Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27199
_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_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 27199 1
2 '3D 1H-15N NOESY' . . . 27199 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
2 $CCPNMR_Analysis . . 27199 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.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 3 3 GLU H H 1 9.232 0.005 . 1 . . 78 . . 3 GLU H . 27199 1
2 . 1 1 3 3 GLU N N 15 120.229 0.014 . 1 . . 79 . . 3 GLU N . 27199 1
3 . 1 1 4 4 LEU H H 1 9.175 0.02 . 1 . . 28 . . 4 LEU H . 27199 1
4 . 1 1 4 4 LEU N N 15 122.217 0.047 . 1 . . 29 . . 4 LEU N . 27199 1
5 . 1 1 5 5 GLU H H 1 8.226 0.026 . 1 . . 218 . . 5 GLU H . 27199 1
6 . 1 1 5 5 GLU N N 15 120.034 . . 1 . . 219 . . 5 GLU N . 27199 1
7 . 1 1 6 6 LYS H H 1 8.748 0.015 . 1 . . 40 . . 6 LYS H . 27199 1
8 . 1 1 6 6 LYS HA H 1 3.912 . . 1 . . 175 . . 6 LYS HA . 27199 1
9 . 1 1 6 6 LYS N N 15 117.083 0.075 . 1 . . 41 . . 6 LYS N . 27199 1
10 . 1 1 7 7 ALA H H 1 8.111 0.018 . 1 . . 84 . . 7 ALA H . 27199 1
11 . 1 1 7 7 ALA HA H 1 4.227 0.004 . 1 . . 210 . . 7 ALA HA . 27199 1
12 . 1 1 7 7 ALA N N 15 123.883 0.02 . 1 . . 85 . . 7 ALA N . 27199 1
13 . 1 1 9 9 VAL H H 1 8.008 . . 1 . . 208 . . 9 VAL H . 27199 1
14 . 1 1 9 9 VAL N N 15 117.689 . . 1 . . 209 . . 9 VAL N . 27199 1
15 . 1 1 10 10 ALA H H 1 8.076 0.01 . 1 . . 123 . . 10 ALA H . 27199 1
16 . 1 1 10 10 ALA HA H 1 4.279 . . 1 . . 206 . . 10 ALA HA . 27199 1
17 . 1 1 10 10 ALA HB1 H 1 1.587 . . 1 . . 207 . . 10 ALA HB1 . 27199 1
18 . 1 1 10 10 ALA HB2 H 1 1.587 . . 1 . . 207 . . 10 ALA HB2 . 27199 1
19 . 1 1 10 10 ALA HB3 H 1 1.587 . . 1 . . 207 . . 10 ALA HB3 . 27199 1
20 . 1 1 10 10 ALA N N 15 122.351 0.005 . 1 . . 124 . . 10 ALA N . 27199 1
21 . 1 1 11 11 LEU H H 1 8.158 0.017 . 1 . . 30 . . 11 LEU H . 27199 1
22 . 1 1 11 11 LEU N N 15 117.782 0.022 . 1 . . 31 . . 11 LEU N . 27199 1
23 . 1 1 12 12 ILE H H 1 8.504 0.001 . 1 . . 26 . . 12 ILE H . 27199 1
24 . 1 1 12 12 ILE N N 15 119.719 0.008 . 1 . . 27 . . 12 ILE N . 27199 1
25 . 1 1 13 13 ASP H H 1 8.755 0.017 . 1 . . 3 . . 13 ASP H . 27199 1
26 . 1 1 13 13 ASP N N 15 122.376 0.061 . 1 . . 4 . . 13 ASP N . 27199 1
27 . 1 1 14 14 VAL H H 1 8.884 0.009 . 1 . . 42 . . 14 VAL H . 27199 1
28 . 1 1 14 14 VAL N N 15 121.289 0.047 . 1 . . 43 . . 14 VAL N . 27199 1
29 . 1 1 15 15 PHE H H 1 7.985 0.015 . 1 . . 117 . . 15 PHE H . 27199 1
30 . 1 1 15 15 PHE HD1 H 1 7.127 0.006 . 1 . . 205 . . 15 PHE HD1 . 27199 1
31 . 1 1 15 15 PHE HD2 H 1 7.127 0.006 . 1 . . 205 . . 15 PHE HD2 . 27199 1
32 . 1 1 15 15 PHE N N 15 119.852 0.011 . 1 . . 118 . . 15 PHE N . 27199 1
33 . 1 1 16 16 HIS H H 1 8.113 0.01 . 1 . . 183 . . 16 HIS H . 27199 1
34 . 1 1 16 16 HIS N N 15 115.877 0.043 . 1 . . 184 . . 16 HIS N . 27199 1
35 . 1 1 17 17 GLN H H 1 8.316 0.008 . 1 . . 181 . . 17 GLN H . 27199 1
36 . 1 1 17 17 GLN HE21 H 1 7.240 . . 1 . . 9 . . 17 GLN HE21 . 27199 1
37 . 1 1 17 17 GLN HE22 H 1 6.930 . . 1 . . 19 . . 17 GLN HE22 . 27199 1
38 . 1 1 17 17 GLN N N 15 122.743 0.027 . 1 . . 182 . . 17 GLN N . 27199 1
39 . 1 1 17 17 GLN NE2 N 15 110.902 0.001 . 1 . . 20 . . 17 GLN NE2 . 27199 1
40 . 1 1 18 18 TYR H H 1 7.192 0.011 . 1 . . 15 . . 18 TYR H . 27199 1
41 . 1 1 18 18 TYR N N 15 115.674 0.016 . 1 . . 16 . . 18 TYR N . 27199 1
42 . 1 1 19 19 SER H H 1 9.295 0.013 . 1 . . 50 . . 19 SER H . 27199 1
43 . 1 1 19 19 SER N N 15 116.085 0.1 . 1 . . 51 . . 19 SER N . 27199 1
44 . 1 1 20 20 GLY H H 1 7.745 0.011 . 1 . . 62 . . 20 GLY H . 27199 1
45 . 1 1 20 20 GLY HA2 H 1 3.847 . . 2 . . 170 . . 20 GLY HA2 . 27199 1
46 . 1 1 20 20 GLY HA3 H 1 3.970 . . 2 . . 171 . . 20 GLY HA3 . 27199 1
47 . 1 1 20 20 GLY N N 15 110.112 0.035 . 1 . . 63 . . 20 GLY N . 27199 1
48 . 1 1 21 21 ARG H H 1 7.077 0.018 . 1 . . 127 . . 21 ARG H . 27199 1
49 . 1 1 21 21 ARG HB2 H 1 2.165 . . 1 . . 174 . . 21 ARG HB2 . 27199 1
50 . 1 1 21 21 ARG HG2 H 1 1.939 . . 1 . . 173 . . 21 ARG HG2 . 27199 1
51 . 1 1 21 21 ARG HD2 H 1 3.241 0.007 . 1 . . 172 . . 21 ARG HD2 . 27199 1
52 . 1 1 21 21 ARG N N 15 121.077 0.038 . 1 . . 128 . . 21 ARG N . 27199 1
53 . 1 1 22 22 GLU H H 1 9.477 0.014 . 1 . . 7 . . 22 GLU H . 27199 1
54 . 1 1 22 22 GLU N N 15 115.983 0.011 . 1 . . 8 . . 22 GLU N . 27199 1
55 . 1 1 25 25 LYS H H 1 9.586 0.016 . 1 . . 163 . . 25 LYS H . 27199 1
56 . 1 1 25 25 LYS HA H 1 4.395 0.001 . 1 . . 232 . . 25 LYS HA . 27199 1
57 . 1 1 25 25 LYS N N 15 114.516 12.225 . 1 . . 164 . . 25 LYS N . 27199 1
58 . 1 1 26 26 HIS H H 1 9.598 0.009 . 1 . . 36 . . 26 HIS H . 27199 1
59 . 1 1 26 26 HIS HA H 1 4.812 0.002 . 1 . . 169 . . 26 HIS HA . 27199 1
60 . 1 1 26 26 HIS HB2 H 1 3.673 . . 2 . . 176 . . 26 HIS HB2 . 27199 1
61 . 1 1 26 26 HIS HB3 H 1 3.186 . . 2 . . 177 . . 26 HIS HB3 . 27199 1
62 . 1 1 26 26 HIS N N 15 119.174 0.051 . 1 . . 37 . . 26 HIS N . 27199 1
63 . 1 1 27 27 LYS H H 1 7.034 0.017 . 1 . . 105 . . 27 LYS H . 27199 1
64 . 1 1 27 27 LYS HB2 H 1 1.660 . . 1 . . 179 . . 27 LYS HB2 . 27199 1
65 . 1 1 27 27 LYS HG2 H 1 1.323 . . 1 . . 178 . . 27 LYS HG2 . 27199 1
66 . 1 1 27 27 LYS N N 15 114.939 0.021 . 1 . . 106 . . 27 LYS N . 27199 1
67 . 1 1 28 28 LEU H H 1 9.566 0.016 . 1 . . 139 . . 28 LEU H . 27199 1
68 . 1 1 28 28 LEU N N 15 125.744 0.019 . 1 . . 140 . . 28 LEU N . 27199 1
69 . 1 1 29 29 LYS H H 1 9.637 0.015 . 1 . . 137 . . 29 LYS H . 27199 1
70 . 1 1 29 29 LYS N N 15 123.772 0.027 . 1 . . 138 . . 29 LYS N . 27199 1
71 . 1 1 30 30 LYS H H 1 9.033 0.021 . 1 . . 34 . . 30 LYS H . 27199 1
72 . 1 1 30 30 LYS HA H 1 4.688 . . 1 . . 185 . . 30 LYS HA . 27199 1
73 . 1 1 30 30 LYS HB2 H 1 1.918 0.005 . 1 . . 186 . . 30 LYS HB2 . 27199 1
74 . 1 1 30 30 LYS N N 15 121.297 0.017 . 1 . . 35 . . 30 LYS N . 27199 1
75 . 1 1 31 31 SER H H 1 8.310 0.015 . 1 . . 133 . . 31 SER H . 27199 1
76 . 1 1 31 31 SER N N 15 111.137 0.011 . 1 . . 134 . . 31 SER N . 27199 1
77 . 1 1 32 32 GLU H H 1 6.549 0.003 . 1 . . 142 . . 32 GLU H . 27199 1
78 . 1 1 32 32 GLU N N 15 123.675 0.029 . 1 . . 143 . . 32 GLU N . 27199 1
79 . 1 1 33 33 LEU H H 1 8.214 0.009 . 1 . . 88 . . 33 LEU H . 27199 1
80 . 1 1 33 33 LEU HA H 1 4.802 0.006 . 1 . . 180 . . 33 LEU HA . 27199 1
81 . 1 1 33 33 LEU HB2 H 1 2.419 . . 1 . . 189 . . 33 LEU HB2 . 27199 1
82 . 1 1 33 33 LEU HG H 1 1.834 . . 1 . . 188 . . 33 LEU HG . 27199 1
83 . 1 1 33 33 LEU HD11 H 1 0.982 . . 1 . . 187 . . 33 LEU HD11 . 27199 1
84 . 1 1 33 33 LEU HD12 H 1 0.982 . . 1 . . 187 . . 33 LEU HD12 . 27199 1
85 . 1 1 33 33 LEU HD13 H 1 0.982 . . 1 . . 187 . . 33 LEU HD13 . 27199 1
86 . 1 1 33 33 LEU N N 15 114.584 0.043 . 1 . . 89 . . 33 LEU N . 27199 1
87 . 1 1 34 34 LYS H H 1 8.358 0.029 . 1 . . 80 . . 34 LYS H . 27199 1
88 . 1 1 34 34 LYS N N 15 118.173 0.013 . 1 . . 81 . . 34 LYS N . 27199 1
89 . 1 1 35 35 GLU H H 1 7.284 0.007 . 1 . . 146 . . 35 GLU H . 27199 1
90 . 1 1 35 35 GLU N N 15 115.356 0.013 . 1 . . 147 . . 35 GLU N . 27199 1
91 . 1 1 36 36 LEU H H 1 7.987 0.011 . 1 . . 121 . . 36 LEU H . 27199 1
92 . 1 1 36 36 LEU HA H 1 3.959 . . 1 . . 190 . . 36 LEU HA . 27199 1
93 . 1 1 36 36 LEU N N 15 123.308 0.015 . 1 . . 122 . . 36 LEU N . 27199 1
94 . 1 1 37 37 ILE H H 1 8.461 0.009 . 1 . . 191 . . 37 ILE H . 27199 1
95 . 1 1 37 37 ILE N N 15 121.021 0.004 . 1 . . 192 . . 37 ILE N . 27199 1
96 . 1 1 38 38 ASN H H 1 8.399 . . 1 . . 224 . . 38 ASN H . 27199 1
97 . 1 1 38 38 ASN N N 15 117.930 . . 1 . . 225 . . 38 ASN N . 27199 1
98 . 1 1 39 39 ASN H H 1 8.214 0.01 . 1 . . 194 . . 39 ASN H . 27199 1
99 . 1 1 39 39 ASN HD21 H 1 7.243 0.01 . 1 . . 159 . . 39 ASN HD21 . 27199 1
100 . 1 1 39 39 ASN HD22 H 1 8.132 0.015 . 1 . . 211 . . 39 ASN HD22 . 27199 1
101 . 1 1 39 39 ASN N N 15 114.712 0.059 . 1 . . 193 . . 39 ASN N . 27199 1
102 . 1 1 39 39 ASN ND2 N 15 114.009 0.051 . 1 . . 160 . . 39 ASN ND2 . 27199 1
103 . 1 1 40 40 GLU H H 1 8.497 0.013 . 1 . . 52 . . 40 GLU H . 27199 1
104 . 1 1 40 40 GLU HB2 H 1 2.396 . . 1 . . 166 . . 40 GLU HB2 . 27199 1
105 . 1 1 40 40 GLU HG2 H 1 2.728 . . 1 . . 165 . . 40 GLU HG2 . 27199 1
106 . 1 1 40 40 GLU N N 15 113.193 0.034 . 1 . . 53 . . 40 GLU N . 27199 1
107 . 1 1 41 41 LEU H H 1 7.421 0.014 . 1 . . 131 . . 41 LEU H . 27199 1
108 . 1 1 41 41 LEU N N 15 119.230 0.079 . 1 . . 132 . . 41 LEU N . 27199 1
109 . 1 1 42 42 SER H H 1 7.628 0.016 . 1 . . 74 . . 42 SER H . 27199 1
110 . 1 1 42 42 SER N N 15 114.560 0.172 . 1 . . 75 . . 42 SER N . 27199 1
111 . 1 1 45 45 LEU H H 1 8.583 0.008 . 1 . . 213 . . 45 LEU H . 27199 1
112 . 1 1 45 45 LEU N N 15 119.146 0.021 . 1 . . 212 . . 45 LEU N . 27199 1
113 . 1 1 46 46 GLU H H 1 8.191 0.011 . 1 . . 48 . . 46 GLU H . 27199 1
114 . 1 1 46 46 GLU N N 15 122.732 0.053 . 1 . . 49 . . 46 GLU N . 27199 1
115 . 1 1 47 47 GLU H H 1 8.122 0.012 . 1 . . 111 . . 47 GLU H . 27199 1
116 . 1 1 47 47 GLU N N 15 120.147 0.09 . 1 . . 112 . . 47 GLU N . 27199 1
117 . 1 1 49 49 LYS H H 1 9.273 0.016 . 1 . . 157 . . 49 LYS H . 27199 1
118 . 1 1 49 49 LYS HA H 1 4.014 0.006 . 1 . . 197 . . 49 LYS HA . 27199 1
119 . 1 1 49 49 LYS N N 15 126.844 0.021 . 1 . . 158 . . 49 LYS N . 27199 1
120 . 1 1 50 50 GLU H H 1 7.546 0.016 . 1 . . 95 . . 50 GLU H . 27199 1
121 . 1 1 50 50 GLU HA H 1 4.571 . . 1 . . 198 . . 50 GLU HA . 27199 1
122 . 1 1 50 50 GLU N N 15 118.023 0.023 . 1 . . 96 . . 50 GLU N . 27199 1
123 . 1 1 51 51 GLN H H 1 9.136 0.016 . 1 . . 70 . . 51 GLN H . 27199 1
124 . 1 1 51 51 GLN HE21 H 1 7.907 0.009 . 1 . . 14 . . 51 GLN HE21 . 27199 1
125 . 1 1 51 51 GLN HE22 H 1 7.008 0.011 . 1 . . 97 . . 51 GLN HE22 . 27199 1
126 . 1 1 51 51 GLN N N 15 125.746 0.048 . 1 . . 71 . . 51 GLN N . 27199 1
127 . 1 1 51 51 GLN NE2 N 15 114.154 0.014 . 1 . . 98 . . 51 GLN NE2 . 27199 1
128 . 1 1 52 52 GLU H H 1 9.409 0.014 . 1 . . 154 . . 52 GLU H . 27199 1
129 . 1 1 52 52 GLU HA H 1 4.151 0.005 . 1 . . 196 . . 52 GLU HA . 27199 1
130 . 1 1 52 52 GLU N N 15 116.640 0.085 . 1 . . 141 . . 52 GLU N . 27199 1
131 . 1 1 53 53 VAL H H 1 7.154 0.016 . 1 . . 152 . . 53 VAL H . 27199 1
132 . 1 1 53 53 VAL HA H 1 3.733 0.009 . 1 . . 195 . . 53 VAL HA . 27199 1
133 . 1 1 53 53 VAL N N 15 118.484 0.038 . 1 . . 153 . . 53 VAL N . 27199 1
134 . 1 1 54 54 VAL H H 1 7.155 0.017 . 1 . . 150 . . 54 VAL H . 27199 1
135 . 1 1 54 54 VAL HA H 1 3.702 0.001 . 1 . . 200 . . 54 VAL HA . 27199 1
136 . 1 1 54 54 VAL N N 15 119.475 0.059 . 1 . . 151 . . 54 VAL N . 27199 1
137 . 1 1 55 55 ASP H H 1 8.588 0.01 . 1 . . 58 . . 55 ASP H . 27199 1
138 . 1 1 55 55 ASP HA H 1 4.126 . . 1 . . 199 . . 55 ASP HA . 27199 1
139 . 1 1 55 55 ASP N N 15 121.352 0.023 . 1 . . 59 . . 55 ASP N . 27199 1
140 . 1 1 56 56 LYS H H 1 7.535 0.011 . 1 . . 5 . . 56 LYS H . 27199 1
141 . 1 1 56 56 LYS N N 15 120.601 0.013 . 1 . . 6 . . 56 LYS N . 27199 1
142 . 1 1 57 57 VAL H H 1 8.205 0.008 . 1 . . 201 . . 57 VAL H . 27199 1
143 . 1 1 57 57 VAL N N 15 121.517 0.059 . 1 . . 202 . . 57 VAL N . 27199 1
144 . 1 1 58 58 MET H H 1 8.430 0.022 . 1 . . 107 . . 58 MET H . 27199 1
145 . 1 1 58 58 MET N N 15 118.204 0.046 . 1 . . 108 . . 58 MET N . 27199 1
146 . 1 1 59 59 GLU H H 1 8.073 0.009 . 1 . . 24 . . 59 GLU H . 27199 1
147 . 1 1 59 59 GLU N N 15 117.537 0.01 . 1 . . 25 . . 59 GLU N . 27199 1
148 . 1 1 60 60 THR H H 1 7.789 0.021 . 1 . . 162 . . 60 THR H . 27199 1
149 . 1 1 60 60 THR N N 15 112.820 0.011 . 1 . . 161 . . 60 THR N . 27199 1
150 . 1 1 61 61 LEU H H 1 7.600 0.013 . 1 . . 125 . . 61 LEU H . 27199 1
151 . 1 1 61 61 LEU N N 15 119.077 0.009 . 1 . . 126 . . 61 LEU N . 27199 1
152 . 1 1 62 62 ASP H H 1 7.947 0.014 . 1 . . 32 . . 62 ASP H . 27199 1
153 . 1 1 62 62 ASP N N 15 117.408 0.014 . 1 . . 33 . . 62 ASP N . 27199 1
154 . 1 1 63 63 ASN H H 1 8.945 0.012 . 1 . . 17 . . 63 ASN H . 27199 1
155 . 1 1 63 63 ASN N N 15 127.190 0.011 . 1 . . 18 . . 63 ASN N . 27199 1
156 . 1 1 64 64 ASP H H 1 8.240 0.013 . 1 . . 64 . . 64 ASP H . 27199 1
157 . 1 1 64 64 ASP N N 15 116.148 0.017 . 1 . . 65 . . 64 ASP N . 27199 1
158 . 1 1 65 65 GLY H H 1 7.644 0.011 . 1 . . 129 . . 65 GLY H . 27199 1
159 . 1 1 65 65 GLY N N 15 108.959 0.02 . 1 . . 130 . . 65 GLY N . 27199 1
160 . 1 1 66 66 ASP H H 1 8.325 0.007 . 1 . . 66 . . 66 ASP H . 27199 1
161 . 1 1 66 66 ASP N N 15 120.509 0.016 . 1 . . 67 . . 66 ASP N . 27199 1
162 . 1 1 67 67 GLY H H 1 10.213 0.015 . 1 . . 115 . . 67 GLY H . 27199 1
163 . 1 1 67 67 GLY HA2 H 1 4.009 . . 2 . . 167 . . 67 GLY HA2 . 27199 1
164 . 1 1 67 67 GLY HA3 H 1 4.087 . . 2 . . 168 . . 67 GLY HA3 . 27199 1
165 . 1 1 67 67 GLY N N 15 113.500 0.022 . 1 . . 116 . . 67 GLY N . 27199 1
166 . 1 1 68 68 GLU H H 1 7.907 0.009 . 1 . . 92 . . 68 GLU H . 27199 1
167 . 1 1 68 68 GLU N N 15 118.275 0.022 . 1 . . 93 . . 68 GLU N . 27199 1
168 . 1 1 69 69 CYS H H 1 9.473 0.024 . 1 . . 86 . . 69 CYS H . 27199 1
169 . 1 1 69 69 CYS N N 15 124.345 0.032 . 1 . . 87 . . 69 CYS N . 27199 1
170 . 1 1 70 70 ASP H H 1 9.855 0.011 . 1 . . 101 . . 70 ASP H . 27199 1
171 . 1 1 70 70 ASP N N 15 114.742 12.236 . 1 . . 102 . . 70 ASP N . 27199 1
172 . 1 1 71 71 PHE H H 1 9.095 0.012 . 1 . . 56 . . 71 PHE H . 27199 1
173 . 1 1 71 71 PHE N N 15 118.889 0.007 . 1 . . 57 . . 71 PHE N . 27199 1
174 . 1 1 72 72 GLN H H 1 8.069 0.008 . 1 . . 68 . . 72 GLN H . 27199 1
175 . 1 1 72 72 GLN HE21 H 1 6.972 0.013 . 1 . . 12 . . 72 GLN HE21 . 27199 1
176 . 1 1 72 72 GLN HE22 H 1 7.708 0.011 . 1 . . 94 . . 72 GLN HE22 . 27199 1
177 . 1 1 72 72 GLN N N 15 118.904 0.029 . 1 . . 69 . . 72 GLN N . 27199 1
178 . 1 1 72 72 GLN NE2 N 15 112.924 0.033 . 1 . . 13 . . 72 GLN NE2 . 27199 1
179 . 1 1 73 73 GLU H H 1 9.086 0.011 . 1 . . 76 . . 73 GLU H . 27199 1
180 . 1 1 73 73 GLU N N 15 122.739 0.009 . 1 . . 77 . . 73 GLU N . 27199 1
181 . 1 1 74 74 PHE H H 1 8.849 0.011 . 1 . . 22 . . 74 PHE H . 27199 1
182 . 1 1 74 74 PHE N N 15 123.129 0.018 . 1 . . 23 . . 74 PHE N . 27199 1
183 . 1 1 75 75 MET H H 1 8.214 0.01 . 1 . . 44 . . 75 MET H . 27199 1
184 . 1 1 75 75 MET N N 15 119.209 0.022 . 1 . . 45 . . 75 MET N . 27199 1
185 . 1 1 76 76 ALA H H 1 7.447 0.011 . 1 . . 82 . . 76 ALA H . 27199 1
186 . 1 1 76 76 ALA HA H 1 4.104 . . 1 . . 203 . . 76 ALA HA . 27199 1
187 . 1 1 76 76 ALA N N 15 122.611 0.036 . 1 . . 83 . . 76 ALA N . 27199 1
188 . 1 1 77 77 PHE H H 1 7.665 0.011 . 1 . . 1 . . 77 PHE H . 27199 1
189 . 1 1 77 77 PHE N N 15 122.244 0.02 . 1 . . 2 . . 77 PHE N . 27199 1
190 . 1 1 78 78 VAL H H 1 8.566 0.021 . 1 . . 103 . . 78 VAL H . 27199 1
191 . 1 1 78 78 VAL N N 15 120.146 0.001 . 1 . . 104 . . 78 VAL N . 27199 1
192 . 1 1 79 79 ALA H H 1 8.172 0.009 . 1 . . 113 . . 79 ALA H . 27199 1
193 . 1 1 79 79 ALA N N 15 123.703 0.039 . 1 . . 114 . . 79 ALA N . 27199 1
194 . 1 1 80 80 MET H H 1 7.796 0.007 . 1 . . 119 . . 80 MET H . 27199 1
195 . 1 1 80 80 MET N N 15 120.300 0.013 . 1 . . 120 . . 80 MET N . 27199 1
196 . 1 1 81 81 VAL H H 1 8.325 0.005 . 1 . . 226 . . 81 VAL H . 27199 1
197 . 1 1 81 81 VAL N N 15 120.477 0.024 . 1 . . 227 . . 81 VAL N . 27199 1
198 . 1 1 83 83 THR H H 1 7.773 . . 1 . . 90 . . 83 THR H . 27199 1
199 . 1 1 83 83 THR N N 15 114.104 . . 1 . . 91 . . 83 THR N . 27199 1
200 . 1 1 84 84 ALA H H 1 7.487 0.014 . 1 . . 148 . . 84 ALA H . 27199 1
201 . 1 1 84 84 ALA HA H 1 4.296 . . 1 . . 204 . . 84 ALA HA . 27199 1
202 . 1 1 84 84 ALA N N 15 122.171 0.01 . 1 . . 149 . . 84 ALA N . 27199 1
203 . 1 1 85 85 CYS H H 1 7.675 0.017 . 1 . . 155 . . 85 CYS H . 27199 1
204 . 1 1 85 85 CYS N N 15 116.643 0.044 . 1 . . 156 . . 85 CYS N . 27199 1
205 . 1 1 86 86 HIS H H 1 8.252 0.001 . 1 . . 10 . . 86 HIS H . 27199 1
206 . 1 1 86 86 HIS N N 15 121.589 0.014 . 1 . . 11 . . 86 HIS N . 27199 1
207 . 1 1 87 87 GLU H H 1 10.332 0.031 . 1 . . 214 . . 87 GLU H . 27199 1
208 . 1 1 87 87 GLU N N 15 120.924 0.09 . 1 . . 215 . . 87 GLU N . 27199 1
209 . 1 1 88 88 PHE H H 1 7.719 . . 1 . . 72 . . 88 PHE H . 27199 1
210 . 1 1 88 88 PHE N N 15 117.748 . . 1 . . 73 . . 88 PHE N . 27199 1
211 . 1 1 89 89 PHE H H 1 7.716 0.013 . 1 . . 109 . . 89 PHE H . 27199 1
212 . 1 1 89 89 PHE N N 15 118.403 0.028 . 1 . . 110 . . 89 PHE N . 27199 1
213 . 1 1 90 90 GLU H H 1 7.993 0.013 . 1 . . 54 . . 90 GLU H . 27199 1
214 . 1 1 90 90 GLU N N 15 120.915 0.108 . 1 . . 55 . . 90 GLU N . 27199 1
215 . 1 1 91 91 HIS H H 1 8.332 . . 1 . . 230 . . 91 HIS H . 27199 1
216 . 1 1 91 91 HIS N N 15 120.579 . . 1 . . 231 . . 91 HIS N . 27199 1
217 . 1 1 92 92 GLU H H 1 8.240 0.011 . 1 . . 99 . . 92 GLU H . 27199 1
218 . 1 1 92 92 GLU N N 15 127.579 0.012 . 1 . . 100 . . 92 GLU N . 27199 1
stop_
save_