 117.18 0.5 . 1 . . . . 28 GLN N . 6722 1
128 . 1 1 31 31 LEU H H 1 8.527 0.05 . 1 . . . . 29 LEU H . 6722 1
129 . 1 1 31 31 LEU C C 13 178.552 0.5 . 1 . . . . 29 LEU C . 6722 1
130 . 1 1 31 31 LEU CA C 13 57.615 0.5 . 1 . . . . 29 LEU CA . 6722 1
131 . 1 1 31 31 LEU CB C 13 41.317 0.5 . 1 . . . . 29 LEU CB . 6722 1
132 . 1 1 31 31 LEU N N 15 118.986 0.5 . 1 . . . . 29 LEU N . 6722 1
133 . 1 1 32 32 ARG H H 1 7.746 0.05 . 1 . . . . 30 ARG H . 6722 1
134 . 1 1 32 32 ARG CA C 13 57.89 0.5 . 1 . . . . 30 ARG CA . 6722 1
135 . 1 1 32 32 ARG CB C 13 28.137 0.5 . 1 . . . . 30 ARG CB . 6722 1
136 . 1 1 32 32 ARG N N 15 117.237 0.5 . 1 . . . . 30 ARG N . 6722 1
137 . 1 1 33 33 HIS C C 13 176.299 0.5 . 1 . . . . 31 HIS C . 6722 1
138 . 1 1 33 33 HIS CA C 13 57.511 0.5 . 1 . . . . 31 HIS CA . 6722 1
139 . 1 1 33 33 HIS CB C 13 30.498 0.5 . 1 . . . . 31 HIS CB . 6722 1
140 . 1 1 34 34 ARG H H 1 7.474 0.05 . 1 . . . . 32 ARG H . 6722 1
141 . 1 1 34 34 ARG C C 13 175.245 0.5 . 1 . . . . 32 ARG C . 6722 1
142 . 1 1 34 34 ARG CA C 13 55.339 0.5 . 1 . . . . 32 ARG CA . 6722 1
143 . 1 1 34 34 ARG N N 15 115.14 0.5 . 1 . . . . 32 ARG N . 6722 1
144 . 1 1 35 35 GLY H H 1 7.734 0.05 . 1 . . . . 33 GLY H . 6722 1
145 . 1 1 35 35 GLY C C 13 175.161 0.5 . 1 . . . . 33 GLY C . 6722 1
146 . 1 1 35 35 GLY CA C 13 45.706 0.5 . 1 . . . . 33 GLY CA . 6722 1
147 . 1 1 35 35 GLY N N 15 106.44 0.5 . 1 . . . . 33 GLY N . 6722 1
148 . 1 1 36 36 LEU H H 1 7.96 0.05 . 1 . . . . 34 LEU H . 6722 1
149 . 1 1 36 36 LEU C C 13 177.036 0.5 . 1 . . . . 34 LEU C . 6722 1
150 . 1 1 36 36 LEU CA C 13 53.545 0.5 . 1 . . . . 34 LEU CA . 6722 1
151 . 1 1 36 36 LEU CB C 13 42.495 0.5 . 1 . . . . 34 LEU CB . 6722 1
152 . 1 1 36 36 LEU N N 15 119.674 0.5 . 1 . . . . 34 LEU N . 6722 1
153 . 1 1 37 37 GLY H H 1 8.849 0.05 . 1 . . . . 35 GLY H . 6722 1
154 . 1 1 37 37 GLY C C 13 173.371 0.5 . 1 . . . . 35 GLY C . 6722 1
155 . 1 1 37 37 GLY CA C 13 46.544 0.5 . 1 . . . . 35 GLY CA . 6722 1
156 . 1 1 37 37 GLY N N 15 108.425 0.5 . 1 . . . . 35 GLY N . 6722 1
157 . 1 1 38 38 ASP H H 1 8.29 0.05 . 1 . . . . 36 ASP H . 6722 1
158 . 1 1 38 38 ASP C C 13 175.835 0.5 . 1 . . . . 36 ASP C . 6722 1
159 . 1 1 38 38 ASP CA C 13 53.787 0.5 . 1 . . . . 36 ASP CA . 6722 1
160 . 1 1 38 38 ASP CB C 13 40.638 0.5 . 1 . . . . 36 ASP CB . 6722 1
161 . 1 1 38 38 ASP N N 15 114.937 0.5 . 1 . . . . 36 ASP N . 6722 1
162 . 1 1 39 39 ALA H H 1 7.361 0.05 . 1 . . . . 37 ALA H . 6722 1
163 . 1 1 39 39 ALA C C 13 175.688 0.5 . 1 . . . . 37 ALA C . 6722 1
164 . 1 1 39 39 ALA CA C 13 52.442 0.5 . 1 . . . . 37 ALA CA . 6722 1
165 . 1 1 39 39 ALA CB C 13 20.108 0.5 . 1 . . . . 37 ALA CB . 6722 1
166 . 1 1 39 39 ALA N N 15 121.176 0.5 . 1 . . . . 37 ALA N . 6722 1
167 . 1 1 40 40 VAL H H 1 7.087 0.05 . 1 . . . . 38 VAL H . 6722 1
168 . 1 1 40 40 VAL C C 13 173.203 0.5 . 1 . . . . 38 VAL C . 6722 1
169 . 1 1 40 40 VAL CA C 13 59.511 0.5 . 1 . . . . 38 VAL CA . 6722 1
170 . 1 1 40 40 VAL CB C 13 34.56 0.5 . 1 . . . . 38 VAL CB . 6722 1
171 . 1 1 40 40 VAL N N 15 115.382 0.5 . 1 . . . . 38 VAL N . 6722 1
172 . 1 1 41 41 ARG H H 1 9.726 0.05 . 1 . . . . 39 ARG H . 6722 1
173 . 1 1 41 41 ARG C C 13 173.308 0.5 . 1 . . . . 39 ARG C . 6722 1
174 . 1 1 41 41 ARG CA C 13 54.166 0.5 . 1 . . . . 39 ARG CA . 6722 1
175 . 1 1 41 41 ARG CB C 13 31.632 0.5 . 1 . . . . 39 ARG CB . 6722 1
176 . 1 1 41 41 ARG N N 15 129.004 0.5 . 1 . . . . 39 ARG N . 6722 1
177 . 1 1 42 42 VAL H H 1 8.634 0.05 . 1 . . . . 40 VAL H . 6722 1
178 . 1 1 42 42 VAL C C 13 175.561 0.5 . 1 . . . . 40 VAL C . 6722 1
179 . 1 1 42 42 VAL CA C 13 60.098 0.5 . 1 . . . . 40 VAL CA . 6722 1
180 . 1 1 42 42 VAL CB C 13 33.11 0.5 . 1 . . . . 40 VAL CB . 6722 1
181 . 1 1 42 42 VAL N N 15 126.023 0.5 . 1 . . . . 40 VAL N . 6722 1
182 . 1 1 43 43 THR H H 1 8.858 0.05 . 1 . . . . 41 THR H . 6722 1
183 . 1 1 43 43 THR C C 13 172.971 0.5 . 1 . . . . 41 THR C . 6722 1
184 . 1 1 43 43 THR CA C 13 59.856 0.5 . 1 . . . . 41 THR CA . 6722 1
185 . 1 1 43 43 THR CB C 13 73.428 0.5 . 1 . . . . 41 THR CB . 6722 1
186 . 1 1 43 43 THR N N 15 116.993 0.5 . 1 . . . . 41 THR N . 6722 1
187 . 1 1 44 44 SER H H 1 8.026 0.05 . 1 . . . . 42 SER H . 6722 1
188 . 1 1 44 44 SER C C 13 171.181 0.5 . 1 . . . . 42 SER C . 6722 1
189 . 1 1 44 44 SER CA C 13 57.615 0.5 . 1 . . . . 42 SER CA . 6722 1
190 . 1 1 44 44 SER CB C 13 65.688 0.5 . 1 . . . . 42 SER CB . 6722 1
191 . 1 1 44 44 SER N N 15 109.585 0.5 . 1 . . . . 42 SER N . 6722 1
192 . 1 1 45 45 ALA H H 1 8.689 0.05 . 1 . . . . 43 ALA H . 6722 1
193 . 1 1 45 45 ALA C C 13 174.003 0.5 . 1 . . . . 43 ALA C . 6722 1
194 . 1 1 45 45 ALA CA C 13 50.579 0.5 . 1 . . . . 43 ALA CA . 6722 1
195 . 1 1 45 45 ALA CB C 13 20.108 0.5 . 1 . . . . 43 ALA CB . 6722 1
196 . 1 1 45 45 ALA N N 15 118.785 0.5 . 1 . . . . 43 ALA N . 6722 1
197 . 1 1 46 46 GLY H H 1 8.652 0.05 . 1 . . . . 44 GLY H . 6722 1
198 . 1 1 46 46 GLY C C 13 173.877 0.5 . 1 . . . . 44 GLY C . 6722 1
199 . 1 1 46 46 GLY CA C 13 41.986 0.5 . 1 . . . . 44 GLY CA . 6722 1
200 . 1 1 46 46 GLY N N 15 103.657 0.5 . 1 . . . . 44 GLY N . 6722 1
201 . 1 1 47 47 THR H H 1 9.156 0.05 . 1 . . . . 45 THR H . 6722 1
202 . 1 1 47 47 THR C C 13 176.425 0.5 . 1 . . . . 45 THR C . 6722 1
203 . 1 1 47 47 THR CA C 13 64.27 0.5 . 1 . . . . 45 THR CA . 6722 1
204 . 1 1 47 47 THR CB C 13 67.243 0.5 . 1 . . . . 45 THR CB . 6722 1
205 . 1 1 47 47 THR N N 15 113.945 0.5 . 1 . . . . 45 THR N . 6722 1
206 . 1 1 48 48 GLY H H 1 8.932 0.05 . 1 . . . . 46 GLY H . 6722 1
207 . 1 1 48 48 GLY C C 13 173.16 0.5 . 1 . . . . 46 GLY C . 6722 1
208 . 1 1 48 48 GLY CA C 13 43.295 0.5 . 1 . . . . 46 GLY CA . 6722 1
209 . 1 1 48 48 GLY N N 15 110.338 0.5 . 1 . . . . 46 GLY N . 6722 1
210 . 1 1 49 49 ASN H H 1 7.689 0.05 . 1 . . . . 47 ASN H . 6722 1
211 . 1 1 49 49 ASN CA C 13 51.097 0.5 . 1 . . . . 47 ASN CA . 6722 1
212 . 1 1 49 49 ASN CB C 13 38.171 0.5 . 1 . . . . 47 ASN CB . 6722 1
213 . 1 1 49 49 ASN N N 15 113.32 0.5 . 1 . . . . 47 ASN N . 6722 1
214 . 1 1 50 50 TRP C C 13 177.036 0.5 . 1 . . . . 48 TRP C . 6722 1
215 . 1 1 50 50 TRP CA C 13 60.236 0.5 . 1 . . . . 48 TRP CA . 6722 1
216 . 1 1 51 51 HIS H H 1 8.648 0.05 . 1 . . . . 49 HIS H . 6722 1
217 . 1 1 51 51 HIS C C 13 174.529 0.5 . 1 . . . . 49 HIS C . 6722 1
218 . 1 1 51 51 HIS CA C 13 53.304 0.5 . 1 . . . . 49 HIS CA . 6722 1
219 . 1 1 51 51 HIS CB C 13 29.89 0.5 . 1 . . . . 49 HIS CB . 6722 1
220 . 1 1 51 51 HIS N N 15 111.977 0.5 . 1 . . . . 49 HIS N . 6722 1
221 . 1 1 52 52 VAL H H 1 6.864 0.05 . 1 . . . . 50 VAL H . 6722 1
222 . 1 1 52 52 VAL C C 13 176.762 0.5 . 1 . . . . 50 VAL C . 6722 1
223 . 1 1 52 52 VAL CA C 13 65.271 0.5 . 1 . . . . 50 VAL CA . 6722 1
224 . 1 1 52 52 VAL CB C 13 30.687 0.5 . 1 . . . . 50 VAL CB . 6722 1
225 . 1 1 52 52 VAL N N 15 118.729 0.5 . 1 . . . . 50 VAL N . 6722 1
226 . 1 1 53 53 GLY H H 1 9.095 0.05 . 1 . . . . 51 GLY H . 6722 1
227 . 1 1 53 53 GLY C C 13 173.898 0.5 . 1 . . . . 51 GLY C . 6722 1
228 . 1 1 53 53 GLY CA C 13 44.339 0.5 . 1 . . . . 51 GLY CA . 6722 1
229 . 1 1 53 53 GLY N N 15 115.122 0.5 . 1 . . . . 51 GLY N . 6722 1
230 . 1 1 54 54 SER H H 1 8.387 0.05 . 1 . . . . 52 SER H . 6722 1
231 . 1 1 54 54 SER C C 13 173.287 0.5 . 1 . . . . 52 SER C . 6722 1
232 . 1 1 54 54 SER CA C 13 58.822 0.5 . 1 . . . . 52 SER CA . 6722 1
233 . 1 1 54 54 SER CB C 13 64.265 0.5 . 1 . . . . 52 SER CB . 6722 1
234 . 1 1 54 54 SER N N 15 116.269 0.5 . 1 . . . . 52 SER N . 6722 1
235 . 1 1 55 55 CYS H H 1 8.171 0.05 . 1 . . . . 53 CYS H . 6722 1
236 . 1 1 55 55 CYS C C 13 178.826 0.5 . 1 . . . . 53 CYS C . 6722 1
237 . 1 1 55 55 CYS CA C 13 57.132 0.5 . 1 . . . . 53 CYS CA . 6722 1
238 . 1 1 55 55 CYS CB C 13 27.639 0.5 . 1 . . . . 53 CYS CB . 6722 1
239 . 1 1 55 55 CYS N N 15 118.491 0.5 . 1 . . . . 53 CYS N . 6722 1
240 . 1 1 56 56 ALA H H 1 8.446 0.05 . 1 . . . . 54 ALA H . 6722 1
241 . 1 1 56 56 ALA C C 13 176.172 0.5 . 1 . . . . 54 ALA C . 6722 1
242 . 1 1 56 56 ALA CA C 13 52.062 0.5 . 1 . . . . 54 ALA CA . 6722 1
243 . 1 1 56 56 ALA CB C 13 16.046 0.5 . 1 . . . . 54 ALA CB . 6722 1
244 . 1 1 56 56 ALA N N 15 118.268 0.5 . 1 . . . . 54 ALA N . 6722 1
245 . 1 1 57 57 ASP H H 1 8.496 0.05 . 1 . . . . 55 ASP H . 6722 1
246 . 1 1 57 57 ASP C C 13 176.846 0.5 . 1 . . . . 55 ASP C . 6722 1
247 . 1 1 57 57 ASP CA C 13 54.407 0.5 . 1 . . . . 55 ASP CA . 6722 1
248 . 1 1 57 57 ASP CB C 13 45.517 0.5 . 1 . . . . 55 ASP CB . 6722 1
249 . 1 1 57 57 ASP N N 15 121.341 0.5 . 1 . . . . 55 ASP N . 6722 1
250 . 1 1 58 58 GLU H H 1 9.23 0.05 . 1 . . . . 56 GLU H . 6722 1
251 . 1 1 58 58 GLU C C 13 178.552 0.5 . 1 . . . . 56 GLU C . 6722 1
252 . 1 1 58 58 GLU CA C 13 59.132 0.5 . 1 . . . . 56 GLU CA . 6722 1
253 . 1 1 58 58 GLU CB C 13 28.798 0.5 . 1 . . . . 56 GLU CB . 6722 1
254 . 1 1 58 58 GLU N N 15 127.388 0.5 . 1 . . . . 56 GLU N . 6722 1
255 . 1 1 59 59 ARG H H 1 9.184 0.05 . 1 . . . . 57 ARG H . 6722 1
256 . 1 1 59 59 ARG C C 13 178.236 0.5 . 1 . . . . 57 ARG C . 6722 1
257 . 1 1 59 59 ARG CA C 13 57.615 0.5 . 1 . . . . 57 ARG CA . 6722 1
258 . 1 1 59 59 ARG CB C 13 26.626 0.5 . 1 . . . . 57 ARG CB . 6722 1
259 . 1 1 59 59 ARG N N 15 120.501 0.5 . 1 . . . . 57 ARG N . 6722 1
260 . 1 1 60 60 ALA H H 1 6.642 0.05 . 1 . . . . 58 ALA H . 6722 1
261 . 1 1 60 60 ALA C C 13 177.836 0.5 . 1 . . . . 58 ALA C . 6722 1
262 . 1 1 60 60 ALA CA C 13 54.2 0.5 . 1 . . . . 58 ALA CA . 6722 1
263 . 1 1 60 60 ALA CB C 13 17.841 0.5 . 1 . . . . 58 ALA CB . 6722 1
264 . 1 1 60 60 ALA N N 15 121.393 0.5 . 1 . . . . 58 ALA N . 6722 1
265 . 1 1 61 61 ALA H H 1 8.542 0.05 . 1 . . . . 59 ALA H . 6722 1
266 . 1 1 61 61 ALA C C 13 178.552 0.5 . 1 . . . . 59 ALA C . 6722 1
267 . 1 1 61 61 ALA CA C 13 54.732 0.5 . 1 . . . . 59 ALA CA . 6722 1
268 . 1 1 61 61 ALA CB C 13 17.558 0.5 . 1 . . . . 59 ALA CB . 6722 1
269 . 1 1 61 61 ALA N N 15 118.592 0.5 . 1 . . . . 59 ALA N . 6722 1
270 . 1 1 62 62 GLY H H 1 8.188 0.05 . 1 . . . . 60 GLY H . 6722 1
271 . 1 1 62 62 GLY C C 13 176.13 0.5 . 1 . . . . 60 GLY C . 6722 1
272 . 1 1 62 62 GLY CA C 13 46.745 0.5 . 1 . . . . 60 GLY CA . 6722 1
273 . 1 1 62 62 GLY N N 15 103.8 0.5 . 1 . . . . 60 GLY N . 6722 1
274 . 1 1 63 63 VAL H H 1 7.293 0.05 . 1 . . . . 61 VAL H . 6722 1
275 . 1 1 63 63 VAL C C 13 177.352 0.5 . 1 . . . . 61 VAL C . 6722 1
276 . 1 1 63 63 VAL CA C 13 65.822 0.5 . 1 . . . . 61 VAL CA . 6722 1
277 . 1 1 63 63 VAL CB C 13 31.254 0.5 . 1 . . . . 61 VAL CB . 6722 1
278 . 1 1 63 63 VAL N N 15 122.549 0.5 . 1 . . . . 61 VAL N . 6722 1
279 . 1 1 64 64 LEU H H 1 8.092 0.05 . 1 . . . . 62 LEU H . 6722 1
280 . 1 1 64 64 LEU C C 13 179.142 0.5 . 1 . . . . 62 LEU C . 6722 1
281 . 1 1 64 64 LEU CA C 13 58.442 0.5 . 1 . . . . 62 LEU CA . 6722 1
282 . 1 1 64 64 LEU CB C 13 40.823 0.5 . 1 . . . . 62 LEU CB . 6722 1
283 . 1 1 64 64 LEU N N 15 120.002 0.5 . 1 . . . . 62 LEU N . 6722 1
284 . 1 1 65 65 ARG H H 1 8.734 0.05 . 1 . . . . 63 ARG H . 6722 1
285 . 1 1 65 65 ARG C C 13 180.342 0.5 . 1 . . . . 63 ARG C . 6722 1
286 . 1 1 65 65 ARG CA C 13 58.925 0.5 . 1 . . . . 63 ARG CA . 6722 1
287 . 1 1 65 65 ARG CB C 13 29.648 0.5 . 1 . . . . 63 ARG CB . 6722 1
288 . 1 1 65 65 ARG N N 15 119.126 0.5 . 1 . . . . 63 ARG N . 6722 1
289 . 1 1 66 66 ALA H H 1 7.907 0.05 . 1 . . . . 64 ALA H . 6722 1
290 . 1 1 66 66 ALA C C 13 178.32 0.5 . 1 . . . . 64 ALA C . 6722 1
291 . 1 1 66 66 ALA CA C 13 53.994 0.5 . 1 . . . . 64 ALA CA . 6722 1
292 . 1 1 66 66 ALA CB C 13 17.369 0.5 . 1 . . . . 64 ALA CB . 6722 1
293 . 1 1 66 66 ALA N N 15 122.272 0.5 . 1 . . . . 64 ALA N . 6722 1
294 . 1 1 67 67 HIS H H 1 7.399 0.05 . 1 . . . . 65 HIS H . 6722 1
295 . 1 1 67 67 HIS C C 13 173.224 0.5 . 1 . . . . 65 HIS C . 6722 1
296 . 1 1 67 67 HIS CA C 13 54.794 0.5 . 1 . . . . 65 HIS CA . 6722 1
297 . 1 1 67 67 HIS CB C 13 29.459 0.5 . 1 . . . . 65 HIS CB . 6722 1
298 . 1 1 67 67 HIS N N 15 112.303 0.5 . 1 . . . . 65 HIS N . 6722 1
299 . 1 1 68 68 GLY H H 1 7.847 0.05 . 1 . . . . 66 GLY H . 6722 1
300 . 1 1 68 68 GLY C C 13 173.518 0.5 . 1 . . . . 66 GLY C . 6722 1
301 . 1 1 68 68 GLY CA C 13 45.801 0.5 . 1 . . . . 66 GLY CA . 6722 1
302 . 1 1 68 68 GLY N N 15 107.154 0.5 . 1 . . . . 66 GLY N . 6722 1
303 . 1 1 69 69 TYR H H 1 8.373 0.05 . 1 . . . . 67 TYR H . 6722 1
304 . 1 1 69 69 TYR CA C 13 56.58 0.5 . 1 . . . . 67 TYR CA . 6722 1
305 . 1 1 69 69 TYR CB C 13 39.283 0.5 . 1 . . . . 67 TYR CB . 6722 1
306 . 1 1 69 69 TYR N N 15 119.617 0.5 . 1 . . . . 67 TYR N . 6722 1
307 . 1 1 70 70 PRO C C 13 174.382 0.5 . 1 . . . . 68 PRO C . 6722 1
308 . 1 1 70 70 PRO CA C 13 62.204 0.5 . 1 . . . . 68 PRO CA . 6722 1
309 . 1 1 70 70 PRO CB C 13 32.102 0.5 . 1 . . . . 68 PRO CB . 6722 1
310 . 1 1 71 71 THR H H 1 7.847 0.05 . 1 . . . . 69 THR H . 6722 1
311 . 1 1 71 71 THR C C 13 174.34 0.5 . 1 . . . . 69 THR C . 6722 1
312 . 1 1 71 71 THR CA C 13 60.878 0.5 . 1 . . . . 69 THR CA . 6722 1
313 . 1 1 71 71 THR CB C 13 70.36 0.5 . 1 . . . . 69 THR CB . 6722 1
314 . 1 1 71 71 THR N N 15 100.304 0.5 . 1 . . . . 69 THR N . 6722 1
315 . 1 1 72 72 ASP H H 1 7.931 0.05 . 1 . . . . 70 ASP H . 6722 1
316 . 1 1 72 72 ASP C C 13 175.814 0.5 . 1 . . . . 70 ASP C . 6722 1
317 . 1 1 72 72 ASP CA C 13 55.573 0.5 . 1 . . . . 70 ASP CA . 6722 1
318 . 1 1 72 72 ASP CB C 13 40.318 0.5 . 1 . . . . 70 ASP CB . 6722 1
319 . 1 1 72 72 ASP N N 15 122.622 0.5 . 1 . . . . 70 ASP N . 6722 1
320 . 1 1 73 73 HIS H H 1 7.991 0.05 . 1 . . . . 71 HIS H . 6722 1
321 . 1 1 73 73 HIS C C 13 172.171 0.5 . 1 . . . . 71 HIS C . 6722 1
322 . 1 1 73 73 HIS CA C 13 56.89 0.5 . 1 . . . . 71 HIS CA . 6722 1
323 . 1 1 73 73 HIS CB C 13 34.655 0.5 . 1 . . . . 71 HIS CB . 6722 1
324 . 1 1 73 73 HIS N N 15 121.414 0.5 . 1 . . . . 71 HIS N . 6722 1
325 . 1 1 74 74 ARG H H 1 7.239 0.05 . 1 . . . . 72 ARG H . 6722 1
326 . 1 1 74 74 ARG C C 13 174.087 0.5 . 1 . . . . 72 ARG C . 6722 1
327 . 1 1 74 74 ARG CA C 13 53.856 0.5 . 1 . . . . 72 ARG CA . 6722 1
328 . 1 1 74 74 ARG CB C 13 31.632 0.5 . 1 . . . . 72 ARG CB . 6722 1
329 . 1 1 74 74 ARG N N 15 125.45 0.5 . 1 . . . . 72 ARG N . 6722 1
330 . 1 1 75 75 ALA H H 1 9.077 0.05 . 1 . . . . 73 ALA H . 6722 1
331 . 1 1 75 75 ALA C C 13 177.31 0.5 . 1 . . . . 73 ALA C . 6722 1
332 . 1 1 75 75 ALA CA C 13 51.648 0.5 . 1 . . . . 73 ALA CA . 6722 1
333 . 1 1 75 75 ALA CB C 13 18.219 0.5 . 1 . . . . 73 ALA CB . 6722 1
334 . 1 1 75 75 ALA N N 15 127.743 0.5 . 1 . . . . 73 ALA N . 6722 1
335 . 1 1 76 76 ALA H H 1 9.391 0.05 . 1 . . . . 74 ALA H . 6722 1
336 . 1 1 76 76 ALA C C 13 175.372 0.5 . 1 . . . . 74 ALA C . 6722 1
337 . 1 1 76 76 ALA CA C 13 50.372 0.5 . 1 . . . . 74 ALA CA . 6722 1
338 . 1 1 76 76 ALA CB C 13 22.942 0.5 . 1 . . . . 74 ALA CB . 6722 1
339 . 1 1 76 76 ALA N N 15 125.891 0.5 . 1 . . . . 74 ALA N . 6722 1
340 . 1 1 77 77 GLN H H 1 8.814 0.05 . 1 . . . . 75 GLN H . 6722 1
341 . 1 1 77 77 GLN C C 13 174.024 0.5 . 1 . . . . 75 GLN C . 6722 1
342 . 1 1 77 77 GLN CA C 13 52.993 0.5 . 1 . . . . 75 GLN CA . 6722 1
343 . 1 1 77 77 GLN CB C 13 29.356 0.5 . 1 . . . . 75 GLN CB . 6722 1
344 . 1 1 77 77 GLN N N 15 123.101 0.5 . 1 . . . . 75 GLN N . 6722 1
345 . 1 1 78 78 VAL H H 1 8.535 0.05 . 1 . . . . 76 VAL H . 6722 1
346 . 1 1 78 78 VAL C C 13 174.972 0.5 . 1 . . . . 76 VAL C . 6722 1
347 . 1 1 78 78 VAL CA C 13 63.167 0.5 . 1 . . . . 76 VAL CA . 6722 1
348 . 1 1 78 78 VAL CB C 13 32.01 0.5 . 1 . . . . 76 VAL CB . 6722 1
349 . 1 1 78 78 VAL N N 15 125.226 0.5 . 1 . . . . 76 VAL N . 6722 1
350 . 1 1 79 79 GLY H H 1 10.944 0.05 . 1 . . . . 77 GLY H . 6722 1
351 . 1 1 79 79 GLY C C 13 173.94 0.5 . 1 . . . . 77 GLY C . 6722 1
352 . 1 1 79 79 GLY CA C 13 43.25 0.5 . 1 . . . . 77 GLY CA . 6722 1
353 . 1 1 79 79 GLY N N 15 121.792 0.5 . 1 . . . . 77 GLY N . 6722 1
354 . 1 1 80 80 THR H H 1 8.545 0.05 . 1 . . . . 78 THR H . 6722 1
355 . 1 1 80 80 THR C C 13 176.362 0.5 . 1 . . . . 78 THR C . 6722 1
356 . 1 1 80 80 THR CA C 13 66.098 0.5 . 1 . . . . 78 THR CA . 6722 1
357 . 1 1 80 80 THR CB C 13 68.377 0.5 . 1 . . . . 78 THR CB . 6722 1
358 . 1 1 80 80 THR N N 15 114.92 0.5 . 1 . . . . 78 THR N . 6722 1
359 . 1 1 81 81 GLU H H 1 9.09 0.05 . 1 . . . . 79 GLU H . 6722 1
360 . 1 1 81 81 GLU C C 13 177.604 0.5 . 1 . . . . 79 GLU C . 6722 1
361 . 1 1 81 81 GLU CA C 13 58.546 0.5 . 1 . . . . 79 GLU CA . 6722 1
362 . 1 1 81 81 GLU CB C 13 28.359 0.5 . 1 . . . . 79 GLU CB . 6722 1
363 . 1 1 81 81 GLU N N 15 118.986 0.5 . 1 . . . . 79 GLU N . 6722 1
364 . 1 1 82 82 HIS H H 1 7.007 0.05 . 1 . . . . 80 HIS H . 6722 1
365 . 1 1 82 82 HIS C C 13 176.804 0.5 . 1 . . . . 80 HIS C . 6722 1
366 . 1 1 82 82 HIS CA C 13 59.96 0.5 . 1 . . . . 80 HIS CA . 6722 1
367 . 1 1 82 82 HIS CB C 13 30.215 0.5 . 1 . . . . 80 HIS CB . 6722 1
368 . 1 1 82 82 HIS N N 15 118.115 0.5 . 1 . . . . 80 HIS N . 6722 1
369 . 1 1 83 83 LEU H H 1 7.862 0.05 . 1 . . . . 81 LEU H . 6722 1
370 . 1 1 83 83 LEU C C 13 176.172 0.5 . 1 . . . . 81 LEU C . 6722 1
371 . 1 1 83 83 LEU CA C 13 56.166 0.5 . 1 . . . . 81 LEU CA . 6722 1
372 . 1 1 83 83 LEU CB C 13 40.164 0.5 . 1 . . . . 81 LEU CB . 6722 1
373 . 1 1 83 83 LEU N N 15 113.677 0.5 . 1 . . . . 81 LEU N . 6722 1
374 . 1 1 84 84 ALA H H 1 6.934 0.05 . 1 . . . . 82 ALA H . 6722 1
375 . 1 1 84 84 ALA C C 13 176.32 0.5 . 1 . . . . 82 ALA C . 6722 1
376 . 1 1 84 84 ALA CA C 13 50.614 0.5 . 1 . . . . 82 ALA CA . 6722 1
377 . 1 1 84 84 ALA CB C 13 18.502 0.5 . 1 . . . . 82 ALA CB . 6722 1
378 . 1 1 84 84 ALA N N 15 118.687 0.5 . 1 . . . . 82 ALA N . 6722 1
379 . 1 1 85 85 ALA H H 1 7.28 0.05 . 1 . . . . 83 ALA H . 6722 1
380 . 1 1 85 85 ALA C C 13 174.424 0.5 . 1 . . . . 83 ALA C . 6722 1
381 . 1 1 85 85 ALA CA C 13 52.821 0.5 . 1 . . . . 83 ALA CA . 6722 1
382 . 1 1 85 85 ALA CB C 13 16.613 0.5 . 1 . . . . 83 ALA CB . 6722 1
383 . 1 1 85 85 ALA N N 15 122.321 0.5 . 1 . . . . 83 ALA N . 6722 1
384 . 1 1 86 86 ASP H H 1 8.415 0.05 . 1 . . . . 84 ASP H . 6722 1
385 . 1 1 86 86 ASP C C 13 174.74 0.5 . 1 . . . . 84 ASP C . 6722 1
386 . 1 1 86 86 ASP CA C 13 57.17 0.5 . 1 . . . . 84 ASP CA . 6722 1
387 . 1 1 86 86 ASP CB C 13 42.202 0.5 . 1 . . . . 84 ASP CB . 6722 1
388 . 1 1 86 86 ASP N N 15 118.347 0.5 . 1 . . . . 84 ASP N . 6722 1
389 . 1 1 87 87 LEU H H 1 7.258 0.05 . 1 . . . . 85 LEU H . 6722 1
390 . 1 1 87 87 LEU C C 13 171.918 0.5 . 1 . . . . 85 LEU C . 6722 1
391 . 1 1 87 87 LEU CA C 13 54.545 0.5 . 1 . . . . 85 LEU CA . 6722 1
392 . 1 1 87 87 LEU CB C 13 44.573 0.5 . 1 . . . . 85 LEU CB . 6722 1
393 . 1 1 87 87 LEU N N 15 114.832 0.5 . 1 . . . . 85 LEU N . 6722 1
394 . 1 1 88 88 LEU H H 1 8.772 0.05 . 1 . . . . 86 LEU H . 6722 1
395 . 1 1 88 88 LEU C C 13 173.097 0.5 . 1 . . . . 86 LEU C . 6722 1
396 . 1 1 88 88 LEU CA C 13 54.718 0.5 . 1 . . . . 86 LEU CA . 6722 1
397 . 1 1 88 88 LEU CB C 13 41.55 0.5 . 1 . . . . 86 LEU CB . 6722 1
398 . 1 1 88 88 LEU N N 15 127.861 0.5 . 1 . . . . 86 LEU N . 6722 1
399 . 1 1 89 89 VAL H H 1 8.999 0.05 . 1 . . . . 87 VAL H . 6722 1
400 . 1 1 89 89 VAL C C 13 174.74 0.5 . 1 . . . . 87 VAL C . 6722 1
401 . 1 1 89 89 VAL CA C 13 59.477 0.5 . 1 . . . . 87 VAL CA . 6722 1
402 . 1 1 89 89 VAL CB C 13 30.215 0.5 . 1 . . . . 87 VAL CB . 6722 1
403 . 1 1 89 89 VAL N N 15 122.23 0.5 . 1 . . . . 87 VAL N . 6722 1
404 . 1 1 90 90 ALA H H 1 8.577 0.05 . 1 . . . . 88 ALA H . 6722 1
405 . 1 1 90 90 ALA C C 13 176.383 0.5 . 1 . . . . 88 ALA C . 6722 1
406 . 1 1 90 90 ALA CA C 13 50.166 0.5 . 1 . . . . 88 ALA CA . 6722 1
407 . 1 1 90 90 ALA CB C 13 20.108 0.5 . 1 . . . . 88 ALA CB . 6722 1
408 . 1 1 90 90 ALA N N 15 129.516 0.5 . 1 . . . . 88 ALA N . 6722 1
409 . 1 1 91 91 LEU H H 1 8.51 0.05 . 1 . . . . 89 LEU H . 6722 1
410 . 1 1 91 91 LEU CA C 13 54.862 0.5 . 1 . . . . 89 LEU CA . 6722 1
411 . 1 1 91 91 LEU N N 15 128.912 0.5 . 1 . . . . 89 LEU N . 6722 1
412 . 1 1 92 92 ASP C C 13 175.604 0.5 . 1 . . . . 90 ASP C . 6722 1
413 . 1 1 92 92 ASP CA C 13 52.671 0.5 . 1 . . . . 90 ASP CA . 6722 1
414 . 1 1 92 92 ASP CB C 13 42.949 0.5 . 1 . . . . 90 ASP CB . 6722 1
415 . 1 1 93 93 ARG H H 1 8.616 0.05 . 1 . . . . 91 ARG H . 6722 1
416 . 1 1 93 93 ARG C C 13 178.7 0.5 . 1 . . . . 91 ARG C . 6722 1
417 . 1 1 93 93 ARG CA C 13 58.479 0.5 . 1 . . . . 91 ARG CA . 6722 1
418 . 1 1 93 93 ARG CB C 13 29.64 0.5 . 1 . . . . 91 ARG CB . 6722 1
419 . 1 1 93 93 ARG N N 15 116.801 0.5 . 1 . . . . 91 ARG N . 6722 1
420 . 1 1 94 94 ASN H H 1 8.547 0.05 . 1 . . . . 92 ASN H . 6722 1
421 . 1 1 94 94 ASN C C 13 177.499 0.5 . 1 . . . . 92 ASN C . 6722 1
422 . 1 1 94 94 ASN CA C 13 55.614 0.5 . 1 . . . . 92 ASN CA . 6722 1
423 . 1 1 94 94 ASN CB C 13 36.922 0.5 . 1 . . . . 92 ASN CB . 6722 1
424 . 1 1 94 94 ASN N N 15 120.265 0.5 . 1 . . . . 92 ASN N . 6722 1
425 . 1 1 95 95 HIS H H 1 7.41 0.05 . 1 . . . . 93 HIS H . 6722 1
426 . 1 1 95 95 HIS C C 13 176.825 0.5 . 1 . . . . 93 HIS C . 6722 1
427 . 1 1 95 95 HIS CA C 13 59.132 0.5 . 1 . . . . 93 HIS CA . 6722 1
428 . 1 1 95 95 HIS CB C 13 30.782 0.5 . 1 . . . . 93 HIS CB . 6722 1
429 . 1 1 95 95 HIS N N 15 120.632 0.5 . 1 . . . . 93 HIS N . 6722 1
430 . 1 1 96 96 ALA H H 1 7.185 0.05 . 1 . . . . 94 ALA H . 6722 1
431 . 1 1 96 96 ALA C C 13 177.625 0.5 . 1 . . . . 94 ALA C . 6722 1
432 . 1 1 96 96 ALA CA C 13 54.994 0.5 . 1 . . . . 94 ALA CA . 6722 1
433 . 1 1 96 96 ALA CB C 13 17.369 0.5 . 1 . . . . 94 ALA CB . 6722 1
434 . 1 1 96 96 ALA N N 15 118.063 0.5 . 1 . . . . 94 ALA N . 6722 1
435 . 1 1 97 97 ARG H H 1 7.596 0.05 . 1 . . . . 95 ARG H . 6722 1
436 . 1 1 97 97 ARG C C 13 178.615 0.5 . 1 . . . . 95 ARG C . 6722 1
437 . 1 1 97 97 ARG CA C 13 59.029 0.5 . 1 . . . . 95 ARG CA . 6722 1
438 . 1 1 97 97 ARG CB C 13 29.459 0.5 . 1 . . . . 95 ARG CB . 6722 1
439 . 1 1 97 97 ARG N N 15 116.886 0.5 . 1 . . . . 95 ARG N . 6722 1
440 . 1 1 98 98 LEU H H 1 8.004 0.05 . 1 . . . . 96 LEU H . 6722 1
441 . 1 1 98 98 LEU CA C 13 57.408 0.5 . 1 . . . . 96 LEU CA . 6722 1
442 . 1 1 98 98 LEU CB C 13 40.795 0.5 . 1 . . . . 96 LEU CB . 6722 1
443 . 1 1 98 98 LEU N N 15 120.367 0.5 . 1 . . . . 96 LEU N . 6722 1
444 . 1 1 100 100 ARG C C 13 180.995 0.5 . 1 . . . . 98 ARG C . 6722 1
445 . 1 1 100 100 ARG CA C 13 58.035 0.5 . 1 . . . . 98 ARG CA . 6722 1
446 . 1 1 100 100 ARG CB C 13 29.806 0.5 . 1 . . . . 98 ARG CB . 6722 1
447 . 1 1 101 101 GLN H H 1 8.023 0.05 . 1 . . . . 99 GLN H . 6722 1
448 . 1 1 101 101 GLN C C 13 177.499 0.5 . 1 . . . . 99 GLN C . 6722 1
449 . 1 1 101 101 GLN CA C 13 58.132 0.5 . 1 . . . . 99 GLN CA . 6722 1
450 . 1 1 101 101 GLN CB C 13 27.665 0.5 . 1 . . . . 99 GLN CB . 6722 1
451 . 1 1 101 101 GLN N N 15 121.048 0.5 . 1 . . . . 99 GLN N . 6722 1
452 . 1 1 102 102 LEU H H 1 7.754 0.05 . 1 . . . . 100 LEU H . 6722 1
453 . 1 1 102 102 LEU C C 13 176.551 0.5 . 1 . . . . 100 LEU C . 6722 1
454 . 1 1 102 102 LEU CA C 13 54.959 0.5 . 1 . . . . 100 LEU CA . 6722 1
455 . 1 1 102 102 LEU CB C 13 41.834 0.5 . 1 . . . . 100 LEU CB . 6722 1
456 . 1 1 102 102 LEU N N 15 118.714 0.5 . 1 . . . . 100 LEU N . 6722 1
457 . 1 1 103 103 GLY H H 1 7.702 0.05 . 1 . . . . 101 GLY H . 6722 1
458 . 1 1 103 103 GLY C C 13 173.666 0.5 . 1 . . . . 101 GLY C . 6722 1
459 . 1 1 103 103 GLY CA C 13 44.478 0.5 . 1 . . . . 101 GLY CA . 6722 1
460 . 1 1 103 103 GLY N N 15 105.501 0.5 . 1 . . . . 101 GLY N . 6722 1
461 . 1 1 104 104 VAL H H 1 7.494 0.05 . 1 . . . . 102 VAL H . 6722 1
462 . 1 1 104 104 VAL C C 13 174.719 0.5 . 1 . . . . 102 VAL C . 6722 1
463 . 1 1 104 104 VAL CA C 13 63.167 0.5 . 1 . . . . 102 VAL CA . 6722 1
464 . 1 1 104 104 VAL CB C 13 30.876 0.5 . 1 . . . . 102 VAL CB . 6722 1
465 . 1 1 104 104 VAL N N 15 122.074 0.5 . 1 . . . . 102 VAL N . 6722 1
466 . 1 1 105 105 GLU H H 1 9.215 0.05 . 1 . . . . 103 GLU H . 6722 1
467 . 1 1 105 105 GLU C C 13 176.067 0.5 . 1 . . . . 103 GLU C . 6722 1
468 . 1 1 105 105 GLU CA C 13 56.339 0.5 . 1 . . . . 103 GLU CA . 6722 1
469 . 1 1 105 105 GLU CB C 13 28.231 0.5 . 1 . . . . 103 GLU CB . 6722 1
470 . 1 1 105 105 GLU N N 15 128.767 0.5 . 1 . . . . 103 GLU N . 6722 1
471 . 1 1 106 106 ALA H H 1 8.488 0.05 . 1 . . . . 104 ALA H . 6722 1
472 . 1 1 106 106 ALA C C 13 179.331 0.5 . 1 . . . . 104 ALA C . 6722 1
473 . 1 1 106 106 ALA CA C 13 55.132 0.5 . 1 . . . . 104 ALA CA . 6722 1
474 . 1 1 106 106 ALA CB C 13 17.558 0.5 . 1 . . . . 104 ALA CB . 6722 1
475 . 1 1 106 106 ALA N N 15 124.098 0.5 . 1 . . . . 104 ALA N . 6722 1
476 . 1 1 107 107 ALA H H 1 8.266 0.05 . 1 . . . . 105 ALA H . 6722 1
477 . 1 1 107 107 ALA C C 13 178.026 0.5 . 1 . . . . 105 ALA C . 6722 1
478 . 1 1 107 107 ALA CA C 13 53.511 0.5 . 1 . . . . 105 ALA CA . 6722 1
479 . 1 1 107 107 ALA CB C 13 18.53 0.5 . 1 . . . . 105 ALA CB . 6722 1
480 . 1 1 107 107 ALA N N 15 114.763 0.5 . 1 . . . . 105 ALA N . 6722 1
481 . 1 1 108 108 ARG H H 1 7.739 0.05 . 1 . . . . 106 ARG H . 6722 1
482 . 1 1 108 108 ARG C C 13 172.297 0.5 . 1 . . . . 106 ARG C . 6722 1
483 . 1 1 108 108 ARG CA C 13 55.994 0.5 . 1 . . . . 106 ARG CA . 6722 1
484 . 1 1 108 108 ARG CB C 13 31.726 0.5 . 1 . . . . 106 ARG CB . 6722 1
485 . 1 1 108 108 ARG N N 15 114.852 0.5 . 1 . . . . 106 ARG N . 6722 1
486 . 1 1 109 109 VAL H H 1 7.279 0.05 . 1 . . . . 107 VAL H . 6722 1
487 . 1 1 109 109 VAL C C 13 174.909 0.5 . 1 . . . . 107 VAL C . 6722 1
488 . 1 1 109 109 VAL CA C 13 60.201 0.5 . 1 . . . . 107 VAL CA . 6722 1
489 . 1 1 109 109 VAL CB C 13 32.954 0.5 . 1 . . . . 107 VAL CB . 6722 1
490 . 1 1 109 109 VAL N N 15 117.929 0.5 . 1 . . . . 107 VAL N . 6722 1
491 . 1 1 110 110 ARG H H 1 8.387 0.05 . 1 . . . . 108 ARG H . 6722 1
492 . 1 1 110 110 ARG C C 13 175.14 0.5 . 1 . . . . 108 ARG C . 6722 1
493 . 1 1 110 110 ARG CA C 13 51.2 0.5 . 1 . . . . 108 ARG CA . 6722 1
494 . 1 1 110 110 ARG CB C 13 34.371 0.5 . 1 . . . . 108 ARG CB . 6722 1
495 . 1 1 110 110 ARG N N 15 123.864 0.5 . 1 . . . . 108 ARG N . 6722 1
496 . 1 1 111 111 MET H H 1 8.926 0.05 . 1 . . . . 109 MET H . 6722 1
497 . 1 1 111 111 MET C C 13 179.1 0.5 . 1 . . . . 109 MET C . 6722 1
498 . 1 1 111 111 MET CA C 13 53.438 0.5 . 1 . . . . 109 MET CA . 6722 1
499 . 1 1 111 111 MET CB C 13 30.121 0.5 . 1 . . . . 109 MET CB . 6722 1
500 . 1 1 111 111 MET N N 15 119.669 0.5 . 1 . . . . 109 MET N . 6722 1
501 . 1 1 112 112 LEU H H 1 9.175 0.05 . 1 . . . . 110 LEU H . 6722 1
502 . 1 1 112 112 LEU C C 13 177.394 0.5 . 1 . . . . 110 LEU C . 6722 1
503 . 1 1 112 112 LEU CA C 13 59.003 0.5 . 1 . . . . 110 LEU CA . 6722 1
504 . 1 1 112 112 LEU CB C 13 40.133 0.5 . 1 . . . . 110 LEU CB . 6722 1
505 . 1 1 112 112 LEU N N 15 128.19 0.5 . 1 . . . . 110 LEU N . 6722 1
506 . 1 1 113 113 ARG H H 1 8.92 0.05 . 1 . . . . 111 ARG H . 6722 1
507 . 1 1 113 113 ARG C C 13 177.078 0.5 . 1 . . . . 111 ARG C . 6722 1
508 . 1 1 113 113 ARG CA C 13 59.442 0.5 . 1 . . . . 111 ARG CA . 6722 1
509 . 1 1 113 113 ARG CB C 13 27.854 0.5 . 1 . . . . 111 ARG CB . 6722 1
510 . 1 1 113 113 ARG N N 15 111.506 0.5 . 1 . . . . 111 ARG N . 6722 1
511 . 1 1 114 114 SER H H 1 7.651 0.05 . 1 . . . . 112 SER H . 6722 1
512 . 1 1 114 114 SER C C 13 174.15 0.5 . 1 . . . . 112 SER C . 6722 1
513 . 1 1 114 114 SER CA C 13 60.537 0.5 . 1 . . . . 112 SER CA . 6722 1
514 . 1 1 114 114 SER CB C 13 62.898 0.5 . 1 . . . . 112 SER CB . 6722 1
515 . 1 1 114 114 SER N N 15 114.579 0.5 . 1 . . . . 112 SER N . 6722 1
516 . 1 1 115 115 PHE H H 1 7.583 0.05 . 1 . . . . 113 PHE H . 6722 1
517 . 1 1 115 115 PHE C C 13 174.656 0.5 . 1 . . . . 113 PHE C . 6722 1
518 . 1 1 115 115 PHE CA C 13 59.373 0.5 . 1 . . . . 113 PHE CA . 6722 1
519 . 1 1 115 115 PHE CB C 13 39.189 0.5 . 1 . . . . 113 PHE CB . 6722 1
520 . 1 1 115 115 PHE N N 15 118.962 0.5 . 1 . . . . 113 PHE N . 6722 1
521 . 1 1 116 116 ASP H H 1 7.403 0.05 . 1 . . . . 114 ASP H . 6722 1
522 . 1 1 116 116 ASP CA C 13 50.579 0.5 . 1 . . . . 114 ASP CA . 6722 1
523 . 1 1 116 116 ASP CB C 13 41.928 0.5 . 1 . . . . 114 ASP CB . 6722 1
524 . 1 1 116 116 ASP N N 15 120.909 0.5 . 1 . . . . 114 ASP N . 6722 1
525 . 1 1 117 117 PRO C C 13 177.331 0.5 . 1 . . . . 115 PRO C . 6722 1
526 . 1 1 117 117 PRO CA C 13 63.926 0.5 . 1 . . . . 115 PRO CA . 6722 1
527 . 1 1 117 117 PRO CB C 13 31.529 0.5 . 1 . . . . 115 PRO CB . 6722 1
528 . 1 1 118 118 ARG H H 1 8.594 0.05 . 1 . . . . 116 ARG H . 6722 1
529 . 1 1 118 118 ARG C C 13 176.783 0.5 . 1 . . . . 116 ARG C . 6722 1
530 . 1 1 118 118 ARG CA C 13 55.856 0.5 . 1 . . . . 116 ARG CA . 6722 1
531 . 1 1 118 118 ARG CB C 13 29.347 0.5 . 1 . . . . 116 ARG CB . 6722 1
532 . 1 1 118 118 ARG N N 15 117.61 0.5 . 1 . . . . 116 ARG N . 6722 1
533 . 1 1 119 119 SER H H 1 7.96 0.05 . 1 . . . . 117 SER H . 6722 1
534 . 1 1 119 119 SER CA C 13 59.408 0.5 . 1 . . . . 117 SER CA . 6722 1
535 . 1 1 119 119 SER CB C 13 63.276 0.5 . 1 . . . . 117 SER CB . 6722 1
536 . 1 1 119 119 SER N N 15 115.864 0.5 . 1 . . . . 117 SER N . 6722 1
537 . 1 1 120 120 GLY H H 1 8.203 0.05 . 1 . . . . 118 GLY H . 6722 1
538 . 1 1 120 120 GLY CA C 13 44.718 0.5 . 1 . . . . 118 GLY CA . 6722 1
539 . 1 1 120 120 GLY N N 15 110.142 0.5 . 1 . . . . 118 GLY N . 6722 1
540 . 1 1 121 121 THR H H 1 8.248 0.05 . 1 . . . . 119 THR H . 6722 1
541 . 1 1 121 121 THR C C 13 173.898 0.5 . 1 . . . . 119 THR C . 6722 1
542 . 1 1 121 121 THR CA C 13 62.925 0.5 . 1 . . . . 119 THR CA . 6722 1
543 . 1 1 121 121 THR N N 15 113.042 0.5 . 1 . . . . 119 THR N . 6722 1
544 . 1 1 122 122 HIS H H 1 7.945 0.05 . 1 . . . . 120 HIS H . 6722 1
545 . 1 1 122 122 HIS C C 13 174.298 0.5 . 1 . . . . 120 HIS C . 6722 1
546 . 1 1 122 122 HIS CA C 13 55.27 0.5 . 1 . . . . 120 HIS CA . 6722 1
547 . 1 1 122 122 HIS CB C 13 30.215 0.5 . 1 . . . . 120 HIS CB . 6722 1
548 . 1 1 122 122 HIS N N 15 119.086 0.5 . 1 . . . . 120 HIS N . 6722 1
549 . 1 1 123 123 ALA H H 1 8.005 0.05 . 1 . . . . 121 ALA H . 6722 1
550 . 1 1 123 123 ALA C C 13 175.519 0.5 . 1 . . . . 121 ALA C . 6722 1
551 . 1 1 123 123 ALA CA C 13 50.993 0.5 . 1 . . . . 121 ALA CA . 6722 1
552 . 1 1 123 123 ALA N N 15 125.653 0.5 . 1 . . . . 121 ALA N . 6722 1
553 . 1 1 124 124 LEU H H 1 7.85 0.05 . 1 . . . . 122 LEU H . 6722 1
554 . 1 1 124 124 LEU C C 13 175.772 0.5 . 1 . . . . 122 LEU C . 6722 1
555 . 1 1 124 124 LEU CA C 13 53.856 0.5 . 1 . . . . 122 LEU CA . 6722 1
556 . 1 1 124 124 LEU CB C 13 43.062 0.5 . 1 . . . . 122 LEU CB . 6722 1
557 . 1 1 124 124 LEU N N 15 119.644 0.5 . 1 . . . . 122 LEU N . 6722 1
558 . 1 1 125 125 ASP H H 1 8.307 0.05 . 1 . . . . 123 ASP H . 6722 1
559 . 1 1 125 125 ASP C C 13 176.699 0.5 . 1 . . . . 123 ASP C . 6722 1
560 . 1 1 125 125 ASP CA C 13 54.787 0.5 . 1 . . . . 123 ASP CA . 6722 1
561 . 1 1 125 125 ASP CB C 13 41.928 0.5 . 1 . . . . 123 ASP CB . 6722 1
562 . 1 1 125 125 ASP N N 15 118.837 0.5 . 1 . . . . 123 ASP N . 6722 1
563 . 1 1 126 126 VAL H H 1 7.861 0.05 . 1 . . . . 124 VAL H . 6722 1
564 . 1 1 126 126 VAL C C 13 174.593 0.5 . 1 . . . . 124 VAL C . 6722 1
565 . 1 1 126 126 VAL CA C 13 61.886 0.5 . 1 . . . . 124 VAL CA . 6722 1
566 . 1 1 126 126 VAL CB C 13 30.233 0.5 . 1 . . . . 124 VAL CB . 6722 1
567 . 1 1 126 126 VAL N N 15 121.62 0.5 . 1 . . . . 124 VAL N . 6722 1
568 . 1 1 127 127 GLU H H 1 9.199 0.05 . 1 . . . . 125 GLU H . 6722 1
569 . 1 1 127 127 GLU C C 13 175.435 0.5 . 1 . . . . 125 GLU C . 6722 1
570 . 1 1 127 127 GLU CA C 13 56.477 0.5 . 1 . . . . 125 GLU CA . 6722 1
571 . 1 1 127 127 GLU CB C 13 29.15 0.5 . 1 . . . . 125 GLU CB . 6722 1
572 . 1 1 127 127 GLU N N 15 129.477 0.5 . 1 . . . . 125 GLU N . 6722 1
573 . 1 1 128 128 ASP H H 1 8.689 0.05 . 1 . . . . 126 ASP H . 6722 1
574 . 1 1 128 128 ASP CA C 13 51.166 0.5 . 1 . . . . 126 ASP CA . 6722 1
575 . 1 1 128 128 ASP CB C 13 41.847 0.5 . 1 . . . . 126 ASP CB . 6722 1
576 . 1 1 128 128 ASP N N 15 121.849 0.5 . 1 . . . . 126 ASP N . 6722 1
577 . 1 1 129 129 PRO C C 13 176.383 0.5 . 1 . . . . 127 PRO C . 6722 1
578 . 1 1 129 129 PRO CA C 13 66.581 0.5 . 1 . . . . 127 PRO CA . 6722 1
579 . 1 1 129 129 PRO CB C 13 30.408 0.5 . 1 . . . . 127 PRO CB . 6722 1
580 . 1 1 130 130 TYR H H 1 8.046 0.05 . 1 . . . . 128 TYR H . 6722 1
581 . 1 1 130 130 TYR C C 13 176.572 0.5 . 1 . . . . 128 TYR C . 6722 1
582 . 1 1 130 130 TYR CA C 13 62.201 0.5 . 1 . . . . 128 TYR CA . 6722 1
583 . 1 1 130 130 TYR CB C 13 38.594 0.5 . 1 . . . . 128 TYR CB . 6722 1
584 . 1 1 130 130 TYR N N 15 118.907 0.5 . 1 . . . . 128 TYR N . 6722 1
585 . 1 1 131 131 TYR H H 1 8.66 0.05 . 1 . . . . 129 TYR H . 6722 1
586 . 1 1 131 131 TYR C C 13 174.951 0.5 . 1 . . . . 129 TYR C . 6722 1
587 . 1 1 131 131 TYR CA C 13 57.925 0.5 . 1 . . . . 129 TYR CA . 6722 1
588 . 1 1 131 131 TYR CB C 13 35.989 0.5 . 1 . . . . 129 TYR CB . 6722 1
589 . 1 1 131 131 TYR N N 15 115.992 0.5 . 1 . . . . 129 TYR N . 6722 1
590 . 1 1 132 132 GLY H H 1 8.053 0.05 . 1 . . . . 130 GLY H . 6722 1
591 . 1 1 132 132 GLY C C 13 172.381 0.5 . 1 . . . . 130 GLY C . 6722 1
592 . 1 1 132 132 GLY CA C 13 43.574 0.5 . 1 . . . . 130 GLY CA . 6722 1
593 . 1 1 132 132 GLY N N 15 110.646 0.5 . 1 . . . . 130 GLY N . 6722 1
594 . 1 1 133 133 ASP H H 1 9.305 0.05 . 1 . . . . 131 ASP H . 6722 1
595 . 1 1 133 133 ASP CA C 13 51.442 0.5 . 1 . . . . 131 ASP CA . 6722 1
596 . 1 1 133 133 ASP CB C 13 42.967 0.5 . 1 . . . . 131 ASP CB . 6722 1
597 . 1 1 133 133 ASP N N 15 121.411 0.5 . 1 . . . . 131 ASP N . 6722 1
598 . 1 1 134 134 HIS C C 13 177.331 0.5 . 1 . . . . 132 HIS C . 6722 1
599 . 1 1 134 134 HIS CA C 13 60.994 0.5 . 1 . . . . 132 HIS CA . 6722 1
600 . 1 1 134 134 HIS CB C 13 29.566 0.5 . 1 . . . . 132 HIS CB . 6722 1
601 . 1 1 135 135 SER H H 1 8.398 0.05 . 1 . . . . 133 SER H . 6722 1
602 . 1 1 135 135 SER C C 13 176.72 0.5 . 1 . . . . 133 SER C . 6722 1
603 . 1 1 135 135 SER CA C 13 61.667 0.5 . 1 . . . . 133 SER CA . 6722 1
604 . 1 1 135 135 SER CB C 13 66.672 0.5 . 1 . . . . 133 SER CB . 6722 1
605 . 1 1 135 135 SER N N 15 115.163 0.5 . 1 . . . . 133 SER N . 6722 1
606 . 1 1 136 136 ASP H H 1 7.967 0.05 . 1 . . . . 134 ASP H . 6722 1
607 . 1 1 136 136 ASP C C 13 179.079 0.5 . 1 . . . . 134 ASP C . 6722 1
608 . 1 1 136 136 ASP CA C 13 57.442 0.5 . 1 . . . . 134 ASP CA . 6722 1
609 . 1 1 136 136 ASP CB C 13 40.228 0.5 . 1 . . . . 134 ASP CB . 6722 1
610 . 1 1 136 136 ASP N N 15 123.074 0.5 . 1 . . . . 134 ASP N . 6722 1
611 . 1 1 137 137 PHE H H 1 8.203 0.05 . 1 . . . . 135 PHE H . 6722 1
612 . 1 1 137 137 PHE C C 13 179.037 0.5 . 1 . . . . 135 PHE C . 6722 1
613 . 1 1 137 137 PHE CA C 13 57.511 0.5 . 1 . . . . 135 PHE CA . 6722 1
614 . 1 1 137 137 PHE CB C 13 41.267 0.5 . 1 . . . . 135 PHE CB . 6722 1
615 . 1 1 137 137 PHE N N 15 118.198 0.5 . 1 . . . . 135 PHE N . 6722 1
616 . 1 1 138 138 GLU H H 1 8.042 0.05 . 1 . . . . 136 GLU H . 6722 1
617 . 1 1 138 138 GLU C C 13 180.574 0.5 . 1 . . . . 136 GLU C . 6722 1
618 . 1 1 138 138 GLU CA C 13 59.339 0.5 . 1 . . . . 136 GLU CA . 6722 1
619 . 1 1 138 138 GLU CB C 13 28.893 0.5 . 1 . . . . 136 GLU CB . 6722 1
620 . 1 1 138 138 GLU N N 15 120.642 0.5 . 1 . . . . 136 GLU N . 6722 1
621 . 1 1 139 139 GLU H H 1 8.453 0.05 . 1 . . . . 137 GLU H . 6722 1
622 . 1 1 139 139 GLU CA C 13 57.511 0.5 . 1 . . . . 137 GLU CA . 6722 1
623 . 1 1 139 139 GLU CB C 13 29.932 0.5 . 1 . . . . 137 GLU CB . 6722 1
624 . 1 1 139 139 GLU N N 15 119.319 0.5 . 1 . . . . 137 GLU N . 6722 1
625 . 1 1 141 141 PHE C C 13 175.182 0.5 . 1 . . . . 139 PHE C . 6722 1
626 . 1 1 141 141 PHE CA C 13 62.236 0.5 . 1 . . . . 139 PHE CA . 6722 1
627 . 1 1 141 141 PHE CB C 13 38.456 0.5 . 1 . . . . 139 PHE CB . 6722 1
628 . 1 1 142 142 ALA H H 1 7.968 0.05 . 1 . . . . 140 ALA H . 6722 1
629 . 1 1 142 142 ALA C C 13 180.742 0.5 . 1 . . . . 140 ALA C . 6722 1
630 . 1 1 142 142 ALA CA C 13 54.58 0.5 . 1 . . . . 140 ALA CA . 6722 1
631 . 1 1 142 142 ALA CB C 13 17.651 0.5 . 1 . . . . 140 ALA CB . 6722 1
632 . 1 1 142 142 ALA N N 15 120.659 0.5 . 1 . . . . 140 ALA N . 6722 1
633 . 1 1 143 143 VAL H H 1 8.264 0.05 . 1 . . . . 141 VAL H . 6722 1
634 . 1 1 143 143 VAL C C 13 177.752 0.5 . 1 . . . . 141 VAL C . 6722 1
635 . 1 1 143 143 VAL CA C 13 65.236 0.5 . 1 . . . . 141 VAL CA . 6722 1
636 . 1 1 143 143 VAL CB C 13 30.844 0.5 . 1 . . . . 141 VAL CB . 6722 1
637 . 1 1 143 143 VAL N N 15 118.45 0.5 . 1 . . . . 141 VAL N . 6722 1
638 . 1 1 144 144 ILE H H 1 8.168 0.05 . 1 . . . . 142 ILE H . 6722 1
639 . 1 1 144 144 ILE C C 13 177.541 0.5 . 1 . . . . 142 ILE C . 6722 1
640 . 1 1 144 144 ILE CA C 13 65.629 0.5 . 1 . . . . 142 ILE CA . 6722 1
641 . 1 1 144 144 ILE CB C 13 36.733 0.5 . 1 . . . . 142 ILE CB . 6722 1
642 . 1 1 144 144 ILE N N 15 121.11 0.5 . 1 . . . . 142 ILE N . 6722 1
643 . 1 1 145 145 GLU H H 1 8.61 0.05 . 1 . . . . 143 GLU H . 6722 1
644 . 1 1 145 145 GLU C C 13 178.721 0.5 . 1 . . . . 143 GLU C . 6722 1
645 . 1 1 145 145 GLU CA C 13 59.27 0.5 . 1 . . . . 143 GLU CA . 6722 1
646 . 1 1 145 145 GLU CB C 13 29.082 0.5 . 1 . . . . 143 GLU CB . 6722 1
647 . 1 1 145 145 GLU N N 15 119.231 0.5 . 1 . . . . 143 GLU N . 6722 1
648 . 1 1 146 146 SER H H 1 7.636 0.05 . 1 . . . . 144 SER H . 6722 1
649 . 1 1 146 146 SER C C 13 174.129 0.5 . 1 . . . . 144 SER C . 6722 1
650 . 1 1 146 146 SER CA C 13 60.339 0.5 . 1 . . . . 144 SER CA . 6722 1
651 . 1 1 146 146 SER CB C 13 63.221 0.5 . 1 . . . . 144 SER CB . 6722 1
652 . 1 1 146 146 SER N N 15 110.65 0.5 . 1 . . . . 144 SER N . 6722 1
653 . 1 1 147 147 ALA H H 1 7.476 0.05 . 1 . . . . 145 ALA H . 6722 1
654 . 1 1 147 147 ALA C C 13 176.278 0.5 . 1 . . . . 145 ALA C . 6722 1
655 . 1 1 147 147 ALA CA C 13 52.89 0.5 . 1 . . . . 145 ALA CA . 6722 1
656 . 1 1 147 147 ALA CB C 13 20.202 0.5 . 1 . . . . 145 ALA CB . 6722 1
657 . 1 1 147 147 ALA N N 15 122.815 0.5 . 1 . . . . 145 ALA N . 6722 1
658 . 1 1 148 148 LEU H H 1 7.386 0.05 . 1 . . . . 146 LEU H . 6722 1
659 . 1 1 148 148 LEU CA C 13 58.546 0.5 . 1 . . . . 146 LEU CA . 6722 1
660 . 1 1 148 148 LEU CB C 13 38.835 0.5 . 1 . . . . 146 LEU CB . 6722 1
661 . 1 1 148 148 LEU N N 15 113.765 0.5 . 1 . . . . 146 LEU N . 6722 1
662 . 1 1 149 149 PRO C C 13 178.531 0.5 . 1 . . . . 147 PRO C . 6722 1
663 . 1 1 149 149 PRO CA C 13 67.409 0.5 . 1 . . . . 147 PRO CA . 6722 1
664 . 1 1 149 149 PRO CB C 13 30.228 0.5 . 1 . . . . 147 PRO CB . 6722 1
665 . 1 1 150 150 GLY H H 1 7.929 0.05 . 1 . . . . 148 GLY H . 6722 1
666 . 1 1 150 150 GLY C C 13 176.404 0.5 . 1 . . . . 148 GLY C . 6722 1
667 . 1 1 150 150 GLY CA C 13 46.745 0.5 . 1 . . . . 148 GLY CA . 6722 1
668 . 1 1 150 150 GLY N N 15 102.149 0.5 . 1 . . . . 148 GLY N . 6722 1
669 . 1 1 151 151 LEU H H 1 7.616 0.05 . 1 . . . . 149 LEU H . 6722 1
670 . 1 1 151 151 LEU C C 13 178.847 0.5 . 1 . . . . 149 LEU C . 6722 1
671 . 1 1 151 151 LEU CA C 13 56.787 0.5 . 1 . . . . 149 LEU CA . 6722 1
672 . 1 1 151 151 LEU CB C 13 40.606 0.5 . 1 . . . . 149 LEU CB . 6722 1
673 . 1 1 151 151 LEU N N 15 127.887 0.5 . 1 . . . . 149 LEU N . 6722 1
674 . 1 1 152 152 HIS H H 1 8.413 0.05 . 1 . . . . 150 HIS H . 6722 1
675 . 1 1 152 152 HIS C C 13 177.457 0.5 . 1 . . . . 150 HIS C . 6722 1
676 . 1 1 152 152 HIS CA C 13 61.925 0.5 . 1 . . . . 150 HIS CA . 6722 1
677 . 1 1 152 152 HIS CB C 13 29.837 0.5 . 1 . . . . 150 HIS CB . 6722 1
678 . 1 1 152 152 HIS N N 15 120.422 0.5 . 1 . . . . 150 HIS N . 6722 1
679 . 1 1 153 153 ASP H H 1 7.795 0.05 . 1 . . . . 151 ASP H . 6722 1
680 . 1 1 153 153 ASP C C 13 177.646 0.5 . 1 . . . . 151 ASP C . 6722 1
681 . 1 1 153 153 ASP CA C 13 57.304 0.5 . 1 . . . . 151 ASP CA . 6722 1
682 . 1 1 153 153 ASP CB C 13 39.472 0.5 . 1 . . . . 151 ASP CB . 6722 1
683 . 1 1 153 153 ASP N N 15 117.815 0.5 . 1 . . . . 151 ASP N . 6722 1
684 . 1 1 154 154 TRP H H 1 7.907 0.05 . 1 . . . . 152 TRP H . 6722 1
685 . 1 1 154 154 TRP C C 13 178.236 0.5 . 1 . . . . 152 TRP C . 6722 1
686 . 1 1 154 154 TRP CA C 13 62.183 0.5 . 1 . . . . 152 TRP CA . 6722 1
687 . 1 1 154 154 TRP CB C 13 29.20 0.5 . 1 . . . . 152 TRP CB . 6722 1
688 . 1 1 154 154 TRP N N 15 122.548 0.5 . 1 . . . . 152 TRP N . 6722 1
689 . 1 1 155 155 VAL H H 1 8.587 0.05 . 1 . . . . 153 VAL H . 6722 1
690 . 1 1 155 155 VAL C C 13 176.488 0.5 . 1 . . . . 153 VAL C . 6722 1
691 . 1 1 155 155 VAL CA C 13 66.512 0.5 . 1 . . . . 153 VAL CA . 6722 1
692 . 1 1 155 155 VAL CB C 13 29.069 0.5 . 1 . . . . 153 VAL CB . 6722 1
693 . 1 1 155 155 VAL N N 15 119.24 0.5 . 1 . . . . 153 VAL N . 6722 1
694 . 1 1 156 156 ASP H H 1 8.534 0.05 . 1 . . . . 154 ASP H . 6722 1
695 . 1 1 156 156 ASP C C 13 179.015 0.5 . 1 . . . . 154 ASP C . 6722 1
696 . 1 1 156 156 ASP CA C 13 57.028 0.5 . 1 . . . . 154 ASP CA . 6722 1
697 . 1 1 156 156 ASP CB C 13 39.378 0.5 . 1 . . . . 154 ASP CB . 6722 1
698 . 1 1 156 156 ASP N N 15 120.124 0.5 . 1 . . . . 154 ASP N . 6722 1
699 . 1 1 157 157 GLU H H 1 7.861 0.05 . 1 . . . . 155 GLU H . 6722 1
700 . 1 1 157 157 GLU C C 13 178.026 0.5 . 1 . . . . 155 GLU C . 6722 1
701 . 1 1 157 157 GLU CA C 13 58.684 0.5 . 1 . . . . 155 GLU CA . 6722 1
702 . 1 1 157 157 GLU CB C 13 28.609 0.5 . 1 . . . . 155 GLU CB . 6722 1
703 . 1 1 157 157 GLU N N 15 119.862 0.5 . 1 . . . . 155 GLU N . 6722 1
704 . 1 1 158 158 ARG H H 1 7.641 0.05 . 1 . . . . 156 ARG H . 6722 1
705 . 1 1 158 158 ARG C C 13 178.952 0.5 . 1 . . . . 156 ARG C . 6722 1
706 . 1 1 158 158 ARG CA C 13 56.477 0.5 . 1 . . . . 156 ARG CA . 6722 1
707 . 1 1 158 158 ARG CB C 13 28.326 0.5 . 1 . . . . 156 ARG CB . 6722 1
708 . 1 1 158 158 ARG N N 15 118.951 0.5 . 1 . . . . 156 ARG N . 6722 1
709 . 1 1 159 159 LEU H H 1 8.51 0.05 . 1 . . . . 157 LEU H . 6722 1
710 . 1 1 159 159 LEU C C 13 178.005 0.5 . 1 . . . . 157 LEU C . 6722 1
711 . 1 1 159 159 LEU CA C 13 56.273 0.5 . 1 . . . . 157 LEU CA . 6722 1
712 . 1 1 159 159 LEU CB C 13 41.073 0.5 . 1 . . . . 157 LEU CB . 6722 1
713 . 1 1 159 159 LEU N N 15 118.555 0.5 . 1 . . . . 157 LEU N . 6722 1
714 . 1 1 160 160 ALA H H 1 7.467 0.05 . 1 . . . . 158 ALA H . 6722 1
715 . 1 1 160 160 ALA C C 13 177.689 0.5 . 1 . . . . 158 ALA C . 6722 1
716 . 1 1 160 160 ALA CA C 13 52.752 0.5 . 1 . . . . 158 ALA CA . 6722 1
717 . 1 1 160 160 ALA CB C 13 17.652 0.5 . 1 . . . . 158 ALA CB . 6722 1
718 . 1 1 160 160 ALA N N 15 120.336 0.5 . 1 . . . . 158 ALA N . 6722 1
719 . 1 1 161 161 ARG H H 1 7.598 0.05 . 1 . . . . 159 ARG H . 6722 1
720 . 1 1 161 161 ARG C C 13 175.625 0.5 . 1 . . . . 159 ARG C . 6722 1
721 . 1 1 161 161 ARG CA C 13 56.408 0.5 . 1 . . . . 159 ARG CA . 6722 1
722 . 1 1 161 161 ARG CB C 13 29.743 0.5 . 1 . . . . 159 ARG CB . 6722 1
723 . 1 1 161 161 ARG N N 15 117.599 0.5 . 1 . . . . 159 ARG N . 6722 1
724 . 1 1 162 162 ASN H H 1 8.083 0.05 . 1 . . . . 160 ASN H . 6722 1
725 . 1 1 162 162 ASN C C 13 174.635 0.5 . 1 . . . . 160 ASN C . 6722 1
726 . 1 1 162 162 ASN CA C 13 52.718 0.5 . 1 . . . . 160 ASN CA . 6722 1
727 . 1 1 162 162 ASN CB C 13 38.456 0.5 . 1 . . . . 160 ASN CB . 6722 1
728 . 1 1 162 162 ASN N N 15 118.235 0.5 . 1 . . . . 160 ASN N . 6722 1
729 . 1 1 163 163 GLY H H 1 7.979 0.05 . 1 . . . . 161 GLY H . 6722 1
730 . 1 1 163 163 GLY CA C 13 44.187 0.5 . 1 . . . . 161 GLY CA . 6722 1
731 . 1 1 163 163 GLY N N 15 108.552 0.5 . 1 . . . . 161 GLY N . 6722 1
732 . 1 1 164 164 PRO C C 13 175.814 0.5 . 1 . . . . 162 PRO C . 6722 1
733 . 1 1 164 164 PRO CA C 13 62.908 0.5 . 1 . . . . 162 PRO CA . 6722 1
734 . 1 1 164 164 PRO CB C 13 31.494 0.5 . 1 . . . . 162 PRO CB . 6722 1
735 . 1 1 165 165 SER H H 1 8.01 0.05 . 1 . . . . 163 SER H . 6722 1
736 . 1 1 165 165 SER CA C 13 59.615 0.5 . 1 . . . . 163 SER CA . 6722 1
737 . 1 1 165 165 SER CB C 13 64.504 0.5 . 1 . . . . 163 SER CB . 6722 1
738 . 1 1 165 165 SER N N 15 121.598 0.5 . 1 . . . . 163 SER N . 6722 1
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