data_19309
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19309
_Entry.PDB_ID 2M9R
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 19309
_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 ALA HA H 2 4.340 4.340 4.463 -0.123 19309
2 1 1 . 1 1 2 2 ALA H H 2 8.600 8.600 8.374 0.226 19309
3 1 1 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.448 -0.208 19309
4 1 1 . 1 1 3 3 GLU H H 3 8.080 8.080 8.475 -0.395 19309
5 1 1 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.644 -0.064 19309
6 1 1 . 1 1 4 4 PHE H H 4 7.920 7.920 8.748 -0.828 19309
7 1 1 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.759 -0.469 19309
8 1 1 . 1 1 5 5 ARG H H 5 8.310 8.310 8.581 -0.271 19309
9 1 1 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.874 -0.244 19309
10 1 1 . 1 1 6 6 HIS H H 6 8.300 8.300 8.605 -0.305 19309
11 1 1 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.636 -0.006 19309
12 1 1 . 1 1 7 7 ASP H H 7 8.420 8.420 8.683 -0.263 19309
13 1 1 . 1 1 8 8 SER HA H 8 4.290 4.290 4.614 -0.324 19309
14 1 1 . 1 1 8 8 SER H H 8 8.100 8.100 7.683 0.417 19309
15 1 1 . 1 1 9 9 GLY H H 9 8.070 8.070 8.342 -0.272 19309
16 1 1 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.762 -0.262 19309
17 1 1 . 1 1 10 10 TYR H H 10 8.010 8.010 8.313 -0.303 19309
18 1 1 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.672 -0.332 19309
19 1 1 . 1 1 11 11 GLU H H 11 8.230 8.230 8.793 -0.563 19309
20 1 1 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.613 -0.463 19309
21 1 1 . 1 1 12 12 VAL H H 12 7.780 7.780 8.173 -0.393 19309
22 1 1 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.409 0.221 19309
23 1 1 . 1 1 13 13 HIS H H 13 8.370 8.370 8.740 -0.370 19309
24 1 1 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.626 0.004 19309
25 1 1 . 1 1 14 14 HIS H H 14 8.280 8.280 8.317 -0.037 19309
26 1 1 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.386 -0.116 19309
27 1 1 . 1 1 15 15 GLN H H 15 8.300 8.300 8.537 -0.237 19309
28 1 1 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.402 -0.122 19309
29 1 1 . 1 1 16 16 LYS H H 16 8.240 8.240 8.698 -0.458 19309
30 1 1 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.704 -0.354 19309
31 1 1 . 1 1 17 17 LEU H H 17 8.020 8.020 7.792 0.228 19309
32 1 1 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.140 -0.030 19309
33 1 1 . 1 1 18 18 VAL H H 18 7.740 7.740 8.283 -0.543 19309
34 1 1 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.640 -0.090 19309
35 1 1 . 1 1 19 19 PHE H H 19 7.930 7.930 7.971 -0.041 19309
36 1 1 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.580 0.010 19309
37 1 1 . 1 1 20 20 PHE H H 20 8.120 8.120 7.966 0.154 19309
38 1 1 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.271 0.079 19309
39 1 1 . 1 1 21 21 ALA H H 21 8.190 8.190 8.799 -0.609 19309
40 1 1 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.386 -0.056 19309
41 1 1 . 1 1 22 22 GLU H H 22 8.030 8.030 7.922 0.108 19309
42 1 1 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.729 -0.099 19309
43 1 1 . 1 1 23 23 ASP H H 23 8.280 8.280 8.547 -0.267 19309
44 1 1 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.098 0.082 19309
45 1 1 . 1 1 24 24 VAL H H 24 7.680 7.680 8.262 -0.582 19309
46 1 1 . 1 1 25 25 GLY H H 25 8.150 8.150 8.304 -0.154 19309
47 1 1 . 1 1 26 26 SER HA H 26 4.380 4.380 4.527 -0.147 19309
48 1 1 . 1 1 26 26 SER H H 26 7.970 7.970 8.246 -0.276 19309
49 1 1 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.771 -0.191 19309
50 1 1 . 1 1 27 27 ASN H H 27 8.270 8.270 8.694 -0.424 19309
51 1 1 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.315 -0.135 19309
52 1 1 . 1 1 28 28 LYS H H 28 8.000 8.000 8.272 -0.272 19309
53 1 1 . 1 1 29 29 GLY H H 29 8.150 8.150 8.416 -0.266 19309
54 1 1 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.533 -0.173 19309
55 1 1 . 1 1 30 30 ALA H H 30 7.890 7.890 8.088 -0.198 19309
56 1 1 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.361 -0.171 19309
57 1 1 . 1 1 31 31 ILE H H 31 7.920 7.920 8.254 -0.334 19309
58 1 1 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.301 -0.111 19309
59 1 1 . 1 1 32 32 ILE H H 32 7.740 7.740 8.485 -0.745 19309
60 1 1 . 1 1 33 33 GLY H H 33 8.110 8.110 8.325 -0.215 19309
61 1 1 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.627 -0.267 19309
62 1 1 . 1 1 34 34 LEU H H 34 7.890 7.890 8.216 -0.326 19309
63 1 1 . 1 1 35 35 MET HA H 35 4.390 4.390 4.755 -0.365 19309
64 1 1 . 1 1 35 35 MET H H 35 8.180 8.180 8.473 -0.293 19309
65 1 1 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.375 -0.195 19309
66 1 1 . 1 1 36 36 VAL H H 36 7.660 7.660 8.447 -0.787 19309
67 1 1 . 1 1 37 37 GLY H H 37 8.220 8.220 8.522 -0.302 19309
68 1 1 . 1 1 38 38 GLY H H 38 8.050 8.050 8.242 -0.192 19309
69 1 1 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.455 -0.105 19309
70 1 1 . 1 1 39 39 VAL H H 39 7.810 7.810 7.844 -0.034 19309
71 1 2 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.533 -0.193 19309
72 1 2 . 1 1 2 2 ALA H H 2 8.600 8.600 8.140 0.460 19309
73 1 2 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.518 -0.278 19309
74 1 2 . 1 1 3 3 GLU H H 3 8.080 8.080 8.434 -0.354 19309
75 1 2 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.714 -0.134 19309
76 1 2 . 1 1 4 4 PHE H H 4 7.920 7.920 8.605 -0.685 19309
77 1 2 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.718 -0.428 19309
78 1 2 . 1 1 5 5 ARG H H 5 8.310 8.310 8.856 -0.546 19309
79 1 2 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.377 0.253 19309
80 1 2 . 1 1 6 6 HIS H H 6 8.300 8.300 8.960 -0.660 19309
81 1 2 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.633 -0.003 19309
82 1 2 . 1 1 7 7 ASP H H 7 8.420 8.420 8.008 0.412 19309
83 1 2 . 1 1 8 8 SER HA H 8 4.290 4.290 4.436 -0.146 19309
84 1 2 . 1 1 8 8 SER H H 8 8.100 8.100 8.028 0.072 19309
85 1 2 . 1 1 9 9 GLY H H 9 8.070 8.070 7.740 0.330 19309
86 1 2 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.634 -0.134 19309
87 1 2 . 1 1 10 10 TYR H H 10 8.010 8.010 7.805 0.205 19309
88 1 2 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.358 -0.018 19309
89 1 2 . 1 1 11 11 GLU H H 11 8.230 8.230 8.656 -0.426 19309
90 1 2 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.428 -0.278 19309
91 1 2 . 1 1 12 12 VAL H H 12 7.780 7.780 8.475 -0.695 19309
92 1 2 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.497 0.133 19309
93 1 2 . 1 1 13 13 HIS H H 13 8.370 8.370 8.612 -0.242 19309
94 1 2 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.719 -0.089 19309
95 1 2 . 1 1 14 14 HIS H H 14 8.280 8.280 8.206 0.074 19309
96 1 2 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.366 -0.096 19309
97 1 2 . 1 1 15 15 GLN H H 15 8.300 8.300 8.513 -0.213 19309
98 1 2 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.496 -0.216 19309
99 1 2 . 1 1 16 16 LYS H H 16 8.240 8.240 8.588 -0.348 19309
100 1 2 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.580 -0.230 19309
101 1 2 . 1 1 17 17 LEU H H 17 8.020 8.020 7.742 0.278 19309
102 1 2 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.098 0.012 19309
103 1 2 . 1 1 18 18 VAL H H 18 7.740 7.740 8.197 -0.457 19309
104 1 2 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.578 -0.028 19309
105 1 2 . 1 1 19 19 PHE H H 19 7.930 7.930 7.731 0.199 19309
106 1 2 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.517 0.073 19309
107 1 2 . 1 1 20 20 PHE H H 20 8.120 8.120 7.994 0.126 19309
108 1 2 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.593 -0.243 19309
109 1 2 . 1 1 21 21 ALA H H 21 8.190 8.190 8.941 -0.751 19309
110 1 2 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.473 -0.143 19309
111 1 2 . 1 1 22 22 GLU H H 22 8.030 8.030 7.914 0.116 19309
112 1 2 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.605 0.025 19309
113 1 2 . 1 1 23 23 ASP H H 23 8.280 8.280 8.754 -0.474 19309
114 1 2 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.225 -0.045 19309
115 1 2 . 1 1 24 24 VAL H H 24 7.680 7.680 7.888 -0.208 19309
116 1 2 . 1 1 25 25 GLY H H 25 8.150 8.150 8.798 -0.648 19309
117 1 2 . 1 1 26 26 SER HA H 26 4.380 4.380 4.492 -0.112 19309
118 1 2 . 1 1 26 26 SER H H 26 7.970 7.970 8.047 -0.077 19309
119 1 2 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.656 -0.076 19309
120 1 2 . 1 1 27 27 ASN H H 27 8.270 8.270 8.625 -0.355 19309
121 1 2 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.640 -0.460 19309
122 1 2 . 1 1 28 28 LYS H H 28 8.000 8.000 8.111 -0.111 19309
123 1 2 . 1 1 29 29 GLY H H 29 8.150 8.150 8.528 -0.378 19309
124 1 2 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.668 -0.308 19309
125 1 2 . 1 1 30 30 ALA H H 30 7.890 7.890 8.083 -0.193 19309
126 1 2 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.315 -0.125 19309
127 1 2 . 1 1 31 31 ILE H H 31 7.920 7.920 8.616 -0.696 19309
128 1 2 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.608 -0.418 19309
129 1 2 . 1 1 32 32 ILE H H 32 7.740 7.740 8.420 -0.680 19309
130 1 2 . 1 1 33 33 GLY H H 33 8.110 8.110 7.994 0.116 19309
131 1 2 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.666 -0.306 19309
132 1 2 . 1 1 34 34 LEU H H 34 7.890 7.890 8.087 -0.197 19309
133 1 2 . 1 1 35 35 MET HA H 35 4.390 4.390 4.599 -0.209 19309
134 1 2 . 1 1 35 35 MET H H 35 8.180 8.180 8.432 -0.252 19309
135 1 2 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.220 -0.040 19309
136 1 2 . 1 1 36 36 VAL H H 36 7.660 7.660 8.592 -0.932 19309
137 1 2 . 1 1 37 37 GLY H H 37 8.220 8.220 8.167 0.053 19309
138 1 2 . 1 1 38 38 GLY H H 38 8.050 8.050 8.317 -0.267 19309
139 1 2 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.345 0.005 19309
140 1 2 . 1 1 39 39 VAL H H 39 7.810 7.810 8.272 -0.462 19309
141 1 3 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.433 -0.093 19309
142 1 3 . 1 1 2 2 ALA H H 2 8.600 8.600 8.360 0.240 19309
143 1 3 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.506 -0.266 19309
144 1 3 . 1 1 3 3 GLU H H 3 8.080 8.080 8.443 -0.363 19309
145 1 3 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.661 -0.081 19309
146 1 3 . 1 1 4 4 PHE H H 4 7.920 7.920 8.683 -0.763 19309
147 1 3 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.598 -0.308 19309
148 1 3 . 1 1 5 5 ARG H H 5 8.310 8.310 8.742 -0.432 19309
149 1 3 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.736 -0.106 19309
150 1 3 . 1 1 6 6 HIS H H 6 8.300 8.300 8.611 -0.311 19309
151 1 3 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.617 0.013 19309
152 1 3 . 1 1 7 7 ASP H H 7 8.420 8.420 8.815 -0.395 19309
153 1 3 . 1 1 8 8 SER HA H 8 4.290 4.290 4.660 -0.370 19309
154 1 3 . 1 1 8 8 SER H H 8 8.100 8.100 8.205 -0.105 19309
155 1 3 . 1 1 9 9 GLY H H 9 8.070 8.070 8.215 -0.145 19309
156 1 3 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.594 -0.094 19309
157 1 3 . 1 1 10 10 TYR H H 10 8.010 8.010 8.308 -0.298 19309
158 1 3 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.583 -0.243 19309
159 1 3 . 1 1 11 11 GLU H H 11 8.230 8.230 8.919 -0.689 19309
160 1 3 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.560 -0.410 19309
161 1 3 . 1 1 12 12 VAL H H 12 7.780 7.780 8.095 -0.315 19309
162 1 3 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.490 0.140 19309
163 1 3 . 1 1 13 13 HIS H H 13 8.370 8.370 8.642 -0.272 19309
164 1 3 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.709 -0.079 19309
165 1 3 . 1 1 14 14 HIS H H 14 8.280 8.280 8.352 -0.072 19309
166 1 3 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.463 -0.193 19309
167 1 3 . 1 1 15 15 GLN H H 15 8.300 8.300 8.643 -0.343 19309
168 1 3 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.438 -0.158 19309
169 1 3 . 1 1 16 16 LYS H H 16 8.240 8.240 8.607 -0.367 19309
170 1 3 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.411 -0.061 19309
171 1 3 . 1 1 17 17 LEU H H 17 8.020 8.020 8.677 -0.657 19309
172 1 3 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.325 -0.215 19309
173 1 3 . 1 1 18 18 VAL H H 18 7.740 7.740 7.929 -0.189 19309
174 1 3 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.639 -0.089 19309
175 1 3 . 1 1 19 19 PHE H H 19 7.930 7.930 8.205 -0.275 19309
176 1 3 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.578 0.012 19309
177 1 3 . 1 1 20 20 PHE H H 20 8.120 8.120 8.215 -0.095 19309
178 1 3 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.501 -0.151 19309
179 1 3 . 1 1 21 21 ALA H H 21 8.190 8.190 8.548 -0.358 19309
180 1 3 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.259 0.071 19309
181 1 3 . 1 1 22 22 GLU H H 22 8.030 8.030 8.843 -0.813 19309
182 1 3 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.776 -0.146 19309
183 1 3 . 1 1 23 23 ASP H H 23 8.280 8.280 8.060 0.220 19309
184 1 3 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.427 -0.247 19309
185 1 3 . 1 1 24 24 VAL H H 24 7.680 7.680 8.337 -0.657 19309
186 1 3 . 1 1 25 25 GLY H H 25 8.150 8.150 8.623 -0.473 19309
187 1 3 . 1 1 26 26 SER HA H 26 4.380 4.380 4.741 -0.361 19309
188 1 3 . 1 1 26 26 SER H H 26 7.970 7.970 8.383 -0.413 19309
189 1 3 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.692 -0.112 19309
190 1 3 . 1 1 27 27 ASN H H 27 8.270 8.270 8.546 -0.276 19309
191 1 3 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.464 -0.284 19309
192 1 3 . 1 1 28 28 LYS H H 28 8.000 8.000 7.982 0.018 19309
193 1 3 . 1 1 29 29 GLY H H 29 8.150 8.150 8.657 -0.507 19309
194 1 3 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.700 -0.340 19309
195 1 3 . 1 1 30 30 ALA H H 30 7.890 7.890 8.152 -0.262 19309
196 1 3 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.351 -0.161 19309
197 1 3 . 1 1 31 31 ILE H H 31 7.920 7.920 8.653 -0.733 19309
198 1 3 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.389 -0.199 19309
199 1 3 . 1 1 32 32 ILE H H 32 7.740 7.740 8.696 -0.956 19309
200 1 3 . 1 1 33 33 GLY H H 33 8.110 8.110 8.340 -0.230 19309
201 1 3 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.551 -0.191 19309
202 1 3 . 1 1 34 34 LEU H H 34 7.890 7.890 8.182 -0.292 19309
203 1 3 . 1 1 35 35 MET HA H 35 4.390 4.390 4.615 -0.225 19309
204 1 3 . 1 1 35 35 MET H H 35 8.180 8.180 8.484 -0.304 19309
205 1 3 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.326 -0.146 19309
206 1 3 . 1 1 36 36 VAL H H 36 7.660 7.660 8.694 -1.034 19309
207 1 3 . 1 1 37 37 GLY H H 37 8.220 8.220 8.434 -0.214 19309
208 1 3 . 1 1 38 38 GLY H H 38 8.050 8.050 8.543 -0.493 19309
209 1 3 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.604 -0.254 19309
210 1 3 . 1 1 39 39 VAL H H 39 7.810 7.810 8.433 -0.623 19309
211 1 4 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.294 0.046 19309
212 1 4 . 1 1 2 2 ALA H H 2 8.600 8.600 7.836 0.764 19309
213 1 4 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.396 -0.156 19309
214 1 4 . 1 1 3 3 GLU H H 3 8.080 8.080 8.020 0.060 19309
215 1 4 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.647 -0.067 19309
216 1 4 . 1 1 4 4 PHE H H 4 7.920 7.920 8.594 -0.674 19309
217 1 4 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.607 -0.317 19309
218 1 4 . 1 1 5 5 ARG H H 5 8.310 8.310 8.748 -0.438 19309
219 1 4 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.776 -0.146 19309
220 1 4 . 1 1 6 6 HIS H H 6 8.300 8.300 8.483 -0.183 19309
221 1 4 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.634 -0.004 19309
222 1 4 . 1 1 7 7 ASP H H 7 8.420 8.420 8.675 -0.255 19309
223 1 4 . 1 1 8 8 SER HA H 8 4.290 4.290 4.669 -0.379 19309
224 1 4 . 1 1 8 8 SER H H 8 8.100 8.100 8.560 -0.460 19309
225 1 4 . 1 1 9 9 GLY H H 9 8.070 8.070 8.706 -0.636 19309
226 1 4 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.731 -0.231 19309
227 1 4 . 1 1 10 10 TYR H H 10 8.010 8.010 8.440 -0.430 19309
228 1 4 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.570 -0.230 19309
229 1 4 . 1 1 11 11 GLU H H 11 8.230 8.230 8.627 -0.397 19309
230 1 4 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.342 -0.192 19309
231 1 4 . 1 1 12 12 VAL H H 12 7.780 7.780 8.194 -0.414 19309
232 1 4 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.460 0.170 19309
233 1 4 . 1 1 13 13 HIS H H 13 8.370 8.370 8.527 -0.157 19309
234 1 4 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.734 -0.104 19309
235 1 4 . 1 1 14 14 HIS H H 14 8.280 8.280 8.414 -0.134 19309
236 1 4 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.430 -0.160 19309
237 1 4 . 1 1 15 15 GLN H H 15 8.300 8.300 8.849 -0.549 19309
238 1 4 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.575 -0.295 19309
239 1 4 . 1 1 16 16 LYS H H 16 8.240 8.240 8.672 -0.432 19309
240 1 4 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.718 -0.368 19309
241 1 4 . 1 1 17 17 LEU H H 17 8.020 8.020 7.878 0.142 19309
242 1 4 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.389 -0.279 19309
243 1 4 . 1 1 18 18 VAL H H 18 7.740 7.740 8.318 -0.578 19309
244 1 4 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.413 0.137 19309
245 1 4 . 1 1 19 19 PHE H H 19 7.930 7.930 8.061 -0.131 19309
246 1 4 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.897 -0.307 19309
247 1 4 . 1 1 20 20 PHE H H 20 8.120 8.120 7.932 0.188 19309
248 1 4 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.426 -0.076 19309
249 1 4 . 1 1 21 21 ALA H H 21 8.190 8.190 8.605 -0.415 19309
250 1 4 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.496 -0.166 19309
251 1 4 . 1 1 22 22 GLU H H 22 8.030 8.030 8.153 -0.123 19309
252 1 4 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.739 -0.109 19309
253 1 4 . 1 1 23 23 ASP H H 23 8.280 8.280 8.608 -0.328 19309
254 1 4 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.298 -0.118 19309
255 1 4 . 1 1 24 24 VAL H H 24 7.680 7.680 8.108 -0.428 19309
256 1 4 . 1 1 25 25 GLY H H 25 8.150 8.150 8.745 -0.595 19309
257 1 4 . 1 1 26 26 SER HA H 26 4.380 4.380 4.511 -0.131 19309
258 1 4 . 1 1 26 26 SER H H 26 7.970 7.970 7.844 0.126 19309
259 1 4 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.772 -0.192 19309
260 1 4 . 1 1 27 27 ASN H H 27 8.270 8.270 8.776 -0.506 19309
261 1 4 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.367 -0.187 19309
262 1 4 . 1 1 28 28 LYS H H 28 8.000 8.000 8.301 -0.301 19309
263 1 4 . 1 1 29 29 GLY H H 29 8.150 8.150 8.469 -0.319 19309
264 1 4 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.520 -0.160 19309
265 1 4 . 1 1 30 30 ALA H H 30 7.890 7.890 8.066 -0.176 19309
266 1 4 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.372 -0.182 19309
267 1 4 . 1 1 31 31 ILE H H 31 7.920 7.920 8.385 -0.465 19309
268 1 4 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.533 -0.343 19309
269 1 4 . 1 1 32 32 ILE H H 32 7.740 7.740 8.091 -0.350 19309
270 1 4 . 1 1 33 33 GLY H H 33 8.110 8.110 8.594 -0.484 19309
271 1 4 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.649 -0.289 19309
272 1 4 . 1 1 34 34 LEU H H 34 7.890 7.890 7.809 0.081 19309
273 1 4 . 1 1 35 35 MET HA H 35 4.390 4.390 4.734 -0.344 19309
274 1 4 . 1 1 35 35 MET H H 35 8.180 8.180 8.479 -0.299 19309
275 1 4 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.209 -0.029 19309
276 1 4 . 1 1 36 36 VAL H H 36 7.660 7.660 8.606 -0.946 19309
277 1 4 . 1 1 37 37 GLY H H 37 8.220 8.220 8.416 -0.196 19309
278 1 4 . 1 1 38 38 GLY H H 38 8.050 8.050 8.430 -0.380 19309
279 1 4 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.340 0.010 19309
280 1 4 . 1 1 39 39 VAL H H 39 7.810 7.810 8.196 -0.386 19309
281 1 5 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.264 0.076 19309
282 1 5 . 1 1 2 2 ALA H H 2 8.600 8.600 8.218 0.382 19309
283 1 5 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.268 -0.028 19309
284 1 5 . 1 1 3 3 GLU H H 3 8.080 8.080 8.063 0.017 19309
285 1 5 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.518 0.062 19309
286 1 5 . 1 1 4 4 PHE H H 4 7.920 7.920 8.509 -0.589 19309
287 1 5 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.631 -0.341 19309
288 1 5 . 1 1 5 5 ARG H H 5 8.310 8.310 8.535 -0.225 19309
289 1 5 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.729 -0.099 19309
290 1 5 . 1 1 6 6 HIS H H 6 8.300 8.300 8.818 -0.518 19309
291 1 5 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.508 0.122 19309
292 1 5 . 1 1 7 7 ASP H H 7 8.420 8.420 8.739 -0.319 19309
293 1 5 . 1 1 8 8 SER HA H 8 4.290 4.290 4.424 -0.134 19309
294 1 5 . 1 1 8 8 SER H H 8 8.100 8.100 7.801 0.299 19309
295 1 5 . 1 1 9 9 GLY H H 9 8.070 8.070 8.739 -0.669 19309
296 1 5 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.903 -0.403 19309
297 1 5 . 1 1 10 10 TYR H H 10 8.010 8.010 8.129 -0.119 19309
298 1 5 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.426 -0.086 19309
299 1 5 . 1 1 11 11 GLU H H 11 8.230 8.230 8.682 -0.452 19309
300 1 5 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.516 -0.366 19309
301 1 5 . 1 1 12 12 VAL H H 12 7.780 7.780 8.137 -0.357 19309
302 1 5 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.454 0.176 19309
303 1 5 . 1 1 13 13 HIS H H 13 8.370 8.370 8.638 -0.268 19309
304 1 5 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.856 -0.226 19309
305 1 5 . 1 1 14 14 HIS H H 14 8.280 8.280 8.150 0.130 19309
306 1 5 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.486 -0.216 19309
307 1 5 . 1 1 15 15 GLN H H 15 8.300 8.300 8.762 -0.462 19309
308 1 5 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.479 -0.199 19309
309 1 5 . 1 1 16 16 LYS H H 16 8.240 8.240 8.764 -0.524 19309
310 1 5 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.484 -0.134 19309
311 1 5 . 1 1 17 17 LEU H H 17 8.020 8.020 7.767 0.253 19309
312 1 5 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.344 -0.234 19309
313 1 5 . 1 1 18 18 VAL H H 18 7.740 7.740 8.074 -0.334 19309
314 1 5 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.516 0.034 19309
315 1 5 . 1 1 19 19 PHE H H 19 7.930 7.930 8.441 -0.511 19309
316 1 5 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.514 0.076 19309
317 1 5 . 1 1 20 20 PHE H H 20 8.120 8.120 8.162 -0.042 19309
318 1 5 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.197 0.153 19309
319 1 5 . 1 1 21 21 ALA H H 21 8.190 8.190 8.243 -0.053 19309
320 1 5 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.268 0.062 19309
321 1 5 . 1 1 22 22 GLU H H 22 8.030 8.030 8.644 -0.614 19309
322 1 5 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.964 -0.334 19309
323 1 5 . 1 1 23 23 ASP H H 23 8.280 8.280 7.949 0.331 19309
324 1 5 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.349 -0.170 19309
325 1 5 . 1 1 24 24 VAL H H 24 7.680 7.680 8.600 -0.920 19309
326 1 5 . 1 1 25 25 GLY H H 25 8.150 8.150 8.588 -0.438 19309
327 1 5 . 1 1 26 26 SER HA H 26 4.380 4.380 4.450 -0.070 19309
328 1 5 . 1 1 26 26 SER H H 26 7.970 7.970 8.287 -0.317 19309
329 1 5 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.763 -0.183 19309
330 1 5 . 1 1 27 27 ASN H H 27 8.270 8.270 8.809 -0.538 19309
331 1 5 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.315 -0.135 19309
332 1 5 . 1 1 28 28 LYS H H 28 8.000 8.000 8.216 -0.216 19309
333 1 5 . 1 1 29 29 GLY H H 29 8.150 8.150 8.518 -0.368 19309
334 1 5 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.520 -0.160 19309
335 1 5 . 1 1 30 30 ALA H H 30 7.890 7.890 8.066 -0.176 19309
336 1 5 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.215 -0.025 19309
337 1 5 . 1 1 31 31 ILE H H 31 7.920 7.920 8.484 -0.564 19309
338 1 5 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.491 -0.301 19309
339 1 5 . 1 1 32 32 ILE H H 32 7.740 7.740 7.709 0.031 19309
340 1 5 . 1 1 33 33 GLY H H 33 8.110 8.110 8.624 -0.514 19309
341 1 5 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.556 -0.196 19309
342 1 5 . 1 1 34 34 LEU H H 34 7.890 7.890 7.820 0.070 19309
343 1 5 . 1 1 35 35 MET HA H 35 4.390 4.390 4.723 -0.333 19309
344 1 5 . 1 1 35 35 MET H H 35 8.180 8.180 8.509 -0.329 19309
345 1 5 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.318 -0.138 19309
346 1 5 . 1 1 36 36 VAL H H 36 7.660 7.660 8.627 -0.967 19309
347 1 5 . 1 1 37 37 GLY H H 37 8.220 8.220 8.282 -0.062 19309
348 1 5 . 1 1 38 38 GLY H H 38 8.050 8.050 8.032 0.018 19309
349 1 5 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.520 -0.170 19309
350 1 5 . 1 1 39 39 VAL H H 39 7.810 7.810 8.203 -0.393 19309
351 1 6 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.601 -0.261 19309
352 1 6 . 1 1 2 2 ALA H H 2 8.600 8.600 8.165 0.435 19309
353 1 6 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.537 -0.297 19309
354 1 6 . 1 1 3 3 GLU H H 3 8.080 8.080 8.818 -0.738 19309
355 1 6 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.882 -0.302 19309
356 1 6 . 1 1 4 4 PHE H H 4 7.920 7.920 8.384 -0.464 19309
357 1 6 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.582 -0.292 19309
358 1 6 . 1 1 5 5 ARG H H 5 8.310 8.310 8.440 -0.130 19309
359 1 6 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.638 -0.008 19309
360 1 6 . 1 1 6 6 HIS H H 6 8.300 8.300 8.823 -0.523 19309
361 1 6 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.598 0.032 19309
362 1 6 . 1 1 7 7 ASP H H 7 8.420 8.420 8.409 0.011 19309
363 1 6 . 1 1 8 8 SER HA H 8 4.290 4.290 4.681 -0.391 19309
364 1 6 . 1 1 8 8 SER H H 8 8.100 8.100 8.201 -0.101 19309
365 1 6 . 1 1 9 9 GLY H H 9 8.070 8.070 8.653 -0.583 19309
366 1 6 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.594 -0.094 19309
367 1 6 . 1 1 10 10 TYR H H 10 8.010 8.010 8.093 -0.083 19309
368 1 6 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.696 -0.356 19309
369 1 6 . 1 1 11 11 GLU H H 11 8.230 8.230 8.985 -0.755 19309
370 1 6 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.526 -0.376 19309
371 1 6 . 1 1 12 12 VAL H H 12 7.780 7.780 8.270 -0.490 19309
372 1 6 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.478 0.152 19309
373 1 6 . 1 1 13 13 HIS H H 13 8.370 8.370 8.743 -0.373 19309
374 1 6 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.530 0.100 19309
375 1 6 . 1 1 14 14 HIS H H 14 8.280 8.280 8.262 0.018 19309
376 1 6 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.420 -0.150 19309
377 1 6 . 1 1 15 15 GLN H H 15 8.300 8.300 8.276 0.024 19309
378 1 6 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.410 -0.130 19309
379 1 6 . 1 1 16 16 LYS H H 16 8.240 8.240 8.736 -0.496 19309
380 1 6 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.511 -0.161 19309
381 1 6 . 1 1 17 17 LEU H H 17 8.020 8.020 7.874 0.146 19309
382 1 6 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.044 0.066 19309
383 1 6 . 1 1 18 18 VAL H H 18 7.740 7.740 8.063 -0.323 19309
384 1 6 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.541 0.009 19309
385 1 6 . 1 1 19 19 PHE H H 19 7.930 7.930 7.828 0.102 19309
386 1 6 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.511 0.079 19309
387 1 6 . 1 1 20 20 PHE H H 20 8.120 8.120 8.177 -0.057 19309
388 1 6 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.589 -0.239 19309
389 1 6 . 1 1 21 21 ALA H H 21 8.190 8.190 8.518 -0.328 19309
390 1 6 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.254 0.076 19309
391 1 6 . 1 1 22 22 GLU H H 22 8.030 8.030 8.889 -0.859 19309
392 1 6 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.650 -0.020 19309
393 1 6 . 1 1 23 23 ASP H H 23 8.280 8.280 8.190 0.090 19309
394 1 6 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.284 -0.104 19309
395 1 6 . 1 1 24 24 VAL H H 24 7.680 7.680 8.296 -0.616 19309
396 1 6 . 1 1 25 25 GLY H H 25 8.150 8.150 8.490 -0.340 19309
397 1 6 . 1 1 26 26 SER HA H 26 4.380 4.380 4.379 0.001 19309
398 1 6 . 1 1 26 26 SER H H 26 7.970 7.970 8.380 -0.410 19309
399 1 6 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.684 -0.104 19309
400 1 6 . 1 1 27 27 ASN H H 27 8.270 8.270 8.696 -0.426 19309
401 1 6 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.675 -0.495 19309
402 1 6 . 1 1 28 28 LYS H H 28 8.000 8.000 7.930 0.070 19309
403 1 6 . 1 1 29 29 GLY H H 29 8.150 8.150 8.536 -0.386 19309
404 1 6 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.942 -0.582 19309
405 1 6 . 1 1 30 30 ALA H H 30 7.890 7.890 8.138 -0.248 19309
406 1 6 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.456 -0.266 19309
407 1 6 . 1 1 31 31 ILE H H 31 7.920 7.920 8.197 -0.277 19309
408 1 6 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.321 -0.131 19309
409 1 6 . 1 1 32 32 ILE H H 32 7.740 7.740 8.479 -0.739 19309
410 1 6 . 1 1 33 33 GLY H H 33 8.110 8.110 8.420 -0.310 19309
411 1 6 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.647 -0.287 19309
412 1 6 . 1 1 34 34 LEU H H 34 7.890 7.890 8.233 -0.343 19309
413 1 6 . 1 1 35 35 MET HA H 35 4.390 4.390 4.815 -0.425 19309
414 1 6 . 1 1 35 35 MET H H 35 8.180 8.180 8.465 -0.285 19309
415 1 6 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.332 -0.152 19309
416 1 6 . 1 1 36 36 VAL H H 36 7.660 7.660 8.646 -0.986 19309
417 1 6 . 1 1 37 37 GLY H H 37 8.220 8.220 8.518 -0.298 19309
418 1 6 . 1 1 38 38 GLY H H 38 8.050 8.050 8.100 -0.050 19309
419 1 6 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.591 -0.241 19309
420 1 6 . 1 1 39 39 VAL H H 39 7.810 7.810 8.110 -0.300 19309
421 1 7 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.319 0.021 19309
422 1 7 . 1 1 2 2 ALA H H 2 8.600 8.600 7.843 0.757 19309
423 1 7 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.469 -0.229 19309
424 1 7 . 1 1 3 3 GLU H H 3 8.080 8.080 8.014 0.066 19309
425 1 7 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.682 -0.102 19309
426 1 7 . 1 1 4 4 PHE H H 4 7.920 7.920 8.750 -0.830 19309
427 1 7 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.659 -0.369 19309
428 1 7 . 1 1 5 5 ARG H H 5 8.310 8.310 8.727 -0.417 19309
429 1 7 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.722 -0.092 19309
430 1 7 . 1 1 6 6 HIS H H 6 8.300 8.300 8.483 -0.183 19309
431 1 7 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.711 -0.081 19309
432 1 7 . 1 1 7 7 ASP H H 7 8.420 8.420 8.749 -0.329 19309
433 1 7 . 1 1 8 8 SER HA H 8 4.290 4.290 4.683 -0.393 19309
434 1 7 . 1 1 8 8 SER H H 8 8.100 8.100 8.530 -0.430 19309
435 1 7 . 1 1 9 9 GLY H H 9 8.070 8.070 8.683 -0.613 19309
436 1 7 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.680 -0.180 19309
437 1 7 . 1 1 10 10 TYR H H 10 8.010 8.010 8.393 -0.383 19309
438 1 7 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.654 -0.314 19309
439 1 7 . 1 1 11 11 GLU H H 11 8.230 8.230 8.914 -0.684 19309
440 1 7 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.532 -0.382 19309
441 1 7 . 1 1 12 12 VAL H H 12 7.780 7.780 8.520 -0.740 19309
442 1 7 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.469 0.161 19309
443 1 7 . 1 1 13 13 HIS H H 13 8.370 8.370 8.707 -0.337 19309
444 1 7 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.695 -0.065 19309
445 1 7 . 1 1 14 14 HIS H H 14 8.280 8.280 8.337 -0.057 19309
446 1 7 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.437 -0.167 19309
447 1 7 . 1 1 15 15 GLN H H 15 8.300 8.300 8.871 -0.571 19309
448 1 7 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.529 -0.249 19309
449 1 7 . 1 1 16 16 LYS H H 16 8.240 8.240 8.852 -0.612 19309
450 1 7 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.551 -0.201 19309
451 1 7 . 1 1 17 17 LEU H H 17 8.020 8.020 7.756 0.264 19309
452 1 7 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.123 -0.013 19309
453 1 7 . 1 1 18 18 VAL H H 18 7.740 7.740 8.374 -0.634 19309
454 1 7 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.538 0.012 19309
455 1 7 . 1 1 19 19 PHE H H 19 7.930 7.930 8.470 -0.540 19309
456 1 7 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.541 0.049 19309
457 1 7 . 1 1 20 20 PHE H H 20 8.120 8.120 8.207 -0.087 19309
458 1 7 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.342 0.008 19309
459 1 7 . 1 1 21 21 ALA H H 21 8.190 8.190 8.306 -0.116 19309
460 1 7 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.327 0.003 19309
461 1 7 . 1 1 22 22 GLU H H 22 8.030 8.030 8.857 -0.827 19309
462 1 7 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.690 -0.060 19309
463 1 7 . 1 1 23 23 ASP H H 23 8.280 8.280 8.135 0.145 19309
464 1 7 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.463 -0.283 19309
465 1 7 . 1 1 24 24 VAL H H 24 7.680 7.680 8.272 -0.592 19309
466 1 7 . 1 1 25 25 GLY H H 25 8.150 8.150 8.519 -0.369 19309
467 1 7 . 1 1 26 26 SER HA H 26 4.380 4.380 4.474 -0.094 19309
468 1 7 . 1 1 26 26 SER H H 26 7.970 7.970 7.958 0.012 19309
469 1 7 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.671 -0.091 19309
470 1 7 . 1 1 27 27 ASN H H 27 8.270 8.270 8.648 -0.378 19309
471 1 7 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.475 -0.295 19309
472 1 7 . 1 1 28 28 LYS H H 28 8.000 8.000 8.091 -0.091 19309
473 1 7 . 1 1 29 29 GLY H H 29 8.150 8.150 8.778 -0.628 19309
474 1 7 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.515 -0.155 19309
475 1 7 . 1 1 30 30 ALA H H 30 7.890 7.890 8.166 -0.276 19309
476 1 7 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.270 -0.080 19309
477 1 7 . 1 1 31 31 ILE H H 31 7.920 7.920 8.388 -0.468 19309
478 1 7 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.556 -0.366 19309
479 1 7 . 1 1 32 32 ILE H H 32 7.740 7.740 7.995 -0.255 19309
480 1 7 . 1 1 33 33 GLY H H 33 8.110 8.110 8.602 -0.492 19309
481 1 7 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.672 -0.312 19309
482 1 7 . 1 1 34 34 LEU H H 34 7.890 7.890 7.768 0.122 19309
483 1 7 . 1 1 35 35 MET HA H 35 4.390 4.390 4.774 -0.384 19309
484 1 7 . 1 1 35 35 MET H H 35 8.180 8.180 8.569 -0.389 19309
485 1 7 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.307 -0.127 19309
486 1 7 . 1 1 36 36 VAL H H 36 7.660 7.660 8.539 -0.879 19309
487 1 7 . 1 1 37 37 GLY H H 37 8.220 8.220 8.675 -0.455 19309
488 1 7 . 1 1 38 38 GLY H H 38 8.050 8.050 7.928 0.122 19309
489 1 7 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.436 -0.086 19309
490 1 7 . 1 1 39 39 VAL H H 39 7.810 7.810 8.217 -0.407 19309
491 1 8 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.363 -0.023 19309
492 1 8 . 1 1 2 2 ALA H H 2 8.600 8.600 8.593 0.007 19309
493 1 8 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.436 -0.196 19309
494 1 8 . 1 1 3 3 GLU H H 3 8.080 8.080 8.033 0.047 19309
495 1 8 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.747 -0.167 19309
496 1 8 . 1 1 4 4 PHE H H 4 7.920 7.920 8.713 -0.793 19309
497 1 8 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.611 -0.321 19309
498 1 8 . 1 1 5 5 ARG H H 5 8.310 8.310 8.723 -0.413 19309
499 1 8 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.497 0.133 19309
500 1 8 . 1 1 6 6 HIS H H 6 8.300 8.300 8.675 -0.375 19309
501 1 8 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.643 -0.013 19309
502 1 8 . 1 1 7 7 ASP H H 7 8.420 8.420 8.368 0.052 19309
503 1 8 . 1 1 8 8 SER HA H 8 4.290 4.290 4.628 -0.338 19309
504 1 8 . 1 1 8 8 SER H H 8 8.100 8.100 8.559 -0.459 19309
505 1 8 . 1 1 9 9 GLY H H 9 8.070 8.070 8.107 -0.037 19309
506 1 8 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.607 -0.107 19309
507 1 8 . 1 1 10 10 TYR H H 10 8.010 8.010 8.523 -0.513 19309
508 1 8 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.549 -0.209 19309
509 1 8 . 1 1 11 11 GLU H H 11 8.230 8.230 8.809 -0.579 19309
510 1 8 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.357 -0.207 19309
511 1 8 . 1 1 12 12 VAL H H 12 7.780 7.780 8.275 -0.495 19309
512 1 8 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.493 0.137 19309
513 1 8 . 1 1 13 13 HIS H H 13 8.370 8.370 8.652 -0.282 19309
514 1 8 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.786 -0.156 19309
515 1 8 . 1 1 14 14 HIS H H 14 8.280 8.280 8.335 -0.055 19309
516 1 8 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.476 -0.206 19309
517 1 8 . 1 1 15 15 GLN H H 15 8.300 8.300 8.757 -0.457 19309
518 1 8 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.514 -0.234 19309
519 1 8 . 1 1 16 16 LYS H H 16 8.240 8.240 8.760 -0.520 19309
520 1 8 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.530 -0.180 19309
521 1 8 . 1 1 17 17 LEU H H 17 8.020 8.020 7.882 0.138 19309
522 1 8 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.138 -0.028 19309
523 1 8 . 1 1 18 18 VAL H H 18 7.740 7.740 8.256 -0.516 19309
524 1 8 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.538 0.012 19309
525 1 8 . 1 1 19 19 PHE H H 19 7.930 7.930 7.878 0.052 19309
526 1 8 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.564 0.026 19309
527 1 8 . 1 1 20 20 PHE H H 20 8.120 8.120 7.817 0.303 19309
528 1 8 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.491 -0.141 19309
529 1 8 . 1 1 21 21 ALA H H 21 8.190 8.190 8.761 -0.571 19309
530 1 8 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.239 0.091 19309
531 1 8 . 1 1 22 22 GLU H H 22 8.030 8.030 8.772 -0.742 19309
532 1 8 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.770 -0.140 19309
533 1 8 . 1 1 23 23 ASP H H 23 8.280 8.280 8.377 -0.097 19309
534 1 8 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.398 -0.218 19309
535 1 8 . 1 1 24 24 VAL H H 24 7.680 7.680 7.982 -0.302 19309
536 1 8 . 1 1 25 25 GLY H H 25 8.150 8.150 8.334 -0.184 19309
537 1 8 . 1 1 26 26 SER HA H 26 4.380 4.380 4.597 -0.217 19309
538 1 8 . 1 1 26 26 SER H H 26 7.970 7.970 7.924 0.046 19309
539 1 8 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.724 -0.144 19309
540 1 8 . 1 1 27 27 ASN H H 27 8.270 8.270 8.566 -0.296 19309
541 1 8 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.476 -0.296 19309
542 1 8 . 1 1 28 28 LYS H H 28 8.000 8.000 8.339 -0.339 19309
543 1 8 . 1 1 29 29 GLY H H 29 8.150 8.150 8.707 -0.556 19309
544 1 8 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.755 -0.395 19309
545 1 8 . 1 1 30 30 ALA H H 30 7.890 7.890 8.025 -0.135 19309
546 1 8 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.434 -0.244 19309
547 1 8 . 1 1 31 31 ILE H H 31 7.920 7.920 8.231 -0.311 19309
548 1 8 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.500 -0.310 19309
549 1 8 . 1 1 32 32 ILE H H 32 7.740 7.740 8.428 -0.688 19309
550 1 8 . 1 1 33 33 GLY H H 33 8.110 8.110 8.636 -0.526 19309
551 1 8 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.577 -0.217 19309
552 1 8 . 1 1 34 34 LEU H H 34 7.890 7.890 7.602 0.288 19309
553 1 8 . 1 1 35 35 MET HA H 35 4.390 4.390 4.628 -0.238 19309
554 1 8 . 1 1 35 35 MET H H 35 8.180 8.180 8.590 -0.410 19309
555 1 8 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.196 -0.016 19309
556 1 8 . 1 1 36 36 VAL H H 36 7.660 7.660 8.617 -0.957 19309
557 1 8 . 1 1 37 37 GLY H H 37 8.220 8.220 8.390 -0.170 19309
558 1 8 . 1 1 38 38 GLY H H 38 8.050 8.050 8.169 -0.119 19309
559 1 8 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.157 0.193 19309
560 1 8 . 1 1 39 39 VAL H H 39 7.810 7.810 7.942 -0.132 19309
561 1 9 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.135 0.205 19309
562 1 9 . 1 1 2 2 ALA H H 2 8.600 8.600 8.132 0.468 19309
563 1 9 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.322 -0.082 19309
564 1 9 . 1 1 3 3 GLU H H 3 8.080 8.080 8.010 0.070 19309
565 1 9 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.582 -0.002 19309
566 1 9 . 1 1 4 4 PHE H H 4 7.920 7.920 8.781 -0.861 19309
567 1 9 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.575 -0.285 19309
568 1 9 . 1 1 5 5 ARG H H 5 8.310 8.310 8.738 -0.428 19309
569 1 9 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.769 -0.139 19309
570 1 9 . 1 1 6 6 HIS H H 6 8.300 8.300 8.684 -0.384 19309
571 1 9 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.689 -0.059 19309
572 1 9 . 1 1 7 7 ASP H H 7 8.420 8.420 8.281 0.139 19309
573 1 9 . 1 1 8 8 SER HA H 8 4.290 4.290 4.471 -0.181 19309
574 1 9 . 1 1 8 8 SER H H 8 8.100 8.100 8.424 -0.324 19309
575 1 9 . 1 1 9 9 GLY H H 9 8.070 8.070 8.530 -0.460 19309
576 1 9 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.574 -0.074 19309
577 1 9 . 1 1 10 10 TYR H H 10 8.010 8.010 8.599 -0.589 19309
578 1 9 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.352 -0.012 19309
579 1 9 . 1 1 11 11 GLU H H 11 8.230 8.230 8.532 -0.302 19309
580 1 9 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.468 -0.318 19309
581 1 9 . 1 1 12 12 VAL H H 12 7.780 7.780 8.137 -0.357 19309
582 1 9 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.423 0.207 19309
583 1 9 . 1 1 13 13 HIS H H 13 8.370 8.370 8.429 -0.059 19309
584 1 9 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.703 -0.073 19309
585 1 9 . 1 1 14 14 HIS H H 14 8.280 8.280 8.339 -0.059 19309
586 1 9 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.473 -0.203 19309
587 1 9 . 1 1 15 15 GLN H H 15 8.300 8.300 8.795 -0.495 19309
588 1 9 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.522 -0.242 19309
589 1 9 . 1 1 16 16 LYS H H 16 8.240 8.240 8.802 -0.562 19309
590 1 9 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.574 -0.224 19309
591 1 9 . 1 1 17 17 LEU H H 17 8.020 8.020 7.804 0.216 19309
592 1 9 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.123 -0.013 19309
593 1 9 . 1 1 18 18 VAL H H 18 7.740 7.740 8.460 -0.720 19309
594 1 9 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.504 0.046 19309
595 1 9 . 1 1 19 19 PHE H H 19 7.930 7.930 8.002 -0.072 19309
596 1 9 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.793 -0.203 19309
597 1 9 . 1 1 20 20 PHE H H 20 8.120 8.120 7.765 0.355 19309
598 1 9 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.359 -0.009 19309
599 1 9 . 1 1 21 21 ALA H H 21 8.190 8.190 8.816 -0.626 19309
600 1 9 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.496 -0.166 19309
601 1 9 . 1 1 22 22 GLU H H 22 8.030 8.030 7.886 0.144 19309
602 1 9 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.622 0.008 19309
603 1 9 . 1 1 23 23 ASP H H 23 8.280 8.280 8.534 -0.254 19309
604 1 9 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.289 -0.109 19309
605 1 9 . 1 1 24 24 VAL H H 24 7.680 7.680 7.824 -0.144 19309
606 1 9 . 1 1 25 25 GLY H H 25 8.150 8.150 8.347 -0.197 19309
607 1 9 . 1 1 26 26 SER HA H 26 4.380 4.380 4.365 0.015 19309
608 1 9 . 1 1 26 26 SER H H 26 7.970 7.970 8.441 -0.471 19309
609 1 9 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.562 0.018 19309
610 1 9 . 1 1 27 27 ASN H H 27 8.270 8.270 8.562 -0.292 19309
611 1 9 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.521 -0.341 19309
612 1 9 . 1 1 28 28 LYS H H 28 8.000 8.000 8.013 -0.013 19309
613 1 9 . 1 1 29 29 GLY H H 29 8.150 8.150 8.715 -0.565 19309
614 1 9 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.616 -0.256 19309
615 1 9 . 1 1 30 30 ALA H H 30 7.890 7.890 8.119 -0.229 19309
616 1 9 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.302 -0.112 19309
617 1 9 . 1 1 31 31 ILE H H 31 7.920 7.920 8.139 -0.219 19309
618 1 9 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.574 -0.384 19309
619 1 9 . 1 1 32 32 ILE H H 32 7.740 7.740 8.227 -0.487 19309
620 1 9 . 1 1 33 33 GLY H H 33 8.110 8.110 8.605 -0.495 19309
621 1 9 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.833 -0.473 19309
622 1 9 . 1 1 34 34 LEU H H 34 7.890 7.890 7.966 -0.076 19309
623 1 9 . 1 1 35 35 MET HA H 35 4.390 4.390 4.618 -0.228 19309
624 1 9 . 1 1 35 35 MET H H 35 8.180 8.180 8.447 -0.267 19309
625 1 9 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.223 -0.043 19309
626 1 9 . 1 1 36 36 VAL H H 36 7.660 7.660 8.660 -1.000 19309
627 1 9 . 1 1 37 37 GLY H H 37 8.220 8.220 8.791 -0.571 19309
628 1 9 . 1 1 38 38 GLY H H 38 8.050 8.050 8.479 -0.429 19309
629 1 9 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.375 -0.025 19309
630 1 9 . 1 1 39 39 VAL H H 39 7.810 7.810 8.099 -0.289 19309
631 1 10 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.198 0.142 19309
632 1 10 . 1 1 2 2 ALA H H 2 8.600 8.600 8.089 0.511 19309
633 1 10 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.293 -0.053 19309
634 1 10 . 1 1 3 3 GLU H H 3 8.080 8.080 8.002 0.078 19309
635 1 10 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.485 0.095 19309
636 1 10 . 1 1 4 4 PHE H H 4 7.920 7.920 8.528 -0.608 19309
637 1 10 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.491 -0.201 19309
638 1 10 . 1 1 5 5 ARG H H 5 8.310 8.310 8.601 -0.291 19309
639 1 10 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.690 -0.060 19309
640 1 10 . 1 1 6 6 HIS H H 6 8.300 8.300 8.747 -0.447 19309
641 1 10 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.605 0.025 19309
642 1 10 . 1 1 7 7 ASP H H 7 8.420 8.420 8.911 -0.491 19309
643 1 10 . 1 1 8 8 SER HA H 8 4.290 4.290 4.565 -0.275 19309
644 1 10 . 1 1 8 8 SER H H 8 8.100 8.100 8.001 0.099 19309
645 1 10 . 1 1 9 9 GLY H H 9 8.070 8.070 8.115 -0.045 19309
646 1 10 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.613 -0.113 19309
647 1 10 . 1 1 10 10 TYR H H 10 8.010 8.010 8.400 -0.390 19309
648 1 10 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.617 -0.277 19309
649 1 10 . 1 1 11 11 GLU H H 11 8.230 8.230 8.818 -0.588 19309
650 1 10 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.404 -0.254 19309
651 1 10 . 1 1 12 12 VAL H H 12 7.780 7.780 8.589 -0.809 19309
652 1 10 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.453 0.177 19309
653 1 10 . 1 1 13 13 HIS H H 13 8.370 8.370 8.461 -0.091 19309
654 1 10 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.577 0.053 19309
655 1 10 . 1 1 14 14 HIS H H 14 8.280 8.280 7.571 0.709 19309
656 1 10 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.294 -0.024 19309
657 1 10 . 1 1 15 15 GLN H H 15 8.300 8.300 8.258 0.042 19309
658 1 10 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.419 -0.139 19309
659 1 10 . 1 1 16 16 LYS H H 16 8.240 8.240 8.666 -0.426 19309
660 1 10 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.517 -0.167 19309
661 1 10 . 1 1 17 17 LEU H H 17 8.020 8.020 7.810 0.210 19309
662 1 10 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.095 0.015 19309
663 1 10 . 1 1 18 18 VAL H H 18 7.740 7.740 8.098 -0.358 19309
664 1 10 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.619 -0.069 19309
665 1 10 . 1 1 19 19 PHE H H 19 7.930 7.930 7.630 0.300 19309
666 1 10 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.641 -0.051 19309
667 1 10 . 1 1 20 20 PHE H H 20 8.120 8.120 8.344 -0.224 19309
668 1 10 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.521 -0.171 19309
669 1 10 . 1 1 21 21 ALA H H 21 8.190 8.190 8.740 -0.550 19309
670 1 10 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.413 -0.083 19309
671 1 10 . 1 1 22 22 GLU H H 22 8.030 8.030 8.187 -0.157 19309
672 1 10 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.682 -0.052 19309
673 1 10 . 1 1 23 23 ASP H H 23 8.280 8.280 8.617 -0.337 19309
674 1 10 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.409 -0.229 19309
675 1 10 . 1 1 24 24 VAL H H 24 7.680 7.680 7.875 -0.195 19309
676 1 10 . 1 1 25 25 GLY H H 25 8.150 8.150 8.437 -0.287 19309
677 1 10 . 1 1 26 26 SER HA H 26 4.380 4.380 4.531 -0.151 19309
678 1 10 . 1 1 26 26 SER H H 26 7.970 7.970 8.337 -0.367 19309
679 1 10 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.745 -0.165 19309
680 1 10 . 1 1 27 27 ASN H H 27 8.270 8.270 7.911 0.359 19309
681 1 10 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.555 -0.375 19309
682 1 10 . 1 1 28 28 LYS H H 28 8.000 8.000 8.117 -0.117 19309
683 1 10 . 1 1 29 29 GLY H H 29 8.150 8.150 8.686 -0.536 19309
684 1 10 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.462 -0.102 19309
685 1 10 . 1 1 30 30 ALA H H 30 7.890 7.890 7.777 0.113 19309
686 1 10 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.324 -0.134 19309
687 1 10 . 1 1 31 31 ILE H H 31 7.920 7.920 8.123 -0.203 19309
688 1 10 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.342 -0.152 19309
689 1 10 . 1 1 32 32 ILE H H 32 7.740 7.740 8.544 -0.804 19309
690 1 10 . 1 1 33 33 GLY H H 33 8.110 8.110 8.414 -0.304 19309
691 1 10 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.394 -0.034 19309
692 1 10 . 1 1 34 34 LEU H H 34 7.890 7.890 8.176 -0.286 19309
693 1 10 . 1 1 35 35 MET HA H 35 4.390 4.390 4.644 -0.254 19309
694 1 10 . 1 1 35 35 MET H H 35 8.180 8.180 8.407 -0.227 19309
695 1 10 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.311 -0.131 19309
696 1 10 . 1 1 36 36 VAL H H 36 7.660 7.660 8.665 -1.005 19309
697 1 10 . 1 1 37 37 GLY H H 37 8.220 8.220 8.530 -0.310 19309
698 1 10 . 1 1 38 38 GLY H H 38 8.050 8.050 8.035 0.015 19309
699 1 10 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.595 -0.245 19309
700 1 10 . 1 1 39 39 VAL H H 39 7.810 7.810 8.093 -0.283 19309
701 1 11 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.437 -0.097 19309
702 1 11 . 1 1 2 2 ALA H H 2 8.600 8.600 8.395 0.205 19309
703 1 11 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.407 -0.167 19309
704 1 11 . 1 1 3 3 GLU H H 3 8.080 8.080 8.498 -0.418 19309
705 1 11 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.534 0.046 19309
706 1 11 . 1 1 4 4 PHE H H 4 7.920 7.920 8.792 -0.872 19309
707 1 11 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.487 -0.197 19309
708 1 11 . 1 1 5 5 ARG H H 5 8.310 8.310 8.617 -0.307 19309
709 1 11 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.668 -0.038 19309
710 1 11 . 1 1 6 6 HIS H H 6 8.300 8.300 8.664 -0.364 19309
711 1 11 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.781 -0.151 19309
712 1 11 . 1 1 7 7 ASP H H 7 8.420 8.420 8.624 -0.204 19309
713 1 11 . 1 1 8 8 SER HA H 8 4.290 4.290 4.461 -0.171 19309
714 1 11 . 1 1 8 8 SER H H 8 8.100 8.100 8.793 -0.693 19309
715 1 11 . 1 1 9 9 GLY H H 9 8.070 8.070 7.701 0.369 19309
716 1 11 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.750 -0.250 19309
717 1 11 . 1 1 10 10 TYR H H 10 8.010 8.010 8.375 -0.365 19309
718 1 11 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.600 -0.260 19309
719 1 11 . 1 1 11 11 GLU H H 11 8.230 8.230 8.653 -0.423 19309
720 1 11 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.375 -0.225 19309
721 1 11 . 1 1 12 12 VAL H H 12 7.780 7.780 8.009 -0.229 19309
722 1 11 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.402 0.228 19309
723 1 11 . 1 1 13 13 HIS H H 13 8.370 8.370 8.593 -0.223 19309
724 1 11 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.617 0.013 19309
725 1 11 . 1 1 14 14 HIS H H 14 8.280 8.280 8.317 -0.037 19309
726 1 11 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.426 -0.156 19309
727 1 11 . 1 1 15 15 GLN H H 15 8.300 8.300 8.637 -0.337 19309
728 1 11 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.452 -0.172 19309
729 1 11 . 1 1 16 16 LYS H H 16 8.240 8.240 8.759 -0.519 19309
730 1 11 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.547 -0.197 19309
731 1 11 . 1 1 17 17 LEU H H 17 8.020 8.020 7.781 0.239 19309
732 1 11 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.052 0.058 19309
733 1 11 . 1 1 18 18 VAL H H 18 7.740 7.740 8.228 -0.488 19309
734 1 11 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.579 -0.029 19309
735 1 11 . 1 1 19 19 PHE H H 19 7.930 7.930 7.796 0.134 19309
736 1 11 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.580 0.010 19309
737 1 11 . 1 1 20 20 PHE H H 20 8.120 8.120 8.407 -0.287 19309
738 1 11 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.503 -0.153 19309
739 1 11 . 1 1 21 21 ALA H H 21 8.190 8.190 8.838 -0.648 19309
740 1 11 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.388 -0.058 19309
741 1 11 . 1 1 22 22 GLU H H 22 8.030 8.030 8.012 0.018 19309
742 1 11 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.604 0.026 19309
743 1 11 . 1 1 23 23 ASP H H 23 8.280 8.280 8.662 -0.382 19309
744 1 11 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.256 -0.076 19309
745 1 11 . 1 1 24 24 VAL H H 24 7.680 7.680 7.959 -0.279 19309
746 1 11 . 1 1 25 25 GLY H H 25 8.150 8.150 8.382 -0.232 19309
747 1 11 . 1 1 26 26 SER HA H 26 4.380 4.380 4.745 -0.365 19309
748 1 11 . 1 1 26 26 SER H H 26 7.970 7.970 8.045 -0.075 19309
749 1 11 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.660 -0.080 19309
750 1 11 . 1 1 27 27 ASN H H 27 8.270 8.270 8.694 -0.424 19309
751 1 11 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.435 -0.255 19309
752 1 11 . 1 1 28 28 LYS H H 28 8.000 8.000 8.170 -0.170 19309
753 1 11 . 1 1 29 29 GLY H H 29 8.150 8.150 8.440 -0.289 19309
754 1 11 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.583 -0.223 19309
755 1 11 . 1 1 30 30 ALA H H 30 7.890 7.890 8.038 -0.148 19309
756 1 11 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.268 -0.078 19309
757 1 11 . 1 1 31 31 ILE H H 31 7.920 7.920 8.401 -0.481 19309
758 1 11 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.272 -0.082 19309
759 1 11 . 1 1 32 32 ILE H H 32 7.740 7.740 8.343 -0.603 19309
760 1 11 . 1 1 33 33 GLY H H 33 8.110 8.110 8.485 -0.375 19309
761 1 11 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.448 -0.088 19309
762 1 11 . 1 1 34 34 LEU H H 34 7.890 7.890 8.055 -0.165 19309
763 1 11 . 1 1 35 35 MET HA H 35 4.390 4.390 4.615 -0.225 19309
764 1 11 . 1 1 35 35 MET H H 35 8.180 8.180 8.658 -0.478 19309
765 1 11 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.287 -0.107 19309
766 1 11 . 1 1 36 36 VAL H H 36 7.660 7.660 8.848 -1.188 19309
767 1 11 . 1 1 37 37 GLY H H 37 8.220 8.220 8.691 -0.471 19309
768 1 11 . 1 1 38 38 GLY H H 38 8.050 8.050 8.321 -0.271 19309
769 1 11 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.606 -0.256 19309
770 1 11 . 1 1 39 39 VAL H H 39 7.810 7.810 7.989 -0.179 19309
771 1 12 . 1 1 2 2 ALA HA H 2 4.340 4.340 4.611 -0.271 19309
772 1 12 . 1 1 2 2 ALA H H 2 8.600 8.600 8.102 0.498 19309
773 1 12 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.428 -0.188 19309
774 1 12 . 1 1 3 3 GLU H H 3 8.080 8.080 8.266 -0.186 19309
775 1 12 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.683 -0.103 19309
776 1 12 . 1 1 4 4 PHE H H 4 7.920 7.920 8.392 -0.472 19309
777 1 12 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.692 -0.402 19309
778 1 12 . 1 1 5 5 ARG H H 5 8.310 8.310 8.427 -0.117 19309
779 1 12 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.847 -0.217 19309
780 1 12 . 1 1 6 6 HIS H H 6 8.300 8.300 8.473 -0.173 19309
781 1 12 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.727 -0.097 19309
782 1 12 . 1 1 7 7 ASP H H 7 8.420 8.420 8.538 -0.118 19309
783 1 12 . 1 1 8 8 SER HA H 8 4.290 4.290 4.448 -0.158 19309
784 1 12 . 1 1 8 8 SER H H 8 8.100 8.100 8.449 -0.349 19309
785 1 12 . 1 1 9 9 GLY H H 9 8.070 8.070 8.879 -0.809 19309
786 1 12 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.760 -0.260 19309
787 1 12 . 1 1 10 10 TYR H H 10 8.010 8.010 7.797 0.213 19309
788 1 12 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.589 -0.249 19309
789 1 12 . 1 1 11 11 GLU H H 11 8.230 8.230 8.873 -0.643 19309
790 1 12 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.446 -0.296 19309
791 1 12 . 1 1 12 12 VAL H H 12 7.780 7.780 8.140 -0.360 19309
792 1 12 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.490 0.140 19309
793 1 12 . 1 1 13 13 HIS H H 13 8.370 8.370 8.691 -0.321 19309
794 1 12 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.714 -0.084 19309
795 1 12 . 1 1 14 14 HIS H H 14 8.280 8.280 8.049 0.231 19309
796 1 12 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.380 -0.110 19309
797 1 12 . 1 1 15 15 GLN H H 15 8.300 8.300 8.756 -0.456 19309
798 1 12 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.541 -0.261 19309
799 1 12 . 1 1 16 16 LYS H H 16 8.240 8.240 8.794 -0.554 19309
800 1 12 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.624 -0.274 19309
801 1 12 . 1 1 17 17 LEU H H 17 8.020 8.020 7.918 0.102 19309
802 1 12 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.173 -0.063 19309
803 1 12 . 1 1 18 18 VAL H H 18 7.740 7.740 8.146 -0.406 19309
804 1 12 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.534 0.016 19309
805 1 12 . 1 1 19 19 PHE H H 19 7.930 7.930 8.102 -0.172 19309
806 1 12 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.543 0.047 19309
807 1 12 . 1 1 20 20 PHE H H 20 8.120 8.120 7.968 0.152 19309
808 1 12 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.547 -0.197 19309
809 1 12 . 1 1 21 21 ALA H H 21 8.190 8.190 8.757 -0.567 19309
810 1 12 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.281 0.049 19309
811 1 12 . 1 1 22 22 GLU H H 22 8.030 8.030 8.634 -0.604 19309
812 1 12 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.679 -0.049 19309
813 1 12 . 1 1 23 23 ASP H H 23 8.280 8.280 8.066 0.214 19309
814 1 12 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.381 -0.201 19309
815 1 12 . 1 1 24 24 VAL H H 24 7.680 7.680 8.350 -0.670 19309
816 1 12 . 1 1 25 25 GLY H H 25 8.150 8.150 8.373 -0.223 19309
817 1 12 . 1 1 26 26 SER HA H 26 4.380 4.380 4.431 -0.051 19309
818 1 12 . 1 1 26 26 SER H H 26 7.970 7.970 7.942 0.028 19309
819 1 12 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.724 -0.144 19309
820 1 12 . 1 1 27 27 ASN H H 27 8.270 8.270 8.675 -0.405 19309
821 1 12 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.662 -0.482 19309
822 1 12 . 1 1 28 28 LYS H H 28 8.000 8.000 7.979 0.021 19309
823 1 12 . 1 1 29 29 GLY H H 29 8.150 8.150 8.864 -0.714 19309
824 1 12 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.573 -0.213 19309
825 1 12 . 1 1 30 30 ALA H H 30 7.890 7.890 8.094 -0.204 19309
826 1 12 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.409 -0.219 19309
827 1 12 . 1 1 31 31 ILE H H 31 7.920 7.920 8.368 -0.448 19309
828 1 12 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.461 -0.271 19309
829 1 12 . 1 1 32 32 ILE H H 32 7.740 7.740 8.416 -0.676 19309
830 1 12 . 1 1 33 33 GLY H H 33 8.110 8.110 8.654 -0.544 19309
831 1 12 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.564 -0.204 19309
832 1 12 . 1 1 34 34 LEU H H 34 7.890 7.890 7.772 0.118 19309
833 1 12 . 1 1 35 35 MET HA H 35 4.390 4.390 4.622 -0.232 19309
834 1 12 . 1 1 35 35 MET H H 35 8.180 8.180 8.640 -0.460 19309
835 1 12 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.227 -0.047 19309
836 1 12 . 1 1 36 36 VAL H H 36 7.660 7.660 8.687 -1.027 19309
837 1 12 . 1 1 37 37 GLY H H 37 8.220 8.220 8.585 -0.365 19309
838 1 12 . 1 1 38 38 GLY H H 38 8.050 8.050 8.354 -0.304 19309
839 1 12 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.309 0.041 19309
840 1 12 . 1 1 39 39 VAL H H 39 7.810 7.810 8.292 -0.482 19309
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 19309
2 1 1 "Average Difference" HA 44 0.208 0.144 0.151 19309
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19309
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19309
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19309
6 1 1 "Average Difference" HN 38 0.385 0.274 0.273 19309
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19309
8 1 2 "Average Difference" HA 44 0.210 0.143 0.155 19309
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19309
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19309
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19309
12 1 2 "Average Difference" HN 38 0.426 0.233 0.362 19309
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19309
14 1 3 "Average Difference" HA 44 0.232 0.180 0.148 19309
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19309
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19309
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19309
18 1 3 "Average Difference" HN 38 0.467 0.375 0.282 19309
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19309
20 1 4 "Average Difference" HA 44 0.208 0.146 0.151 19309
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19309
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19309
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19309
24 1 4 "Average Difference" HN 38 0.417 0.295 0.299 19309
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19309
26 1 5 "Average Difference" HA 44 0.201 0.108 0.171 19309
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19309
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19309
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19309
30 1 5 "Average Difference" HN 38 0.421 0.272 0.326 19309
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19309
32 1 6 "Average Difference" HA 44 0.251 0.187 0.169 19309
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19309
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19309
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19309
36 1 6 "Average Difference" HN 38 0.427 0.301 0.307 19309
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19309
38 1 7 "Average Difference" HA 44 0.208 0.156 0.139 19309
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19309
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19309
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19309
42 1 7 "Average Difference" HN 38 0.475 0.331 0.345 19309
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19309
44 1 8 "Average Difference" HA 44 0.216 0.162 0.145 19309
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19309
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19309
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19309
48 1 8 "Average Difference" HN 38 0.415 0.292 0.299 19309
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19309
50 1 9 "Average Difference" HA 44 0.219 0.143 0.167 19309
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19309
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19309
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19309
54 1 9 "Average Difference" HN 38 0.425 0.287 0.318 19309
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19309
56 1 10 "Average Difference" HA 44 0.219 0.157 0.154 19309
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19309
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19309
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19309
60 1 10 "Average Difference" HN 38 0.416 0.218 0.359 19309
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19309
62 1 11 "Average Difference" HA 44 0.212 0.163 0.137 19309
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19309
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19309
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19309
66 1 11 "Average Difference" HN 38 0.423 0.307 0.295 19309
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19309
68 1 12 "Average Difference" HA 44 0.229 0.173 0.152 19309
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19309
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19309
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19309
72 1 12 "Average Difference" HN 38 0.443 0.296 0.334 19309
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 19309
_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 ALA HA H 2 4.340 4.340 4.388 -0.048 19309
2 1 . 1 1 2 2 ALA H H 2 8.600 8.600 8.187 0.413 19309
3 1 . 1 1 3 3 GLU HA H 3 4.240 4.240 4.419 -0.179 19309
4 1 . 1 1 3 3 GLU H H 3 8.080 8.080 8.256 -0.176 19309
5 1 . 1 1 4 4 PHE HA H 4 4.580 4.580 4.648 -0.068 19309
6 1 . 1 1 4 4 PHE H H 4 7.920 7.920 8.623 -0.703 19309
7 1 . 1 1 5 5 ARG HA H 5 4.290 4.290 4.618 -0.328 19309
8 1 . 1 1 5 5 ARG H H 5 8.310 8.310 8.645 -0.335 19309
9 1 . 1 1 6 6 HIS HA H 6 4.630 4.630 4.694 -0.064 19309
10 1 . 1 1 6 6 HIS H H 6 8.300 8.300 8.669 -0.369 19309
11 1 . 1 1 7 7 ASP HA H 7 4.630 4.630 4.648 -0.018 19309
12 1 . 1 1 7 7 ASP H H 7 8.420 8.420 8.567 -0.147 19309
13 1 . 1 1 8 8 SER HA H 8 4.290 4.290 4.562 -0.272 19309
14 1 . 1 1 8 8 SER H H 8 8.100 8.100 8.270 -0.169 19309
15 1 . 1 1 9 9 GLY H H 9 8.070 8.070 8.367 -0.298 19309
16 1 . 1 1 10 10 TYR HA H 10 4.500 4.500 4.683 -0.183 19309
17 1 . 1 1 10 10 TYR H H 10 8.010 8.010 8.265 -0.255 19309
18 1 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.555 -0.215 19309
19 1 . 1 1 11 11 GLU H H 11 8.230 8.230 8.772 -0.542 19309
20 1 . 1 1 12 12 VAL HA H 12 4.150 4.150 4.464 -0.314 19309
21 1 . 1 1 12 12 VAL H H 12 7.780 7.780 8.251 -0.471 19309
22 1 . 1 1 13 13 HIS HA H 13 4.630 4.630 4.460 0.170 19309
23 1 . 1 1 13 13 HIS H H 13 8.370 8.370 8.620 -0.250 19309
24 1 . 1 1 14 14 HIS HA H 14 4.630 4.630 4.689 -0.059 19309
25 1 . 1 1 14 14 HIS H H 14 8.280 8.280 8.221 0.059 19309
26 1 . 1 1 15 15 GLN HA H 15 4.270 4.270 4.420 -0.150 19309
27 1 . 1 1 15 15 GLN H H 15 8.300 8.300 8.638 -0.338 19309
28 1 . 1 1 16 16 LYS HA H 16 4.280 4.280 4.481 -0.201 19309
29 1 . 1 1 16 16 LYS H H 16 8.240 8.240 8.725 -0.485 19309
30 1 . 1 1 17 17 LEU HA H 17 4.350 4.350 4.563 -0.213 19309
31 1 . 1 1 17 17 LEU H H 17 8.020 8.020 7.890 0.130 19309
32 1 . 1 1 18 18 VAL HA H 18 4.110 4.110 4.170 -0.060 19309
33 1 . 1 1 18 18 VAL H H 18 7.740 7.740 8.202 -0.462 19309
34 1 . 1 1 19 19 PHE HA H 19 4.550 4.550 4.553 -0.003 19309
35 1 . 1 1 19 19 PHE H H 19 7.930 7.930 8.010 -0.080 19309
36 1 . 1 1 20 20 PHE HA H 20 4.590 4.590 4.605 -0.015 19309
37 1 . 1 1 20 20 PHE H H 20 8.120 8.120 8.079 0.041 19309
38 1 . 1 1 21 21 ALA HA H 21 4.350 4.350 4.445 -0.095 19309
39 1 . 1 1 21 21 ALA H H 21 8.190 8.190 8.656 -0.466 19309
40 1 . 1 1 22 22 GLU HA H 22 4.330 4.330 4.357 -0.027 19309
41 1 . 1 1 22 22 GLU H H 22 8.030 8.030 8.393 -0.363 19309
42 1 . 1 1 23 23 ASP HA H 23 4.630 4.630 4.709 -0.079 19309
43 1 . 1 1 23 23 ASP H H 23 8.280 8.280 8.375 -0.095 19309
44 1 . 1 1 24 24 VAL HA H 24 4.180 4.180 4.323 -0.143 19309
45 1 . 1 1 24 24 VAL H H 24 7.680 7.680 8.146 -0.466 19309
46 1 . 1 1 25 25 GLY H H 25 8.150 8.150 8.495 -0.345 19309
47 1 . 1 1 26 26 SER HA H 26 4.380 4.380 4.520 -0.140 19309
48 1 . 1 1 26 26 SER H H 26 7.970 7.970 8.153 -0.183 19309
49 1 . 1 1 27 27 ASN HA H 27 4.580 4.580 4.702 -0.122 19309
50 1 . 1 1 27 27 ASN H H 27 8.270 8.270 8.600 -0.330 19309
51 1 . 1 1 28 28 LYS HA H 28 4.180 4.180 4.492 -0.312 19309
52 1 . 1 1 28 28 LYS H H 28 8.000 8.000 8.127 -0.127 19309
53 1 . 1 1 29 29 GLY H H 29 8.150 8.150 8.610 -0.459 19309
54 1 . 1 1 30 30 ALA HA H 30 4.360 4.360 4.616 -0.256 19309
55 1 . 1 1 30 30 ALA H H 30 7.890 7.890 8.068 -0.178 19309
56 1 . 1 1 31 31 ILE HA H 31 4.190 4.190 4.340 -0.150 19309
57 1 . 1 1 31 31 ILE H H 31 7.920 7.920 8.353 -0.433 19309
58 1 . 1 1 32 32 ILE HA H 32 4.190 4.190 4.446 -0.256 19309
59 1 . 1 1 32 32 ILE H H 32 7.740 7.740 8.319 -0.579 19309
60 1 . 1 1 33 33 GLY H H 33 8.110 8.110 8.474 -0.364 19309
61 1 . 1 1 34 34 LEU HA H 34 4.360 4.360 4.599 -0.239 19309
62 1 . 1 1 34 34 LEU H H 34 7.890 7.890 7.974 -0.084 19309
63 1 . 1 1 35 35 MET HA H 35 4.390 4.390 4.679 -0.289 19309
64 1 . 1 1 35 35 MET H H 35 8.180 8.180 8.513 -0.333 19309
65 1 . 1 1 36 36 VAL HA H 36 4.180 4.180 4.278 -0.098 19309
66 1 . 1 1 36 36 VAL H H 36 7.660 7.660 8.636 -0.976 19309
67 1 . 1 1 37 37 GLY H H 37 8.220 8.220 8.500 -0.280 19309
68 1 . 1 1 38 38 GLY H H 38 8.050 8.050 8.246 -0.196 19309
69 1 . 1 1 39 39 VAL HA H 39 4.350 4.350 4.444 -0.094 19309
70 1 . 1 1 39 39 VAL H H 39 7.810 7.810 8.141 -0.331 19309
stop_
save_