data_25457
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25457
_Entry.PDB_ID 2MYM
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 25457
_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 SER HA H 2 4.330 4.330 4.485 -0.155 25457
2 1 1 . 1 1 2 2 SER H H 2 8.140 8.140 8.953 -0.813 25457
3 1 1 . 1 1 3 3 GLY H H 3 8.340 8.340 7.849 0.491 25457
4 1 1 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.522 -0.282 25457
5 1 1 . 1 1 4 4 LEU H H 4 7.880 7.880 8.354 -0.474 25457
6 1 1 . 1 1 5 5 SER HA H 5 4.280 4.280 4.305 -0.025 25457
7 1 1 . 1 1 5 5 SER H H 5 8.300 8.300 8.475 -0.175 25457
8 1 1 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457
9 1 1 . 1 1 6 6 PHE H H 6 8.250 8.250 8.126 0.124 25457
10 1 1 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.305 -0.025 25457
11 1 1 . 1 1 7 7 GLU H H 7 8.060 8.060 7.808 0.252 25457
12 1 1 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.349 -0.379 25457
13 1 1 . 1 1 11 11 ARG H H 11 7.880 7.880 7.774 0.106 25457
14 1 1 . 1 1 15 15 THR HA H 15 4.070 4.070 4.161 -0.091 25457
15 1 1 . 1 1 15 15 THR H H 15 7.870 7.870 8.407 -0.537 25457
16 1 1 . 1 1 16 16 MET HA H 16 4.220 4.220 4.384 -0.164 25457
17 1 1 . 1 1 16 16 MET H H 16 7.930 7.930 8.097 -0.167 25457
18 1 1 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457
19 1 1 . 1 1 17 17 VAL H H 17 7.700 7.700 7.946 -0.246 25457
20 1 1 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.164 -0.364 25457
21 1 1 . 1 1 18 18 LEU H H 18 7.810 7.810 7.618 0.192 25457
22 1 1 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.393 0.137 25457
23 1 1 . 1 1 19 19 HIS H H 19 8.000 8.000 7.796 0.204 25457
24 1 2 . 1 1 2 2 SER HA H 2 4.330 4.330 4.493 -0.163 25457
25 1 2 . 1 1 2 2 SER H H 2 8.140 8.140 9.134 -0.994 25457
26 1 2 . 1 1 3 3 GLY H H 3 8.340 8.340 8.677 -0.337 25457
27 1 2 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.061 0.179 25457
28 1 2 . 1 1 4 4 LEU H H 4 7.880 7.880 7.811 0.069 25457
29 1 2 . 1 1 5 5 SER HA H 5 4.280 4.280 4.159 0.121 25457
30 1 2 . 1 1 5 5 SER H H 5 8.300 8.300 8.476 -0.176 25457
31 1 2 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.582 0.008 25457
32 1 2 . 1 1 6 6 PHE H H 6 8.250 8.250 7.855 0.395 25457
33 1 2 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.040 0.240 25457
34 1 2 . 1 1 7 7 GLU H H 7 8.060 8.060 6.679 1.381 25457
35 1 2 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.436 -0.466 25457
36 1 2 . 1 1 11 11 ARG H H 11 7.880 7.880 7.733 0.147 25457
37 1 2 . 1 1 15 15 THR HA H 15 4.070 4.070 4.167 -0.097 25457
38 1 2 . 1 1 15 15 THR H H 15 7.870 7.870 8.442 -0.572 25457
39 1 2 . 1 1 16 16 MET HA H 16 4.220 4.220 4.422 -0.202 25457
40 1 2 . 1 1 16 16 MET H H 16 7.930 7.930 8.174 -0.244 25457
41 1 2 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.810 0.010 25457
42 1 2 . 1 1 17 17 VAL H H 17 7.700 7.700 7.979 -0.279 25457
43 1 2 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.158 -0.358 25457
44 1 2 . 1 1 18 18 LEU H H 18 7.810 7.810 7.629 0.181 25457
45 1 2 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.383 0.147 25457
46 1 2 . 1 1 19 19 HIS H H 19 8.000 8.000 7.795 0.205 25457
47 1 3 . 1 1 2 2 SER HA H 2 4.330 4.330 4.527 -0.197 25457
48 1 3 . 1 1 2 2 SER H H 2 8.140 8.140 8.622 -0.482 25457
49 1 3 . 1 1 3 3 GLY H H 3 8.340 8.340 8.470 -0.130 25457
50 1 3 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.497 -0.257 25457
51 1 3 . 1 1 4 4 LEU H H 4 7.880 7.880 7.745 0.135 25457
52 1 3 . 1 1 5 5 SER HA H 5 4.280 4.280 4.430 -0.150 25457
53 1 3 . 1 1 5 5 SER H H 5 8.300 8.300 8.617 -0.317 25457
54 1 3 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.471 0.119 25457
55 1 3 . 1 1 6 6 PHE H H 6 8.250 8.250 8.112 0.138 25457
56 1 3 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.353 -0.072 25457
57 1 3 . 1 1 7 7 GLU H H 7 8.060 8.060 8.598 -0.538 25457
58 1 3 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.384 -0.414 25457
59 1 3 . 1 1 11 11 ARG H H 11 7.880 7.880 7.659 0.221 25457
60 1 3 . 1 1 15 15 THR HA H 15 4.070 4.070 4.195 -0.125 25457
61 1 3 . 1 1 15 15 THR H H 15 7.870 7.870 8.457 -0.587 25457
62 1 3 . 1 1 16 16 MET HA H 16 4.220 4.220 4.399 -0.179 25457
63 1 3 . 1 1 16 16 MET H H 16 7.930 7.930 8.166 -0.236 25457
64 1 3 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.789 0.031 25457
65 1 3 . 1 1 17 17 VAL H H 17 7.700 7.700 8.002 -0.302 25457
66 1 3 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.149 -0.349 25457
67 1 3 . 1 1 18 18 LEU H H 18 7.810 7.810 7.651 0.160 25457
68 1 3 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.382 0.148 25457
69 1 3 . 1 1 19 19 HIS H H 19 8.000 8.000 7.788 0.212 25457
70 1 4 . 1 1 2 2 SER HA H 2 4.330 4.330 4.913 -0.583 25457
71 1 4 . 1 1 2 2 SER H H 2 8.140 8.140 8.640 -0.500 25457
72 1 4 . 1 1 3 3 GLY H H 3 8.340 8.340 8.291 0.049 25457
73 1 4 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.492 -0.252 25457
74 1 4 . 1 1 4 4 LEU H H 4 7.880 7.880 7.854 0.026 25457
75 1 4 . 1 1 5 5 SER HA H 5 4.280 4.280 4.280 -0.000 25457
76 1 4 . 1 1 5 5 SER H H 5 8.300 8.300 8.293 0.007 25457
77 1 4 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.420 0.170 25457
78 1 4 . 1 1 6 6 PHE H H 6 8.250 8.250 8.255 -0.005 25457
79 1 4 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.303 -0.023 25457
80 1 4 . 1 1 7 7 GLU H H 7 8.060 8.060 7.909 0.151 25457
81 1 4 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.383 -0.413 25457
82 1 4 . 1 1 11 11 ARG H H 11 7.880 7.880 7.687 0.193 25457
83 1 4 . 1 1 15 15 THR HA H 15 4.070 4.070 4.291 -0.221 25457
84 1 4 . 1 1 15 15 THR H H 15 7.870 7.870 8.351 -0.481 25457
85 1 4 . 1 1 16 16 MET HA H 16 4.220 4.220 4.423 -0.203 25457
86 1 4 . 1 1 16 16 MET H H 16 7.930 7.930 8.282 -0.352 25457
87 1 4 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.740 0.080 25457
88 1 4 . 1 1 17 17 VAL H H 17 7.700 7.700 8.141 -0.441 25457
89 1 4 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.122 -0.322 25457
90 1 4 . 1 1 18 18 LEU H H 18 7.810 7.810 7.578 0.232 25457
91 1 4 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.379 0.151 25457
92 1 4 . 1 1 19 19 HIS H H 19 8.000 8.000 7.784 0.216 25457
93 1 5 . 1 1 2 2 SER HA H 2 4.330 4.330 4.472 -0.142 25457
94 1 5 . 1 1 2 2 SER H H 2 8.140 8.140 8.495 -0.355 25457
95 1 5 . 1 1 3 3 GLY H H 3 8.340 8.340 7.700 0.640 25457
96 1 5 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.018 0.222 25457
97 1 5 . 1 1 4 4 LEU H H 4 7.880 7.880 8.394 -0.514 25457
98 1 5 . 1 1 5 5 SER HA H 5 4.280 4.280 4.221 0.059 25457
99 1 5 . 1 1 5 5 SER H H 5 8.300 8.300 8.370 -0.070 25457
100 1 5 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457
101 1 5 . 1 1 6 6 PHE H H 6 8.250 8.250 7.706 0.544 25457
102 1 5 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.273 0.007 25457
103 1 5 . 1 1 7 7 GLU H H 7 8.060 8.060 7.818 0.242 25457
104 1 5 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.394 -0.424 25457
105 1 5 . 1 1 11 11 ARG H H 11 7.880 7.880 7.703 0.177 25457
106 1 5 . 1 1 15 15 THR HA H 15 4.070 4.070 4.264 -0.194 25457
107 1 5 . 1 1 15 15 THR H H 15 7.870 7.870 8.226 -0.356 25457
108 1 5 . 1 1 16 16 MET HA H 16 4.220 4.220 4.375 -0.155 25457
109 1 5 . 1 1 16 16 MET H H 16 7.930 7.930 8.142 -0.212 25457
110 1 5 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457
111 1 5 . 1 1 17 17 VAL H H 17 7.700 7.700 8.190 -0.490 25457
112 1 5 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.129 -0.329 25457
113 1 5 . 1 1 18 18 LEU H H 18 7.810 7.810 7.541 0.269 25457
114 1 5 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.371 0.159 25457
115 1 5 . 1 1 19 19 HIS H H 19 8.000 8.000 7.774 0.226 25457
116 1 6 . 1 1 2 2 SER HA H 2 4.330 4.330 4.597 -0.267 25457
117 1 6 . 1 1 2 2 SER H H 2 8.140 8.140 8.181 -0.041 25457
118 1 6 . 1 1 3 3 GLY H H 3 8.340 8.340 7.762 0.578 25457
119 1 6 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.929 0.311 25457
120 1 6 . 1 1 4 4 LEU H H 4 7.880 7.880 8.681 -0.801 25457
121 1 6 . 1 1 5 5 SER HA H 5 4.280 4.280 4.161 0.119 25457
122 1 6 . 1 1 5 5 SER H H 5 8.300 8.300 8.345 -0.045 25457
123 1 6 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.403 0.187 25457
124 1 6 . 1 1 6 6 PHE H H 6 8.250 8.250 7.454 0.796 25457
125 1 6 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.307 -0.027 25457
126 1 6 . 1 1 7 7 GLU H H 7 8.060 8.060 7.929 0.131 25457
127 1 6 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.472 -0.502 25457
128 1 6 . 1 1 11 11 ARG H H 11 7.880 7.880 7.757 0.123 25457
129 1 6 . 1 1 15 15 THR HA H 15 4.070 4.070 4.293 -0.223 25457
130 1 6 . 1 1 15 15 THR H H 15 7.870 7.870 8.356 -0.486 25457
131 1 6 . 1 1 16 16 MET HA H 16 4.220 4.220 4.402 -0.182 25457
132 1 6 . 1 1 16 16 MET H H 16 7.930 7.930 8.228 -0.298 25457
133 1 6 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.807 0.013 25457
134 1 6 . 1 1 17 17 VAL H H 17 7.700 7.700 8.194 -0.494 25457
135 1 6 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.135 -0.335 25457
136 1 6 . 1 1 18 18 LEU H H 18 7.810 7.810 7.554 0.256 25457
137 1 6 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457
138 1 6 . 1 1 19 19 HIS H H 19 8.000 8.000 7.783 0.217 25457
139 1 7 . 1 1 2 2 SER HA H 2 4.330 4.330 4.546 -0.216 25457
140 1 7 . 1 1 2 2 SER H H 2 8.140 8.140 8.575 -0.435 25457
141 1 7 . 1 1 3 3 GLY H H 3 8.340 8.340 7.956 0.384 25457
142 1 7 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.525 0.715 25457
143 1 7 . 1 1 4 4 LEU H H 4 7.880 7.880 8.414 -0.534 25457
144 1 7 . 1 1 5 5 SER HA H 5 4.280 4.280 4.255 0.025 25457
145 1 7 . 1 1 5 5 SER H H 5 8.300 8.300 8.332 -0.032 25457
146 1 7 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.645 -0.055 25457
147 1 7 . 1 1 6 6 PHE H H 6 8.250 8.250 7.635 0.615 25457
148 1 7 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.300 -0.020 25457
149 1 7 . 1 1 7 7 GLU H H 7 8.060 8.060 7.905 0.155 25457
150 1 7 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.402 -0.432 25457
151 1 7 . 1 1 11 11 ARG H H 11 7.880 7.880 7.810 0.070 25457
152 1 7 . 1 1 15 15 THR HA H 15 4.070 4.070 4.324 -0.254 25457
153 1 7 . 1 1 15 15 THR H H 15 7.870 7.870 8.296 -0.426 25457
154 1 7 . 1 1 16 16 MET HA H 16 4.220 4.220 4.432 -0.212 25457
155 1 7 . 1 1 16 16 MET H H 16 7.930 7.930 8.207 -0.277 25457
156 1 7 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.768 0.052 25457
157 1 7 . 1 1 17 17 VAL H H 17 7.700 7.700 8.144 -0.444 25457
158 1 7 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.118 -0.318 25457
159 1 7 . 1 1 18 18 LEU H H 18 7.810 7.810 7.559 0.251 25457
160 1 7 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.380 0.150 25457
161 1 7 . 1 1 19 19 HIS H H 19 8.000 8.000 7.783 0.217 25457
162 1 8 . 1 1 2 2 SER HA H 2 4.330 4.330 4.791 -0.461 25457
163 1 8 . 1 1 2 2 SER H H 2 8.140 8.140 8.878 -0.738 25457
164 1 8 . 1 1 3 3 GLY H H 3 8.340 8.340 7.888 0.452 25457
165 1 8 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.452 0.788 25457
166 1 8 . 1 1 4 4 LEU H H 4 7.880 7.880 7.885 -0.005 25457
167 1 8 . 1 1 5 5 SER HA H 5 4.280 4.280 4.316 -0.036 25457
168 1 8 . 1 1 5 5 SER H H 5 8.300 8.300 7.875 0.425 25457
169 1 8 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.578 0.012 25457
170 1 8 . 1 1 6 6 PHE H H 6 8.250 8.250 7.523 0.727 25457
171 1 8 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.302 -0.022 25457
172 1 8 . 1 1 7 7 GLU H H 7 8.060 8.060 7.911 0.149 25457
173 1 8 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.382 -0.412 25457
174 1 8 . 1 1 11 11 ARG H H 11 7.880 7.880 7.781 0.099 25457
175 1 8 . 1 1 15 15 THR HA H 15 4.070 4.070 4.289 -0.219 25457
176 1 8 . 1 1 15 15 THR H H 15 7.870 7.870 8.345 -0.475 25457
177 1 8 . 1 1 16 16 MET HA H 16 4.220 4.220 4.419 -0.199 25457
178 1 8 . 1 1 16 16 MET H H 16 7.930 7.930 8.285 -0.355 25457
179 1 8 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.786 0.034 25457
180 1 8 . 1 1 17 17 VAL H H 17 7.700 7.700 8.017 -0.317 25457
181 1 8 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.118 -0.318 25457
182 1 8 . 1 1 18 18 LEU H H 18 7.810 7.810 7.355 0.455 25457
183 1 8 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.382 0.148 25457
184 1 8 . 1 1 19 19 HIS H H 19 8.000 8.000 7.786 0.214 25457
185 1 9 . 1 1 2 2 SER HA H 2 4.330 4.330 4.592 -0.262 25457
186 1 9 . 1 1 2 2 SER H H 2 8.140 8.140 8.320 -0.180 25457
187 1 9 . 1 1 3 3 GLY H H 3 8.340 8.340 7.697 0.643 25457
188 1 9 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.373 0.867 25457
189 1 9 . 1 1 4 4 LEU H H 4 7.880 7.880 8.350 -0.470 25457
190 1 9 . 1 1 5 5 SER HA H 5 4.280 4.280 4.347 -0.067 25457
191 1 9 . 1 1 5 5 SER H H 5 8.300 8.300 8.058 0.242 25457
192 1 9 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.684 -0.094 25457
193 1 9 . 1 1 6 6 PHE H H 6 8.250 8.250 7.638 0.612 25457
194 1 9 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.260 0.020 25457
195 1 9 . 1 1 7 7 GLU H H 7 8.060 8.060 7.695 0.365 25457
196 1 9 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.488 -0.518 25457
197 1 9 . 1 1 11 11 ARG H H 11 7.880 7.880 7.725 0.155 25457
198 1 9 . 1 1 15 15 THR HA H 15 4.070 4.070 4.300 -0.230 25457
199 1 9 . 1 1 15 15 THR H H 15 7.870 7.870 8.362 -0.492 25457
200 1 9 . 1 1 16 16 MET HA H 16 4.220 4.220 4.390 -0.170 25457
201 1 9 . 1 1 16 16 MET H H 16 7.930 7.930 8.237 -0.307 25457
202 1 9 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.787 0.033 25457
203 1 9 . 1 1 17 17 VAL H H 17 7.700 7.700 8.223 -0.523 25457
204 1 9 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.143 -0.343 25457
205 1 9 . 1 1 18 18 LEU H H 18 7.810 7.810 7.676 0.134 25457
206 1 9 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.383 0.147 25457
207 1 9 . 1 1 19 19 HIS H H 19 8.000 8.000 7.797 0.203 25457
208 1 10 . 1 1 2 2 SER HA H 2 4.330 4.330 4.284 0.046 25457
209 1 10 . 1 1 2 2 SER H H 2 8.140 8.140 8.269 -0.129 25457
210 1 10 . 1 1 3 3 GLY H H 3 8.340 8.340 8.133 0.207 25457
211 1 10 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.496 -0.256 25457
212 1 10 . 1 1 4 4 LEU H H 4 7.880 7.880 7.906 -0.026 25457
213 1 10 . 1 1 5 5 SER HA H 5 4.280 4.280 4.301 -0.021 25457
214 1 10 . 1 1 5 5 SER H H 5 8.300 8.300 8.319 -0.019 25457
215 1 10 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457
216 1 10 . 1 1 6 6 PHE H H 6 8.250 8.250 8.226 0.024 25457
217 1 10 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.275 0.005 25457
218 1 10 . 1 1 7 7 GLU H H 7 8.060 8.060 7.787 0.273 25457
219 1 10 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.445 -0.475 25457
220 1 10 . 1 1 11 11 ARG H H 11 7.880 7.880 7.744 0.136 25457
221 1 10 . 1 1 15 15 THR HA H 15 4.070 4.070 4.304 -0.234 25457
222 1 10 . 1 1 15 15 THR H H 15 7.870 7.870 8.345 -0.475 25457
223 1 10 . 1 1 16 16 MET HA H 16 4.220 4.220 4.384 -0.164 25457
224 1 10 . 1 1 16 16 MET H H 16 7.930 7.930 8.216 -0.286 25457
225 1 10 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.826 -0.006 25457
226 1 10 . 1 1 17 17 VAL H H 17 7.700 7.700 7.954 -0.254 25457
227 1 10 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.162 -0.362 25457
228 1 10 . 1 1 18 18 LEU H H 18 7.810 7.810 7.473 0.337 25457
229 1 10 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457
230 1 10 . 1 1 19 19 HIS H H 19 8.000 8.000 7.782 0.218 25457
231 1 11 . 1 1 2 2 SER HA H 2 4.330 4.330 4.889 -0.559 25457
232 1 11 . 1 1 2 2 SER H H 2 8.140 8.140 8.494 -0.354 25457
233 1 11 . 1 1 3 3 GLY H H 3 8.340 8.340 8.250 0.090 25457
234 1 11 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.633 -0.393 25457
235 1 11 . 1 1 4 4 LEU H H 4 7.880 7.880 8.225 -0.345 25457
236 1 11 . 1 1 5 5 SER HA H 5 4.280 4.280 4.536 -0.256 25457
237 1 11 . 1 1 5 5 SER H H 5 8.300 8.300 8.383 -0.083 25457
238 1 11 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.498 0.092 25457
239 1 11 . 1 1 6 6 PHE H H 6 8.250 8.250 8.170 0.080 25457
240 1 11 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.332 -0.052 25457
241 1 11 . 1 1 7 7 GLU H H 7 8.060 8.060 8.648 -0.588 25457
242 1 11 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.516 -0.546 25457
243 1 11 . 1 1 11 11 ARG H H 11 7.880 7.880 7.827 0.053 25457
244 1 11 . 1 1 15 15 THR HA H 15 4.070 4.070 4.282 -0.212 25457
245 1 11 . 1 1 15 15 THR H H 15 7.870 7.870 8.328 -0.458 25457
246 1 11 . 1 1 16 16 MET HA H 16 4.220 4.220 4.399 -0.179 25457
247 1 11 . 1 1 16 16 MET H H 16 7.930 7.930 8.229 -0.299 25457
248 1 11 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.740 0.080 25457
249 1 11 . 1 1 17 17 VAL H H 17 7.700 7.700 8.126 -0.426 25457
250 1 11 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.109 -0.309 25457
251 1 11 . 1 1 18 18 LEU H H 18 7.810 7.810 7.553 0.257 25457
252 1 11 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457
253 1 11 . 1 1 19 19 HIS H H 19 8.000 8.000 7.775 0.225 25457
254 1 12 . 1 1 2 2 SER HA H 2 4.330 4.330 4.966 -0.636 25457
255 1 12 . 1 1 2 2 SER H H 2 8.140 8.140 8.891 -0.751 25457
256 1 12 . 1 1 3 3 GLY H H 3 8.340 8.340 7.837 0.503 25457
257 1 12 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.039 0.201 25457
258 1 12 . 1 1 4 4 LEU H H 4 7.880 7.880 8.264 -0.384 25457
259 1 12 . 1 1 5 5 SER HA H 5 4.280 4.280 4.580 -0.300 25457
260 1 12 . 1 1 5 5 SER H H 5 8.300 8.300 8.271 0.029 25457
261 1 12 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.568 0.022 25457
262 1 12 . 1 1 6 6 PHE H H 6 8.250 8.250 8.145 0.105 25457
263 1 12 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.355 -0.075 25457
264 1 12 . 1 1 7 7 GLU H H 7 8.060 8.060 8.748 -0.688 25457
265 1 12 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.353 -0.383 25457
266 1 12 . 1 1 11 11 ARG H H 11 7.880 7.880 7.604 0.276 25457
267 1 12 . 1 1 15 15 THR HA H 15 4.070 4.070 4.300 -0.230 25457
268 1 12 . 1 1 15 15 THR H H 15 7.870 7.870 8.266 -0.396 25457
269 1 12 . 1 1 16 16 MET HA H 16 4.220 4.220 4.437 -0.217 25457
270 1 12 . 1 1 16 16 MET H H 16 7.930 7.930 8.279 -0.349 25457
271 1 12 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.777 0.043 25457
272 1 12 . 1 1 17 17 VAL H H 17 7.700 7.700 8.017 -0.317 25457
273 1 12 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.145 -0.345 25457
274 1 12 . 1 1 18 18 LEU H H 18 7.810 7.810 7.464 0.346 25457
275 1 12 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.381 0.149 25457
276 1 12 . 1 1 19 19 HIS H H 19 8.000 8.000 7.794 0.206 25457
277 1 13 . 1 1 2 2 SER HA H 2 4.330 4.330 4.478 -0.148 25457
278 1 13 . 1 1 2 2 SER H H 2 8.140 8.140 8.498 -0.358 25457
279 1 13 . 1 1 3 3 GLY H H 3 8.340 8.340 7.794 0.546 25457
280 1 13 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.289 0.951 25457
281 1 13 . 1 1 4 4 LEU H H 4 7.880 7.880 8.273 -0.393 25457
282 1 13 . 1 1 5 5 SER HA H 5 4.280 4.280 4.232 0.048 25457
283 1 13 . 1 1 5 5 SER H H 5 8.300 8.300 7.802 0.498 25457
284 1 13 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.734 -0.144 25457
285 1 13 . 1 1 6 6 PHE H H 6 8.250 8.250 7.323 0.927 25457
286 1 13 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.257 0.023 25457
287 1 13 . 1 1 7 7 GLU H H 7 8.060 8.060 7.883 0.177 25457
288 1 13 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.447 -0.477 25457
289 1 13 . 1 1 11 11 ARG H H 11 7.880 7.880 7.740 0.140 25457
290 1 13 . 1 1 15 15 THR HA H 15 4.070 4.070 4.309 -0.239 25457
291 1 13 . 1 1 15 15 THR H H 15 7.870 7.870 8.283 -0.413 25457
292 1 13 . 1 1 16 16 MET HA H 16 4.220 4.220 4.469 -0.249 25457
293 1 13 . 1 1 16 16 MET H H 16 7.930 7.930 8.287 -0.357 25457
294 1 13 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.811 0.009 25457
295 1 13 . 1 1 17 17 VAL H H 17 7.700 7.700 8.098 -0.398 25457
296 1 13 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.103 -0.303 25457
297 1 13 . 1 1 18 18 LEU H H 18 7.810 7.810 7.321 0.489 25457
298 1 13 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.353 0.177 25457
299 1 13 . 1 1 19 19 HIS H H 19 8.000 8.000 7.805 0.195 25457
300 1 14 . 1 1 2 2 SER HA H 2 4.330 4.330 4.860 -0.530 25457
301 1 14 . 1 1 2 2 SER H H 2 8.140 8.140 8.797 -0.657 25457
302 1 14 . 1 1 3 3 GLY H H 3 8.340 8.340 7.798 0.542 25457
303 1 14 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.080 0.160 25457
304 1 14 . 1 1 4 4 LEU H H 4 7.880 7.880 8.254 -0.374 25457
305 1 14 . 1 1 5 5 SER HA H 5 4.280 4.280 4.449 -0.169 25457
306 1 14 . 1 1 5 5 SER H H 5 8.300 8.300 8.151 0.149 25457
307 1 14 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.453 0.137 25457
308 1 14 . 1 1 6 6 PHE H H 6 8.250 8.250 8.148 0.102 25457
309 1 14 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.249 0.031 25457
310 1 14 . 1 1 7 7 GLU H H 7 8.060 8.060 8.586 -0.526 25457
311 1 14 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.313 -0.343 25457
312 1 14 . 1 1 11 11 ARG H H 11 7.880 7.880 7.871 0.009 25457
313 1 14 . 1 1 15 15 THR HA H 15 4.070 4.070 4.158 -0.088 25457
314 1 14 . 1 1 15 15 THR H H 15 7.870 7.870 8.506 -0.636 25457
315 1 14 . 1 1 16 16 MET HA H 16 4.220 4.220 4.331 -0.111 25457
316 1 14 . 1 1 16 16 MET H H 16 7.930 7.930 8.048 -0.118 25457
317 1 14 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457
318 1 14 . 1 1 17 17 VAL H H 17 7.700 7.700 8.003 -0.303 25457
319 1 14 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.201 -0.401 25457
320 1 14 . 1 1 18 18 LEU H H 18 7.810 7.810 7.700 0.110 25457
321 1 14 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.419 0.111 25457
322 1 14 . 1 1 19 19 HIS H H 19 8.000 8.000 7.826 0.174 25457
323 1 15 . 1 1 2 2 SER HA H 2 4.330 4.330 4.532 -0.202 25457
324 1 15 . 1 1 2 2 SER H H 2 8.140 8.140 8.459 -0.319 25457
325 1 15 . 1 1 3 3 GLY H H 3 8.340 8.340 7.987 0.353 25457
326 1 15 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.080 0.160 25457
327 1 15 . 1 1 4 4 LEU H H 4 7.880 7.880 8.171 -0.291 25457
328 1 15 . 1 1 5 5 SER HA H 5 4.280 4.280 4.418 -0.138 25457
329 1 15 . 1 1 5 5 SER H H 5 8.300 8.300 8.074 0.226 25457
330 1 15 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.466 0.124 25457
331 1 15 . 1 1 6 6 PHE H H 6 8.250 8.250 8.041 0.209 25457
332 1 15 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.266 0.014 25457
333 1 15 . 1 1 7 7 GLU H H 7 8.060 8.060 8.448 -0.388 25457
334 1 15 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.409 -0.439 25457
335 1 15 . 1 1 11 11 ARG H H 11 7.880 7.880 7.721 0.159 25457
336 1 15 . 1 1 15 15 THR HA H 15 4.070 4.070 4.169 -0.099 25457
337 1 15 . 1 1 15 15 THR H H 15 7.870 7.870 8.420 -0.550 25457
338 1 15 . 1 1 16 16 MET HA H 16 4.220 4.220 4.443 -0.223 25457
339 1 15 . 1 1 16 16 MET H H 16 7.930 7.930 8.268 -0.338 25457
340 1 15 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.789 0.031 25457
341 1 15 . 1 1 17 17 VAL H H 17 7.700 7.700 7.967 -0.267 25457
342 1 15 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.145 -0.345 25457
343 1 15 . 1 1 18 18 LEU H H 18 7.810 7.810 7.644 0.166 25457
344 1 15 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.384 0.146 25457
345 1 15 . 1 1 19 19 HIS H H 19 8.000 8.000 7.797 0.203 25457
346 1 16 . 1 1 2 2 SER HA H 2 4.330 4.330 4.610 -0.280 25457
347 1 16 . 1 1 2 2 SER H H 2 8.140 8.140 8.781 -0.641 25457
348 1 16 . 1 1 3 3 GLY H H 3 8.340 8.340 8.034 0.306 25457
349 1 16 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.992 0.248 25457
350 1 16 . 1 1 4 4 LEU H H 4 7.880 7.880 8.439 -0.559 25457
351 1 16 . 1 1 5 5 SER HA H 5 4.280 4.280 4.699 -0.419 25457
352 1 16 . 1 1 5 5 SER H H 5 8.300 8.300 8.490 -0.190 25457
353 1 16 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.557 0.033 25457
354 1 16 . 1 1 6 6 PHE H H 6 8.250 8.250 8.181 0.069 25457
355 1 16 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.326 -0.046 25457
356 1 16 . 1 1 7 7 GLU H H 7 8.060 8.060 8.546 -0.486 25457
357 1 16 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.391 -0.421 25457
358 1 16 . 1 1 11 11 ARG H H 11 7.880 7.880 7.904 -0.024 25457
359 1 16 . 1 1 15 15 THR HA H 15 4.070 4.070 4.090 -0.020 25457
360 1 16 . 1 1 15 15 THR H H 15 7.870 7.870 8.455 -0.585 25457
361 1 16 . 1 1 16 16 MET HA H 16 4.220 4.220 4.304 -0.084 25457
362 1 16 . 1 1 16 16 MET H H 16 7.930 7.930 8.014 -0.084 25457
363 1 16 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.806 0.014 25457
364 1 16 . 1 1 17 17 VAL H H 17 7.700 7.700 7.967 -0.267 25457
365 1 16 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.170 -0.370 25457
366 1 16 . 1 1 18 18 LEU H H 18 7.810 7.810 7.633 0.177 25457
367 1 16 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.404 0.126 25457
368 1 16 . 1 1 19 19 HIS H H 19 8.000 8.000 7.807 0.193 25457
369 1 17 . 1 1 2 2 SER HA H 2 4.330 4.330 4.987 -0.657 25457
370 1 17 . 1 1 2 2 SER H H 2 8.140 8.140 8.907 -0.767 25457
371 1 17 . 1 1 3 3 GLY H H 3 8.340 8.340 7.820 0.520 25457
372 1 17 . 1 1 4 4 LEU HA H 4 4.240 4.240 5.101 -0.861 25457
373 1 17 . 1 1 4 4 LEU H H 4 7.880 7.880 8.243 -0.363 25457
374 1 17 . 1 1 5 5 SER HA H 5 4.280 4.280 4.246 0.034 25457
375 1 17 . 1 1 5 5 SER H H 5 8.300 8.300 8.542 -0.242 25457
376 1 17 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.696 -0.106 25457
377 1 17 . 1 1 6 6 PHE H H 6 8.250 8.250 7.880 0.370 25457
378 1 17 . 1 1 7 7 GLU HA H 7 4.280 4.280 3.747 0.533 25457
379 1 17 . 1 1 7 7 GLU H H 7 8.060 8.060 7.501 0.559 25457
380 1 17 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.257 -0.287 25457
381 1 17 . 1 1 11 11 ARG H H 11 7.880 7.880 7.662 0.218 25457
382 1 17 . 1 1 15 15 THR HA H 15 4.070 4.070 4.173 -0.103 25457
383 1 17 . 1 1 15 15 THR H H 15 7.870 7.870 8.475 -0.605 25457
384 1 17 . 1 1 16 16 MET HA H 16 4.220 4.220 4.423 -0.203 25457
385 1 17 . 1 1 16 16 MET H H 16 7.930 7.930 8.166 -0.236 25457
386 1 17 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.816 0.004 25457
387 1 17 . 1 1 17 17 VAL H H 17 7.700 7.700 7.937 -0.237 25457
388 1 17 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.164 -0.364 25457
389 1 17 . 1 1 18 18 LEU H H 18 7.810 7.810 7.644 0.166 25457
390 1 17 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.386 0.144 25457
391 1 17 . 1 1 19 19 HIS H H 19 8.000 8.000 7.793 0.207 25457
392 1 18 . 1 1 2 2 SER HA H 2 4.330 4.330 4.642 -0.312 25457
393 1 18 . 1 1 2 2 SER H H 2 8.140 8.140 8.204 -0.064 25457
394 1 18 . 1 1 3 3 GLY H H 3 8.340 8.340 8.295 0.045 25457
395 1 18 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.538 -0.298 25457
396 1 18 . 1 1 4 4 LEU H H 4 7.880 7.880 7.620 0.260 25457
397 1 18 . 1 1 5 5 SER HA H 5 4.280 4.280 4.261 0.019 25457
398 1 18 . 1 1 5 5 SER H H 5 8.300 8.300 8.364 -0.064 25457
399 1 18 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.450 0.140 25457
400 1 18 . 1 1 6 6 PHE H H 6 8.250 8.250 8.016 0.234 25457
401 1 18 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.219 0.061 25457
402 1 18 . 1 1 7 7 GLU H H 7 8.060 8.060 8.409 -0.349 25457
403 1 18 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.485 -0.515 25457
404 1 18 . 1 1 11 11 ARG H H 11 7.880 7.880 7.795 0.085 25457
405 1 18 . 1 1 15 15 THR HA H 15 4.070 4.070 4.166 -0.096 25457
406 1 18 . 1 1 15 15 THR H H 15 7.870 7.870 8.386 -0.516 25457
407 1 18 . 1 1 16 16 MET HA H 16 4.220 4.220 4.401 -0.181 25457
408 1 18 . 1 1 16 16 MET H H 16 7.930 7.930 8.100 -0.170 25457
409 1 18 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.804 0.016 25457
410 1 18 . 1 1 17 17 VAL H H 17 7.700 7.700 7.935 -0.235 25457
411 1 18 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.172 -0.372 25457
412 1 18 . 1 1 18 18 LEU H H 18 7.810 7.810 7.643 0.167 25457
413 1 18 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.393 0.137 25457
414 1 18 . 1 1 19 19 HIS H H 19 8.000 8.000 7.800 0.200 25457
415 1 19 . 1 1 2 2 SER HA H 2 4.330 4.330 4.527 -0.197 25457
416 1 19 . 1 1 2 2 SER H H 2 8.140 8.140 8.192 -0.052 25457
417 1 19 . 1 1 3 3 GLY H H 3 8.340 8.340 8.564 -0.224 25457
418 1 19 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.704 -0.464 25457
419 1 19 . 1 1 4 4 LEU H H 4 7.880 7.880 8.094 -0.214 25457
420 1 19 . 1 1 5 5 SER HA H 5 4.280 4.280 4.434 -0.154 25457
421 1 19 . 1 1 5 5 SER H H 5 8.300 8.300 8.175 0.125 25457
422 1 19 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.467 0.123 25457
423 1 19 . 1 1 6 6 PHE H H 6 8.250 8.250 8.206 0.045 25457
424 1 19 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.393 -0.113 25457
425 1 19 . 1 1 7 7 GLU H H 7 8.060 8.060 8.710 -0.650 25457
426 1 19 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.381 -0.411 25457
427 1 19 . 1 1 11 11 ARG H H 11 7.880 7.880 7.853 0.027 25457
428 1 19 . 1 1 15 15 THR HA H 15 4.070 4.070 4.181 -0.111 25457
429 1 19 . 1 1 15 15 THR H H 15 7.870 7.870 8.444 -0.574 25457
430 1 19 . 1 1 16 16 MET HA H 16 4.220 4.220 4.403 -0.183 25457
431 1 19 . 1 1 16 16 MET H H 16 7.930 7.930 8.209 -0.279 25457
432 1 19 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.742 0.078 25457
433 1 19 . 1 1 17 17 VAL H H 17 7.700 7.700 7.895 -0.195 25457
434 1 19 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.190 -0.390 25457
435 1 19 . 1 1 18 18 LEU H H 18 7.810 7.810 7.658 0.152 25457
436 1 19 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.404 0.126 25457
437 1 19 . 1 1 19 19 HIS H H 19 8.000 8.000 7.817 0.183 25457
438 1 20 . 1 1 2 2 SER HA H 2 4.330 4.330 4.790 -0.460 25457
439 1 20 . 1 1 2 2 SER H H 2 8.140 8.140 8.603 -0.463 25457
440 1 20 . 1 1 3 3 GLY H H 3 8.340 8.340 7.826 0.514 25457
441 1 20 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.361 0.879 25457
442 1 20 . 1 1 4 4 LEU H H 4 7.880 7.880 8.050 -0.170 25457
443 1 20 . 1 1 5 5 SER HA H 5 4.280 4.280 4.488 -0.208 25457
444 1 20 . 1 1 5 5 SER H H 5 8.300 8.300 7.869 0.431 25457
445 1 20 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.777 -0.187 25457
446 1 20 . 1 1 6 6 PHE H H 6 8.250 8.250 7.375 0.875 25457
447 1 20 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.330 -0.050 25457
448 1 20 . 1 1 7 7 GLU H H 7 8.060 8.060 7.933 0.127 25457
449 1 20 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.369 -0.399 25457
450 1 20 . 1 1 11 11 ARG H H 11 7.880 7.880 7.706 0.174 25457
451 1 20 . 1 1 15 15 THR HA H 15 4.070 4.070 4.286 -0.216 25457
452 1 20 . 1 1 15 15 THR H H 15 7.870 7.870 8.346 -0.476 25457
453 1 20 . 1 1 16 16 MET HA H 16 4.220 4.220 4.427 -0.207 25457
454 1 20 . 1 1 16 16 MET H H 16 7.930 7.930 8.285 -0.355 25457
455 1 20 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.745 0.075 25457
456 1 20 . 1 1 17 17 VAL H H 17 7.700 7.700 8.141 -0.441 25457
457 1 20 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.133 -0.333 25457
458 1 20 . 1 1 18 18 LEU H H 18 7.810 7.810 7.650 0.160 25457
459 1 20 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.381 0.149 25457
460 1 20 . 1 1 19 19 HIS H H 19 8.000 8.000 7.800 0.200 25457
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 25457
2 1 1 "Average Difference" HA 13 0.197 0.086 0.184 25457
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25457
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25457
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25457
6 1 1 "Average Difference" HN 12 0.377 0.087 0.383 25457
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25457
8 1 2 "Average Difference" HA 13 0.214 0.056 0.215 25457
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25457
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25457
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25457
12 1 2 "Average Difference" HN 12 0.560 0.019 0.584 25457
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25457
14 1 3 "Average Difference" HA 13 0.217 0.139 0.173 25457
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25457
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25457
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25457
18 1 3 "Average Difference" HN 12 0.327 0.144 0.307 25457
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25457
20 1 4 "Average Difference" HA 13 0.259 0.137 0.229 25457
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25457
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25457
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25457
24 1 4 "Average Difference" HN 12 0.283 0.075 0.285 25457
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25457
26 1 5 "Average Difference" HA 13 0.201 0.037 0.205 25457
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25457
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25457
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25457
30 1 5 "Average Difference" HN 12 0.379 -0.008 0.396 25457
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25457
32 1 6 "Average Difference" HA 13 0.272 0.112 0.258 25457
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25457
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25457
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25457
36 1 6 "Average Difference" HN 12 0.440 0.005 0.460 25457
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25457
38 1 7 "Average Difference" HA 13 0.288 0.070 0.291 25457
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25457
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25457
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25457
42 1 7 "Average Difference" HN 12 0.365 0.038 0.379 25457
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25457
44 1 8 "Average Difference" HA 13 0.321 0.020 0.333 25457
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25457
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25457
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25457
48 1 8 "Average Difference" HN 12 0.428 -0.053 0.443 25457
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25457
50 1 9 "Average Difference" HA 13 0.326 0.031 0.338 25457
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25457
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25457
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25457
54 1 9 "Average Difference" HN 12 0.401 -0.032 0.417 25457
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25457
56 1 10 "Average Difference" HA 13 0.216 0.098 0.200 25457
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25457
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25457
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25457
60 1 10 "Average Difference" HN 12 0.239 -0.000 0.250 25457
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25457
62 1 11 "Average Difference" HA 13 0.330 0.231 0.246 25457
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25457
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25457
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25457
66 1 11 "Average Difference" HN 12 0.318 0.154 0.290 25457
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25457
68 1 12 "Average Difference" HA 13 0.275 0.122 0.256 25457
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25457
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25457
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25457
72 1 12 "Average Difference" HN 12 0.415 0.118 0.415 25457
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25457
74 1 13 "Average Difference" HA 13 0.348 -0.011 0.362 25457
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25457
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25457
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25457
78 1 13 "Average Difference" HN 12 0.454 -0.088 0.465 25457
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25457
80 1 14 "Average Difference" HA 13 0.232 0.091 0.222 25457
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25457
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25457
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25457
84 1 14 "Average Difference" HN 12 0.379 0.127 0.373 25457
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25457
86 1 15 "Average Difference" HA 13 0.220 0.040 0.226 25457
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25457
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25457
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25457
90 1 15 "Average Difference" HN 12 0.308 0.070 0.313 25457
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25457
92 1 16 "Average Difference" HA 13 0.238 0.070 0.237 25457
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25457
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25457
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25457
96 1 16 "Average Difference" HN 12 0.363 0.174 0.333 25457
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25457
98 1 17 "Average Difference" HA 13 0.371 0.142 0.356 25457
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25457
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25457
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25457
102 1 17 "Average Difference" HN 12 0.418 0.034 0.435 25457
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25457
104 1 18 "Average Difference" HA 13 0.255 0.147 0.216 25457
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25457
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25457
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25457
108 1 18 "Average Difference" HN 12 0.238 0.034 0.246 25457
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25457
110 1 19 "Average Difference" HA 13 0.237 0.136 0.202 25457
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25457
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25457
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25457
114 1 19 "Average Difference" HN 12 0.295 0.138 0.272 25457
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25457
116 1 20 "Average Difference" HA 13 0.339 0.071 0.344 25457
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25457
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25457
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25457
120 1 20 "Average Difference" HN 12 0.420 -0.048 0.436 25457
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 25457
_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 SER HA H 2 4.330 4.330 4.649 -0.319 25457
2 1 . 1 1 2 2 SER H H 2 8.140 8.140 8.595 -0.455 25457
3 1 . 1 1 3 3 GLY H H 3 8.340 8.340 8.031 0.309 25457
4 1 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.109 0.131 25457
5 1 . 1 1 4 4 LEU H H 4 7.880 7.880 8.151 -0.271 25457
6 1 . 1 1 5 5 SER HA H 5 4.280 4.280 4.356 -0.076 25457
7 1 . 1 1 5 5 SER H H 5 8.300 8.300 8.264 0.036 25457
8 1 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.535 0.055 25457
9 1 . 1 1 6 6 PHE H H 6 8.250 8.250 7.901 0.349 25457
10 1 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.260 0.020 25457
11 1 . 1 1 7 7 GLU H H 7 8.060 8.060 8.073 -0.013 25457
12 1 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.403 -0.433 25457
13 1 . 1 1 11 11 ARG H H 11 7.880 7.880 7.753 0.127 25457
14 1 . 1 1 15 15 THR HA H 15 4.070 4.070 4.235 -0.165 25457
15 1 . 1 1 15 15 THR H H 15 7.870 7.870 8.375 -0.505 25457
16 1 . 1 1 16 16 MET HA H 16 4.220 4.220 4.403 -0.183 25457
17 1 . 1 1 16 16 MET H H 16 7.930 7.930 8.196 -0.266 25457
18 1 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.788 0.032 25457
19 1 . 1 1 17 17 VAL H H 17 7.700 7.700 8.044 -0.344 25457
20 1 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.146 -0.346 25457
21 1 . 1 1 18 18 LEU H H 18 7.810 7.810 7.577 0.233 25457
22 1 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.384 0.146 25457
23 1 . 1 1 19 19 HIS H H 19 8.000 8.000 7.794 0.206 25457
stop_
save_