data_18481
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18481
_Entry.PDB_ID 2LTI
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 18481
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.688 0.655 18481
2 1 1 . 1 1 2 2 LEU H H 2 8.093 8.093 7.699 0.394 18481
3 1 1 . 1 1 3 3 SER HA H 3 4.275 4.275 4.824 -0.549 18481
4 1 1 . 1 1 3 3 SER H H 3 7.783 7.783 8.065 -0.282 18481
5 1 1 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.497 -0.237 18481
6 1 1 . 1 1 4 4 GLN H H 4 7.962 7.962 9.790 -1.828 18481
7 1 1 . 1 1 5 5 GLY H H 5 8.187 8.187 8.971 -0.784 18481
8 1 1 . 1 1 6 6 VAL HA H 6 4.134 4.134 5.173 -1.039 18481
9 1 1 . 1 1 6 6 VAL H H 6 7.789 7.789 8.106 -0.317 18481
10 1 1 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.642 -0.082 18481
11 1 1 . 1 1 7 7 GLU H H 7 7.693 7.693 9.124 -1.431 18481
12 1 1 . 1 1 8 8 PRO HA H 8 4.334 4.334 5.013 -0.679 18481
13 1 1 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.864 -0.289 18481
14 1 1 . 1 1 9 9 ASP H H 9 8.195 8.195 8.614 -0.419 18481
15 1 1 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.062 0.064 18481
16 1 1 . 1 1 10 10 ILE H H 10 7.617 7.617 8.810 -1.193 18481
17 1 1 . 1 1 11 11 GLY H H 11 8.307 8.307 7.572 0.735 18481
18 1 1 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.779 0.528 18481
19 1 1 . 1 1 12 12 GLN H H 12 7.945 7.945 8.827 -0.882 18481
20 1 1 . 1 1 13 13 THR HA H 13 4.169 4.169 4.227 -0.058 18481
21 1 1 . 1 1 13 13 THR H H 13 7.745 7.745 8.155 -0.410 18481
22 1 1 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.259 0.158 18481
23 1 1 . 1 1 14 14 TYR H H 14 7.739 7.739 7.435 0.304 18481
24 1 1 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.892 -0.375 18481
25 1 1 . 1 1 15 15 PHE H H 15 8.178 8.178 8.676 -0.498 18481
26 1 1 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.517 -0.225 18481
27 1 1 . 1 1 16 16 GLU H H 16 8.152 8.152 8.442 -0.290 18481
28 1 1 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.715 -0.397 18481
29 1 1 . 1 1 17 17 GLU H H 17 8.002 8.002 8.875 -0.873 18481
30 1 1 . 1 1 18 18 SER HA H 18 4.329 4.329 4.529 -0.200 18481
31 1 1 . 1 1 18 18 SER H H 18 8.036 8.036 8.413 -0.377 18481
32 1 1 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.297 0.038 18481
33 1 1 . 1 1 19 19 ARG H H 19 8.133 8.133 8.635 -0.502 18481
34 1 1 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.158 0.026 18481
35 1 1 . 1 1 20 20 ILE H H 20 7.823 7.823 7.779 0.044 18481
36 1 1 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.332 0.193 18481
37 1 1 . 1 1 21 21 ASN H H 21 8.212 8.212 8.239 -0.027 18481
38 1 1 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.280 -0.046 18481
39 1 1 . 1 1 22 22 GLN H H 22 7.843 7.843 8.026 -0.183 18481
40 1 2 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.058 0.285 18481
41 1 2 . 1 1 2 2 LEU H H 2 8.093 8.093 8.341 -0.248 18481
42 1 2 . 1 1 3 3 SER HA H 3 4.275 4.275 4.844 -0.569 18481
43 1 2 . 1 1 3 3 SER H H 3 7.783 7.783 7.785 -0.002 18481
44 1 2 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.249 0.011 18481
45 1 2 . 1 1 4 4 GLN H H 4 7.962 7.962 8.587 -0.625 18481
46 1 2 . 1 1 5 5 GLY H H 5 8.187 8.187 8.985 -0.798 18481
47 1 2 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.538 0.596 18481
48 1 2 . 1 1 6 6 VAL H H 6 7.789 7.789 8.049 -0.260 18481
49 1 2 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.585 -0.025 18481
50 1 2 . 1 1 7 7 GLU H H 7 7.693 7.693 8.401 -0.708 18481
51 1 2 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.527 -0.193 18481
52 1 2 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.575 0.000 18481
53 1 2 . 1 1 9 9 ASP H H 9 8.195 8.195 8.420 -0.225 18481
54 1 2 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.989 0.137 18481
55 1 2 . 1 1 10 10 ILE H H 10 7.617 7.617 7.823 -0.206 18481
56 1 2 . 1 1 11 11 GLY H H 11 8.307 8.307 8.283 0.024 18481
57 1 2 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.347 -0.040 18481
58 1 2 . 1 1 12 12 GLN H H 12 7.945 7.945 8.513 -0.568 18481
59 1 2 . 1 1 13 13 THR HA H 13 4.169 4.169 4.025 0.144 18481
60 1 2 . 1 1 13 13 THR H H 13 7.745 7.745 7.945 -0.200 18481
61 1 2 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.362 0.055 18481
62 1 2 . 1 1 14 14 TYR H H 14 7.739 7.739 7.405 0.334 18481
63 1 2 . 1 1 15 15 PHE HA H 15 4.517 4.517 5.055 -0.538 18481
64 1 2 . 1 1 15 15 PHE H H 15 8.178 8.178 7.938 0.240 18481
65 1 2 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.166 0.126 18481
66 1 2 . 1 1 16 16 GLU H H 16 8.152 8.152 8.032 0.120 18481
67 1 2 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.014 0.304 18481
68 1 2 . 1 1 17 17 GLU H H 17 8.002 8.002 8.669 -0.667 18481
69 1 2 . 1 1 18 18 SER HA H 18 4.329 4.329 4.676 -0.347 18481
70 1 2 . 1 1 18 18 SER H H 18 8.036 8.036 8.742 -0.706 18481
71 1 2 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.585 -0.250 18481
72 1 2 . 1 1 19 19 ARG H H 19 8.133 8.133 8.307 -0.174 18481
73 1 2 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.282 -0.098 18481
74 1 2 . 1 1 20 20 ILE H H 20 7.823 7.823 7.609 0.214 18481
75 1 2 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.937 -0.412 18481
76 1 2 . 1 1 21 21 ASN H H 21 8.212 8.212 8.393 -0.181 18481
77 1 2 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.421 -0.187 18481
78 1 2 . 1 1 22 22 GLN H H 22 7.843 7.843 7.727 0.116 18481
79 1 3 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.446 0.897 18481
80 1 3 . 1 1 2 2 LEU H H 2 8.093 8.093 8.124 -0.031 18481
81 1 3 . 1 1 3 3 SER HA H 3 4.275 4.275 4.645 -0.370 18481
82 1 3 . 1 1 3 3 SER H H 3 7.783 7.783 8.166 -0.383 18481
83 1 3 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.479 -0.219 18481
84 1 3 . 1 1 4 4 GLN H H 4 7.962 7.962 9.286 -1.324 18481
85 1 3 . 1 1 5 5 GLY H H 5 8.187 8.187 8.350 -0.163 18481
86 1 3 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.335 -0.201 18481
87 1 3 . 1 1 6 6 VAL H H 6 7.789 7.789 8.461 -0.672 18481
88 1 3 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.694 -0.134 18481
89 1 3 . 1 1 7 7 GLU H H 7 7.693 7.693 8.205 -0.512 18481
90 1 3 . 1 1 8 8 PRO HA H 8 4.334 4.334 5.380 -1.046 18481
91 1 3 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.890 -0.315 18481
92 1 3 . 1 1 9 9 ASP H H 9 8.195 8.195 8.955 -0.760 18481
93 1 3 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.907 0.219 18481
94 1 3 . 1 1 10 10 ILE H H 10 7.617 7.617 8.788 -1.171 18481
95 1 3 . 1 1 11 11 GLY H H 11 8.307 8.307 7.643 0.664 18481
96 1 3 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.989 0.318 18481
97 1 3 . 1 1 12 12 GLN H H 12 7.945 7.945 8.177 -0.232 18481
98 1 3 . 1 1 13 13 THR HA H 13 4.169 4.169 4.211 -0.042 18481
99 1 3 . 1 1 13 13 THR H H 13 7.745 7.745 7.540 0.205 18481
100 1 3 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.671 -0.254 18481
101 1 3 . 1 1 14 14 TYR H H 14 7.739 7.739 7.601 0.138 18481
102 1 3 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.623 -0.106 18481
103 1 3 . 1 1 15 15 PHE H H 15 8.178 8.178 8.706 -0.528 18481
104 1 3 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.493 -0.201 18481
105 1 3 . 1 1 16 16 GLU H H 16 8.152 8.152 8.780 -0.628 18481
106 1 3 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.315 0.003 18481
107 1 3 . 1 1 17 17 GLU H H 17 8.002 8.002 8.969 -0.967 18481
108 1 3 . 1 1 18 18 SER HA H 18 4.329 4.329 4.499 -0.170 18481
109 1 3 . 1 1 18 18 SER H H 18 8.036 8.036 8.368 -0.332 18481
110 1 3 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.163 0.172 18481
111 1 3 . 1 1 19 19 ARG H H 19 8.133 8.133 7.859 0.274 18481
112 1 3 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.792 0.392 18481
113 1 3 . 1 1 20 20 ILE H H 20 7.823 7.823 8.220 -0.397 18481
114 1 3 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.798 -0.273 18481
115 1 3 . 1 1 21 21 ASN H H 21 8.212 8.212 9.471 -1.259 18481
116 1 3 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.549 -0.315 18481
117 1 3 . 1 1 22 22 GLN H H 22 7.843 7.843 8.178 -0.335 18481
118 1 4 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.007 0.336 18481
119 1 4 . 1 1 2 2 LEU H H 2 8.093 8.093 8.201 -0.108 18481
120 1 4 . 1 1 3 3 SER HA H 3 4.275 4.275 4.403 -0.128 18481
121 1 4 . 1 1 3 3 SER H H 3 7.783 7.783 8.309 -0.526 18481
122 1 4 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.472 -0.212 18481
123 1 4 . 1 1 4 4 GLN H H 4 7.962 7.962 8.524 -0.562 18481
124 1 4 . 1 1 5 5 GLY H H 5 8.187 8.187 7.862 0.325 18481
125 1 4 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.496 -0.362 18481
126 1 4 . 1 1 6 6 VAL H H 6 7.789 7.789 8.102 -0.313 18481
127 1 4 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.275 0.285 18481
128 1 4 . 1 1 7 7 GLU H H 7 7.693 7.693 8.246 -0.553 18481
129 1 4 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.645 -0.311 18481
130 1 4 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.629 -0.054 18481
131 1 4 . 1 1 9 9 ASP H H 9 8.195 8.195 8.363 -0.168 18481
132 1 4 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.440 0.686 18481
133 1 4 . 1 1 10 10 ILE H H 10 7.617 7.617 7.702 -0.085 18481
134 1 4 . 1 1 11 11 GLY H H 11 8.307 8.307 7.483 0.824 18481
135 1 4 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.084 0.223 18481
136 1 4 . 1 1 12 12 GLN H H 12 7.945 7.945 8.124 -0.179 18481
137 1 4 . 1 1 13 13 THR HA H 13 4.169 4.169 4.144 0.025 18481
138 1 4 . 1 1 13 13 THR H H 13 7.745 7.745 7.446 0.299 18481
139 1 4 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.669 -0.252 18481
140 1 4 . 1 1 14 14 TYR H H 14 7.739 7.739 7.471 0.268 18481
141 1 4 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.854 -0.337 18481
142 1 4 . 1 1 15 15 PHE H H 15 8.178 8.178 8.786 -0.608 18481
143 1 4 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.795 -0.503 18481
144 1 4 . 1 1 16 16 GLU H H 16 8.152 8.152 9.011 -0.859 18481
145 1 4 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.569 -0.251 18481
146 1 4 . 1 1 17 17 GLU H H 17 8.002 8.002 8.544 -0.542 18481
147 1 4 . 1 1 18 18 SER HA H 18 4.329 4.329 4.113 0.216 18481
148 1 4 . 1 1 18 18 SER H H 18 8.036 8.036 8.221 -0.185 18481
149 1 4 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.462 -0.127 18481
150 1 4 . 1 1 19 19 ARG H H 19 8.133 8.133 8.226 -0.093 18481
151 1 4 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.532 0.652 18481
152 1 4 . 1 1 20 20 ILE H H 20 7.823 7.823 7.863 -0.040 18481
153 1 4 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.891 -0.366 18481
154 1 4 . 1 1 21 21 ASN H H 21 8.212 8.212 7.729 0.483 18481
155 1 4 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.688 -0.454 18481
156 1 4 . 1 1 22 22 GLN H H 22 7.843 7.843 8.183 -0.340 18481
157 1 5 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.027 0.316 18481
158 1 5 . 1 1 2 2 LEU H H 2 8.093 8.093 8.880 -0.787 18481
159 1 5 . 1 1 3 3 SER HA H 3 4.275 4.275 4.269 0.006 18481
160 1 5 . 1 1 3 3 SER H H 3 7.783 7.783 8.923 -1.140 18481
161 1 5 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.461 -0.201 18481
162 1 5 . 1 1 4 4 GLN H H 4 7.962 7.962 9.315 -1.353 18481
163 1 5 . 1 1 5 5 GLY H H 5 8.187 8.187 7.982 0.205 18481
164 1 5 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.574 0.560 18481
165 1 5 . 1 1 6 6 VAL H H 6 7.789 7.789 8.349 -0.560 18481
166 1 5 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.578 -0.018 18481
167 1 5 . 1 1 7 7 GLU H H 7 7.693 7.693 7.987 -0.294 18481
168 1 5 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.429 -0.095 18481
169 1 5 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.633 -0.058 18481
170 1 5 . 1 1 9 9 ASP H H 9 8.195 8.195 8.017 0.178 18481
171 1 5 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.957 0.169 18481
172 1 5 . 1 1 10 10 ILE H H 10 7.617 7.617 8.166 -0.549 18481
173 1 5 . 1 1 11 11 GLY H H 11 8.307 8.307 8.425 -0.118 18481
174 1 5 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.065 0.242 18481
175 1 5 . 1 1 12 12 GLN H H 12 7.945 7.945 8.468 -0.523 18481
176 1 5 . 1 1 13 13 THR HA H 13 4.169 4.169 4.276 -0.107 18481
177 1 5 . 1 1 13 13 THR H H 13 7.745 7.745 8.412 -0.667 18481
178 1 5 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.654 -0.237 18481
179 1 5 . 1 1 14 14 TYR H H 14 7.739 7.739 8.456 -0.717 18481
180 1 5 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.963 -0.446 18481
181 1 5 . 1 1 15 15 PHE H H 15 8.178 8.178 7.716 0.462 18481
182 1 5 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.871 -0.579 18481
183 1 5 . 1 1 16 16 GLU H H 16 8.152 8.152 8.111 0.041 18481
184 1 5 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.818 -0.500 18481
185 1 5 . 1 1 17 17 GLU H H 17 8.002 8.002 7.564 0.438 18481
186 1 5 . 1 1 18 18 SER HA H 18 4.329 4.329 4.135 0.194 18481
187 1 5 . 1 1 18 18 SER H H 18 8.036 8.036 8.597 -0.561 18481
188 1 5 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.580 -0.245 18481
189 1 5 . 1 1 19 19 ARG H H 19 8.133 8.133 8.145 -0.012 18481
190 1 5 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.509 -0.325 18481
191 1 5 . 1 1 20 20 ILE H H 20 7.823 7.823 7.991 -0.168 18481
192 1 5 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.386 0.139 18481
193 1 5 . 1 1 21 21 ASN H H 21 8.212 8.212 9.244 -1.032 18481
194 1 5 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.368 -0.134 18481
195 1 5 . 1 1 22 22 GLN H H 22 7.843 7.843 8.379 -0.536 18481
196 1 6 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.047 0.296 18481
197 1 6 . 1 1 2 2 LEU H H 2 8.093 8.093 8.395 -0.302 18481
198 1 6 . 1 1 3 3 SER HA H 3 4.275 4.275 4.089 0.186 18481
199 1 6 . 1 1 3 3 SER H H 3 7.783 7.783 9.098 -1.315 18481
200 1 6 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.024 0.236 18481
201 1 6 . 1 1 4 4 GLN H H 4 7.962 7.962 8.577 -0.615 18481
202 1 6 . 1 1 5 5 GLY H H 5 8.187 8.187 8.916 -0.729 18481
203 1 6 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.272 -0.138 18481
204 1 6 . 1 1 6 6 VAL H H 6 7.789 7.789 8.266 -0.477 18481
205 1 6 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.602 -0.042 18481
206 1 6 . 1 1 7 7 GLU H H 7 7.693 7.693 7.993 -0.300 18481
207 1 6 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.589 -0.255 18481
208 1 6 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.801 -0.226 18481
209 1 6 . 1 1 9 9 ASP H H 9 8.195 8.195 8.162 0.033 18481
210 1 6 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.477 -0.351 18481
211 1 6 . 1 1 10 10 ILE H H 10 7.617 7.617 8.378 -0.761 18481
212 1 6 . 1 1 11 11 GLY H H 11 8.307 8.307 7.919 0.388 18481
213 1 6 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.976 0.331 18481
214 1 6 . 1 1 12 12 GLN H H 12 7.945 7.945 7.856 0.089 18481
215 1 6 . 1 1 13 13 THR HA H 13 4.169 4.169 4.073 0.096 18481
216 1 6 . 1 1 13 13 THR H H 13 7.745 7.745 7.814 -0.069 18481
217 1 6 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.720 -0.303 18481
218 1 6 . 1 1 14 14 TYR H H 14 7.739 7.739 7.269 0.470 18481
219 1 6 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.857 -0.340 18481
220 1 6 . 1 1 15 15 PHE H H 15 8.178 8.178 9.067 -0.889 18481
221 1 6 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.483 -0.191 18481
222 1 6 . 1 1 16 16 GLU H H 16 8.152 8.152 8.303 -0.151 18481
223 1 6 . 1 1 17 17 GLU HA H 17 4.318 4.318 3.959 0.359 18481
224 1 6 . 1 1 17 17 GLU H H 17 8.002 8.002 8.628 -0.626 18481
225 1 6 . 1 1 18 18 SER HA H 18 4.329 4.329 4.675 -0.346 18481
226 1 6 . 1 1 18 18 SER H H 18 8.036 8.036 8.749 -0.713 18481
227 1 6 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.714 -0.379 18481
228 1 6 . 1 1 19 19 ARG H H 19 8.133 8.133 8.097 0.036 18481
229 1 6 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.025 0.159 18481
230 1 6 . 1 1 20 20 ILE H H 20 7.823 7.823 8.746 -0.923 18481
231 1 6 . 1 1 21 21 ASN HA H 21 4.525 4.525 5.062 -0.537 18481
232 1 6 . 1 1 21 21 ASN H H 21 8.212 8.212 7.373 0.839 18481
233 1 6 . 1 1 22 22 GLN HA H 22 4.234 4.234 3.875 0.359 18481
234 1 6 . 1 1 22 22 GLN H H 22 7.843 7.843 8.624 -0.781 18481
235 1 7 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.277 1.066 18481
236 1 7 . 1 1 2 2 LEU H H 2 8.093 8.093 6.803 1.290 18481
237 1 7 . 1 1 3 3 SER HA H 3 4.275 4.275 4.821 -0.546 18481
238 1 7 . 1 1 3 3 SER H H 3 7.783 7.783 7.724 0.059 18481
239 1 7 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.707 -0.447 18481
240 1 7 . 1 1 4 4 GLN H H 4 7.962 7.962 8.259 -0.297 18481
241 1 7 . 1 1 5 5 GLY H H 5 8.187 8.187 9.574 -1.387 18481
242 1 7 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.751 0.384 18481
243 1 7 . 1 1 6 6 VAL H H 6 7.789 7.789 9.096 -1.307 18481
244 1 7 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.534 0.026 18481
245 1 7 . 1 1 7 7 GLU H H 7 7.693 7.693 7.926 -0.233 18481
246 1 7 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.441 -0.107 18481
247 1 7 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.746 -0.171 18481
248 1 7 . 1 1 9 9 ASP H H 9 8.195 8.195 8.407 -0.212 18481
249 1 7 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.041 0.085 18481
250 1 7 . 1 1 10 10 ILE H H 10 7.617 7.617 8.996 -1.379 18481
251 1 7 . 1 1 11 11 GLY H H 11 8.307 8.307 7.958 0.349 18481
252 1 7 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.035 0.272 18481
253 1 7 . 1 1 12 12 GLN H H 12 7.945 7.945 8.123 -0.178 18481
254 1 7 . 1 1 13 13 THR HA H 13 4.169 4.169 4.210 -0.041 18481
255 1 7 . 1 1 13 13 THR H H 13 7.745 7.745 7.354 0.391 18481
256 1 7 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.674 -0.257 18481
257 1 7 . 1 1 14 14 TYR H H 14 7.739 7.739 7.450 0.289 18481
258 1 7 . 1 1 15 15 PHE HA H 15 4.517 4.517 5.120 -0.603 18481
259 1 7 . 1 1 15 15 PHE H H 15 8.178 8.178 8.809 -0.631 18481
260 1 7 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.363 -0.071 18481
261 1 7 . 1 1 16 16 GLU H H 16 8.152 8.152 8.728 -0.576 18481
262 1 7 . 1 1 17 17 GLU HA H 17 4.318 4.318 3.973 0.345 18481
263 1 7 . 1 1 17 17 GLU H H 17 8.002 8.002 8.628 -0.626 18481
264 1 7 . 1 1 18 18 SER HA H 18 4.329 4.329 4.506 -0.177 18481
265 1 7 . 1 1 18 18 SER H H 18 8.036 8.036 9.249 -1.213 18481
266 1 7 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.359 -0.024 18481
267 1 7 . 1 1 19 19 ARG H H 19 8.133 8.133 7.684 0.449 18481
268 1 7 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.177 0.007 18481
269 1 7 . 1 1 20 20 ILE H H 20 7.823 7.823 8.388 -0.565 18481
270 1 7 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.341 0.184 18481
271 1 7 . 1 1 21 21 ASN H H 21 8.212 8.212 8.227 -0.015 18481
272 1 7 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.265 -0.031 18481
273 1 7 . 1 1 22 22 GLN H H 22 7.843 7.843 8.536 -0.693 18481
274 1 8 . 1 1 2 2 LEU HA H 2 4.343 4.343 2.995 1.348 18481
275 1 8 . 1 1 2 2 LEU H H 2 8.093 8.093 7.885 0.208 18481
276 1 8 . 1 1 3 3 SER HA H 3 4.275 4.275 4.898 -0.623 18481
277 1 8 . 1 1 3 3 SER H H 3 7.783 7.783 7.756 0.027 18481
278 1 8 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.553 -0.293 18481
279 1 8 . 1 1 4 4 GLN H H 4 7.962 7.962 9.679 -1.717 18481
280 1 8 . 1 1 5 5 GLY H H 5 8.187 8.187 8.809 -0.622 18481
281 1 8 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.722 0.412 18481
282 1 8 . 1 1 6 6 VAL H H 6 7.789 7.789 9.061 -1.272 18481
283 1 8 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.645 -0.085 18481
284 1 8 . 1 1 7 7 GLU H H 7 7.693 7.693 8.527 -0.834 18481
285 1 8 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.725 -0.391 18481
286 1 8 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.693 -0.118 18481
287 1 8 . 1 1 9 9 ASP H H 9 8.195 8.195 8.132 0.063 18481
288 1 8 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.942 0.184 18481
289 1 8 . 1 1 10 10 ILE H H 10 7.617 7.617 8.544 -0.927 18481
290 1 8 . 1 1 11 11 GLY H H 11 8.307 8.307 7.630 0.677 18481
291 1 8 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.794 0.513 18481
292 1 8 . 1 1 12 12 GLN H H 12 7.945 7.945 9.109 -1.164 18481
293 1 8 . 1 1 13 13 THR HA H 13 4.169 4.169 4.257 -0.088 18481
294 1 8 . 1 1 13 13 THR H H 13 7.745 7.745 7.883 -0.138 18481
295 1 8 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.164 0.253 18481
296 1 8 . 1 1 14 14 TYR H H 14 7.739 7.739 7.074 0.665 18481
297 1 8 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.610 -0.093 18481
298 1 8 . 1 1 15 15 PHE H H 15 8.178 8.178 8.618 -0.440 18481
299 1 8 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.257 0.035 18481
300 1 8 . 1 1 16 16 GLU H H 16 8.152 8.152 9.092 -0.940 18481
301 1 8 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.725 -0.407 18481
302 1 8 . 1 1 17 17 GLU H H 17 8.002 8.002 8.212 -0.210 18481
303 1 8 . 1 1 18 18 SER HA H 18 4.329 4.329 4.181 0.148 18481
304 1 8 . 1 1 18 18 SER H H 18 8.036 8.036 8.940 -0.904 18481
305 1 8 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.132 0.203 18481
306 1 8 . 1 1 19 19 ARG H H 19 8.133 8.133 8.502 -0.369 18481
307 1 8 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.918 0.266 18481
308 1 8 . 1 1 20 20 ILE H H 20 7.823 7.823 7.494 0.329 18481
309 1 8 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.437 0.088 18481
310 1 8 . 1 1 21 21 ASN H H 21 8.212 8.212 8.027 0.185 18481
311 1 8 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.667 -0.433 18481
312 1 8 . 1 1 22 22 GLN H H 22 7.843 7.843 9.163 -1.320 18481
313 1 9 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.076 0.267 18481
314 1 9 . 1 1 2 2 LEU H H 2 8.093 8.093 8.123 -0.030 18481
315 1 9 . 1 1 3 3 SER HA H 3 4.275 4.275 4.800 -0.525 18481
316 1 9 . 1 1 3 3 SER H H 3 7.783 7.783 7.824 -0.041 18481
317 1 9 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.457 -0.197 18481
318 1 9 . 1 1 4 4 GLN H H 4 7.962 7.962 9.566 -1.604 18481
319 1 9 . 1 1 5 5 GLY H H 5 8.187 8.187 8.237 -0.050 18481
320 1 9 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.782 0.352 18481
321 1 9 . 1 1 6 6 VAL H H 6 7.789 7.789 8.014 -0.225 18481
322 1 9 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.469 0.091 18481
323 1 9 . 1 1 7 7 GLU H H 7 7.693 7.693 8.103 -0.410 18481
324 1 9 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.667 -0.333 18481
325 1 9 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.518 0.057 18481
326 1 9 . 1 1 9 9 ASP H H 9 8.195 8.195 8.103 0.092 18481
327 1 9 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.479 -0.353 18481
328 1 9 . 1 1 10 10 ILE H H 10 7.617 7.617 8.212 -0.595 18481
329 1 9 . 1 1 11 11 GLY H H 11 8.307 8.307 8.485 -0.178 18481
330 1 9 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.385 -0.078 18481
331 1 9 . 1 1 12 12 GLN H H 12 7.945 7.945 8.044 -0.099 18481
332 1 9 . 1 1 13 13 THR HA H 13 4.169 4.169 3.664 0.505 18481
333 1 9 . 1 1 13 13 THR H H 13 7.745 7.745 7.505 0.240 18481
334 1 9 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.449 -0.032 18481
335 1 9 . 1 1 14 14 TYR H H 14 7.739 7.739 7.349 0.390 18481
336 1 9 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.908 -0.391 18481
337 1 9 . 1 1 15 15 PHE H H 15 8.178 8.178 8.673 -0.495 18481
338 1 9 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.522 -0.230 18481
339 1 9 . 1 1 16 16 GLU H H 16 8.152 8.152 8.421 -0.269 18481
340 1 9 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.420 -0.102 18481
341 1 9 . 1 1 17 17 GLU H H 17 8.002 8.002 8.159 -0.157 18481
342 1 9 . 1 1 18 18 SER HA H 18 4.329 4.329 4.280 0.049 18481
343 1 9 . 1 1 18 18 SER H H 18 8.036 8.036 8.676 -0.640 18481
344 1 9 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.749 -0.414 18481
345 1 9 . 1 1 19 19 ARG H H 19 8.133 8.133 8.502 -0.369 18481
346 1 9 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.664 0.520 18481
347 1 9 . 1 1 20 20 ILE H H 20 7.823 7.823 9.038 -1.215 18481
348 1 9 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.957 -0.432 18481
349 1 9 . 1 1 21 21 ASN H H 21 8.212 8.212 7.938 0.274 18481
350 1 9 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.500 -0.266 18481
351 1 9 . 1 1 22 22 GLN H H 22 7.843 7.843 8.475 -0.632 18481
352 1 10 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.639 0.704 18481
353 1 10 . 1 1 2 2 LEU H H 2 8.093 8.093 7.632 0.461 18481
354 1 10 . 1 1 3 3 SER HA H 3 4.275 4.275 4.825 -0.550 18481
355 1 10 . 1 1 3 3 SER H H 3 7.783 7.783 7.817 -0.034 18481
356 1 10 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.127 0.133 18481
357 1 10 . 1 1 4 4 GLN H H 4 7.962 7.962 9.677 -1.714 18481
358 1 10 . 1 1 5 5 GLY H H 5 8.187 8.187 8.968 -0.781 18481
359 1 10 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.848 -0.714 18481
360 1 10 . 1 1 6 6 VAL H H 6 7.789 7.789 8.059 -0.270 18481
361 1 10 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.632 -0.072 18481
362 1 10 . 1 1 7 7 GLU H H 7 7.693 7.693 7.637 0.056 18481
363 1 10 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.616 -0.282 18481
364 1 10 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.656 -0.081 18481
365 1 10 . 1 1 9 9 ASP H H 9 8.195 8.195 7.672 0.523 18481
366 1 10 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.916 0.210 18481
367 1 10 . 1 1 10 10 ILE H H 10 7.617 7.617 8.207 -0.590 18481
368 1 10 . 1 1 11 11 GLY H H 11 8.307 8.307 7.909 0.398 18481
369 1 10 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.978 0.329 18481
370 1 10 . 1 1 12 12 GLN H H 12 7.945 7.945 8.589 -0.644 18481
371 1 10 . 1 1 13 13 THR HA H 13 4.169 4.169 4.242 -0.073 18481
372 1 10 . 1 1 13 13 THR H H 13 7.745 7.745 7.567 0.178 18481
373 1 10 . 1 1 14 14 TYR HA H 14 4.417 4.417 3.952 0.465 18481
374 1 10 . 1 1 14 14 TYR H H 14 7.739 7.739 7.087 0.652 18481
375 1 10 . 1 1 15 15 PHE HA H 15 4.517 4.517 5.201 -0.684 18481
376 1 10 . 1 1 15 15 PHE H H 15 8.178 8.178 8.363 -0.185 18481
377 1 10 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.356 -0.064 18481
378 1 10 . 1 1 16 16 GLU H H 16 8.152 8.152 9.247 -1.095 18481
379 1 10 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.507 -0.189 18481
380 1 10 . 1 1 17 17 GLU H H 17 8.002 8.002 8.308 -0.306 18481
381 1 10 . 1 1 18 18 SER HA H 18 4.329 4.329 4.482 -0.153 18481
382 1 10 . 1 1 18 18 SER H H 18 8.036 8.036 8.312 -0.276 18481
383 1 10 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.073 0.262 18481
384 1 10 . 1 1 19 19 ARG H H 19 8.133 8.133 8.906 -0.773 18481
385 1 10 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.029 0.155 18481
386 1 10 . 1 1 20 20 ILE H H 20 7.823 7.823 8.263 -0.440 18481
387 1 10 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.407 0.118 18481
388 1 10 . 1 1 21 21 ASN H H 21 8.212 8.212 8.266 -0.054 18481
389 1 10 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.513 -0.279 18481
390 1 10 . 1 1 22 22 GLN H H 22 7.843 7.843 8.748 -0.905 18481
391 1 11 . 1 1 2 2 LEU HA H 2 4.343 4.343 5.071 -0.728 18481
392 1 11 . 1 1 2 2 LEU H H 2 8.093 8.093 8.985 -0.892 18481
393 1 11 . 1 1 3 3 SER HA H 3 4.275 4.275 4.569 -0.294 18481
394 1 11 . 1 1 3 3 SER H H 3 7.783 7.783 8.436 -0.653 18481
395 1 11 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.687 -0.427 18481
396 1 11 . 1 1 4 4 GLN H H 4 7.962 7.962 7.827 0.135 18481
397 1 11 . 1 1 5 5 GLY H H 5 8.187 8.187 9.076 -0.889 18481
398 1 11 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.154 -0.020 18481
399 1 11 . 1 1 6 6 VAL H H 6 7.789 7.789 7.581 0.208 18481
400 1 11 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.674 -0.114 18481
401 1 11 . 1 1 7 7 GLU H H 7 7.693 7.693 8.097 -0.404 18481
402 1 11 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.686 -0.352 18481
403 1 11 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.550 0.025 18481
404 1 11 . 1 1 9 9 ASP H H 9 8.195 8.195 8.301 -0.106 18481
405 1 11 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.997 0.129 18481
406 1 11 . 1 1 10 10 ILE H H 10 7.617 7.617 8.168 -0.551 18481
407 1 11 . 1 1 11 11 GLY H H 11 8.307 8.307 8.301 0.006 18481
408 1 11 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.956 0.351 18481
409 1 11 . 1 1 12 12 GLN H H 12 7.945 7.945 8.029 -0.084 18481
410 1 11 . 1 1 13 13 THR HA H 13 4.169 4.169 3.857 0.312 18481
411 1 11 . 1 1 13 13 THR H H 13 7.745 7.745 7.837 -0.092 18481
412 1 11 . 1 1 14 14 TYR HA H 14 4.417 4.417 3.922 0.495 18481
413 1 11 . 1 1 14 14 TYR H H 14 7.739 7.739 7.189 0.550 18481
414 1 11 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.732 -0.215 18481
415 1 11 . 1 1 15 15 PHE H H 15 8.178 8.178 8.361 -0.183 18481
416 1 11 . 1 1 16 16 GLU HA H 16 4.292 4.292 5.094 -0.802 18481
417 1 11 . 1 1 16 16 GLU H H 16 8.152 8.152 8.195 -0.043 18481
418 1 11 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.479 -0.161 18481
419 1 11 . 1 1 17 17 GLU H H 17 8.002 8.002 8.689 -0.687 18481
420 1 11 . 1 1 18 18 SER HA H 18 4.329 4.329 4.672 -0.343 18481
421 1 11 . 1 1 18 18 SER H H 18 8.036 8.036 8.678 -0.642 18481
422 1 11 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.741 -0.406 18481
423 1 11 . 1 1 19 19 ARG H H 19 8.133 8.133 9.144 -1.011 18481
424 1 11 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.412 -0.228 18481
425 1 11 . 1 1 20 20 ILE H H 20 7.823 7.823 8.815 -0.992 18481
426 1 11 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.790 -0.265 18481
427 1 11 . 1 1 21 21 ASN H H 21 8.212 8.212 7.789 0.423 18481
428 1 11 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.047 0.187 18481
429 1 11 . 1 1 22 22 GLN H H 22 7.843 7.843 8.491 -0.648 18481
430 1 12 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.056 0.287 18481
431 1 12 . 1 1 2 2 LEU H H 2 8.093 8.093 8.375 -0.282 18481
432 1 12 . 1 1 3 3 SER HA H 3 4.275 4.275 3.990 0.285 18481
433 1 12 . 1 1 3 3 SER H H 3 7.783 7.783 7.402 0.381 18481
434 1 12 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.145 0.115 18481
435 1 12 . 1 1 4 4 GLN H H 4 7.962 7.962 8.206 -0.244 18481
436 1 12 . 1 1 5 5 GLY H H 5 8.187 8.187 8.781 -0.594 18481
437 1 12 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.407 -0.273 18481
438 1 12 . 1 1 6 6 VAL H H 6 7.789 7.789 8.539 -0.750 18481
439 1 12 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.548 0.012 18481
440 1 12 . 1 1 7 7 GLU H H 7 7.693 7.693 8.192 -0.499 18481
441 1 12 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.710 -0.376 18481
442 1 12 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.801 -0.226 18481
443 1 12 . 1 1 9 9 ASP H H 9 8.195 8.195 8.211 -0.016 18481
444 1 12 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.262 -0.136 18481
445 1 12 . 1 1 10 10 ILE H H 10 7.617 7.617 9.122 -1.505 18481
446 1 12 . 1 1 11 11 GLY H H 11 8.307 8.307 8.795 -0.488 18481
447 1 12 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.427 -0.120 18481
448 1 12 . 1 1 12 12 GLN H H 12 7.945 7.945 8.255 -0.310 18481
449 1 12 . 1 1 13 13 THR HA H 13 4.169 4.169 4.083 0.086 18481
450 1 12 . 1 1 13 13 THR H H 13 7.745 7.745 8.397 -0.652 18481
451 1 12 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.280 0.137 18481
452 1 12 . 1 1 14 14 TYR H H 14 7.739 7.739 6.997 0.742 18481
453 1 12 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.809 -0.292 18481
454 1 12 . 1 1 15 15 PHE H H 15 8.178 8.178 8.758 -0.580 18481
455 1 12 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.500 -0.208 18481
456 1 12 . 1 1 16 16 GLU H H 16 8.152 8.152 8.077 0.075 18481
457 1 12 . 1 1 17 17 GLU HA H 17 4.318 4.318 3.964 0.354 18481
458 1 12 . 1 1 17 17 GLU H H 17 8.002 8.002 8.677 -0.675 18481
459 1 12 . 1 1 18 18 SER HA H 18 4.329 4.329 4.123 0.206 18481
460 1 12 . 1 1 18 18 SER H H 18 8.036 8.036 8.527 -0.490 18481
461 1 12 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.335 -0.000 18481
462 1 12 . 1 1 19 19 ARG H H 19 8.133 8.133 7.671 0.462 18481
463 1 12 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.221 -0.037 18481
464 1 12 . 1 1 20 20 ILE H H 20 7.823 7.823 8.015 -0.192 18481
465 1 12 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.424 0.101 18481
466 1 12 . 1 1 21 21 ASN H H 21 8.212 8.212 8.359 -0.147 18481
467 1 12 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.578 -0.344 18481
468 1 12 . 1 1 22 22 GLN H H 22 7.843 7.843 8.196 -0.353 18481
469 1 13 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.019 0.324 18481
470 1 13 . 1 1 2 2 LEU H H 2 8.093 8.093 9.689 -1.596 18481
471 1 13 . 1 1 3 3 SER HA H 3 4.275 4.275 4.198 0.077 18481
472 1 13 . 1 1 3 3 SER H H 3 7.783 7.783 8.682 -0.899 18481
473 1 13 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.457 -0.197 18481
474 1 13 . 1 1 4 4 GLN H H 4 7.962 7.962 8.795 -0.833 18481
475 1 13 . 1 1 5 5 GLY H H 5 8.187 8.187 8.092 0.095 18481
476 1 13 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.598 -0.464 18481
477 1 13 . 1 1 6 6 VAL H H 6 7.789 7.789 8.852 -1.063 18481
478 1 13 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.751 -0.191 18481
479 1 13 . 1 1 7 7 GLU H H 7 7.693 7.693 9.010 -1.317 18481
480 1 13 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.426 -0.092 18481
481 1 13 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.891 -0.316 18481
482 1 13 . 1 1 9 9 ASP H H 9 8.195 8.195 8.502 -0.307 18481
483 1 13 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.068 0.058 18481
484 1 13 . 1 1 10 10 ILE H H 10 7.617 7.617 8.036 -0.419 18481
485 1 13 . 1 1 11 11 GLY H H 11 8.307 8.307 7.686 0.621 18481
486 1 13 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.070 0.237 18481
487 1 13 . 1 1 12 12 GLN H H 12 7.945 7.945 8.331 -0.386 18481
488 1 13 . 1 1 13 13 THR HA H 13 4.169 4.169 4.111 0.058 18481
489 1 13 . 1 1 13 13 THR H H 13 7.745 7.745 8.069 -0.324 18481
490 1 13 . 1 1 14 14 TYR HA H 14 4.417 4.417 3.546 0.871 18481
491 1 13 . 1 1 14 14 TYR H H 14 7.739 7.739 8.019 -0.280 18481
492 1 13 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.959 -0.442 18481
493 1 13 . 1 1 15 15 PHE H H 15 8.178 8.178 8.281 -0.103 18481
494 1 13 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.506 -0.214 18481
495 1 13 . 1 1 16 16 GLU H H 16 8.152 8.152 8.072 0.080 18481
496 1 13 . 1 1 17 17 GLU HA H 17 4.318 4.318 3.938 0.380 18481
497 1 13 . 1 1 17 17 GLU H H 17 8.002 8.002 9.053 -1.051 18481
498 1 13 . 1 1 18 18 SER HA H 18 4.329 4.329 4.646 -0.317 18481
499 1 13 . 1 1 18 18 SER H H 18 8.036 8.036 9.254 -1.218 18481
500 1 13 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.348 -0.013 18481
501 1 13 . 1 1 19 19 ARG H H 19 8.133 8.133 8.280 -0.147 18481
502 1 13 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.257 -0.073 18481
503 1 13 . 1 1 20 20 ILE H H 20 7.823 7.823 8.351 -0.528 18481
504 1 13 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.395 0.130 18481
505 1 13 . 1 1 21 21 ASN H H 21 8.212 8.212 8.253 -0.041 18481
506 1 13 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.367 -0.133 18481
507 1 13 . 1 1 22 22 GLN H H 22 7.843 7.843 8.245 -0.402 18481
508 1 14 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.125 0.218 18481
509 1 14 . 1 1 2 2 LEU H H 2 8.093 8.093 8.692 -0.599 18481
510 1 14 . 1 1 3 3 SER HA H 3 4.275 4.275 4.294 -0.019 18481
511 1 14 . 1 1 3 3 SER H H 3 7.783 7.783 7.815 -0.032 18481
512 1 14 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.664 -0.404 18481
513 1 14 . 1 1 4 4 GLN H H 4 7.962 7.962 8.097 -0.135 18481
514 1 14 . 1 1 5 5 GLY H H 5 8.187 8.187 8.438 -0.251 18481
515 1 14 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.277 -0.143 18481
516 1 14 . 1 1 6 6 VAL H H 6 7.789 7.789 8.332 -0.543 18481
517 1 14 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.601 -0.041 18481
518 1 14 . 1 1 7 7 GLU H H 7 7.693 7.693 8.740 -1.047 18481
519 1 14 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.797 -0.463 18481
520 1 14 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.850 -0.275 18481
521 1 14 . 1 1 9 9 ASP H H 9 8.195 8.195 8.528 -0.333 18481
522 1 14 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.835 0.291 18481
523 1 14 . 1 1 10 10 ILE H H 10 7.617 7.617 8.502 -0.885 18481
524 1 14 . 1 1 11 11 GLY H H 11 8.307 8.307 7.646 0.661 18481
525 1 14 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.511 -0.204 18481
526 1 14 . 1 1 12 12 GLN H H 12 7.945 7.945 6.651 1.294 18481
527 1 14 . 1 1 13 13 THR HA H 13 4.169 4.169 4.009 0.160 18481
528 1 14 . 1 1 13 13 THR H H 13 7.745 7.745 8.155 -0.410 18481
529 1 14 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.724 -0.307 18481
530 1 14 . 1 1 14 14 TYR H H 14 7.739 7.739 7.451 0.288 18481
531 1 14 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.724 -0.207 18481
532 1 14 . 1 1 15 15 PHE H H 15 8.178 8.178 9.057 -0.879 18481
533 1 14 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.738 -0.446 18481
534 1 14 . 1 1 16 16 GLU H H 16 8.152 8.152 8.459 -0.307 18481
535 1 14 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.439 -0.121 18481
536 1 14 . 1 1 17 17 GLU H H 17 8.002 8.002 8.409 -0.407 18481
537 1 14 . 1 1 18 18 SER HA H 18 4.329 4.329 4.319 0.010 18481
538 1 14 . 1 1 18 18 SER H H 18 8.036 8.036 7.979 0.057 18481
539 1 14 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.615 -0.280 18481
540 1 14 . 1 1 19 19 ARG H H 19 8.133 8.133 8.931 -0.798 18481
541 1 14 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.855 0.329 18481
542 1 14 . 1 1 20 20 ILE H H 20 7.823 7.823 8.587 -0.764 18481
543 1 14 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.836 -0.311 18481
544 1 14 . 1 1 21 21 ASN H H 21 8.212 8.212 8.204 0.008 18481
545 1 14 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.624 -0.390 18481
546 1 14 . 1 1 22 22 GLN H H 22 7.843 7.843 8.562 -0.719 18481
547 1 15 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.031 0.312 18481
548 1 15 . 1 1 2 2 LEU H H 2 8.093 8.093 8.211 -0.118 18481
549 1 15 . 1 1 3 3 SER HA H 3 4.275 4.275 4.927 -0.652 18481
550 1 15 . 1 1 3 3 SER H H 3 7.783 7.783 7.725 0.058 18481
551 1 15 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.743 -0.483 18481
552 1 15 . 1 1 4 4 GLN H H 4 7.962 7.962 9.375 -1.413 18481
553 1 15 . 1 1 5 5 GLY H H 5 8.187 8.187 8.463 -0.276 18481
554 1 15 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.527 -0.393 18481
555 1 15 . 1 1 6 6 VAL H H 6 7.789 7.789 8.090 -0.301 18481
556 1 15 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.555 0.005 18481
557 1 15 . 1 1 7 7 GLU H H 7 7.693 7.693 7.662 0.031 18481
558 1 15 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.427 -0.093 18481
559 1 15 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.555 0.020 18481
560 1 15 . 1 1 9 9 ASP H H 9 8.195 8.195 8.398 -0.203 18481
561 1 15 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.042 0.084 18481
562 1 15 . 1 1 10 10 ILE H H 10 7.617 7.617 8.579 -0.963 18481
563 1 15 . 1 1 11 11 GLY H H 11 8.307 8.307 7.949 0.358 18481
564 1 15 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.094 0.213 18481
565 1 15 . 1 1 12 12 GLN H H 12 7.945 7.945 8.980 -1.035 18481
566 1 15 . 1 1 13 13 THR HA H 13 4.169 4.169 4.147 0.022 18481
567 1 15 . 1 1 13 13 THR H H 13 7.745 7.745 7.452 0.293 18481
568 1 15 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.422 -0.005 18481
569 1 15 . 1 1 14 14 TYR H H 14 7.739 7.739 7.619 0.120 18481
570 1 15 . 1 1 15 15 PHE HA H 15 4.517 4.517 5.203 -0.686 18481
571 1 15 . 1 1 15 15 PHE H H 15 8.178 8.178 8.747 -0.569 18481
572 1 15 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.450 -0.158 18481
573 1 15 . 1 1 16 16 GLU H H 16 8.152 8.152 8.269 -0.117 18481
574 1 15 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.589 -0.271 18481
575 1 15 . 1 1 17 17 GLU H H 17 8.002 8.002 8.114 -0.112 18481
576 1 15 . 1 1 18 18 SER HA H 18 4.329 4.329 5.078 -0.749 18481
577 1 15 . 1 1 18 18 SER H H 18 8.036 8.036 8.708 -0.672 18481
578 1 15 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.119 0.216 18481
579 1 15 . 1 1 19 19 ARG H H 19 8.133 8.133 9.487 -1.354 18481
580 1 15 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.293 -0.109 18481
581 1 15 . 1 1 20 20 ILE H H 20 7.823 7.823 7.802 0.021 18481
582 1 15 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.766 -0.241 18481
583 1 15 . 1 1 21 21 ASN H H 21 8.212 8.212 7.414 0.798 18481
584 1 15 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.020 0.214 18481
585 1 15 . 1 1 22 22 GLN H H 22 7.843 7.843 8.578 -0.735 18481
586 1 16 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.510 0.833 18481
587 1 16 . 1 1 2 2 LEU H H 2 8.093 8.093 7.541 0.552 18481
588 1 16 . 1 1 3 3 SER HA H 3 4.275 4.275 4.782 -0.507 18481
589 1 16 . 1 1 3 3 SER H H 3 7.783 7.783 8.429 -0.646 18481
590 1 16 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.637 -0.377 18481
591 1 16 . 1 1 4 4 GLN H H 4 7.962 7.962 7.707 0.255 18481
592 1 16 . 1 1 5 5 GLY H H 5 8.187 8.187 9.240 -1.053 18481
593 1 16 . 1 1 6 6 VAL HA H 6 4.134 4.134 3.662 0.472 18481
594 1 16 . 1 1 6 6 VAL H H 6 7.789 7.789 8.677 -0.888 18481
595 1 16 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.845 -0.285 18481
596 1 16 . 1 1 7 7 GLU H H 7 7.693 7.693 8.616 -0.923 18481
597 1 16 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.537 -0.203 18481
598 1 16 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.655 -0.080 18481
599 1 16 . 1 1 9 9 ASP H H 9 8.195 8.195 8.238 -0.043 18481
600 1 16 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.424 -0.298 18481
601 1 16 . 1 1 10 10 ILE H H 10 7.617 7.617 8.382 -0.765 18481
602 1 16 . 1 1 11 11 GLY H H 11 8.307 8.307 8.377 -0.070 18481
603 1 16 . 1 1 12 12 GLN HA H 12 4.307 4.307 3.997 0.310 18481
604 1 16 . 1 1 12 12 GLN H H 12 7.945 7.945 8.828 -0.883 18481
605 1 16 . 1 1 13 13 THR HA H 13 4.169 4.169 4.096 0.073 18481
606 1 16 . 1 1 13 13 THR H H 13 7.745 7.745 7.423 0.322 18481
607 1 16 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.554 -0.137 18481
608 1 16 . 1 1 14 14 TYR H H 14 7.739 7.739 7.007 0.732 18481
609 1 16 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.691 -0.174 18481
610 1 16 . 1 1 15 15 PHE H H 15 8.178 8.178 8.509 -0.331 18481
611 1 16 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.472 -0.180 18481
612 1 16 . 1 1 16 16 GLU H H 16 8.152 8.152 8.241 -0.089 18481
613 1 16 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.863 -0.545 18481
614 1 16 . 1 1 17 17 GLU H H 17 8.002 8.002 7.931 0.071 18481
615 1 16 . 1 1 18 18 SER HA H 18 4.329 4.329 4.207 0.122 18481
616 1 16 . 1 1 18 18 SER H H 18 8.036 8.036 8.373 -0.337 18481
617 1 16 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.218 0.117 18481
618 1 16 . 1 1 19 19 ARG H H 19 8.133 8.133 8.533 -0.400 18481
619 1 16 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.063 0.121 18481
620 1 16 . 1 1 20 20 ILE H H 20 7.823 7.823 8.073 -0.250 18481
621 1 16 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.473 0.052 18481
622 1 16 . 1 1 21 21 ASN H H 21 8.212 8.212 7.923 0.289 18481
623 1 16 . 1 1 22 22 GLN HA H 22 4.234 4.234 3.876 0.358 18481
624 1 16 . 1 1 22 22 GLN H H 22 7.843 7.843 8.818 -0.975 18481
625 1 17 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.825 -0.482 18481
626 1 17 . 1 1 2 2 LEU H H 2 8.093 8.093 9.336 -1.243 18481
627 1 17 . 1 1 3 3 SER HA H 3 4.275 4.275 4.431 -0.156 18481
628 1 17 . 1 1 3 3 SER H H 3 7.783 7.783 8.993 -1.210 18481
629 1 17 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.354 -0.094 18481
630 1 17 . 1 1 4 4 GLN H H 4 7.962 7.962 9.071 -1.109 18481
631 1 17 . 1 1 5 5 GLY H H 5 8.187 8.187 7.686 0.501 18481
632 1 17 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.803 -0.669 18481
633 1 17 . 1 1 6 6 VAL H H 6 7.789 7.789 8.357 -0.568 18481
634 1 17 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.725 -0.165 18481
635 1 17 . 1 1 7 7 GLU H H 7 7.693 7.693 8.379 -0.686 18481
636 1 17 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.898 -0.564 18481
637 1 17 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.557 0.018 18481
638 1 17 . 1 1 9 9 ASP H H 9 8.195 8.195 8.352 -0.157 18481
639 1 17 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.491 -0.365 18481
640 1 17 . 1 1 10 10 ILE H H 10 7.617 7.617 7.590 0.027 18481
641 1 17 . 1 1 11 11 GLY H H 11 8.307 8.307 8.926 -0.619 18481
642 1 17 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.592 -0.285 18481
643 1 17 . 1 1 12 12 GLN H H 12 7.945 7.945 8.419 -0.474 18481
644 1 17 . 1 1 13 13 THR HA H 13 4.169 4.169 4.015 0.154 18481
645 1 17 . 1 1 13 13 THR H H 13 7.745 7.745 7.846 -0.101 18481
646 1 17 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.098 0.319 18481
647 1 17 . 1 1 14 14 TYR H H 14 7.739 7.739 6.763 0.976 18481
648 1 17 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.717 -0.200 18481
649 1 17 . 1 1 15 15 PHE H H 15 8.178 8.178 8.493 -0.315 18481
650 1 17 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.424 -0.132 18481
651 1 17 . 1 1 16 16 GLU H H 16 8.152 8.152 8.705 -0.553 18481
652 1 17 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.693 -0.375 18481
653 1 17 . 1 1 17 17 GLU H H 17 8.002 8.002 7.684 0.318 18481
654 1 17 . 1 1 18 18 SER HA H 18 4.329 4.329 4.123 0.206 18481
655 1 17 . 1 1 18 18 SER H H 18 8.036 8.036 8.521 -0.485 18481
656 1 17 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.682 -0.347 18481
657 1 17 . 1 1 19 19 ARG H H 19 8.133 8.133 8.821 -0.688 18481
658 1 17 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.336 -0.152 18481
659 1 17 . 1 1 20 20 ILE H H 20 7.823 7.823 8.269 -0.446 18481
660 1 17 . 1 1 21 21 ASN HA H 21 4.525 4.525 5.242 -0.717 18481
661 1 17 . 1 1 21 21 ASN H H 21 8.212 8.212 7.373 0.839 18481
662 1 17 . 1 1 22 22 GLN HA H 22 4.234 4.234 3.962 0.272 18481
663 1 17 . 1 1 22 22 GLN H H 22 7.843 7.843 8.660 -0.817 18481
664 1 18 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.578 -0.235 18481
665 1 18 . 1 1 2 2 LEU H H 2 8.093 8.093 9.593 -1.500 18481
666 1 18 . 1 1 3 3 SER HA H 3 4.275 4.275 4.548 -0.273 18481
667 1 18 . 1 1 3 3 SER H H 3 7.783 7.783 7.720 0.063 18481
668 1 18 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.067 0.193 18481
669 1 18 . 1 1 4 4 GLN H H 4 7.962 7.962 8.394 -0.432 18481
670 1 18 . 1 1 5 5 GLY H H 5 8.187 8.187 8.119 0.068 18481
671 1 18 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.510 -0.376 18481
672 1 18 . 1 1 6 6 VAL H H 6 7.789 7.789 7.963 -0.174 18481
673 1 18 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.790 -0.230 18481
674 1 18 . 1 1 7 7 GLU H H 7 7.693 7.693 8.107 -0.413 18481
675 1 18 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.456 -0.122 18481
676 1 18 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.880 -0.305 18481
677 1 18 . 1 1 9 9 ASP H H 9 8.195 8.195 8.014 0.181 18481
678 1 18 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.519 -0.393 18481
679 1 18 . 1 1 10 10 ILE H H 10 7.617 7.617 8.892 -1.275 18481
680 1 18 . 1 1 11 11 GLY H H 11 8.307 8.307 8.471 -0.164 18481
681 1 18 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.142 0.165 18481
682 1 18 . 1 1 12 12 GLN H H 12 7.945 7.945 8.870 -0.925 18481
683 1 18 . 1 1 13 13 THR HA H 13 4.169 4.169 4.149 0.020 18481
684 1 18 . 1 1 13 13 THR H H 13 7.745 7.745 7.687 0.058 18481
685 1 18 . 1 1 14 14 TYR HA H 14 4.417 4.417 3.768 0.649 18481
686 1 18 . 1 1 14 14 TYR H H 14 7.739 7.739 7.684 0.055 18481
687 1 18 . 1 1 15 15 PHE HA H 15 4.517 4.517 5.181 -0.664 18481
688 1 18 . 1 1 15 15 PHE H H 15 8.178 8.178 8.241 -0.063 18481
689 1 18 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.649 -0.357 18481
690 1 18 . 1 1 16 16 GLU H H 16 8.152 8.152 8.392 -0.240 18481
691 1 18 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.415 -0.097 18481
692 1 18 . 1 1 17 17 GLU H H 17 8.002 8.002 8.344 -0.342 18481
693 1 18 . 1 1 18 18 SER HA H 18 4.329 4.329 4.424 -0.095 18481
694 1 18 . 1 1 18 18 SER H H 18 8.036 8.036 8.555 -0.519 18481
695 1 18 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.334 0.001 18481
696 1 18 . 1 1 19 19 ARG H H 19 8.133 8.133 8.478 -0.345 18481
697 1 18 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.216 -0.032 18481
698 1 18 . 1 1 20 20 ILE H H 20 7.823 7.823 8.387 -0.564 18481
699 1 18 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.504 0.021 18481
700 1 18 . 1 1 21 21 ASN H H 21 8.212 8.212 8.732 -0.520 18481
701 1 18 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.238 -0.004 18481
702 1 18 . 1 1 22 22 GLN H H 22 7.843 7.843 7.650 0.193 18481
703 1 19 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.419 0.924 18481
704 1 19 . 1 1 2 2 LEU H H 2 8.093 8.093 7.351 0.742 18481
705 1 19 . 1 1 3 3 SER HA H 3 4.275 4.275 4.983 -0.708 18481
706 1 19 . 1 1 3 3 SER H H 3 7.783 7.783 7.911 -0.128 18481
707 1 19 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.311 -0.051 18481
708 1 19 . 1 1 4 4 GLN H H 4 7.962 7.962 9.651 -1.689 18481
709 1 19 . 1 1 5 5 GLY H H 5 8.187 8.187 8.661 -0.474 18481
710 1 19 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.383 -0.249 18481
711 1 19 . 1 1 6 6 VAL H H 6 7.789 7.789 8.197 -0.408 18481
712 1 19 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.671 -0.111 18481
713 1 19 . 1 1 7 7 GLU H H 7 7.693 7.693 8.821 -1.128 18481
714 1 19 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.909 -0.575 18481
715 1 19 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.681 -0.106 18481
716 1 19 . 1 1 9 9 ASP H H 9 8.195 8.195 8.644 -0.449 18481
717 1 19 . 1 1 10 10 ILE HA H 10 4.126 4.126 3.766 0.360 18481
718 1 19 . 1 1 10 10 ILE H H 10 7.617 7.617 8.025 -0.408 18481
719 1 19 . 1 1 11 11 GLY H H 11 8.307 8.307 8.486 -0.179 18481
720 1 19 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.034 0.273 18481
721 1 19 . 1 1 12 12 GLN H H 12 7.945 7.945 8.330 -0.385 18481
722 1 19 . 1 1 13 13 THR HA H 13 4.169 4.169 4.214 -0.045 18481
723 1 19 . 1 1 13 13 THR H H 13 7.745 7.745 7.931 -0.186 18481
724 1 19 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.405 0.012 18481
725 1 19 . 1 1 14 14 TYR H H 14 7.739 7.739 7.555 0.184 18481
726 1 19 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.817 -0.300 18481
727 1 19 . 1 1 15 15 PHE H H 15 8.178 8.178 8.703 -0.525 18481
728 1 19 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.782 -0.490 18481
729 1 19 . 1 1 16 16 GLU H H 16 8.152 8.152 8.436 -0.284 18481
730 1 19 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.534 -0.216 18481
731 1 19 . 1 1 17 17 GLU H H 17 8.002 8.002 9.098 -1.096 18481
732 1 19 . 1 1 18 18 SER HA H 18 4.329 4.329 4.378 -0.049 18481
733 1 19 . 1 1 18 18 SER H H 18 8.036 8.036 7.917 0.119 18481
734 1 19 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.123 0.212 18481
735 1 19 . 1 1 19 19 ARG H H 19 8.133 8.133 8.720 -0.587 18481
736 1 19 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.360 -0.176 18481
737 1 19 . 1 1 20 20 ILE H H 20 7.823 7.823 7.950 -0.127 18481
738 1 19 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.152 0.373 18481
739 1 19 . 1 1 21 21 ASN H H 21 8.212 8.212 8.481 -0.269 18481
740 1 19 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.477 -0.243 18481
741 1 19 . 1 1 22 22 GLN H H 22 7.843 7.843 7.819 0.024 18481
742 1 20 . 1 1 2 2 LEU HA H 2 4.343 4.343 4.585 -0.242 18481
743 1 20 . 1 1 2 2 LEU H H 2 8.093 8.093 9.241 -1.148 18481
744 1 20 . 1 1 3 3 SER HA H 3 4.275 4.275 4.360 -0.085 18481
745 1 20 . 1 1 3 3 SER H H 3 7.783 7.783 9.598 -1.815 18481
746 1 20 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.652 -0.392 18481
747 1 20 . 1 1 4 4 GLN H H 4 7.962 7.962 8.866 -0.904 18481
748 1 20 . 1 1 5 5 GLY H H 5 8.187 8.187 7.853 0.334 18481
749 1 20 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.574 -0.440 18481
750 1 20 . 1 1 6 6 VAL H H 6 7.789 7.789 8.137 -0.348 18481
751 1 20 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.156 0.404 18481
752 1 20 . 1 1 7 7 GLU H H 7 7.693 7.693 9.394 -1.701 18481
753 1 20 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.593 -0.259 18481
754 1 20 . 1 1 9 9 ASP HA H 9 4.575 4.575 5.055 -0.480 18481
755 1 20 . 1 1 9 9 ASP H H 9 8.195 8.195 8.003 0.192 18481
756 1 20 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.493 -0.367 18481
757 1 20 . 1 1 10 10 ILE H H 10 7.617 7.617 9.069 -1.452 18481
758 1 20 . 1 1 11 11 GLY H H 11 8.307 8.307 9.037 -0.730 18481
759 1 20 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.078 0.229 18481
760 1 20 . 1 1 12 12 GLN H H 12 7.945 7.945 8.328 -0.383 18481
761 1 20 . 1 1 13 13 THR HA H 13 4.169 4.169 4.205 -0.036 18481
762 1 20 . 1 1 13 13 THR H H 13 7.745 7.745 7.621 0.124 18481
763 1 20 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.218 0.199 18481
764 1 20 . 1 1 14 14 TYR H H 14 7.739 7.739 7.399 0.340 18481
765 1 20 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.615 -0.098 18481
766 1 20 . 1 1 15 15 PHE H H 15 8.178 8.178 8.160 0.018 18481
767 1 20 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.256 0.036 18481
768 1 20 . 1 1 16 16 GLU H H 16 8.152 8.152 8.285 -0.133 18481
769 1 20 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.257 0.061 18481
770 1 20 . 1 1 17 17 GLU H H 17 8.002 8.002 8.793 -0.791 18481
771 1 20 . 1 1 18 18 SER HA H 18 4.329 4.329 4.913 -0.584 18481
772 1 20 . 1 1 18 18 SER H H 18 8.036 8.036 9.061 -1.025 18481
773 1 20 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.363 -0.028 18481
774 1 20 . 1 1 19 19 ARG H H 19 8.133 8.133 8.210 -0.077 18481
775 1 20 . 1 1 20 20 ILE HA H 20 4.184 4.184 3.990 0.194 18481
776 1 20 . 1 1 20 20 ILE H H 20 7.823 7.823 8.266 -0.443 18481
777 1 20 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.734 -0.209 18481
778 1 20 . 1 1 21 21 ASN H H 21 8.212 8.212 7.533 0.679 18481
779 1 20 . 1 1 22 22 GLN HA H 22 4.234 4.234 3.927 0.307 18481
780 1 20 . 1 1 22 22 GLN H H 22 7.843 7.843 8.477 -0.634 18481
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 18481
2 1 1 "Average Difference" HA 23 0.382 0.137 0.364 18481
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18481
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18481
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18481
6 1 1 "Average Difference" HN 20 0.743 0.441 0.614 18481
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18481
8 1 2 "Average Difference" HA 23 0.272 0.061 0.272 18481
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18481
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18481
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18481
12 1 2 "Average Difference" HN 20 0.410 0.226 0.351 18481
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18481
14 1 3 "Average Difference" HA 23 0.473 0.066 0.479 18481
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18481
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18481
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18481
18 1 3 "Average Difference" HN 20 0.663 0.421 0.526 18481
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18481
20 1 4 "Average Difference" HA 23 0.413 0.066 0.417 18481
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18481
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18481
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18481
24 1 4 "Average Difference" HN 20 0.437 0.148 0.422 18481
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18481
26 1 5 "Average Difference" HA 23 0.276 0.031 0.280 18481
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18481
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18481
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18481
30 1 5 "Average Difference" HN 20 0.627 0.385 0.509 18481
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18481
32 1 6 "Average Difference" HA 23 0.551 -0.009 0.564 18481
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18481
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18481
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18481
36 1 6 "Average Difference" HN 20 0.628 0.340 0.542 18481
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18481
38 1 7 "Average Difference" HA 23 0.443 -0.063 0.449 18481
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18481
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18481
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18481
42 1 7 "Average Difference" HN 20 0.754 0.324 0.699 18481
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18481
44 1 8 "Average Difference" HA 23 0.404 -0.012 0.413 18481
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18481
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18481
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18481
48 1 8 "Average Difference" HN 20 0.800 0.435 0.688 18481
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18481
50 1 9 "Average Difference" HA 23 0.299 0.093 0.290 18481
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18481
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18481
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18481
54 1 9 "Average Difference" HN 20 0.559 0.301 0.484 18481
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18481
56 1 10 "Average Difference" HA 23 0.360 0.083 0.358 18481
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18481
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18481
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18481
60 1 10 "Average Difference" HN 20 0.652 0.290 0.599 18481
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18481
62 1 11 "Average Difference" HA 23 0.359 0.176 0.320 18481
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18481
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18481
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18481
66 1 11 "Average Difference" HN 20 0.565 0.328 0.473 18481
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18481
68 1 12 "Average Difference" HA 23 0.268 0.067 0.266 18481
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18481
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18481
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18481
72 1 12 "Average Difference" HN 20 0.568 0.306 0.491 18481
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18481
74 1 13 "Average Difference" HA 23 0.332 0.082 0.328 18481
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18481
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18481
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18481
78 1 13 "Average Difference" HN 20 0.741 0.506 0.555 18481
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18481
80 1 14 "Average Difference" HA 23 0.256 0.114 0.234 18481
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18481
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18481
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18481
84 1 14 "Average Difference" HN 20 0.627 0.290 0.570 18481
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18481
86 1 15 "Average Difference" HA 23 0.336 0.140 0.312 18481
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18481
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18481
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18481
90 1 15 "Average Difference" HN 20 0.643 0.309 0.578 18481
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18481
92 1 16 "Average Difference" HA 23 0.315 0.034 0.320 18481
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18481
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18481
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18481
96 1 16 "Average Difference" HN 20 0.593 0.272 0.541 18481
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18481
98 1 17 "Average Difference" HA 23 0.369 0.223 0.300 18481
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18481
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18481
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18481
102 1 17 "Average Difference" HN 20 0.695 0.341 0.622 18481
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18481
104 1 18 "Average Difference" HA 23 0.283 0.110 0.267 18481
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18481
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18481
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18481
108 1 18 "Average Difference" HN 20 0.565 0.343 0.461 18481
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18481
110 1 19 "Average Difference" HA 23 0.373 0.075 0.373 18481
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18481
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18481
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18481
114 1 19 "Average Difference" HN 20 0.621 0.363 0.517 18481
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18481
116 1 20 "Average Difference" HA 23 0.295 0.106 0.281 18481
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18481
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18481
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18481
120 1 20 "Average Difference" HN 20 0.845 0.495 0.702 18481
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 18481
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 LEU HA H 2 4.343 4.343 3.974 0.369 18481
2 1 . 1 1 2 2 LEU H H 2 8.093 8.093 8.355 -0.262 18481
3 1 . 1 1 3 3 SER HA H 3 4.275 4.275 4.575 -0.300 18481
4 1 . 1 1 3 3 SER H H 3 7.783 7.783 8.209 -0.426 18481
5 1 . 1 1 4 4 GLN HA H 4 4.260 4.260 4.437 -0.177 18481
6 1 . 1 1 4 4 GLN H H 4 7.962 7.962 8.862 -0.900 18481
7 1 . 1 1 5 5 GLY H H 5 8.187 8.187 8.553 -0.366 18481
8 1 . 1 1 6 6 VAL HA H 6 4.134 4.134 4.269 -0.135 18481
9 1 . 1 1 6 6 VAL H H 6 7.789 7.789 8.314 -0.525 18481
10 1 . 1 1 7 7 GLU HA H 7 4.560 4.560 4.599 -0.039 18481
11 1 . 1 1 7 7 GLU H H 7 7.693 7.693 8.358 -0.665 18481
12 1 . 1 1 8 8 PRO HA H 8 4.334 4.334 4.674 -0.340 18481
13 1 . 1 1 9 9 ASP HA H 9 4.575 4.575 4.724 -0.149 18481
14 1 . 1 1 9 9 ASP H H 9 8.195 8.195 8.302 -0.107 18481
15 1 . 1 1 10 10 ILE HA H 10 4.126 4.126 4.105 0.021 18481
16 1 . 1 1 10 10 ILE H H 10 7.617 7.617 8.400 -0.783 18481
17 1 . 1 1 11 11 GLY H H 11 8.307 8.307 8.149 0.158 18481
18 1 . 1 1 12 12 GLN HA H 12 4.307 4.307 4.117 0.190 18481
19 1 . 1 1 12 12 GLN H H 12 7.945 7.945 8.343 -0.398 18481
20 1 . 1 1 13 13 THR HA H 13 4.169 4.169 4.111 0.058 18481
21 1 . 1 1 13 13 THR H H 13 7.745 7.745 7.802 -0.057 18481
22 1 . 1 1 14 14 TYR HA H 14 4.417 4.417 4.326 0.091 18481
23 1 . 1 1 14 14 TYR H H 14 7.739 7.739 7.414 0.325 18481
24 1 . 1 1 15 15 PHE HA H 15 4.517 4.517 4.877 -0.360 18481
25 1 . 1 1 15 15 PHE H H 15 8.178 8.178 8.533 -0.355 18481
26 1 . 1 1 16 16 GLU HA H 16 4.292 4.292 4.535 -0.243 18481
27 1 . 1 1 16 16 GLU H H 16 8.152 8.152 8.465 -0.313 18481
28 1 . 1 1 17 17 GLU HA H 17 4.318 4.318 4.409 -0.091 18481
29 1 . 1 1 17 17 GLU H H 17 8.002 8.002 8.467 -0.465 18481
30 1 . 1 1 18 18 SER HA H 18 4.329 4.329 4.448 -0.119 18481
31 1 . 1 1 18 18 SER H H 18 8.036 8.036 8.592 -0.556 18481
32 1 . 1 1 19 19 ARG HA H 19 4.335 4.335 4.400 -0.065 18481
33 1 . 1 1 19 19 ARG H H 19 8.133 8.133 8.457 -0.324 18481
34 1 . 1 1 20 20 ILE HA H 20 4.184 4.184 4.104 0.080 18481
35 1 . 1 1 20 20 ILE H H 20 7.823 7.823 8.195 -0.372 18481
36 1 . 1 1 21 21 ASN HA H 21 4.525 4.525 4.643 -0.118 18481
37 1 . 1 1 21 21 ASN H H 21 8.212 8.212 8.148 0.064 18481
38 1 . 1 1 22 22 GLN HA H 22 4.234 4.234 4.312 -0.078 18481
39 1 . 1 1 22 22 GLN H H 22 7.843 7.843 8.377 -0.534 18481
stop_
save_