Content for NMR-STAR saveframe, "chemical_shift_assignment"
save_chemical_shift_assignment
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment
_Assigned_chem_shift_list.Entry_ID 4075
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference
_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 $sample_one . 4075 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 ASN H H 1 8.41 0.01 . 1 . . . . . . . . 4075 1
2 . 1 1 3 3 ASN HA H 1 4.68 0.01 . 1 . . . . . . . . 4075 1
3 . 1 1 3 3 ASN C C 13 174.9 0.1 . 1 . . . . . . . . 4075 1
4 . 1 1 3 3 ASN CA C 13 53.1 0.1 . 1 . . . . . . . . 4075 1
5 . 1 1 3 3 ASN N N 15 118.5 0.1 . 1 . . . . . . . . 4075 1
6 . 1 1 4 4 LYS H H 1 8.23 0.01 . 1 . . . . . . . . 4075 1
7 . 1 1 4 4 LYS HA H 1 4.57 0.01 . 1 . . . . . . . . 4075 1
8 . 1 1 4 4 LYS CA C 13 54.2 0.1 . 1 . . . . . . . . 4075 1
9 . 1 1 4 4 LYS N N 15 122.4 0.1 . 1 . . . . . . . . 4075 1
10 . 1 1 5 5 PRO HA H 1 4.35 0.01 . 1 . . . . . . . . 4075 1
11 . 1 1 5 5 PRO C C 13 176.7 0.1 . 1 . . . . . . . . 4075 1
12 . 1 1 5 5 PRO CA C 13 63.2 0.1 . 1 . . . . . . . . 4075 1
13 . 1 1 6 6 PHE H H 1 8.2 0.01 . 1 . . . . . . . . 4075 1
14 . 1 1 6 6 PHE HA H 1 4.54 0.01 . 1 . . . . . . . . 4075 1
15 . 1 1 6 6 PHE CA C 13 57.7 0.1 . 1 . . . . . . . . 4075 1
16 . 1 1 6 6 PHE N N 15 120.1 0.1 . 1 . . . . . . . . 4075 1
17 . 1 1 7 7 ASN H H 1 8.19 0.01 . 1 . . . . . . . . 4075 1
18 . 1 1 7 7 ASN HA H 1 4.6 0.01 . 1 . . . . . . . . 4075 1
19 . 1 1 7 7 ASN C C 13 174.7 0.1 . 1 . . . . . . . . 4075 1
20 . 1 1 7 7 ASN CA C 13 52.9 0.1 . 1 . . . . . . . . 4075 1
21 . 1 1 7 7 ASN N N 15 120.9 0.1 . 1 . . . . . . . . 4075 1
22 . 1 1 8 8 LYS H H 1 8.14 0.01 . 1 . . . . . . . . 4075 1
23 . 1 1 8 8 LYS HA H 1 4.19 0.01 . 1 . . . . . . . . 4075 1
24 . 1 1 8 8 LYS CA C 13 56.7 0.1 . 1 . . . . . . . . 4075 1
25 . 1 1 8 8 LYS N N 15 121.9 0.1 . 1 . . . . . . . . 4075 1
26 . 1 1 9 9 GLN H H 1 8.29 0.01 . 1 . . . . . . . . 4075 1
27 . 1 1 9 9 GLN HA H 1 4.26 0.01 . 1 . . . . . . . . 4075 1
28 . 1 1 9 9 GLN CA C 13 56.1 0.1 . 1 . . . . . . . . 4075 1
29 . 1 1 9 9 GLN N N 15 120.9 0.1 . 1 . . . . . . . . 4075 1
30 . 1 1 10 10 GLN H H 1 8.21 0.01 . 1 . . . . . . . . 4075 1
31 . 1 1 10 10 GLN HA H 1 4.27 0.01 . 1 . . . . . . . . 4075 1
32 . 1 1 10 10 GLN C C 13 175.4 0.1 . 1 . . . . . . . . 4075 1
33 . 1 1 10 10 GLN CA C 13 55.7 0.1 . 1 . . . . . . . . 4075 1
34 . 1 1 10 10 GLN N N 15 121.1 0.1 . 1 . . . . . . . . 4075 1
35 . 1 1 11 11 ALA H H 1 8.22 0.01 . 1 . . . . . . . . 4075 1
36 . 1 1 11 11 ALA HA H 1 4.3 0.01 . 1 . . . . . . . . 4075 1
37 . 1 1 11 11 ALA C C 13 177.3 0.1 . 1 . . . . . . . . 4075 1
38 . 1 1 11 11 ALA CA C 13 52.3 0.1 . 1 . . . . . . . . 4075 1
39 . 1 1 11 11 ALA N N 15 125.1 0.1 . 1 . . . . . . . . 4075 1
40 . 1 1 12 12 GLU H H 1 8.28 0.01 . 1 . . . . . . . . 4075 1
41 . 1 1 12 12 GLU HA H 1 4.54 0.01 . 1 . . . . . . . . 4075 1
42 . 1 1 12 12 GLU CA C 13 54.4 0.1 . 1 . . . . . . . . 4075 1
43 . 1 1 12 12 GLU N N 15 121.5 0.1 . 1 . . . . . . . . 4075 1
44 . 1 1 13 13 PRO HA H 1 4.38 0.01 . 1 . . . . . . . . 4075 1
45 . 1 1 13 13 PRO C C 13 177.00 0.1 . 1 . . . . . . . . 4075 1
46 . 1 1 13 13 PRO CA C 13 63.3 0.1 . 1 . . . . . . . . 4075 1
47 . 1 1 14 14 ARG H H 1 8.35 0.01 . 1 . . . . . . . . 4075 1
48 . 1 1 14 14 ARG HA H 1 4.3 0.01 . 1 . . . . . . . . 4075 1
49 . 1 1 14 14 ARG C C 13 176.4 0.1 . 1 . . . . . . . . 4075 1
50 . 1 1 14 14 ARG CA C 13 56.2 0.1 . 1 . . . . . . . . 4075 1
51 . 1 1 14 14 ARG N N 15 120.9 0.1 . 1 . . . . . . . . 4075 1
52 . 1 1 15 15 GLU H H 1 8.36 0.01 . 1 . . . . . . . . 4075 1
53 . 1 1 15 15 GLU HA H 1 4.24 0.01 . 1 . . . . . . . . 4075 1
54 . 1 1 15 15 GLU C C 13 176.2 0.1 . 1 . . . . . . . . 4075 1
55 . 1 1 15 15 GLU CA C 13 56.6 0.1 . 1 . . . . . . . . 4075 1
56 . 1 1 15 15 GLU N N 15 121.3 0.1 . 1 . . . . . . . . 4075 1
57 . 1 1 16 16 ARG H H 1 8.23 0.01 . 1 . . . . . . . . 4075 1
58 . 1 1 16 16 ARG HA H 1 4.26 0.01 . 1 . . . . . . . . 4075 1
59 . 1 1 16 16 ARG C C 13 175.7 0.1 . 1 . . . . . . . . 4075 1
60 . 1 1 16 16 ARG CA C 13 55.9 0.1 . 1 . . . . . . . . 4075 1
61 . 1 1 16 16 ARG N N 15 121.3 0.1 . 1 . . . . . . . . 4075 1
62 . 1 1 17 17 ASP H H 1 8.28 0.01 . 1 . . . . . . . . 4075 1
63 . 1 1 17 17 ASP HA H 1 4.82 0.01 . 1 . . . . . . . . 4075 1
64 . 1 1 17 17 ASP CA C 13 52.4 0.1 . 1 . . . . . . . . 4075 1
65 . 1 1 17 17 ASP N N 15 122.8 0.1 . 1 . . . . . . . . 4075 1
66 . 1 1 18 18 PRO HA H 1 4.36 0.01 . 1 . . . . . . . . 4075 1
67 . 1 1 18 18 PRO C C 13 177.4 0.1 . 1 . . . . . . . . 4075 1
68 . 1 1 18 18 PRO CA C 13 63.7 0.1 . 1 . . . . . . . . 4075 1
69 . 1 1 19 19 GLN H H 1 8.47 0.01 . 1 . . . . . . . . 4075 1
70 . 1 1 19 19 GLN HA H 1 4.25 0.01 . 1 . . . . . . . . 4075 1
71 . 1 1 19 19 GLN C C 13 176.5 0.1 . 1 . . . . . . . . 4075 1
72 . 1 1 19 19 GLN CA C 13 56.4 0.1 . 1 . . . . . . . . 4075 1
73 . 1 1 19 19 GLN N N 15 119.00 0.1 . 1 . . . . . . . . 4075 1
74 . 1 1 20 20 VAL H H 1 7.86 0.01 . 1 . . . . . . . . 4075 1
75 . 1 1 20 20 VAL HA H 1 4.06 0.01 . 1 . . . . . . . . 4075 1
76 . 1 1 20 20 VAL C C 13 176.1 0.1 . 1 . . . . . . . . 4075 1
77 . 1 1 20 20 VAL CA C 13 62.5 0.1 . 1 . . . . . . . . 4075 1
78 . 1 1 20 20 VAL N N 15 119.7 0.1 . 1 . . . . . . . . 4075 1
79 . 1 1 21 21 ALA H H 1 8.2 0.01 . 1 . . . . . . . . 4075 1
80 . 1 1 21 21 ALA HA H 1 4.27 0.01 . 1 . . . . . . . . 4075 1
81 . 1 1 21 21 ALA C C 13 178.2 0.1 . 1 . . . . . . . . 4075 1
82 . 1 1 21 21 ALA CA C 13 52.9 0.1 . 1 . . . . . . . . 4075 1
83 . 1 1 21 21 ALA N N 15 126.4 0.1 . 1 . . . . . . . . 4075 1
84 . 1 1 22 22 GLY H H 1 8.19 0.01 . 1 . . . . . . . . 4075 1
85 . 1 1 22 22 GLY HA2 H 1 3.9 0.1 . 2 . . . . . . . . 4075 1
86 . 1 1 22 22 GLY C C 13 174.00 0.1 . 1 . . . . . . . . 4075 1
87 . 1 1 22 22 GLY CA C 13 45.3 0.1 . 1 . . . . . . . . 4075 1
88 . 1 1 22 22 GLY N N 15 107.3 0.1 . 1 . . . . . . . . 4075 1
89 . 1 1 23 23 LEU H H 1 7.87 0.01 . 1 . . . . . . . . 4075 1
90 . 1 1 23 23 LEU HA H 1 4.31 0.01 . 1 . . . . . . . . 4075 1
91 . 1 1 23 23 LEU C C 13 177.3 0.1 . 1 . . . . . . . . 4075 1
92 . 1 1 23 23 LEU CA C 13 55.2 0.1 . 1 . . . . . . . . 4075 1
93 . 1 1 23 23 LEU N N 15 121.2 0.1 . 1 . . . . . . . . 4075 1
94 . 1 1 24 24 LYS H H 1 8.29 0.01 . 1 . . . . . . . . 4075 1
95 . 1 1 24 24 LYS HA H 1 4.33 0.01 . 1 . . . . . . . . 4075 1
96 . 1 1 24 24 LYS C C 13 176.2 0.1 . 1 . . . . . . . . 4075 1
97 . 1 1 24 24 LYS CA C 13 56.1 0.1 . 1 . . . . . . . . 4075 1
98 . 1 1 24 24 LYS N N 15 122.3 0.1 . 1 . . . . . . . . 4075 1
99 . 1 1 25 25 VAL H H 1 7.95 0.01 . 1 . . . . . . . . 4075 1
100 . 1 1 25 25 VAL HA H 1 4.41 0.01 . 1 . . . . . . . . 4075 1
101 . 1 1 25 25 VAL C C 13 173.9 0.1 . 1 . . . . . . . . 4075 1
102 . 1 1 25 25 VAL CA C 13 59.5 0.1 . 1 . . . . . . . . 4075 1
103 . 1 1 25 25 VAL N N 15 122.00 0.1 . 1 . . . . . . . . 4075 1
104 . 1 1 29 29 SER HA H 1 4.7 0.01 . 1 . . . . . . . . 4075 1
105 . 1 1 29 29 SER C C 13 174.6 0.1 . 1 . . . . . . . . 4075 1
106 . 1 1 30 30 ILE H H 1 9.16 0.01 . 1 . . . . . . . . 4075 1
107 . 1 1 30 30 ILE HA H 1 4.01 0.01 . 1 . . . . . . . . 4075 1
108 . 1 1 30 30 ILE C C 13 178.00 0.1 . 1 . . . . . . . . 4075 1
109 . 1 1 30 30 ILE CA C 13 64.2 0.1 . 1 . . . . . . . . 4075 1
110 . 1 1 30 30 ILE N N 15 129.9 0.1 . 1 . . . . . . . . 4075 1
111 . 1 1 31 31 GLU H H 1 8.93 0.01 . 1 . . . . . . . . 4075 1
112 . 1 1 31 31 GLU HA H 1 4.12 0.01 . 1 . . . . . . . . 4075 1
113 . 1 1 31 31 GLU C C 13 179.4 0.1 . 1 . . . . . . . . 4075 1
114 . 1 1 31 31 GLU CA C 13 60.00 0.1 . 1 . . . . . . . . 4075 1
115 . 1 1 31 31 GLU N N 15 120.1 0.1 . 1 . . . . . . . . 4075 1
116 . 1 1 32 32 ALA H H 1 8.02 0.01 . 1 . . . . . . . . 4075 1
117 . 1 1 32 32 ALA HA H 1 3.81 0.01 . 1 . . . . . . . . 4075 1
118 . 1 1 32 32 ALA C C 13 179.2 0.1 . 1 . . . . . . . . 4075 1
119 . 1 1 32 32 ALA CA C 13 55.5 0.1 . 1 . . . . . . . . 4075 1
120 . 1 1 32 32 ALA N N 15 122.7 0.1 . 1 . . . . . . . . 4075 1
121 . 1 1 33 33 GLU H H 1 7.9 0.01 . 1 . . . . . . . . 4075 1
122 . 1 1 33 33 GLU HA H 1 3.79 0.01 . 1 . . . . . . . . 4075 1
123 . 1 1 33 33 GLU C C 13 178.9 0.1 . 1 . . . . . . . . 4075 1
124 . 1 1 33 33 GLU CA C 13 60.9 0.1 . 1 . . . . . . . . 4075 1
125 . 1 1 33 33 GLU N N 15 115.8 0.1 . 1 . . . . . . . . 4075 1
126 . 1 1 34 34 GLN H H 1 8.65 0.01 . 1 . . . . . . . . 4075 1
127 . 1 1 34 34 GLN HA H 1 3.56 0.01 . 1 . . . . . . . . 4075 1
128 . 1 1 34 34 GLN C C 13 178.7 0.1 . 1 . . . . . . . . 4075 1
129 . 1 1 34 34 GLN CA C 13 59.6 0.1 . 1 . . . . . . . . 4075 1
130 . 1 1 34 34 GLN N N 15 115.2 0.1 . 1 . . . . . . . . 4075 1
131 . 1 1 35 35 SER H H 1 7.87 0.01 . 1 . . . . . . . . 4075 1
132 . 1 1 35 35 SER HA H 1 4.15 0.01 . 1 . . . . . . . . 4075 1
133 . 1 1 35 35 SER C C 13 176.9 0.1 . 1 . . . . . . . . 4075 1
134 . 1 1 35 35 SER CA C 13 62.4 0.1 . 1 . . . . . . . . 4075 1
135 . 1 1 35 35 SER N N 15 114.8 0.1 . 1 . . . . . . . . 4075 1
136 . 1 1 36 36 VAL H H 1 7.99 0.01 . 1 . . . . . . . . 4075 1
137 . 1 1 36 36 VAL HA H 1 3.67 0.01 . 1 . . . . . . . . 4075 1
138 . 1 1 36 36 VAL C C 13 176.4 0.1 . 1 . . . . . . . . 4075 1
139 . 1 1 36 36 VAL CA C 13 66.9 0.1 . 1 . . . . . . . . 4075 1
140 . 1 1 36 36 VAL N N 15 121.7 0.1 . 1 . . . . . . . . 4075 1
141 . 1 1 37 37 LEU H H 1 7.7 0.01 . 1 . . . . . . . . 4075 1
142 . 1 1 37 37 LEU HA H 1 4.05 0.01 . 1 . . . . . . . . 4075 1
143 . 1 1 37 37 LEU C C 13 179.00 0.1 . 1 . . . . . . . . 4075 1
144 . 1 1 37 37 LEU CA C 13 58.2 0.1 . 1 . . . . . . . . 4075 1
145 . 1 1 37 37 LEU N N 15 116.2 0.1 . 1 . . . . . . . . 4075 1
146 . 1 1 38 38 GLY H H 1 8.81 0.01 . 1 . . . . . . . . 4075 1
147 . 1 1 38 38 GLY HA2 H 1 3.88 0.1 . 2 . . . . . . . . 4075 1
148 . 1 1 38 38 GLY HA3 H 1 3.5 0.1 . 2 . . . . . . . . 4075 1
149 . 1 1 38 38 GLY C C 13 176.6 0.1 . 1 . . . . . . . . 4075 1
150 . 1 1 38 38 GLY CA C 13 47.4 0.1 . 1 . . . . . . . . 4075 1
151 . 1 1 38 38 GLY N N 15 104.6 0.1 . 1 . . . . . . . . 4075 1
152 . 1 1 39 39 GLY H H 1 8.06 0.01 . 1 . . . . . . . . 4075 1
153 . 1 1 39 39 GLY HA2 H 1 3.75 0.1 . 2 . . . . . . . . 4075 1
154 . 1 1 39 39 GLY C C 13 175.8 0.1 . 1 . . . . . . . . 4075 1
155 . 1 1 39 39 GLY CA C 13 47.6 0.1 . 1 . . . . . . . . 4075 1
156 . 1 1 39 39 GLY N N 15 108.6 0.1 . 1 . . . . . . . . 4075 1
157 . 1 1 40 40 LEU H H 1 7.93 0.01 . 1 . . . . . . . . 4075 1
158 . 1 1 40 40 LEU HA H 1 4.14 0.01 . 1 . . . . . . . . 4075 1
159 . 1 1 40 40 LEU C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
160 . 1 1 40 40 LEU CA C 13 56.9 0.1 . 1 . . . . . . . . 4075 1
161 . 1 1 40 40 LEU N N 15 122.1 0.1 . 1 . . . . . . . . 4075 1
162 . 1 1 41 41 MET H H 1 7.29 0.01 . 1 . . . . . . . . 4075 1
163 . 1 1 41 41 MET HA H 1 4.2 0.01 . 1 . . . . . . . . 4075 1
164 . 1 1 41 41 MET C C 13 178.6 0.1 . 1 . . . . . . . . 4075 1
165 . 1 1 41 41 MET CA C 13 58.9 0.1 . 1 . . . . . . . . 4075 1
166 . 1 1 41 41 MET N N 15 115.5 0.1 . 1 . . . . . . . . 4075 1
167 . 1 1 42 42 LEU H H 1 7.29 0.01 . 1 . . . . . . . . 4075 1
168 . 1 1 42 42 LEU HA H 1 4.23 0.01 . 1 . . . . . . . . 4075 1
169 . 1 1 42 42 LEU C C 13 177.2 0.1 . 1 . . . . . . . . 4075 1
170 . 1 1 42 42 LEU CA C 13 56.5 0.1 . 1 . . . . . . . . 4075 1
171 . 1 1 42 42 LEU N N 15 118.1 0.1 . 1 . . . . . . . . 4075 1
172 . 1 1 43 43 ASP H H 1 8.1 0.01 . 1 . . . . . . . . 4075 1
173 . 1 1 43 43 ASP HA H 1 4.93 0.01 . 1 . . . . . . . . 4075 1
174 . 1 1 43 43 ASP C C 13 175.3 0.1 . 1 . . . . . . . . 4075 1
175 . 1 1 43 43 ASP CA C 13 52.5 0.1 . 1 . . . . . . . . 4075 1
176 . 1 1 43 43 ASP N N 15 119.4 0.1 . 1 . . . . . . . . 4075 1
177 . 1 1 44 44 ASN H H 1 9.1 0.01 . 1 . . . . . . . . 4075 1
178 . 1 1 44 44 ASN HA H 1 4.55 0.01 . 1 . . . . . . . . 4075 1
179 . 1 1 44 44 ASN C C 13 177.4 0.1 . 1 . . . . . . . . 4075 1
180 . 1 1 44 44 ASN CA C 13 55.1 0.1 . 1 . . . . . . . . 4075 1
181 . 1 1 44 44 ASN N N 15 120.6 0.1 . 1 . . . . . . . . 4075 1
182 . 1 1 45 45 GLU H H 1 8.35 0.01 . 1 . . . . . . . . 4075 1
183 . 1 1 45 45 GLU HA H 1 4.26 0.01 . 1 . . . . . . . . 4075 1
184 . 1 1 45 45 GLU C C 13 177.6 0.1 . 1 . . . . . . . . 4075 1
185 . 1 1 45 45 GLU CA C 13 58.1 0.1 . 1 . . . . . . . . 4075 1
186 . 1 1 45 45 GLU N N 15 116.6 0.1 . 1 . . . . . . . . 4075 1
187 . 1 1 46 46 ARG H H 1 7.59 0.01 . 1 . . . . . . . . 4075 1
188 . 1 1 46 46 ARG HA H 1 4.52 0.01 . 1 . . . . . . . . 4075 1
189 . 1 1 46 46 ARG C C 13 175.4 0.1 . 1 . . . . . . . . 4075 1
190 . 1 1 46 46 ARG CA C 13 55.2 0.1 . 1 . . . . . . . . 4075 1
191 . 1 1 46 46 ARG N N 15 116.8 0.1 . 1 . . . . . . . . 4075 1
192 . 1 1 47 47 TRP H H 1 7.71 0.01 . 1 . . . . . . . . 4075 1
193 . 1 1 47 47 TRP HA H 1 4.00 0.01 . 1 . . . . . . . . 4075 1
194 . 1 1 47 47 TRP C C 13 176.3 0.1 . 1 . . . . . . . . 4075 1
195 . 1 1 47 47 TRP CA C 13 61.5 0.1 . 1 . . . . . . . . 4075 1
196 . 1 1 47 47 TRP N N 15 119.4 0.1 . 1 . . . . . . . . 4075 1
197 . 1 1 48 48 ASP H H 1 8.34 0.01 . 1 . . . . . . . . 4075 1
198 . 1 1 48 48 ASP HA H 1 4.06 0.01 . 1 . . . . . . . . 4075 1
199 . 1 1 48 48 ASP C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
200 . 1 1 48 48 ASP CA C 13 58.00 0.1 . 1 . . . . . . . . 4075 1
201 . 1 1 48 48 ASP N N 15 115.6 0.1 . 1 . . . . . . . . 4075 1
202 . 1 1 49 49 ASP H H 1 7.77 0.01 . 1 . . . . . . . . 4075 1
203 . 1 1 49 49 ASP HA H 1 4.24 0.01 . 1 . . . . . . . . 4075 1
204 . 1 1 49 49 ASP C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
205 . 1 1 49 49 ASP CA C 13 56.9 0.1 . 1 . . . . . . . . 4075 1
206 . 1 1 49 49 ASP N N 15 117.7 0.1 . 1 . . . . . . . . 4075 1
207 . 1 1 50 50 VAL H H 1 7.58 0.01 . 1 . . . . . . . . 4075 1
208 . 1 1 50 50 VAL HA H 1 3.35 0.01 . 1 . . . . . . . . 4075 1
209 . 1 1 50 50 VAL C C 13 177.7 0.1 . 1 . . . . . . . . 4075 1
210 . 1 1 50 50 VAL CA C 13 66.7 0.1 . 1 . . . . . . . . 4075 1
211 . 1 1 50 50 VAL N N 15 118.3 0.1 . 1 . . . . . . . . 4075 1
212 . 1 1 51 51 ALA H H 1 8.79 0.01 . 1 . . . . . . . . 4075 1
213 . 1 1 51 51 ALA HA H 1 4.04 0.01 . 1 . . . . . . . . 4075 1
214 . 1 1 51 51 ALA C C 13 178.8 0.1 . 1 . . . . . . . . 4075 1
215 . 1 1 51 51 ALA CA C 13 53.9 0.1 . 1 . . . . . . . . 4075 1
216 . 1 1 51 51 ALA N N 15 121.9 0.1 . 1 . . . . . . . . 4075 1
217 . 1 1 52 52 GLU H H 1 7.18 0.01 . 1 . . . . . . . . 4075 1
218 . 1 1 52 52 GLU HA H 1 4.22 0.01 . 1 . . . . . . . . 4075 1
219 . 1 1 52 52 GLU C C 13 177.00 0.1 . 1 . . . . . . . . 4075 1
220 . 1 1 52 52 GLU CA C 13 57.00 0.1 . 1 . . . . . . . . 4075 1
221 . 1 1 52 52 GLU N N 15 113.7 0.1 . 1 . . . . . . . . 4075 1
222 . 1 1 53 53 ARG H H 1 7.82 0.01 . 1 . . . . . . . . 4075 1
223 . 1 1 53 53 ARG HA H 1 4.28 0.01 . 1 . . . . . . . . 4075 1
224 . 1 1 53 53 ARG C C 13 175.3 0.1 . 1 . . . . . . . . 4075 1
225 . 1 1 53 53 ARG CA C 13 57.1 0.1 . 1 . . . . . . . . 4075 1
226 . 1 1 53 53 ARG N N 15 118.3 0.1 . 1 . . . . . . . . 4075 1
227 . 1 1 54 54 VAL H H 1 7.63 0.01 . 1 . . . . . . . . 4075 1
228 . 1 1 54 54 VAL HA H 1 4.79 0.01 . 1 . . . . . . . . 4075 1
229 . 1 1 54 54 VAL C C 13 173.6 0.1 . 1 . . . . . . . . 4075 1
230 . 1 1 54 54 VAL CA C 13 59.00 0.1 . 1 . . . . . . . . 4075 1
231 . 1 1 54 54 VAL N N 15 112.5 0.1 . 1 . . . . . . . . 4075 1
232 . 1 1 55 55 VAL H H 1 8.29 0.01 . 1 . . . . . . . . 4075 1
233 . 1 1 55 55 VAL HA H 1 4.66 0.01 . 1 . . . . . . . . 4075 1
234 . 1 1 55 55 VAL C C 13 177.6 0.1 . 1 . . . . . . . . 4075 1
235 . 1 1 55 55 VAL CA C 13 58.8 0.1 . 1 . . . . . . . . 4075 1
236 . 1 1 55 55 VAL N N 15 113.1 0.1 . 1 . . . . . . . . 4075 1
237 . 1 1 56 56 ALA H H 1 8.99 0.01 . 1 . . . . . . . . 4075 1
238 . 1 1 56 56 ALA HA H 1 3.94 0.01 . 1 . . . . . . . . 4075 1
239 . 1 1 56 56 ALA C C 13 179.2 0.1 . 1 . . . . . . . . 4075 1
240 . 1 1 56 56 ALA CA C 13 56.5 0.1 . 1 . . . . . . . . 4075 1
241 . 1 1 56 56 ALA N N 15 123.6 0.1 . 1 . . . . . . . . 4075 1
242 . 1 1 57 57 ASP H H 1 8.04 0.01 . 1 . . . . . . . . 4075 1
243 . 1 1 57 57 ASP HA H 1 4.34 0.01 . 1 . . . . . . . . 4075 1
244 . 1 1 57 57 ASP C C 13 176.1 0.1 . 1 . . . . . . . . 4075 1
245 . 1 1 57 57 ASP CA C 13 56.00 0.1 . 1 . . . . . . . . 4075 1
246 . 1 1 57 57 ASP N N 15 110.7 0.1 . 1 . . . . . . . . 4075 1
247 . 1 1 58 58 ASP H H 1 7.94 0.01 . 1 . . . . . . . . 4075 1
248 . 1 1 58 58 ASP HA H 1 4.28 0.01 . 1 . . . . . . . . 4075 1
249 . 1 1 58 58 ASP CA C 13 56.3 0.1 . 1 . . . . . . . . 4075 1
250 . 1 1 58 58 ASP N N 15 117.4 0.1 . 1 . . . . . . . . 4075 1
251 . 1 1 63 63 PRO HA H 1 4.25 0.01 . 1 . . . . . . . . 4075 1
252 . 1 1 63 63 PRO C C 13 178.2 0.1 . 1 . . . . . . . . 4075 1
253 . 1 1 63 63 PRO CA C 13 66.4 0.1 . 1 . . . . . . . . 4075 1
254 . 1 1 64 64 HIS H H 1 7.2 0.01 . 1 . . . . . . . . 4075 1
255 . 1 1 64 64 HIS HA H 1 4.33 0.01 . 1 . . . . . . . . 4075 1
256 . 1 1 64 64 HIS C C 13 176.8 0.1 . 1 . . . . . . . . 4075 1
257 . 1 1 64 64 HIS CA C 13 57.1 0.1 . 1 . . . . . . . . 4075 1
258 . 1 1 64 64 HIS N N 15 114.00 0.1 . 1 . . . . . . . . 4075 1
259 . 1 1 65 65 ARG H H 1 8.03 0.01 . 1 . . . . . . . . 4075 1
260 . 1 1 65 65 ARG HA H 1 3.89 0.01 . 1 . . . . . . . . 4075 1
261 . 1 1 65 65 ARG CA C 13 60.7 0.1 . 1 . . . . . . . . 4075 1
262 . 1 1 65 65 ARG N N 15 119.00 0.1 . 1 . . . . . . . . 4075 1
263 . 1 1 66 66 HIS H H 1 8.18 0.01 . 1 . . . . . . . . 4075 1
264 . 1 1 66 66 HIS HA H 1 4.3 0.01 . 1 . . . . . . . . 4075 1
265 . 1 1 66 66 HIS C C 13 178.8 0.1 . 1 . . . . . . . . 4075 1
266 . 1 1 66 66 HIS CA C 13 58.9 0.1 . 1 . . . . . . . . 4075 1
267 . 1 1 66 66 HIS N N 15 119.3 0.1 . 1 . . . . . . . . 4075 1
268 . 1 1 67 67 ILE H H 1 8.66 0.01 . 1 . . . . . . . . 4075 1
269 . 1 1 67 67 ILE HA H 1 3.46 0.01 . 1 . . . . . . . . 4075 1
270 . 1 1 67 67 ILE C C 13 176.8 0.1 . 1 . . . . . . . . 4075 1
271 . 1 1 67 67 ILE CA C 13 66.9 0.1 . 1 . . . . . . . . 4075 1
272 . 1 1 67 67 ILE N N 15 120.2 0.1 . 1 . . . . . . . . 4075 1
273 . 1 1 68 68 PHE H H 1 8.41 0.01 . 1 . . . . . . . . 4075 1
274 . 1 1 68 68 PHE HA H 1 4.02 0.01 . 1 . . . . . . . . 4075 1
275 . 1 1 68 68 PHE C C 13 177.1 0.1 . 1 . . . . . . . . 4075 1
276 . 1 1 68 68 PHE CA C 13 62.7 0.1 . 1 . . . . . . . . 4075 1
277 . 1 1 68 68 PHE N N 15 120.00 0.1 . 1 . . . . . . . . 4075 1
278 . 1 1 69 69 THR H H 1 8.21 0.01 . 1 . . . . . . . . 4075 1
279 . 1 1 69 69 THR HA H 1 3.94 0.01 . 1 . . . . . . . . 4075 1
280 . 1 1 69 69 THR C C 13 176.4 0.1 . 1 . . . . . . . . 4075 1
281 . 1 1 69 69 THR CA C 13 67.1 0.1 . 1 . . . . . . . . 4075 1
282 . 1 1 69 69 THR N N 15 113.4 0.1 . 1 . . . . . . . . 4075 1
283 . 1 1 70 70 GLU H H 1 7.92 0.01 . 1 . . . . . . . . 4075 1
284 . 1 1 70 70 GLU HA H 1 4.31 0.01 . 1 . . . . . . . . 4075 1
285 . 1 1 70 70 GLU C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
286 . 1 1 70 70 GLU CA C 13 58.2 0.1 . 1 . . . . . . . . 4075 1
287 . 1 1 70 70 GLU N N 15 123.3 0.1 . 1 . . . . . . . . 4075 1
288 . 1 1 71 71 MET H H 1 8.47 0.01 . 1 . . . . . . . . 4075 1
289 . 1 1 71 71 MET HA H 1 3.57 0.01 . 1 . . . . . . . . 4075 1
290 . 1 1 71 71 MET C C 13 176.7 0.1 . 1 . . . . . . . . 4075 1
291 . 1 1 71 71 MET CA C 13 60.3 0.1 . 1 . . . . . . . . 4075 1
292 . 1 1 71 71 MET N N 15 119.4 0.1 . 1 . . . . . . . . 4075 1
293 . 1 1 72 72 ALA H H 1 7.94 0.01 . 1 . . . . . . . . 4075 1
294 . 1 1 72 72 ALA HA H 1 3.34 0.01 . 1 . . . . . . . . 4075 1
295 . 1 1 72 72 ALA C C 13 180.3 0.1 . 1 . . . . . . . . 4075 1
296 . 1 1 72 72 ALA CA C 13 54.9 0.1 . 1 . . . . . . . . 4075 1
297 . 1 1 72 72 ALA N N 15 119.8 0.1 . 1 . . . . . . . . 4075 1
298 . 1 1 73 73 ARG H H 1 7.71 0.01 . 1 . . . . . . . . 4075 1
299 . 1 1 73 73 ARG HA H 1 3.88 0.01 . 1 . . . . . . . . 4075 1
300 . 1 1 73 73 ARG C C 13 180.2 0.1 . 1 . . . . . . . . 4075 1
301 . 1 1 73 73 ARG CA C 13 59.1 0.1 . 1 . . . . . . . . 4075 1
302 . 1 1 73 73 ARG N N 15 120.2 0.1 . 1 . . . . . . . . 4075 1
303 . 1 1 74 74 LEU H H 1 8.38 0.01 . 1 . . . . . . . . 4075 1
304 . 1 1 74 74 LEU HA H 1 3.75 0.01 . 1 . . . . . . . . 4075 1
305 . 1 1 74 74 LEU C C 13 179.8 0.1 . 1 . . . . . . . . 4075 1
306 . 1 1 74 74 LEU CA C 13 58.00 0.1 . 1 . . . . . . . . 4075 1
307 . 1 1 74 74 LEU N N 15 122.2 0.1 . 1 . . . . . . . . 4075 1
308 . 1 1 75 75 GLN H H 1 8.38 0.01 . 1 . . . . . . . . 4075 1
309 . 1 1 75 75 GLN HA H 1 3.73 0.01 . 1 . . . . . . . . 4075 1
310 . 1 1 75 75 GLN C C 13 180.4 0.1 . 1 . . . . . . . . 4075 1
311 . 1 1 75 75 GLN CA C 13 59.2 0.1 . 1 . . . . . . . . 4075 1
312 . 1 1 75 75 GLN N N 15 120.4 0.1 . 1 . . . . . . . . 4075 1
313 . 1 1 76 76 GLU H H 1 7.89 0.01 . 1 . . . . . . . . 4075 1
314 . 1 1 76 76 GLU HA H 1 3.92 0.01 . 1 . . . . . . . . 4075 1
315 . 1 1 76 76 GLU C C 13 177.6 0.1 . 1 . . . . . . . . 4075 1
316 . 1 1 76 76 GLU CA C 13 58.9 0.1 . 1 . . . . . . . . 4075 1
317 . 1 1 76 76 GLU N N 15 120.6 0.1 . 1 . . . . . . . . 4075 1
318 . 1 1 77 77 SER H H 1 7.41 0.01 . 1 . . . . . . . . 4075 1
319 . 1 1 77 77 SER HA H 1 4.5 0.01 . 1 . . . . . . . . 4075 1
320 . 1 1 77 77 SER C C 13 174.6 0.1 . 1 . . . . . . . . 4075 1
321 . 1 1 77 77 SER CA C 13 58.4 0.1 . 1 . . . . . . . . 4075 1
322 . 1 1 77 77 SER N N 15 111.9 0.1 . 1 . . . . . . . . 4075 1
323 . 1 1 78 78 GLY H H 1 7.77 0.01 . 1 . . . . . . . . 4075 1
324 . 1 1 78 78 GLY HA2 H 1 4.1 0.1 . 2 . . . . . . . . 4075 1
325 . 1 1 78 78 GLY HA3 H 1 3.76 0.1 . 2 . . . . . . . . 4075 1
326 . 1 1 78 78 GLY C C 13 174.6 0.1 . 1 . . . . . . . . 4075 1
327 . 1 1 78 78 GLY CA C 13 45.7 0.1 . 1 . . . . . . . . 4075 1
328 . 1 1 78 78 GLY N N 15 109.9 0.1 . 1 . . . . . . . . 4075 1
329 . 1 1 79 79 SER H H 1 7.84 0.01 . 1 . . . . . . . . 4075 1
330 . 1 1 79 79 SER HA H 1 4.83 0.01 . 1 . . . . . . . . 4075 1
331 . 1 1 79 79 SER CA C 13 56.00 0.1 . 1 . . . . . . . . 4075 1
332 . 1 1 79 79 SER N N 15 117.1 0.1 . 1 . . . . . . . . 4075 1
333 . 1 1 80 80 PRO HA H 1 4.43 0.01 . 1 . . . . . . . . 4075 1
334 . 1 1 80 80 PRO C C 13 174.5 0.1 . 1 . . . . . . . . 4075 1
335 . 1 1 80 80 PRO CA C 13 62.8 0.1 . 1 . . . . . . . . 4075 1
336 . 1 1 81 81 ILE H H 1 7.06 0.01 . 1 . . . . . . . . 4075 1
337 . 1 1 81 81 ILE HA H 1 4.33 0.01 . 1 . . . . . . . . 4075 1
338 . 1 1 81 81 ILE C C 13 173.4 0.1 . 1 . . . . . . . . 4075 1
339 . 1 1 81 81 ILE CA C 13 60.1 0.1 . 1 . . . . . . . . 4075 1
340 . 1 1 81 81 ILE N N 15 108.8 0.1 . 1 . . . . . . . . 4075 1
341 . 1 1 82 82 ASP H H 1 7.4 0.01 . 1 . . . . . . . . 4075 1
342 . 1 1 82 82 ASP HA H 1 4.81 0.01 . 1 . . . . . . . . 4075 1
343 . 1 1 82 82 ASP C C 13 173.6 0.1 . 1 . . . . . . . . 4075 1
344 . 1 1 82 82 ASP CA C 13 52.8 0.1 . 1 . . . . . . . . 4075 1
345 . 1 1 82 82 ASP N N 15 113.9 0.1 . 1 . . . . . . . . 4075 1
346 . 1 1 83 83 LEU H H 1 8.37 0.01 . 1 . . . . . . . . 4075 1
347 . 1 1 83 83 LEU HA H 1 3.94 0.01 . 1 . . . . . . . . 4075 1
348 . 1 1 83 83 LEU C C 13 177.00 0.1 . 1 . . . . . . . . 4075 1
349 . 1 1 83 83 LEU CA C 13 59.2 0.1 . 1 . . . . . . . . 4075 1
350 . 1 1 83 83 LEU N N 15 118.3 0.1 . 1 . . . . . . . . 4075 1
351 . 1 1 84 84 ILE H H 1 7.59 0.01 . 1 . . . . . . . . 4075 1
352 . 1 1 84 84 ILE HA H 1 3.8 0.01 . 1 . . . . . . . . 4075 1
353 . 1 1 84 84 ILE C C 13 178.4 0.1 . 1 . . . . . . . . 4075 1
354 . 1 1 84 84 ILE CA C 13 64.2 0.1 . 1 . . . . . . . . 4075 1
355 . 1 1 84 84 ILE N N 15 115.3 0.1 . 1 . . . . . . . . 4075 1
356 . 1 1 85 85 THR H H 1 7.95 0.01 . 1 . . . . . . . . 4075 1
357 . 1 1 85 85 THR HA H 1 3.76 0.01 . 1 . . . . . . . . 4075 1
358 . 1 1 85 85 THR C C 13 177.9 0.1 . 1 . . . . . . . . 4075 1
359 . 1 1 85 85 THR CA C 13 66.8 0.1 . 1 . . . . . . . . 4075 1
360 . 1 1 85 85 THR N N 15 119.1 0.1 . 1 . . . . . . . . 4075 1
361 . 1 1 86 86 LEU H H 1 8.58 0.01 . 1 . . . . . . . . 4075 1
362 . 1 1 86 86 LEU HA H 1 3.86 0.01 . 1 . . . . . . . . 4075 1
363 . 1 1 86 86 LEU C C 13 178.00 0.1 . 1 . . . . . . . . 4075 1
364 . 1 1 86 86 LEU CA C 13 58.2 0.1 . 1 . . . . . . . . 4075 1
365 . 1 1 86 86 LEU N N 15 122.1 0.1 . 1 . . . . . . . . 4075 1
366 . 1 1 87 87 ALA H H 1 8.59 0.01 . 1 . . . . . . . . 4075 1
367 . 1 1 87 87 ALA HA H 1 3.81 0.01 . 1 . . . . . . . . 4075 1
368 . 1 1 87 87 ALA C C 13 179.8 0.1 . 1 . . . . . . . . 4075 1
369 . 1 1 87 87 ALA CA C 13 55.8 0.1 . 1 . . . . . . . . 4075 1
370 . 1 1 87 87 ALA N N 15 120.2 0.1 . 1 . . . . . . . . 4075 1
371 . 1 1 88 88 GLU H H 1 8.45 0.01 . 1 . . . . . . . . 4075 1
372 . 1 1 88 88 GLU HA H 1 4.01 0.01 . 1 . . . . . . . . 4075 1
373 . 1 1 88 88 GLU C C 13 179.1 0.1 . 1 . . . . . . . . 4075 1
374 . 1 1 88 88 GLU CA C 13 60.1 0.1 . 1 . . . . . . . . 4075 1
375 . 1 1 88 88 GLU N N 15 116.7 0.1 . 1 . . . . . . . . 4075 1
376 . 1 1 89 89 SER H H 1 8.02 0.01 . 1 . . . . . . . . 4075 1
377 . 1 1 89 89 SER HA H 1 4.12 0.01 . 1 . . . . . . . . 4075 1
378 . 1 1 89 89 SER C C 13 179.00 0.1 . 1 . . . . . . . . 4075 1
379 . 1 1 89 89 SER CA C 13 61.3 0.1 . 1 . . . . . . . . 4075 1
380 . 1 1 89 89 SER N N 15 114.2 0.1 . 1 . . . . . . . . 4075 1
381 . 1 1 90 90 LEU H H 1 8.4 0.01 . 1 . . . . . . . . 4075 1
382 . 1 1 90 90 LEU HA H 1 3.89 0.01 . 1 . . . . . . . . 4075 1
383 . 1 1 90 90 LEU C C 13 179.6 0.1 . 1 . . . . . . . . 4075 1
384 . 1 1 90 90 LEU CA C 13 58.1 0.1 . 1 . . . . . . . . 4075 1
385 . 1 1 90 90 LEU N N 15 118.4 0.1 . 1 . . . . . . . . 4075 1
386 . 1 1 91 91 GLU H H 1 8.84 0.01 . 1 . . . . . . . . 4075 1
387 . 1 1 91 91 GLU HA H 1 4.14 0.01 . 1 . . . . . . . . 4075 1
388 . 1 1 91 91 GLU C C 13 180.6 0.1 . 1 . . . . . . . . 4075 1
389 . 1 1 91 91 GLU CA C 13 59.9 0.1 . 1 . . . . . . . . 4075 1
390 . 1 1 91 91 GLU N N 15 122.2 0.1 . 1 . . . . . . . . 4075 1
391 . 1 1 92 92 ARG H H 1 8.42 0.01 . 1 . . . . . . . . 4075 1
392 . 1 1 92 92 ARG HA H 1 4.13 0.01 . 1 . . . . . . . . 4075 1
393 . 1 1 92 92 ARG C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
394 . 1 1 92 92 ARG CA C 13 59.4 0.1 . 1 . . . . . . . . 4075 1
395 . 1 1 92 92 ARG N N 15 121.5 0.1 . 1 . . . . . . . . 4075 1
396 . 1 1 93 93 GLN H H 1 7.33 0.01 . 1 . . . . . . . . 4075 1
397 . 1 1 93 93 GLN HA H 1 4.38 0.01 . 1 . . . . . . . . 4075 1
398 . 1 1 93 93 GLN C C 13 176.3 0.1 . 1 . . . . . . . . 4075 1
399 . 1 1 93 93 GLN CA C 13 55.7 0.1 . 1 . . . . . . . . 4075 1
400 . 1 1 93 93 GLN N N 15 114.2 0.1 . 1 . . . . . . . . 4075 1
401 . 1 1 94 94 GLY H H 1 8.16 0.01 . 1 . . . . . . . . 4075 1
402 . 1 1 94 94 GLY HA2 H 1 4.08 0.1 . 2 . . . . . . . . 4075 1
403 . 1 1 94 94 GLY C C 13 176.2 0.1 . 1 . . . . . . . . 4075 1
404 . 1 1 94 94 GLY CA C 13 46.5 0.1 . 1 . . . . . . . . 4075 1
405 . 1 1 94 94 GLY N N 15 109.5 0.1 . 1 . . . . . . . . 4075 1
406 . 1 1 95 95 GLN H H 1 8.18 0.01 . 1 . . . . . . . . 4075 1
407 . 1 1 95 95 GLN HA H 1 4.63 0.01 . 1 . . . . . . . . 4075 1
408 . 1 1 95 95 GLN C C 13 176.4 0.1 . 1 . . . . . . . . 4075 1
409 . 1 1 95 95 GLN CA C 13 55.00 0.1 . 1 . . . . . . . . 4075 1
410 . 1 1 95 95 GLN N N 15 115.2 0.1 . 1 . . . . . . . . 4075 1
411 . 1 1 96 96 LEU H H 1 7.74 0.01 . 1 . . . . . . . . 4075 1
412 . 1 1 96 96 LEU HA H 1 3.98 0.01 . 1 . . . . . . . . 4075 1
413 . 1 1 96 96 LEU C C 13 178.9 0.1 . 1 . . . . . . . . 4075 1
414 . 1 1 96 96 LEU CA C 13 58.2 0.1 . 1 . . . . . . . . 4075 1
415 . 1 1 96 96 LEU N N 15 122.9 0.1 . 1 . . . . . . . . 4075 1
416 . 1 1 97 97 ASP H H 1 8.54 0.01 . 1 . . . . . . . . 4075 1
417 . 1 1 97 97 ASP HA H 1 4.29 0.01 . 1 . . . . . . . . 4075 1
418 . 1 1 97 97 ASP C C 13 179.8 0.1 . 1 . . . . . . . . 4075 1
419 . 1 1 97 97 ASP CA C 13 57.6 0.1 . 1 . . . . . . . . 4075 1
420 . 1 1 97 97 ASP N N 15 118.7 0.1 . 1 . . . . . . . . 4075 1
421 . 1 1 98 98 SER H H 1 7.82 0.01 . 1 . . . . . . . . 4075 1
422 . 1 1 98 98 SER HA H 1 4.23 0.01 . 1 . . . . . . . . 4075 1
423 . 1 1 98 98 SER C C 13 175.8 0.1 . 1 . . . . . . . . 4075 1
424 . 1 1 98 98 SER CA C 13 61.00 0.1 . 1 . . . . . . . . 4075 1
425 . 1 1 98 98 SER N N 15 115.2 0.1 . 1 . . . . . . . . 4075 1
426 . 1 1 99 99 VAL H H 1 7.11 0.01 . 1 . . . . . . . . 4075 1
427 . 1 1 99 99 VAL HA H 1 4.47 0.01 . 1 . . . . . . . . 4075 1
428 . 1 1 99 99 VAL C C 13 173.6 0.1 . 1 . . . . . . . . 4075 1
429 . 1 1 99 99 VAL CA C 13 60.4 0.1 . 1 . . . . . . . . 4075 1
430 . 1 1 99 99 VAL N N 15 111.2 0.1 . 1 . . . . . . . . 4075 1
431 . 1 1 100 100 GLY H H 1 7.39 0.01 . 1 . . . . . . . . 4075 1
432 . 1 1 100 100 GLY HA2 H 1 4.35 0.1 . 2 . . . . . . . . 4075 1
433 . 1 1 100 100 GLY HA3 H 1 3.55 0.1 . 2 . . . . . . . . 4075 1
434 . 1 1 100 100 GLY C C 13 175.4 0.1 . 1 . . . . . . . . 4075 1
435 . 1 1 100 100 GLY CA C 13 44.4 0.1 . 1 . . . . . . . . 4075 1
436 . 1 1 100 100 GLY N N 15 104.9 0.1 . 1 . . . . . . . . 4075 1
437 . 1 1 101 101 GLY H H 1 7.92 0.01 . 1 . . . . . . . . 4075 1
438 . 1 1 101 101 GLY HA2 H 1 3.68 0.01 . 2 . . . . . . . . 4075 1
439 . 1 1 101 101 GLY C C 13 172.9 0.1 . 1 . . . . . . . . 4075 1
440 . 1 1 101 101 GLY CA C 13 44.2 0.1 . 1 . . . . . . . . 4075 1
441 . 1 1 101 101 GLY N N 15 107.4 0.1 . 1 . . . . . . . . 4075 1
442 . 1 1 103 103 ALA HA H 1 3.94 0.01 . 1 . . . . . . . . 4075 1
443 . 1 1 103 103 ALA C C 13 180.2 0.1 . 1 . . . . . . . . 4075 1
444 . 1 1 103 103 ALA CA C 13 55.2 0.1 . 1 . . . . . . . . 4075 1
445 . 1 1 104 104 TYR H H 1 7.13 0.01 . 1 . . . . . . . . 4075 1
446 . 1 1 104 104 TYR HA H 1 4.36 0.01 . 1 . . . . . . . . 4075 1
447 . 1 1 104 104 TYR C C 13 177.2 0.1 . 1 . . . . . . . . 4075 1
448 . 1 1 104 104 TYR CA C 13 61.4 0.1 . 1 . . . . . . . . 4075 1
449 . 1 1 104 104 TYR N N 15 117.3 0.1 . 1 . . . . . . . . 4075 1
450 . 1 1 105 105 LEU H H 1 7.02 0.01 . 1 . . . . . . . . 4075 1
451 . 1 1 105 105 LEU HA H 1 3.56 0.01 . 1 . . . . . . . . 4075 1
452 . 1 1 105 105 LEU C C 13 178.6 0.1 . 1 . . . . . . . . 4075 1
453 . 1 1 105 105 LEU CA C 13 57.9 0.1 . 1 . . . . . . . . 4075 1
454 . 1 1 105 105 LEU N N 15 116.6 0.1 . 1 . . . . . . . . 4075 1
455 . 1 1 106 106 ALA H H 1 8.43 0.01 . 1 . . . . . . . . 4075 1
456 . 1 1 106 106 ALA HA H 1 3.67 0.01 . 1 . . . . . . . . 4075 1
457 . 1 1 106 106 ALA C C 13 180.7 0.1 . 1 . . . . . . . . 4075 1
458 . 1 1 106 106 ALA CA C 13 54.5 0.1 . 1 . . . . . . . . 4075 1
459 . 1 1 106 106 ALA N N 15 119.1 0.1 . 1 . . . . . . . . 4075 1
460 . 1 1 107 107 GLU H H 1 7.68 0.01 . 1 . . . . . . . . 4075 1
461 . 1 1 107 107 GLU HA H 1 3.82 0.01 . 1 . . . . . . . . 4075 1
462 . 1 1 107 107 GLU C C 13 179.1 0.1 . 1 . . . . . . . . 4075 1
463 . 1 1 107 107 GLU CA C 13 59.4 0.1 . 1 . . . . . . . . 4075 1
464 . 1 1 107 107 GLU N N 15 121.00 0.1 . 1 . . . . . . . . 4075 1
465 . 1 1 108 108 LEU H H 1 7.77 0.01 . 1 . . . . . . . . 4075 1
466 . 1 1 108 108 LEU HA H 1 3.69 0.01 . 1 . . . . . . . . 4075 1
467 . 1 1 108 108 LEU C C 13 179.4 0.1 . 1 . . . . . . . . 4075 1
468 . 1 1 108 108 LEU CA C 13 57.7 0.1 . 1 . . . . . . . . 4075 1
469 . 1 1 108 108 LEU N N 15 118.6 0.1 . 1 . . . . . . . . 4075 1
470 . 1 1 109 109 SER H H 1 7.53 0.01 . 1 . . . . . . . . 4075 1
471 . 1 1 109 109 SER HA H 1 4.18 0.01 . 1 . . . . . . . . 4075 1
472 . 1 1 109 109 SER C C 13 175.4 0.1 . 1 . . . . . . . . 4075 1
473 . 1 1 109 109 SER CA C 13 60.5 0.1 . 1 . . . . . . . . 4075 1
474 . 1 1 109 109 SER N N 15 111.7 0.1 . 1 . . . . . . . . 4075 1
475 . 1 1 110 110 LYS H H 1 7.66 0.01 . 1 . . . . . . . . 4075 1
476 . 1 1 110 110 LYS HA H 1 4.11 0.01 . 1 . . . . . . . . 4075 1
477 . 1 1 110 110 LYS C C 13 177.6 0.1 . 1 . . . . . . . . 4075 1
478 . 1 1 110 110 LYS CA C 13 57.9 0.1 . 1 . . . . . . . . 4075 1
479 . 1 1 110 110 LYS N N 15 120.2 0.1 . 1 . . . . . . . . 4075 1
480 . 1 1 111 111 ASN H H 1 7.75 0.01 . 1 . . . . . . . . 4075 1
481 . 1 1 111 111 ASN HA H 1 4.66 0.01 . 1 . . . . . . . . 4075 1
482 . 1 1 111 111 ASN C C 13 174.2 0.1 . 1 . . . . . . . . 4075 1
483 . 1 1 111 111 ASN CA C 13 53.4 0.1 . 1 . . . . . . . . 4075 1
484 . 1 1 111 111 ASN N N 15 116.5 0.1 . 1 . . . . . . . . 4075 1
485 . 1 1 112 112 THR H H 1 7.48 0.01 . 1 . . . . . . . . 4075 1
486 . 1 1 112 112 THR HA H 1 4.55 0.01 . 1 . . . . . . . . 4075 1
487 . 1 1 112 112 THR C C 13 172.8 0.1 . 1 . . . . . . . . 4075 1
488 . 1 1 112 112 THR CA C 13 59.5 0.1 . 1 . . . . . . . . 4075 1
489 . 1 1 112 112 THR N N 15 114.6 0.1 . 1 . . . . . . . . 4075 1
490 . 1 1 113 113 PRO HA H 1 4.53 0.01 . 1 . . . . . . . . 4075 1
491 . 1 1 113 113 PRO C C 13 176.6 0.1 . 1 . . . . . . . . 4075 1
492 . 1 1 113 113 PRO CA C 13 63.1 0.1 . 1 . . . . . . . . 4075 1
493 . 1 1 114 114 SER H H 1 7.97 0.01 . 1 . . . . . . . . 4075 1
494 . 1 1 114 114 SER HA H 1 4.42 0.01 . 1 . . . . . . . . 4075 1
495 . 1 1 114 114 SER C C 13 174.4 0.1 . 1 . . . . . . . . 4075 1
496 . 1 1 114 114 SER CA C 13 57.8 0.1 . 1 . . . . . . . . 4075 1
497 . 1 1 114 114 SER N N 15 113.2 0.1 . 1 . . . . . . . . 4075 1
498 . 1 1 115 115 ALA H H 1 8.81 0.01 . 1 . . . . . . . . 4075 1
499 . 1 1 115 115 ALA HA H 1 4.4 0.01 . 1 . . . . . . . . 4075 1
500 . 1 1 115 115 ALA C C 13 178.00 0.1 . 1 . . . . . . . . 4075 1
501 . 1 1 115 115 ALA CA C 13 53.00 0.1 . 1 . . . . . . . . 4075 1
502 . 1 1 115 115 ALA N N 15 125.4 0.1 . 1 . . . . . . . . 4075 1
503 . 1 1 116 116 ALA H H 1 8.1 0.01 . 1 . . . . . . . . 4075 1
504 . 1 1 116 116 ALA HA H 1 4.12 0.01 . 1 . . . . . . . . 4075 1
505 . 1 1 116 116 ALA C C 13 178.8 0.1 . 1 . . . . . . . . 4075 1
506 . 1 1 116 116 ALA CA C 13 54.2 0.1 . 1 . . . . . . . . 4075 1
507 . 1 1 116 116 ALA N N 15 120.4 0.1 . 1 . . . . . . . . 4075 1
508 . 1 1 117 117 ASN H H 1 8.26 0.01 . 1 . . . . . . . . 4075 1
509 . 1 1 117 117 ASN HA H 1 4.8 0.01 . 1 . . . . . . . . 4075 1
510 . 1 1 117 117 ASN C C 13 176.2 0.1 . 1 . . . . . . . . 4075 1
511 . 1 1 117 117 ASN CA C 13 52.9 0.1 . 1 . . . . . . . . 4075 1
512 . 1 1 117 117 ASN N N 15 116.1 0.1 . 1 . . . . . . . . 4075 1
513 . 1 1 118 118 ILE H H 1 8.00 0.01 . 1 . . . . . . . . 4075 1
514 . 1 1 118 118 ILE HA H 1 3.91 0.01 . 1 . . . . . . . . 4075 1
515 . 1 1 118 118 ILE C C 13 176.9 0.1 . 1 . . . . . . . . 4075 1
516 . 1 1 118 118 ILE CA C 13 66.1 0.1 . 1 . . . . . . . . 4075 1
517 . 1 1 118 118 ILE N N 15 121.00 0.1 . 1 . . . . . . . . 4075 1
518 . 1 1 119 119 SER H H 1 8.13 0.01 . 1 . . . . . . . . 4075 1
519 . 1 1 119 119 SER HA H 1 3.81 0.01 . 1 . . . . . . . . 4075 1
520 . 1 1 119 119 SER C C 13 174.9 0.1 . 1 . . . . . . . . 4075 1
521 . 1 1 119 119 SER CA C 13 62.5 0.1 . 1 . . . . . . . . 4075 1
522 . 1 1 119 119 SER N N 15 117.2 0.1 . 1 . . . . . . . . 4075 1
523 . 1 1 120 120 ALA H H 1 7.21 0.01 . 1 . . . . . . . . 4075 1
524 . 1 1 120 120 ALA HA H 1 4.12 0.01 . 1 . . . . . . . . 4075 1
525 . 1 1 120 120 ALA C C 13 181.5 0.1 . 1 . . . . . . . . 4075 1
526 . 1 1 120 120 ALA CA C 13 54.5 0.1 . 1 . . . . . . . . 4075 1
527 . 1 1 120 120 ALA N N 15 123.1 0.1 . 1 . . . . . . . . 4075 1
528 . 1 1 121 121 TYR H H 1 7.71 0.01 . 1 . . . . . . . . 4075 1
529 . 1 1 121 121 TYR HA H 1 4.4 0.01 . 1 . . . . . . . . 4075 1
530 . 1 1 121 121 TYR C C 13 177.8 0.1 . 1 . . . . . . . . 4075 1
531 . 1 1 121 121 TYR CA C 13 60.8 0.1 . 1 . . . . . . . . 4075 1
532 . 1 1 121 121 TYR N N 15 116.8 0.1 . 1 . . . . . . . . 4075 1
533 . 1 1 122 122 ALA H H 1 8.3 0.01 . 1 . . . . . . . . 4075 1
534 . 1 1 122 122 ALA HA H 1 3.73 0.01 . 1 . . . . . . . . 4075 1
535 . 1 1 122 122 ALA C C 13 177.9 0.1 . 1 . . . . . . . . 4075 1
536 . 1 1 122 122 ALA CA C 13 55.7 0.1 . 1 . . . . . . . . 4075 1
537 . 1 1 122 122 ALA N N 15 122.9 0.1 . 1 . . . . . . . . 4075 1
538 . 1 1 123 123 ASP H H 1 8.01 0.01 . 1 . . . . . . . . 4075 1
539 . 1 1 123 123 ASP HA H 1 4.37 0.01 . 1 . . . . . . . . 4075 1
540 . 1 1 123 123 ASP C C 13 179.1 0.1 . 1 . . . . . . . . 4075 1
541 . 1 1 123 123 ASP CA C 13 57.5 0.1 . 1 . . . . . . . . 4075 1
542 . 1 1 123 123 ASP N N 15 117.2 0.1 . 1 . . . . . . . . 4075 1
543 . 1 1 124 124 ILE H H 1 7.42 0.01 . 1 . . . . . . . . 4075 1
544 . 1 1 124 124 ILE HA H 1 3.76 0.01 . 1 . . . . . . . . 4075 1
545 . 1 1 124 124 ILE C C 13 177.4 0.1 . 1 . . . . . . . . 4075 1
546 . 1 1 124 124 ILE CA C 13 65.3 0.1 . 1 . . . . . . . . 4075 1
547 . 1 1 124 124 ILE N N 15 121.1 0.1 . 1 . . . . . . . . 4075 1
548 . 1 1 125 125 VAL H H 1 7.75 0.01 . 1 . . . . . . . . 4075 1
549 . 1 1 125 125 VAL HA H 1 3.37 0.01 . 1 . . . . . . . . 4075 1
550 . 1 1 125 125 VAL C C 13 179.7 0.1 . 1 . . . . . . . . 4075 1
551 . 1 1 125 125 VAL CA C 13 67.00 0.1 . 1 . . . . . . . . 4075 1
552 . 1 1 125 125 VAL N N 15 120.3 0.1 . 1 . . . . . . . . 4075 1
553 . 1 1 126 126 ARG H H 1 8.06 0.01 . 1 . . . . . . . . 4075 1
554 . 1 1 126 126 ARG HA H 1 3.82 0.01 . 1 . . . . . . . . 4075 1
555 . 1 1 126 126 ARG C C 13 177.4 0.1 . 1 . . . . . . . . 4075 1
556 . 1 1 126 126 ARG CA C 13 59.4 0.1 . 1 . . . . . . . . 4075 1
557 . 1 1 126 126 ARG N N 15 120.9 0.1 . 1 . . . . . . . . 4075 1
558 . 1 1 127 127 GLU H H 1 8.53 0.01 . 1 . . . . . . . . 4075 1
559 . 1 1 127 127 GLU HA H 1 3.92 0.01 . 1 . . . . . . . . 4075 1
560 . 1 1 127 127 GLU C C 13 180.00 0.1 . 1 . . . . . . . . 4075 1
561 . 1 1 127 127 GLU CA C 13 59.8 0.1 . 1 . . . . . . . . 4075 1
562 . 1 1 127 127 GLU N N 15 119.6 0.1 . 1 . . . . . . . . 4075 1
563 . 1 1 128 128 ARG H H 1 8.62 0.01 . 1 . . . . . . . . 4075 1
564 . 1 1 128 128 ARG HA H 1 3.99 0.01 . 1 . . . . . . . . 4075 1
565 . 1 1 128 128 ARG C C 13 177.5 0.1 . 1 . . . . . . . . 4075 1
566 . 1 1 128 128 ARG CA C 13 57.7 0.1 . 1 . . . . . . . . 4075 1
567 . 1 1 128 128 ARG N N 15 115.9 0.1 . 1 . . . . . . . . 4075 1
568 . 1 1 129 129 ALA H H 1 7.6 0.01 . 1 . . . . . . . . 4075 1
569 . 1 1 129 129 ALA HA H 1 3.98 0.01 . 1 . . . . . . . . 4075 1
570 . 1 1 129 129 ALA C C 13 180.4 0.1 . 1 . . . . . . . . 4075 1
571 . 1 1 129 129 ALA CA C 13 55.4 0.1 . 1 . . . . . . . . 4075 1
572 . 1 1 129 129 ALA N N 15 121.8 0.1 . 1 . . . . . . . . 4075 1
573 . 1 1 130 130 VAL H H 1 8.08 0.01 . 1 . . . . . . . . 4075 1
574 . 1 1 130 130 VAL HA H 1 3.67 0.01 . 1 . . . . . . . . 4075 1
575 . 1 1 130 130 VAL C C 13 179.00 0.1 . 1 . . . . . . . . 4075 1
576 . 1 1 130 130 VAL CA C 13 66.3 0.1 . 1 . . . . . . . . 4075 1
577 . 1 1 130 130 VAL N N 15 120.2 0.1 . 1 . . . . . . . . 4075 1
578 . 1 1 131 131 VAL H H 1 7.57 0.01 . 1 . . . . . . . . 4075 1
579 . 1 1 131 131 VAL HA H 1 3.75 0.01 . 1 . . . . . . . . 4075 1
580 . 1 1 131 131 VAL C C 13 178.3 0.1 . 1 . . . . . . . . 4075 1
581 . 1 1 131 131 VAL CA C 13 66.1 0.1 . 1 . . . . . . . . 4075 1
582 . 1 1 131 131 VAL N N 15 119.1 0.1 . 1 . . . . . . . . 4075 1
583 . 1 1 132 132 ARG H H 1 8.29 0.01 . 1 . . . . . . . . 4075 1
584 . 1 1 132 132 ARG HA H 1 3.97 0.01 . 1 . . . . . . . . 4075 1
585 . 1 1 132 132 ARG C C 13 178.5 0.1 . 1 . . . . . . . . 4075 1
586 . 1 1 132 132 ARG CA C 13 60.3 0.1 . 1 . . . . . . . . 4075 1
587 . 1 1 132 132 ARG N N 15 119.5 0.1 . 1 . . . . . . . . 4075 1
588 . 1 1 133 133 GLU H H 1 7.97 0.01 . 1 . . . . . . . . 4075 1
589 . 1 1 133 133 GLU HA H 1 4.18 0.01 . 1 . . . . . . . . 4075 1
590 . 1 1 133 133 GLU C C 13 178.00 0.1 . 1 . . . . . . . . 4075 1
591 . 1 1 133 133 GLU CA C 13 58.3 0.1 . 1 . . . . . . . . 4075 1
592 . 1 1 133 133 GLU N N 15 118.5 0.1 . 1 . . . . . . . . 4075 1
593 . 1 1 134 134 MET H H 1 7.89 0.01 . 1 . . . . . . . . 4075 1
594 . 1 1 134 134 MET HA H 1 4.29 0.01 . 1 . . . . . . . . 4075 1
595 . 1 1 134 134 MET C C 13 177.9 0.1 . 1 . . . . . . . . 4075 1
596 . 1 1 134 134 MET CA C 13 57.7 0.1 . 1 . . . . . . . . 4075 1
597 . 1 1 134 134 MET N N 15 118.5 0.1 . 1 . . . . . . . . 4075 1
598 . 1 1 135 135 ILE H H 1 7.97 0.01 . 1 . . . . . . . . 4075 1
599 . 1 1 135 135 ILE HA H 1 4.12 0.01 . 1 . . . . . . . . 4075 1
600 . 1 1 135 135 ILE C C 13 176.9 0.1 . 1 . . . . . . . . 4075 1
601 . 1 1 135 135 ILE CA C 13 62.6 0.1 . 1 . . . . . . . . 4075 1
602 . 1 1 135 135 ILE N N 15 118.3 0.1 . 1 . . . . . . . . 4075 1
603 . 1 1 136 136 SER H H 1 7.97 0.01 . 1 . . . . . . . . 4075 1
604 . 1 1 136 136 SER HA H 1 4.41 0.01 . 1 . . . . . . . . 4075 1
605 . 1 1 136 136 SER C C 13 175.2 0.1 . 1 . . . . . . . . 4075 1
606 . 1 1 136 136 SER CA C 13 59.4 0.1 . 1 . . . . . . . . 4075 1
607 . 1 1 136 136 SER N N 15 117.6 0.1 . 1 . . . . . . . . 4075 1
608 . 1 1 137 137 VAL H H 1 7.94 0.01 . 1 . . . . . . . . 4075 1
609 . 1 1 137 137 VAL HA H 1 4.13 0.01 . 1 . . . . . . . . 4075 1
610 . 1 1 137 137 VAL C C 13 176.3 0.1 . 1 . . . . . . . . 4075 1
611 . 1 1 137 137 VAL CA C 13 62.7 0.1 . 1 . . . . . . . . 4075 1
612 . 1 1 137 137 VAL N N 15 120.3 0.1 . 1 . . . . . . . . 4075 1
613 . 1 1 138 138 ALA H H 1 8.07 0.01 . 1 . . . . . . . . 4075 1
614 . 1 1 138 138 ALA HA H 1 4.3 0.01 . 1 . . . . . . . . 4075 1
615 . 1 1 138 138 ALA C C 13 177.6 0.1 . 1 . . . . . . . . 4075 1
616 . 1 1 138 138 ALA CA C 13 52.8 0.1 . 1 . . . . . . . . 4075 1
617 . 1 1 138 138 ALA N N 15 125.8 0.1 . 1 . . . . . . . . 4075 1
618 . 1 1 139 139 ASN H H 1 8.18 0.01 . 1 . . . . . . . . 4075 1
619 . 1 1 139 139 ASN HA H 1 4.68 0.01 . 1 . . . . . . . . 4075 1
620 . 1 1 139 139 ASN C C 13 175.1 0.1 . 1 . . . . . . . . 4075 1
621 . 1 1 139 139 ASN CA C 13 53.4 0.1 . 1 . . . . . . . . 4075 1
622 . 1 1 139 139 ASN N N 15 117.2 0.1 . 1 . . . . . . . . 4075 1
623 . 1 1 140 140 GLU H H 1 8.15 0.01 . 1 . . . . . . . . 4075 1
624 . 1 1 140 140 GLU HA H 1 4.28 0.01 . 1 . . . . . . . . 4075 1
625 . 1 1 140 140 GLU C C 13 176.2 0.1 . 1 . . . . . . . . 4075 1
626 . 1 1 140 140 GLU CA C 13 56.7 0.1 . 1 . . . . . . . . 4075 1
627 . 1 1 140 140 GLU N N 15 120.7 0.1 . 1 . . . . . . . . 4075 1
628 . 1 1 141 141 ILE H H 1 8.05 0.01 . 1 . . . . . . . . 4075 1
629 . 1 1 141 141 ILE HA H 1 4.16 0.01 . 1 . . . . . . . . 4075 1
630 . 1 1 141 141 ILE C C 13 174.9 0.1 . 1 . . . . . . . . 4075 1
631 . 1 1 141 141 ILE CA C 13 61.1 0.1 . 1 . . . . . . . . 4075 1
632 . 1 1 141 141 ILE N N 15 121.5 0.1 . 1 . . . . . . . . 4075 1
633 . 1 1 142 142 ALA H H 1 7.84 0.01 . 1 . . . . . . . . 4075 1
634 . 1 1 142 142 ALA HA H 1 4.13 0.01 . 1 . . . . . . . . 4075 1
635 . 1 1 142 142 ALA CA C 13 53.8 0.1 . 1 . . . . . . . . 4075 1
636 . 1 1 142 142 ALA N N 15 133.6 0.1 . 1 . . . . . . . . 4075 1
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