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 6690
_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 .
_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
. . 2 $sample_2 isotropic 6690 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 8 8 ILE H H 1 7.860 0.01 . 1 . . . . 18 ILE H . 6690 1
2 . 1 1 8 8 ILE CA C 13 63.969 0.2 . 1 . . . . 18 ILE CA . 6690 1
3 . 1 1 8 8 ILE N N 15 120.235 0.2 . 1 . . . . 18 ILE N . 6690 1
4 . 1 1 9 9 GLU HA H 1 3.998 0.01 . 1 . . . . 19 GLU HA . 6690 1
5 . 1 1 9 9 GLU HB2 H 1 1.975 0.01 . 2 . . . . 19 GLU HB2 . 6690 1
6 . 1 1 10 10 TYR H H 1 7.938 0.01 . 1 . . . . 20 TYR H . 6690 1
7 . 1 1 10 10 TYR CA C 13 60.889 0.2 . 1 . . . . 20 TYR CA . 6690 1
8 . 1 1 10 10 TYR CB C 13 38.301 0.2 . 1 . . . . 20 TYR CB . 6690 1
9 . 1 1 10 10 TYR N N 15 120.884 0.2 . 1 . . . . 20 TYR N . 6690 1
10 . 1 1 11 11 TYR H H 1 8.151 0.01 . 1 . . . . 21 TYR H . 6690 1
11 . 1 1 11 11 TYR CA C 13 60.486 0.2 . 1 . . . . 21 TYR CA . 6690 1
12 . 1 1 11 11 TYR N N 15 118.875 0.2 . 1 . . . . 21 TYR N . 6690 1
13 . 1 1 12 12 LYS H H 1 8.028 0.01 . 1 . . . . 22 LYS H . 6690 1
14 . 1 1 12 12 LYS CA C 13 58.731 0.2 . 1 . . . . 22 LYS CA . 6690 1
15 . 1 1 12 12 LYS N N 15 120.763 0.2 . 1 . . . . 22 LYS N . 6690 1
16 . 1 1 13 13 GLN H H 1 8.098 0.01 . 1 . . . . 23 GLN H . 6690 1
17 . 1 1 13 13 GLN HA H 1 4.052 0.01 . 1 . . . . 23 GLN HA . 6690 1
18 . 1 1 13 13 GLN HB2 H 1 1.995 0.01 . 2 . . . . 23 GLN HB2 . 6690 1
19 . 1 1 13 13 GLN CA C 13 57.718 0.2 . 1 . . . . 23 GLN CA . 6690 1
20 . 1 1 13 13 GLN CB C 13 32.488 0.2 . 1 . . . . 23 GLN CB . 6690 1
21 . 1 1 13 13 GLN N N 15 119.116 0.2 . 1 . . . . 23 GLN N . 6690 1
22 . 1 1 14 14 MET H H 1 7.856 0.01 . 1 . . . . 24 MET H . 6690 1
23 . 1 1 14 14 MET CA C 13 56.026 0.2 . 1 . . . . 24 MET CA . 6690 1
24 . 1 1 14 14 MET N N 15 117.606 0.2 . 1 . . . . 24 MET N . 6690 1
25 . 1 1 15 15 GLY H H 1 8.011 0.01 . 1 . . . . 25 GLY H . 6690 1
26 . 1 1 15 15 GLY CA C 13 45.698 0.2 . 1 . . . . 25 GLY CA . 6690 1
27 . 1 1 15 15 GLY N N 15 108.578 0.2 . 1 . . . . 25 GLY N . 6690 1
28 . 1 1 16 16 SER H H 1 8.105 0.01 . 1 . . . . 26 SER H . 6690 1
29 . 1 1 16 16 SER CA C 13 58.575 0.2 . 1 . . . . 26 SER CA . 6690 1
30 . 1 1 16 16 SER N N 15 115.843 0.2 . 1 . . . . 26 SER N . 6690 1
31 . 1 1 17 17 HIS H H 1 8.154 0.01 . 1 . . . . 27 HIS H . 6690 1
32 . 1 1 17 17 HIS N N 15 120.044 0.2 . 1 . . . . 27 HIS N . 6690 1
33 . 1 1 18 18 ARG H H 1 8.241 0.01 . 1 . . . . 28 ARG H . 6690 1
34 . 1 1 18 18 ARG CA C 13 57.123 0.2 . 1 . . . . 28 ARG CA . 6690 1
35 . 1 1 18 18 ARG N N 15 121.096 0.2 . 1 . . . . 28 ARG N . 6690 1
36 . 1 1 19 19 GLU H H 1 8.323 0.01 . 1 . . . . 29 GLU H . 6690 1
37 . 1 1 19 19 GLU CA C 13 58.544 0.2 . 1 . . . . 29 GLU CA . 6690 1
38 . 1 1 19 19 GLU N N 15 121.122 0.2 . 1 . . . . 29 GLU N . 6690 1
39 . 1 1 20 20 ALA H H 1 8.097 0.01 . 1 . . . . 30 ALA H . 6690 1
40 . 1 1 20 20 ALA CA C 13 54.368 0.2 . 1 . . . . 30 ALA CA . 6690 1
41 . 1 1 20 20 ALA N N 15 122.303 0.2 . 1 . . . . 30 ALA N . 6690 1
42 . 1 1 21 21 GLU H H 1 8.153 0.01 . 1 . . . . 31 GLU H . 6690 1
43 . 1 1 21 21 GLU CA C 13 58.271 0.2 . 1 . . . . 31 GLU CA . 6690 1
44 . 1 1 21 21 GLU N N 15 118.611 0.2 . 1 . . . . 31 GLU N . 6690 1
45 . 1 1 22 22 MET H H 1 8.025 0.01 . 1 . . . . 32 MET H . 6690 1
46 . 1 1 22 22 MET CA C 13 57.438 0.2 . 1 . . . . 32 MET CA . 6690 1
47 . 1 1 22 22 MET N N 15 119.820 0.2 . 1 . . . . 32 MET N . 6690 1
48 . 1 1 23 23 ILE H H 1 7.948 0.01 . 1 . . . . 33 ILE H . 6690 1
49 . 1 1 23 23 ILE CA C 13 63.386 0.2 . 1 . . . . 33 ILE CA . 6690 1
50 . 1 1 23 23 ILE N N 15 121.205 0.2 . 1 . . . . 33 ILE N . 6690 1
51 . 1 1 24 24 GLU H H 1 8.179 0.01 . 1 . . . . 34 GLU H . 6690 1
52 . 1 1 24 24 GLU CA C 13 54.252 0.2 . 1 . . . . 34 GLU CA . 6690 1
53 . 1 1 24 24 GLU N N 15 121.818 0.2 . 1 . . . . 34 GLU N . 6690 1
54 . 1 1 25 25 GLN H H 1 8.209 0.01 . 1 . . . . 35 GLN H . 6690 1
55 . 1 1 25 25 GLN CA C 13 57.994 0.2 . 1 . . . . 35 GLN CA . 6690 1
56 . 1 1 25 25 GLN N N 15 118.662 0.2 . 1 . . . . 35 GLN N . 6690 1
57 . 1 1 26 26 GLN H H 1 8.113 0.01 . 1 . . . . 36 GLN H . 6690 1
58 . 1 1 26 26 GLN CA C 13 57.817 0.2 . 1 . . . . 36 GLN CA . 6690 1
59 . 1 1 26 26 GLN N N 15 120.023 0.2 . 1 . . . . 36 GLN N . 6690 1
60 . 1 1 27 27 MET H H 1 8.215 0.01 . 1 . . . . 37 MET H . 6690 1
61 . 1 1 27 27 MET CA C 13 57.176 0.2 . 1 . . . . 37 MET CA . 6690 1
62 . 1 1 27 27 MET N N 15 119.690 0.2 . 1 . . . . 37 MET N . 6690 1
63 . 1 1 28 28 LYS H H 1 8.005 0.01 . 1 . . . . 38 LYS H . 6690 1
64 . 1 1 28 28 LYS CA C 13 57.878 0.2 . 1 . . . . 38 LYS CA . 6690 1
65 . 1 1 28 28 LYS CB C 13 32.422 0.2 . 1 . . . . 38 LYS CB . 6690 1
66 . 1 1 28 28 LYS N N 15 120.609 0.2 . 1 . . . . 38 LYS N . 6690 1
67 . 1 1 29 29 ALA H H 1 7.919 0.01 . 1 . . . . 39 ALA H . 6690 1
68 . 1 1 29 29 ALA CA C 13 53.412 0.2 . 1 . . . . 39 ALA CA . 6690 1
69 . 1 1 29 29 ALA CB C 13 18.574 0.2 . 1 . . . . 39 ALA CB . 6690 1
70 . 1 1 29 29 ALA N N 15 122.784 0.2 . 1 . . . . 39 ALA N . 6690 1
71 . 1 1 30 30 LYS H H 1 7.940 0.01 . 1 . . . . 40 LYS H . 6690 1
72 . 1 1 30 30 LYS CA C 13 57.088 0.2 . 1 . . . . 40 LYS CA . 6690 1
73 . 1 1 30 30 LYS CB C 13 32.683 0.2 . 1 . . . . 40 LYS CB . 6690 1
74 . 1 1 30 30 LYS N N 15 119.239 0.2 . 1 . . . . 40 LYS N . 6690 1
75 . 1 1 31 31 GLN H H 1 8.074 0.01 . 1 . . . . 41 GLN H . 6690 1
76 . 1 1 31 31 GLN CA C 13 56.154 0.2 . 1 . . . . 41 GLN CA . 6690 1
77 . 1 1 31 31 GLN CB C 13 29.040 0.2 . 1 . . . . 41 GLN CB . 6690 1
78 . 1 1 31 31 GLN N N 15 120.191 0.2 . 1 . . . . 41 GLN N . 6690 1
79 . 1 1 32 32 ALA H H 1 8.193 0.01 . 1 . . . . 42 ALA H . 6690 1
80 . 1 1 32 32 ALA CA C 13 52.837 0.2 . 1 . . . . 42 ALA CA . 6690 1
81 . 1 1 32 32 ALA CB C 13 18.972 0.2 . 1 . . . . 42 ALA CB . 6690 1
82 . 1 1 32 32 ALA N N 15 124.505 0.2 . 1 . . . . 42 ALA N . 6690 1
83 . 1 1 33 33 GLY H H 1 8.273 0.01 . 1 . . . . 43 GLY H . 6690 1
84 . 1 1 33 33 GLY N N 15 107.968 0.2 . 1 . . . . 43 GLY N . 6690 1
85 . 1 1 34 34 GLY H H 1 8.215 0.01 . 1 . . . . 44 GLY H . 6690 1
86 . 1 1 34 34 GLY N N 15 108.751 0.2 . 1 . . . . 44 GLY N . 6690 1
87 . 1 1 61 61 GLY H H 1 8.147 0.01 . 1 . . . . 71 GLY H . 6690 1
88 . 1 1 61 61 GLY HA2 H 1 3.903 0.01 . 1 . . . . 71 GLY HA . 6690 1
89 . 1 1 61 61 GLY HA3 H 1 3.903 0.01 . 1 . . . . 71 GLY HA . 6690 1
90 . 1 1 61 61 GLY CA C 13 44.956 0.2 . 1 . . . . 71 GLY CA . 6690 1
91 . 1 1 61 61 GLY N N 15 123.800 0.2 . 1 . . . . 71 GLY N . 6690 1
92 . 1 1 62 62 ALA H H 1 8.160 0.01 . 1 . . . . 72 ALA H . 6690 1
93 . 1 1 62 62 ALA HA H 1 4.155 0.01 . 1 . . . . 72 ALA HA . 6690 1
94 . 1 1 62 62 ALA HB1 H 1 1.194 0.01 . 1 . . . . 72 ALA HB . 6690 1
95 . 1 1 62 62 ALA HB2 H 1 1.194 0.01 . 1 . . . . 72 ALA HB . 6690 1
96 . 1 1 62 62 ALA HB3 H 1 1.194 0.01 . 1 . . . . 72 ALA HB . 6690 1
97 . 1 1 62 62 ALA CA C 13 52.199 0.2 . 1 . . . . 72 ALA CA . 6690 1
98 . 1 1 62 62 ALA CB C 13 19.955 0.2 . 1 . . . . 72 ALA CB . 6690 1
99 . 1 1 62 62 ALA N N 15 123.737 0.2 . 1 . . . . 72 ALA N . 6690 1
100 . 1 1 63 63 ASP H H 1 8.042 0.01 . 1 . . . . 73 ASP H . 6690 1
101 . 1 1 63 63 ASP HA H 1 4.641 0.01 . 1 . . . . 73 ASP HA . 6690 1
102 . 1 1 63 63 ASP HB2 H 1 2.569 0.01 . 2 . . . . 73 ASP HB2 . 6690 1
103 . 1 1 63 63 ASP HB3 H 1 2.673 0.01 . 2 . . . . 73 ASP HB3 . 6690 1
104 . 1 1 63 63 ASP CA C 13 53.800 0.2 . 1 . . . . 73 ASP CA . 6690 1
105 . 1 1 63 63 ASP CB C 13 42.491 0.2 . 1 . . . . 73 ASP CB . 6690 1
106 . 1 1 63 63 ASP N N 15 118.695 0.2 . 1 . . . . 73 ASP N . 6690 1
107 . 1 1 64 64 TYR H H 1 8.904 0.01 . 1 . . . . 74 TYR H . 6690 1
108 . 1 1 64 64 TYR HA H 1 5.065 0.01 . 1 . . . . 74 TYR HA . 6690 1
109 . 1 1 64 64 TYR HB2 H 1 2.899 0.01 . 2 . . . . 74 TYR HB2 . 6690 1
110 . 1 1 64 64 TYR HB3 H 1 3.494 0.01 . 2 . . . . 74 TYR HB3 . 6690 1
111 . 1 1 64 64 TYR HD1 H 1 6.901 0.01 . 1 . . . . 74 TYR HD1 . 6690 1
112 . 1 1 64 64 TYR HD2 H 1 6.901 0.01 . 1 . . . . 74 TYR HD2 . 6690 1
113 . 1 1 64 64 TYR HE1 H 1 6.712 0.01 . 1 . . . . 74 TYR HE1 . 6690 1
114 . 1 1 64 64 TYR CA C 13 58.000 0.2 . 1 . . . . 74 TYR CA . 6690 1
115 . 1 1 64 64 TYR CB C 13 38.202 0.2 . 1 . . . . 74 TYR CB . 6690 1
116 . 1 1 64 64 TYR CD1 C 13 133.047 0.2 . 1 . . . . 74 TYR CD1 . 6690 1
117 . 1 1 64 64 TYR CD2 C 13 133.047 0.2 . 1 . . . . 74 TYR CD2 . 6690 1
118 . 1 1 64 64 TYR CE1 C 13 118.149 0.2 . 1 . . . . 74 TYR CE1 . 6690 1
119 . 1 1 64 64 TYR CE2 C 13 118.149 0.2 . 1 . . . . 74 TYR CE2 . 6690 1
120 . 1 1 64 64 TYR N N 15 122.600 0.2 . 1 . . . . 74 TYR N . 6690 1
121 . 1 1 65 65 SER H H 1 8.784 0.01 . 1 . . . . 75 SER H . 6690 1
122 . 1 1 65 65 SER HA H 1 3.752 0.01 . 1 . . . . 75 SER HA . 6690 1
123 . 1 1 65 65 SER HB2 H 1 3.556 0.01 . 2 . . . . 75 SER HB2 . 6690 1
124 . 1 1 65 65 SER HB3 H 1 3.758 0.01 . 2 . . . . 75 SER HB3 . 6690 1
125 . 1 1 65 65 SER CA C 13 64.858 0.2 . 1 . . . . 75 SER CA . 6690 1
126 . 1 1 65 65 SER CB C 13 62.778 0.2 . 1 . . . . 75 SER CB . 6690 1
127 . 1 1 65 65 SER N N 15 120.113 0.2 . 1 . . . . 75 SER N . 6690 1
128 . 1 1 66 66 ALA H H 1 8.889 0.01 . 1 . . . . 76 ALA H . 6690 1
129 . 1 1 66 66 ALA HA H 1 3.894 0.01 . 1 . . . . 76 ALA HA . 6690 1
130 . 1 1 66 66 ALA HB1 H 1 1.346 0.01 . 1 . . . . 76 ALA HB . 6690 1
131 . 1 1 66 66 ALA HB2 H 1 1.346 0.01 . 1 . . . . 76 ALA HB . 6690 1
132 . 1 1 66 66 ALA HB3 H 1 1.346 0.01 . 1 . . . . 76 ALA HB . 6690 1
133 . 1 1 66 66 ALA CA C 13 55.700 0.2 . 1 . . . . 76 ALA CA . 6690 1
134 . 1 1 66 66 ALA CB C 13 17.700 0.2 . 1 . . . . 76 ALA CB . 6690 1
135 . 1 1 66 66 ALA N N 15 123.000 0.2 . 1 . . . . 76 ALA N . 6690 1
136 . 1 1 67 67 GLN H H 1 8.245 0.01 . 1 . . . . 77 GLN H . 6690 1
137 . 1 1 67 67 GLN HA H 1 4.070 0.01 . 1 . . . . 77 GLN HA . 6690 1
138 . 1 1 67 67 GLN HB2 H 1 1.897 0.01 . 2 . . . . 77 GLN HB2 . 6690 1
139 . 1 1 67 67 GLN HB3 H 1 2.265 0.01 . 2 . . . . 77 GLN HB3 . 6690 1
140 . 1 1 67 67 GLN HG2 H 1 2.463 0.01 . 2 . . . . 77 GLN HG2 . 6690 1
141 . 1 1 67 67 GLN HG3 H 1 2.629 0.01 . 2 . . . . 77 GLN HG3 . 6690 1
142 . 1 1 67 67 GLN CA C 13 60.000 0.2 . 1 . . . . 77 GLN CA . 6690 1
143 . 1 1 67 67 GLN CB C 13 27.295 0.2 . 1 . . . . 77 GLN CB . 6690 1
144 . 1 1 67 67 GLN CG C 13 35.198 0.2 . 1 . . . . 77 GLN CG . 6690 1
145 . 1 1 67 67 GLN N N 15 118.805 0.2 . 1 . . . . 77 GLN N . 6690 1
146 . 1 1 68 68 TRP H H 1 8.801 0.01 . 1 . . . . 78 TRP H . 6690 1
147 . 1 1 68 68 TRP HA H 1 3.795 0.01 . 1 . . . . 78 TRP HA . 6690 1
148 . 1 1 68 68 TRP HB2 H 1 2.704 0.01 . 2 . . . . 78 TRP HB2 . 6690 1
149 . 1 1 68 68 TRP HB3 H 1 2.925 0.01 . 2 . . . . 78 TRP HB3 . 6690 1
150 . 1 1 68 68 TRP HE3 H 1 6.849 0.01 . 1 . . . . 78 TRP HE3 . 6690 1
151 . 1 1 68 68 TRP HZ2 H 1 7.098 0.01 . 1 . . . . 78 TRP HZ2 . 6690 1
152 . 1 1 68 68 TRP HZ3 H 1 6.898 0.01 . 1 . . . . 78 TRP HZ3 . 6690 1
153 . 1 1 68 68 TRP HH2 H 1 7.026 0.01 . 1 . . . . 78 TRP HH2 . 6690 1
154 . 1 1 68 68 TRP CA C 13 62.230 0.2 . 1 . . . . 78 TRP CA . 6690 1
155 . 1 1 68 68 TRP CB C 13 27.803 0.2 . 1 . . . . 78 TRP CB . 6690 1
156 . 1 1 68 68 TRP CE3 C 13 120.280 0.2 . 1 . . . . 78 TRP CE3 . 6690 1
157 . 1 1 68 68 TRP CZ2 C 13 114.530 0.2 . 1 . . . . 78 TRP CZ2 . 6690 1
158 . 1 1 68 68 TRP CZ3 C 13 122.590 0.2 . 1 . . . . 78 TRP CZ3 . 6690 1
159 . 1 1 68 68 TRP CH2 C 13 124.287 0.2 . 1 . . . . 78 TRP CH2 . 6690 1
160 . 1 1 68 68 TRP N N 15 123.302 0.2 . 1 . . . . 78 TRP N . 6690 1
161 . 1 1 69 69 ALA H H 1 8.278 0.01 . 1 . . . . 79 ALA H . 6690 1
162 . 1 1 69 69 ALA HA H 1 4.177 0.01 . 1 . . . . 79 ALA HA . 6690 1
163 . 1 1 69 69 ALA HB1 H 1 1.637 0.01 . 1 . . . . 79 ALA HB . 6690 1
164 . 1 1 69 69 ALA HB2 H 1 1.637 0.01 . 1 . . . . 79 ALA HB . 6690 1
165 . 1 1 69 69 ALA HB3 H 1 1.637 0.01 . 1 . . . . 79 ALA HB . 6690 1
166 . 1 1 69 69 ALA CA C 13 56.900 0.2 . 1 . . . . 79 ALA CA . 6690 1
167 . 1 1 69 69 ALA CB C 13 17.380 0.2 . 1 . . . . 79 ALA CB . 6690 1
168 . 1 1 69 69 ALA N N 15 121.927 0.2 . 1 . . . . 79 ALA N . 6690 1
169 . 1 1 70 70 GLU H H 1 7.409 0.01 . 1 . . . . 80 GLU H . 6690 1
170 . 1 1 70 70 GLU HA H 1 3.921 0.01 . 1 . . . . 80 GLU HA . 6690 1
171 . 1 1 70 70 GLU HB2 H 1 2.045 0.01 . 2 . . . . 80 GLU HB2 . 6690 1
172 . 1 1 70 70 GLU HG2 H 1 2.159 0.01 . 2 . . . . 80 GLU HG2 . 6690 1
173 . 1 1 70 70 GLU HG3 H 1 2.346 0.01 . 2 . . . . 80 GLU HG3 . 6690 1
174 . 1 1 70 70 GLU CA C 13 59.407 0.2 . 1 . . . . 80 GLU CA . 6690 1
175 . 1 1 70 70 GLU CG C 13 36.252 0.2 . 1 . . . . 80 GLU CG . 6690 1
176 . 1 1 70 70 GLU N N 15 116.630 0.2 . 1 . . . . 80 GLU N . 6690 1
177 . 1 1 71 71 TYR H H 1 8.273 0.01 . 1 . . . . 81 TYR H . 6690 1
178 . 1 1 71 71 TYR HA H 1 3.940 0.01 . 1 . . . . 81 TYR HA . 6690 1
179 . 1 1 71 71 TYR HB2 H 1 2.657 0.01 . 2 . . . . 81 TYR HB2 . 6690 1
180 . 1 1 71 71 TYR HD1 H 1 6.511 0.01 . 1 . . . . 81 TYR HD1 . 6690 1
181 . 1 1 71 71 TYR HD2 H 1 6.511 0.01 . 1 . . . . 81 TYR HD2 . 6690 1
182 . 1 1 71 71 TYR HE1 H 1 6.576 0.01 . 1 . . . . 81 TYR HE1 . 6690 1
183 . 1 1 71 71 TYR HE2 H 1 6.576 0.01 . 1 . . . . 81 TYR HE2 . 6690 1
184 . 1 1 71 71 TYR CA C 13 61.340 0.2 . 1 . . . . 81 TYR CA . 6690 1
185 . 1 1 71 71 TYR CB C 13 37.779 0.2 . 1 . . . . 81 TYR CB . 6690 1
186 . 1 1 71 71 TYR CD1 C 13 133.228 0.2 . 1 . . . . 81 TYR CD1 . 6690 1
187 . 1 1 71 71 TYR CD2 C 13 133.228 0.2 . 1 . . . . 81 TYR CD2 . 6690 1
188 . 1 1 71 71 TYR CE1 C 13 117.838 0.2 . 1 . . . . 81 TYR CE1 . 6690 1
189 . 1 1 71 71 TYR CE2 C 13 117.838 0.2 . 1 . . . . 81 TYR CE2 . 6690 1
190 . 1 1 71 71 TYR N N 15 122.306 0.2 . 1 . . . . 81 TYR N . 6690 1
191 . 1 1 72 72 TYR H H 1 9.309 0.01 . 1 . . . . 82 TYR H . 6690 1
192 . 1 1 72 72 TYR HA H 1 4.288 0.01 . 1 . . . . 82 TYR HA . 6690 1
193 . 1 1 72 72 TYR HB2 H 1 2.968 0.01 . 2 . . . . 82 TYR HB2 . 6690 1
194 . 1 1 72 72 TYR HB3 H 1 3.774 0.01 . 2 . . . . 82 TYR HB3 . 6690 1
195 . 1 1 72 72 TYR HD1 H 1 6.935 0.01 . 1 . . . . 82 TYR HD1 . 6690 1
196 . 1 1 72 72 TYR HD2 H 1 6.935 0.01 . 1 . . . . 82 TYR HD2 . 6690 1
197 . 1 1 72 72 TYR HE1 H 1 7.061 0.01 . 1 . . . . 82 TYR HE1 . 6690 1
198 . 1 1 72 72 TYR CA C 13 59.458 0.2 . 1 . . . . 82 TYR CA . 6690 1
199 . 1 1 72 72 TYR CB C 13 36.100 0.2 . 1 . . . . 82 TYR CB . 6690 1
200 . 1 1 72 72 TYR CD1 C 13 132.258 0.2 . 1 . . . . 82 TYR CD1 . 6690 1
201 . 1 1 72 72 TYR CD2 C 13 132.258 0.2 . 1 . . . . 82 TYR CD2 . 6690 1
202 . 1 1 72 72 TYR CE1 C 13 118.314 0.2 . 1 . . . . 82 TYR CE1 . 6690 1
203 . 1 1 72 72 TYR CE2 C 13 118.314 0.2 . 1 . . . . 82 TYR CE2 . 6690 1
204 . 1 1 72 72 TYR N N 15 121.100 0.2 . 1 . . . . 82 TYR N . 6690 1
205 . 1 1 73 73 ARG H H 1 8.318 0.01 . 1 . . . . 83 ARG H . 6690 1
206 . 1 1 73 73 ARG HA H 1 3.648 0.01 . 1 . . . . 83 ARG HA . 6690 1
207 . 1 1 73 73 ARG HB2 H 1 1.749 0.01 . 1 . . . . 83 ARG HB2 . 6690 1
208 . 1 1 73 73 ARG HD2 H 1 2.989 0.01 . 2 . . . . 83 ARG HD2 . 6690 1
209 . 1 1 73 73 ARG HD3 H 1 3.125 0.01 . 2 . . . . 83 ARG HD3 . 6690 1
210 . 1 1 73 73 ARG CA C 13 61.160 0.2 . 1 . . . . 83 ARG CA . 6690 1
211 . 1 1 73 73 ARG CB C 13 29.591 0.2 . 1 . . . . 83 ARG CB . 6690 1
212 . 1 1 73 73 ARG CD C 13 42.598 0.2 . 1 . . . . 83 ARG CD . 6690 1
213 . 1 1 73 73 ARG N N 15 119.002 0.2 . 1 . . . . 83 ARG N . 6690 1
214 . 1 1 74 74 SER H H 1 7.975 0.01 . 1 . . . . 84 SER H . 6690 1
215 . 1 1 74 74 SER HA H 1 4.225 0.01 . 1 . . . . 84 SER HA . 6690 1
216 . 1 1 74 74 SER HB2 H 1 3.869 0.01 . 2 . . . . 84 SER HB2 . 6690 1
217 . 1 1 74 74 SER HB3 H 1 3.986 0.01 . 2 . . . . 84 SER HB3 . 6690 1
218 . 1 1 74 74 SER CA C 13 61.700 0.2 . 1 . . . . 84 SER CA . 6690 1
219 . 1 1 74 74 SER CB C 13 62.998 0.2 . 1 . . . . 84 SER CB . 6690 1
220 . 1 1 74 74 SER N N 15 117.799 0.2 . 1 . . . . 84 SER N . 6690 1
221 . 1 1 75 75 VAL H H 1 7.127 0.01 . 1 . . . . 85 VAL H . 6690 1
222 . 1 1 75 75 VAL HA H 1 4.566 0.01 . 1 . . . . 85 VAL HA . 6690 1
223 . 1 1 75 75 VAL HB H 1 2.451 0.01 . 1 . . . . 85 VAL HB . 6690 1
224 . 1 1 75 75 VAL HG11 H 1 0.602 0.01 . 2 . . . . 85 VAL HG1 . 6690 1
225 . 1 1 75 75 VAL HG12 H 1 0.602 0.01 . 2 . . . . 85 VAL HG1 . 6690 1
226 . 1 1 75 75 VAL HG13 H 1 0.602 0.01 . 2 . . . . 85 VAL HG1 . 6690 1
227 . 1 1 75 75 VAL HG21 H 1 0.731 0.01 . 2 . . . . 85 VAL HG2 . 6690 1
228 . 1 1 75 75 VAL HG22 H 1 0.731 0.01 . 2 . . . . 85 VAL HG2 . 6690 1
229 . 1 1 75 75 VAL HG23 H 1 0.731 0.01 . 2 . . . . 85 VAL HG2 . 6690 1
230 . 1 1 75 75 VAL CA C 13 60.703 0.2 . 1 . . . . 85 VAL CA . 6690 1
231 . 1 1 75 75 VAL CB C 13 31.093 0.2 . 1 . . . . 85 VAL CB . 6690 1
232 . 1 1 75 75 VAL CG1 C 13 21.000 0.2 . 2 . . . . 85 VAL CG1 . 6690 1
233 . 1 1 75 75 VAL CG2 C 13 18.213 0.2 . 2 . . . . 85 VAL CG2 . 6690 1
234 . 1 1 75 75 VAL N N 15 112.200 0.2 . 1 . . . . 85 VAL N . 6690 1
235 . 1 1 76 76 GLY H H 1 7.598 0.01 . 1 . . . . 86 GLY H . 6690 1
236 . 1 1 76 76 GLY HA2 H 1 3.655 0.01 . 2 . . . . 86 GLY HA2 . 6690 1
237 . 1 1 76 76 GLY HA3 H 1 4.189 0.01 . 2 . . . . 86 GLY HA3 . 6690 1
238 . 1 1 76 76 GLY CA C 13 46.200 0.2 . 1 . . . . 86 GLY CA . 6690 1
239 . 1 1 76 76 GLY N N 15 109.206 0.2 . 1 . . . . 86 GLY N . 6690 1
240 . 1 1 77 77 LYS H H 1 8.442 0.01 . 1 . . . . 87 LYS H . 6690 1
241 . 1 1 77 77 LYS HA H 1 4.508 0.01 . 1 . . . . 87 LYS HA . 6690 1
242 . 1 1 77 77 LYS HB2 H 1 1.464 0.01 . 2 . . . . 87 LYS HB2 . 6690 1
243 . 1 1 77 77 LYS HB3 H 1 1.798 0.01 . 2 . . . . 87 LYS HB3 . 6690 1
244 . 1 1 77 77 LYS CA C 13 54.992 0.2 . 1 . . . . 87 LYS CA . 6690 1
245 . 1 1 77 77 LYS CB C 13 30.634 0.2 . 1 . . . . 87 LYS CB . 6690 1
246 . 1 1 77 77 LYS N N 15 126.021 0.2 . 1 . . . . 87 LYS N . 6690 1
247 . 1 1 78 78 ILE H H 1 7.396 0.01 . 1 . . . . 88 ILE H . 6690 1
248 . 1 1 78 78 ILE HA H 1 3.403 0.01 . 1 . . . . 88 ILE HA . 6690 1
249 . 1 1 78 78 ILE HB H 1 1.875 0.01 . 1 . . . . 88 ILE HB . 6690 1
250 . 1 1 78 78 ILE HG12 H 1 1.312 0.01 . 2 . . . . 88 ILE HG12 . 6690 1
251 . 1 1 78 78 ILE HG13 H 1 1.419 0.01 . 2 . . . . 88 ILE HG13 . 6690 1
252 . 1 1 78 78 ILE HG21 H 1 0.827 0.01 . 1 . . . . 88 ILE HG2 . 6690 1
253 . 1 1 78 78 ILE HG22 H 1 0.827 0.01 . 1 . . . . 88 ILE HG2 . 6690 1
254 . 1 1 78 78 ILE HG23 H 1 0.827 0.01 . 1 . . . . 88 ILE HG2 . 6690 1
255 . 1 1 78 78 ILE HD11 H 1 0.797 0.01 . 1 . . . . 88 ILE HD1 . 6690 1
256 . 1 1 78 78 ILE HD12 H 1 0.797 0.01 . 1 . . . . 88 ILE HD1 . 6690 1
257 . 1 1 78 78 ILE HD13 H 1 0.797 0.01 . 1 . . . . 88 ILE HD1 . 6690 1
258 . 1 1 78 78 ILE CA C 13 63.900 0.2 . 1 . . . . 88 ILE CA . 6690 1
259 . 1 1 78 78 ILE CB C 13 36.629 0.2 . 1 . . . . 88 ILE CB . 6690 1
260 . 1 1 78 78 ILE CG1 C 13 28.432 0.2 . 1 . . . . 88 ILE CG1 . 6690 1
261 . 1 1 78 78 ILE CG2 C 13 17.858 0.2 . 1 . . . . 88 ILE CG2 . 6690 1
262 . 1 1 78 78 ILE CD1 C 13 11.250 0.2 . 1 . . . . 88 ILE CD1 . 6690 1
263 . 1 1 78 78 ILE N N 15 120.600 0.2 . 1 . . . . 88 ILE N . 6690 1
264 . 1 1 79 79 GLU H H 1 8.714 0.01 . 1 . . . . 89 GLU H . 6690 1
265 . 1 1 79 79 GLU HA H 1 3.921 0.01 . 1 . . . . 89 GLU HA . 6690 1
266 . 1 1 79 79 GLU HB2 H 1 1.828 0.01 . 2 . . . . 89 GLU HB2 . 6690 1
267 . 1 1 79 79 GLU HB3 H 1 1.879 0.01 . 2 . . . . 89 GLU HB3 . 6690 1
268 . 1 1 79 79 GLU HG2 H 1 2.208 0.01 . 2 . . . . 89 GLU HG2 . 6690 1
269 . 1 1 79 79 GLU CA C 13 60.165 0.2 . 1 . . . . 89 GLU CA . 6690 1
270 . 1 1 79 79 GLU CB C 13 28.648 0.2 . 1 . . . . 89 GLU CB . 6690 1
271 . 1 1 79 79 GLU CG C 13 36.629 0.2 . 1 . . . . 89 GLU CG . 6690 1
272 . 1 1 79 79 GLU N N 15 120.800 0.2 . 1 . . . . 89 GLU N . 6690 1
273 . 1 1 80 80 GLU H H 1 9.037 0.01 . 1 . . . . 90 GLU H . 6690 1
274 . 1 1 80 80 GLU HA H 1 3.747 0.01 . 1 . . . . 90 GLU HA . 6690 1
275 . 1 1 80 80 GLU HB2 H 1 0.968 0.01 . 2 . . . . 90 GLU HB2 . 6690 1
276 . 1 1 80 80 GLU HB3 H 1 1.373 0.01 . 2 . . . . 90 GLU HB3 . 6690 1
277 . 1 1 80 80 GLU HG2 H 1 1.967 0.01 . 2 . . . . 90 GLU HG2 . 6690 1
278 . 1 1 80 80 GLU CA C 13 60.299 0.2 . 1 . . . . 90 GLU CA . 6690 1
279 . 1 1 80 80 GLU CB C 13 27.500 0.2 . 1 . . . . 90 GLU CB . 6690 1
280 . 1 1 80 80 GLU CG C 13 37.770 0.2 . 1 . . . . 90 GLU CG . 6690 1
281 . 1 1 80 80 GLU N N 15 121.500 0.2 . 1 . . . . 90 GLU N . 6690 1
282 . 1 1 81 81 ALA H H 1 7.709 0.01 . 1 . . . . 91 ALA H . 6690 1
283 . 1 1 81 81 ALA HA H 1 4.128 0.01 . 1 . . . . 91 ALA HA . 6690 1
284 . 1 1 81 81 ALA HB1 H 1 1.641 0.01 . 1 . . . . 91 ALA HB . 6690 1
285 . 1 1 81 81 ALA HB2 H 1 1.641 0.01 . 1 . . . . 91 ALA HB . 6690 1
286 . 1 1 81 81 ALA HB3 H 1 1.641 0.01 . 1 . . . . 91 ALA HB . 6690 1
287 . 1 1 81 81 ALA CA C 13 55.958 0.2 . 1 . . . . 91 ALA CA . 6690 1
288 . 1 1 81 81 ALA CB C 13 20.058 0.2 . 1 . . . . 91 ALA CB . 6690 1
289 . 1 1 81 81 ALA N N 15 121.295 0.2 . 1 . . . . 91 ALA N . 6690 1
290 . 1 1 82 82 GLU H H 1 8.911 0.01 . 1 . . . . 92 GLU H . 6690 1
291 . 1 1 82 82 GLU HA H 1 3.904 0.01 . 1 . . . . 92 GLU HA . 6690 1
292 . 1 1 82 82 GLU HB2 H 1 1.854 0.01 . 2 . . . . 92 GLU HB2 . 6690 1
293 . 1 1 82 82 GLU HB3 H 1 2.090 0.01 . 2 . . . . 92 GLU HB3 . 6690 1
294 . 1 1 82 82 GLU HG2 H 1 2.092 0.01 . 2 . . . . 92 GLU HG2 . 6690 1
295 . 1 1 82 82 GLU HG3 H 1 2.525 0.01 . 2 . . . . 92 GLU HG3 . 6690 1
296 . 1 1 82 82 GLU CA C 13 59.400 0.2 . 1 . . . . 92 GLU CA . 6690 1
297 . 1 1 82 82 GLU CB C 13 29.342 0.2 . 1 . . . . 92 GLU CB . 6690 1
298 . 1 1 82 82 GLU CG C 13 37.304 0.2 . 1 . . . . 92 GLU CG . 6690 1
299 . 1 1 82 82 GLU N N 15 117.700 0.2 . 1 . . . . 92 GLU N . 6690 1
300 . 1 1 83 83 ALA H H 1 7.763 0.01 . 1 . . . . 93 ALA H . 6690 1
301 . 1 1 83 83 ALA HA H 1 4.064 0.01 . 1 . . . . 93 ALA HA . 6690 1
302 . 1 1 83 83 ALA HB1 H 1 1.442 0.01 . 1 . . . . 93 ALA HB . 6690 1
303 . 1 1 83 83 ALA HB2 H 1 1.442 0.01 . 1 . . . . 93 ALA HB . 6690 1
304 . 1 1 83 83 ALA HB3 H 1 1.442 0.01 . 1 . . . . 93 ALA HB . 6690 1
305 . 1 1 83 83 ALA CA C 13 55.000 0.2 . 1 . . . . 93 ALA CA . 6690 1
306 . 1 1 83 83 ALA CB C 13 17.792 0.2 . 1 . . . . 93 ALA CB . 6690 1
307 . 1 1 83 83 ALA N N 15 120.700 0.2 . 1 . . . . 93 ALA N . 6690 1
308 . 1 1 84 84 ILE H H 1 7.264 0.01 . 1 . . . . 94 ILE H . 6690 1
309 . 1 1 84 84 ILE HA H 1 3.750 0.01 . 1 . . . . 94 ILE HA . 6690 1
310 . 1 1 84 84 ILE HB H 1 1.916 0.01 . 1 . . . . 94 ILE HB . 6690 1
311 . 1 1 84 84 ILE HG12 H 1 0.863 0.01 . 2 . . . . 94 ILE HG12 . 6690 1
312 . 1 1 84 84 ILE HG13 H 1 1.923 0.01 . 2 . . . . 94 ILE HG13 . 6690 1
313 . 1 1 84 84 ILE HG21 H 1 0.757 0.01 . 1 . . . . 94 ILE HG2 . 6690 1
314 . 1 1 84 84 ILE HG22 H 1 0.757 0.01 . 1 . . . . 94 ILE HG2 . 6690 1
315 . 1 1 84 84 ILE HG23 H 1 0.757 0.01 . 1 . . . . 94 ILE HG2 . 6690 1
316 . 1 1 84 84 ILE HD11 H 1 0.852 0.01 . 1 . . . . 94 ILE HD1 . 6690 1
317 . 1 1 84 84 ILE HD12 H 1 0.852 0.01 . 1 . . . . 94 ILE HD1 . 6690 1
318 . 1 1 84 84 ILE HD13 H 1 0.852 0.01 . 1 . . . . 94 ILE HD1 . 6690 1
319 . 1 1 84 84 ILE CA C 13 64.630 0.2 . 1 . . . . 94 ILE CA . 6690 1
320 . 1 1 84 84 ILE CB C 13 39.098 0.2 . 1 . . . . 94 ILE CB . 6690 1
321 . 1 1 84 84 ILE CG1 C 13 28.442 0.2 . 1 . . . . 94 ILE CG1 . 6690 1
322 . 1 1 84 84 ILE CG2 C 13 18.040 0.2 . 1 . . . . 94 ILE CG2 . 6690 1
323 . 1 1 84 84 ILE CD1 C 13 14.860 0.2 . 1 . . . . 94 ILE CD1 . 6690 1
324 . 1 1 84 84 ILE N N 15 118.200 0.2 . 1 . . . . 94 ILE N . 6690 1
325 . 1 1 85 85 GLU H H 1 8.762 0.01 . 1 . . . . 95 GLU H . 6690 1
326 . 1 1 85 85 GLU HA H 1 3.721 0.01 . 1 . . . . 95 GLU HA . 6690 1
327 . 1 1 85 85 GLU HB2 H 1 1.896 0.01 . 2 . . . . 95 GLU HB2 . 6690 1
328 . 1 1 85 85 GLU HB3 H 1 2.078 0.01 . 2 . . . . 95 GLU HB3 . 6690 1
329 . 1 1 85 85 GLU HG2 H 1 2.195 0.01 . 2 . . . . 95 GLU HG2 . 6690 1
330 . 1 1 85 85 GLU HG3 H 1 2.393 0.01 . 2 . . . . 95 GLU HG3 . 6690 1
331 . 1 1 85 85 GLU CA C 13 59.600 0.2 . 1 . . . . 95 GLU CA . 6690 1
332 . 1 1 85 85 GLU CG C 13 36.221 0.2 . 1 . . . . 95 GLU CG . 6690 1
333 . 1 1 85 85 GLU N N 15 120.500 0.2 . 1 . . . . 95 GLU N . 6690 1
334 . 1 1 86 86 LYS H H 1 8.074 0.01 . 1 . . . . 96 LYS H . 6690 1
335 . 1 1 86 86 LYS HA H 1 4.064 0.01 . 1 . . . . 96 LYS HA . 6690 1
336 . 1 1 86 86 LYS HB2 H 1 1.872 0.01 . 2 . . . . 96 LYS HB2 . 6690 1
337 . 1 1 86 86 LYS CA C 13 59.200 0.2 . 1 . . . . 96 LYS CA . 6690 1
338 . 1 1 86 86 LYS CB C 13 32.600 0.2 . 1 . . . . 96 LYS CB . 6690 1
339 . 1 1 86 86 LYS N N 15 117.700 0.2 . 1 . . . . 96 LYS N . 6690 1
340 . 1 1 87 87 THR H H 1 7.629 0.01 . 1 . . . . 97 THR H . 6690 1
341 . 1 1 87 87 THR HA H 1 4.261 0.01 . 1 . . . . 97 THR HA . 6690 1
342 . 1 1 87 87 THR HB H 1 4.426 0.01 . 1 . . . . 97 THR HB . 6690 1
343 . 1 1 87 87 THR HG21 H 1 1.254 0.01 . 1 . . . . 97 THR HG2 . 6690 1
344 . 1 1 87 87 THR HG22 H 1 1.254 0.01 . 1 . . . . 97 THR HG2 . 6690 1
345 . 1 1 87 87 THR HG23 H 1 1.254 0.01 . 1 . . . . 97 THR HG2 . 6690 1
346 . 1 1 87 87 THR CA C 13 63.700 0.2 . 1 . . . . 97 THR CA . 6690 1
347 . 1 1 87 87 THR CB C 13 69.513 0.2 . 1 . . . . 97 THR CB . 6690 1
348 . 1 1 87 87 THR CG2 C 13 21.899 0.2 . 1 . . . . 97 THR CG2 . 6690 1
349 . 1 1 87 87 THR N N 15 111.197 0.2 . 1 . . . . 97 THR N . 6690 1
350 . 1 1 88 88 LEU H H 1 7.623 0.01 . 1 . . . . 98 LEU H . 6690 1
351 . 1 1 88 88 LEU HA H 1 4.142 0.01 . 1 . . . . 98 LEU HA . 6690 1
352 . 1 1 88 88 LEU HB2 H 1 1.500 0.01 . 2 . . . . 98 LEU HB2 . 6690 1
353 . 1 1 88 88 LEU HB3 H 1 1.750 0.01 . 2 . . . . 98 LEU HB3 . 6690 1
354 . 1 1 88 88 LEU HG H 1 1.749 0.01 . 1 . . . . 98 LEU HG . 6690 1
355 . 1 1 88 88 LEU HD11 H 1 0.752 0.01 . 2 . . . . 98 LEU HD1 . 6690 1
356 . 1 1 88 88 LEU HD12 H 1 0.752 0.01 . 2 . . . . 98 LEU HD1 . 6690 1
357 . 1 1 88 88 LEU HD13 H 1 0.752 0.01 . 2 . . . . 98 LEU HD1 . 6690 1
358 . 1 1 88 88 LEU CA C 13 56.300 0.2 . 1 . . . . 98 LEU CA . 6690 1
359 . 1 1 88 88 LEU CB C 13 41.900 0.2 . 1 . . . . 98 LEU CB . 6690 1
360 . 1 1 88 88 LEU CG C 13 26.428 0.2 . 1 . . . . 98 LEU CG . 6690 1
361 . 1 1 88 88 LEU CD1 C 13 22.810 0.2 . 2 . . . . 98 LEU CD1 . 6690 1
362 . 1 1 88 88 LEU N N 15 122.096 0.2 . 1 . . . . 98 LEU N . 6690 1
363 . 1 1 89 89 LYS H H 1 7.965 0.01 . 1 . . . . 99 LYS H . 6690 1
364 . 1 1 89 89 LYS HA H 1 4.182 0.01 . 1 . . . . 99 LYS HA . 6690 1
365 . 1 1 89 89 LYS HB2 H 1 1.864 0.01 . 2 . . . . 99 LYS HB2 . 6690 1
366 . 1 1 89 89 LYS HB3 H 1 1.747 0.01 . 2 . . . . 99 LYS HB3 . 6690 1
367 . 1 1 89 89 LYS CA C 13 57.100 0.2 . 1 . . . . 99 LYS CA . 6690 1
368 . 1 1 89 89 LYS CB C 13 32.600 0.2 . 1 . . . . 99 LYS CB . 6690 1
369 . 1 1 89 89 LYS N N 15 119.343 0.2 . 1 . . . . 99 LYS N . 6690 1
370 . 1 1 90 90 ASN H H 1 8.056 0.01 . 1 . . . . 100 ASN H . 6690 1
371 . 1 1 90 90 ASN HA H 1 4.621 0.01 . 1 . . . . 100 ASN HA . 6690 1
372 . 1 1 90 90 ASN HB2 H 1 2.736 0.01 . 2 . . . . 100 ASN HB2 . 6690 1
373 . 1 1 90 90 ASN HB3 H 1 2.806 0.01 . 2 . . . . 100 ASN HB3 . 6690 1
374 . 1 1 90 90 ASN CA C 13 53.480 0.2 . 1 . . . . 100 ASN CA . 6690 1
375 . 1 1 90 90 ASN CB C 13 38.550 0.2 . 1 . . . . 100 ASN CB . 6690 1
376 . 1 1 90 90 ASN N N 15 118.300 0.2 . 1 . . . . 100 ASN N . 6690 1
377 . 1 1 91 91 LYS H H 1 8.036 0.01 . 1 . . . . 101 LYS H . 6690 1
378 . 1 1 91 91 LYS HA H 1 4.245 0.01 . 1 . . . . 101 LYS HA . 6690 1
379 . 1 1 91 91 LYS HB2 H 1 1.736 0.01 . 2 . . . . 101 LYS HB2 . 6690 1
380 . 1 1 91 91 LYS HB3 H 1 1.803 0.01 . 2 . . . . 101 LYS HB3 . 6690 1
381 . 1 1 91 91 LYS HG2 H 1 1.384 0.01 . 2 . . . . 101 LYS HG2 . 6690 1
382 . 1 1 91 91 LYS HD2 H 1 1.628 0.01 . 2 . . . . 101 LYS HD2 . 6690 1
383 . 1 1 91 91 LYS CA C 13 56.638 0.2 . 1 . . . . 101 LYS CA . 6690 1
384 . 1 1 91 91 LYS CB C 13 32.921 0.2 . 1 . . . . 101 LYS CB . 6690 1
385 . 1 1 91 91 LYS CG C 13 24.751 0.2 . 1 . . . . 101 LYS CG . 6690 1
386 . 1 1 91 91 LYS CD C 13 29.159 0.2 . 1 . . . . 101 LYS CD . 6690 1
387 . 1 1 91 91 LYS CE C 13 42.114 0.2 . 1 . . . . 101 LYS CE . 6690 1
388 . 1 1 91 91 LYS N N 15 121.300 0.2 . 1 . . . . 101 LYS N . 6690 1
389 . 1 1 92 92 GLN H H 1 8.350 0.01 . 1 . . . . 102 GLN H . 6690 1
390 . 1 1 92 92 GLN HA H 1 4.269 0.01 . 1 . . . . 102 GLN HA . 6690 1
391 . 1 1 92 92 GLN HB2 H 1 1.905 0.01 . 2 . . . . 102 GLN HB2 . 6690 1
392 . 1 1 92 92 GLN HB3 H 1 2.074 0.01 . 2 . . . . 102 GLN HB3 . 6690 1
393 . 1 1 92 92 GLN CB C 13 29.547 0.2 . 1 . . . . 102 GLN CB . 6690 1
394 . 1 1 92 92 GLN N N 15 121.800 0.2 . 1 . . . . 102 GLN N . 6690 1
395 . 1 1 93 93 ASN H H 1 8.056 0.01 . 1 . . . . 103 ASN H . 6690 1
396 . 1 1 93 93 ASN HA H 1 4.394 0.01 . 1 . . . . 103 ASN HA . 6690 1
397 . 1 1 93 93 ASN HB2 H 1 2.703 0.01 . 2 . . . . 103 ASN HB2 . 6690 1
398 . 1 1 93 93 ASN HB3 H 1 2.607 0.01 . 2 . . . . 103 ASN HB3 . 6690 1
399 . 1 1 93 93 ASN CA C 13 54.811 0.2 . 1 . . . . 103 ASN CA . 6690 1
400 . 1 1 93 93 ASN CB C 13 40.200 0.2 . 1 . . . . 103 ASN CB . 6690 1
401 . 1 1 93 93 ASN N N 15 125.504 0.2 . 1 . . . . 103 ASN N . 6690 1
402 . 2 2 5 5 ALA H H 1 8.353 0.01 . 1 . . . . 5 ALA H . 6690 1
403 . 2 2 5 5 ALA HA H 1 4.154 0.01 . 1 . . . . 5 ALA HA . 6690 1
404 . 2 2 5 5 ALA HB1 H 1 1.240 0.01 . 1 . . . . 5 ALA HB . 6690 1
405 . 2 2 5 5 ALA HB2 H 1 1.240 0.01 . 1 . . . . 5 ALA HB . 6690 1
406 . 2 2 5 5 ALA HB3 H 1 1.240 0.01 . 1 . . . . 5 ALA HB . 6690 1
407 . 2 2 8 8 ASN H H 1 8.582 0.01 . 1 . . . . 8 ASN H . 6690 1
408 . 2 2 8 8 ASN HA H 1 4.523 0.01 . 1 . . . . 8 ASN HA . 6690 1
409 . 2 2 8 8 ASN HB2 H 1 2.690 0.01 . 2 . . . . 8 ASN HB2 . 6690 1
410 . 2 2 10 10 PHE H H 1 8.344 0.01 . 1 . . . . 10 PHE H . 6690 1
411 . 2 2 10 10 PHE HA H 1 4.555 0.01 . 1 . . . . 10 PHE HA . 6690 1
412 . 2 2 10 10 PHE HB2 H 1 3.091 0.01 . 2 . . . . 10 PHE HB2 . 6690 1
413 . 2 2 10 10 PHE HD1 H 1 7.278 0.01 . 1 . . . . 10 PHE HD1 . 6690 1
414 . 2 2 10 10 PHE HD2 H 1 7.278 0.01 . 1 . . . . 10 PHE HD2 . 6690 1
415 . 2 2 10 10 PHE HE1 H 1 7.310 0.01 . 1 . . . . 10 PHE HE1 . 6690 1
416 . 2 2 10 10 PHE HE2 H 1 7.310 0.01 . 1 . . . . 10 PHE HE2 . 6690 1
417 . 2 2 10 10 PHE HZ H 1 7.198 0.01 . 1 . . . . 10 PHE HZ . 6690 1
418 . 2 2 12 12 VAL H H 1 8.017 0.01 . 1 . . . . 12 VAL H . 6690 1
419 . 2 2 12 12 VAL HA H 1 4.084 0.01 . 1 . . . . 12 VAL HA . 6690 1
420 . 2 2 12 12 VAL HB H 1 1.965 0.01 . 1 . . . . 12 VAL HB . 6690 1
421 . 2 2 12 12 VAL HG11 H 1 0.851 0.01 . 2 . . . . 12 VAL HG1 . 6690 1
422 . 2 2 12 12 VAL HG12 H 1 0.851 0.01 . 2 . . . . 12 VAL HG1 . 6690 1
423 . 2 2 12 12 VAL HG13 H 1 0.851 0.01 . 2 . . . . 12 VAL HG1 . 6690 1
424 . 2 2 17 17 ILE H H 1 8.205 0.01 . 1 . . . . 17 ILE H . 6690 1
425 . 2 2 17 17 ILE HA H 1 4.052 0.01 . 1 . . . . 17 ILE HA . 6690 1
426 . 2 2 17 17 ILE HB H 1 1.742 0.01 . 1 . . . . 17 ILE HB . 6690 1
427 . 2 2 17 17 ILE HG12 H 1 1.112 0.01 . 2 . . . . 17 ILE HG12 . 6690 1
428 . 2 2 17 17 ILE HG13 H 1 1.462 0.01 . 2 . . . . 17 ILE HG13 . 6690 1
429 . 2 2 17 17 ILE HG21 H 1 0.839 0.01 . 1 . . . . 17 ILE HG2 . 6690 1
430 . 2 2 17 17 ILE HG22 H 1 0.839 0.01 . 1 . . . . 17 ILE HG2 . 6690 1
431 . 2 2 17 17 ILE HG23 H 1 0.839 0.01 . 1 . . . . 17 ILE HG2 . 6690 1
432 . 2 2 17 17 ILE HD11 H 1 0.788 0.01 . 1 . . . . 17 ILE HD1 . 6690 1
433 . 2 2 17 17 ILE HD12 H 1 0.788 0.01 . 1 . . . . 17 ILE HD1 . 6690 1
434 . 2 2 17 17 ILE HD13 H 1 0.788 0.01 . 1 . . . . 17 ILE HD1 . 6690 1
435 . 2 2 18 18 LEU H H 1 8.344 0.01 . 1 . . . . 18 LEU H . 6690 1
436 . 2 2 18 18 LEU HA H 1 4.351 0.01 . 1 . . . . 18 LEU HA . 6690 1
437 . 2 2 18 18 LEU HB2 H 1 1.539 0.01 . 2 . . . . 18 LEU HB2 . 6690 1
438 . 2 2 18 18 LEU HB3 H 1 1.640 0.01 . 2 . . . . 18 LEU HB3 . 6690 1
439 . 2 2 18 18 LEU HD11 H 1 0.877 0.01 . 1 . . . . 18 LEU HD1 . 6690 1
440 . 2 2 18 18 LEU HD12 H 1 0.877 0.01 . 1 . . . . 18 LEU HD1 . 6690 1
441 . 2 2 18 18 LEU HD13 H 1 0.877 0.01 . 1 . . . . 18 LEU HD1 . 6690 1
442 . 2 2 19 19 GLY H H 1 8.114 0.01 . 1 . . . . 19 GLY H . 6690 1
443 . 2 2 19 19 GLY HA2 H 1 3.715 0.01 . 2 . . . . 19 GLY HA2 . 6690 1
444 . 2 2 20 20 ARG H H 1 8.200 0.01 . 1 . . . . 20 ARG H . 6690 1
445 . 2 2 20 20 ARG HA H 1 4.346 0.01 . 1 . . . . 20 ARG HA . 6690 1
446 . 2 2 20 20 ARG HB2 H 1 1.704 0.01 . 2 . . . . 20 ARG HB2 . 6690 1
447 . 2 2 20 20 ARG HB3 H 1 1.882 0.01 . 2 . . . . 20 ARG HB3 . 6690 1
448 . 2 2 20 20 ARG HG2 H 1 1.590 0.01 . 2 . . . . 20 ARG HG2 . 6690 1
449 . 2 2 20 20 ARG HD2 H 1 3.155 0.01 . 2 . . . . 20 ARG HD2 . 6690 1
450 . 2 2 21 21 GLY H H 1 8.458 0.01 . 1 . . . . 21 GLY H . 6690 1
451 . 2 2 21 21 GLY HA2 H 1 3.912 0.01 . 2 . . . . 21 GLY HA2 . 6690 1
stop_
save_