data_25343 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25343 _Entry.PDB_ID 2MWN 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 25343 _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 8 8 ILE HA H 8 4.065 4.065 4.264 -0.199 25343 2 1 1 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.657 -0.207 25343 3 1 1 . 1 1 9 9 ASP H H 9 8.333 8.333 8.767 -0.434 25343 4 1 1 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.545 -0.419 25343 5 1 1 . 1 1 10 10 GLN H H 10 8.245 8.245 8.530 -0.285 25343 6 1 1 . 1 1 11 11 MET HA H 11 4.217 4.217 3.760 0.457 25343 7 1 1 . 1 1 11 11 MET H H 11 8.282 8.282 8.282 0.000 25343 8 1 1 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.069 0.421 25343 9 1 1 . 1 1 12 12 PHE H H 12 8.110 8.110 6.999 1.111 25343 10 1 1 . 1 1 13 13 SER HA H 13 4.299 4.299 4.330 -0.031 25343 11 1 1 . 1 1 13 13 SER H H 13 8.115 8.115 8.743 -0.628 25343 12 1 1 . 1 1 14 14 THR HA H 14 4.179 4.179 4.114 0.065 25343 13 1 1 . 1 1 14 14 THR H H 14 8.048 8.048 8.016 0.032 25343 14 1 1 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.500 -0.377 25343 15 1 1 . 1 1 15 15 LEU H H 15 7.900 7.900 8.270 -0.370 25343 16 1 1 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.077 0.136 25343 17 1 1 . 1 1 16 16 LEU H H 16 8.048 8.048 8.864 -0.816 25343 18 1 1 . 1 1 17 17 GLY H H 17 8.208 8.208 8.063 0.145 25343 19 1 1 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.180 -0.057 25343 20 1 1 . 1 1 18 18 GLU H H 18 8.149 8.149 7.778 0.371 25343 21 1 1 . 1 1 19 19 MET HA H 19 4.286 4.286 4.124 0.162 25343 22 1 1 . 1 1 19 19 MET H H 19 8.256 8.256 8.631 -0.375 25343 23 1 1 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.362 0.081 25343 24 1 1 . 1 1 20 20 ASP H H 20 8.166 8.166 7.820 0.346 25343 25 1 1 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.189 -0.066 25343 26 1 1 . 1 1 21 21 LEU H H 21 8.000 8.000 8.101 -0.101 25343 27 1 1 . 1 1 23 23 THR HA H 23 4.122 4.122 4.402 -0.280 25343 28 1 1 . 1 1 23 23 THR H H 23 7.902 7.902 7.537 0.365 25343 29 1 1 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.076 0.144 25343 30 1 1 . 1 1 24 24 GLN H H 24 8.105 8.105 7.938 0.167 25343 31 1 1 . 1 1 25 25 SER HA H 25 4.335 4.335 4.381 -0.046 25343 32 1 1 . 1 1 25 25 SER H H 25 8.210 8.210 8.378 -0.168 25343 33 1 1 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.247 -0.129 25343 34 1 1 . 1 1 26 26 LEU H H 26 8.150 8.150 8.156 -0.006 25343 35 1 1 . 1 1 27 27 GLY H H 27 8.266 8.266 8.661 -0.395 25343 36 1 1 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.330 -0.232 25343 37 1 1 . 1 1 28 28 VAL H H 28 7.853 7.853 8.063 -0.210 25343 38 1 1 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.423 0.181 25343 39 1 1 . 1 1 29 29 ASP H H 29 8.400 8.400 8.719 -0.319 25343 40 1 2 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.215 -0.150 25343 41 1 2 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.681 -0.231 25343 42 1 2 . 1 1 9 9 ASP H H 9 8.333 8.333 8.755 -0.422 25343 43 1 2 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.522 -0.396 25343 44 1 2 . 1 1 10 10 GLN H H 10 8.245 8.245 8.532 -0.287 25343 45 1 2 . 1 1 11 11 MET HA H 11 4.217 4.217 3.750 0.467 25343 46 1 2 . 1 1 11 11 MET H H 11 8.282 8.282 8.167 0.115 25343 47 1 2 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.054 0.436 25343 48 1 2 . 1 1 12 12 PHE H H 12 8.110 8.110 6.926 1.184 25343 49 1 2 . 1 1 13 13 SER HA H 13 4.299 4.299 4.305 -0.006 25343 50 1 2 . 1 1 13 13 SER H H 13 8.115 8.115 8.561 -0.446 25343 51 1 2 . 1 1 14 14 THR HA H 14 4.179 4.179 4.051 0.128 25343 52 1 2 . 1 1 14 14 THR H H 14 8.048 8.048 8.329 -0.281 25343 53 1 2 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.476 -0.353 25343 54 1 2 . 1 1 15 15 LEU H H 15 7.900 7.900 8.223 -0.323 25343 55 1 2 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.075 0.138 25343 56 1 2 . 1 1 16 16 LEU H H 16 8.048 8.048 8.824 -0.776 25343 57 1 2 . 1 1 17 17 GLY H H 17 8.208 8.208 8.519 -0.311 25343 58 1 2 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.195 -0.072 25343 59 1 2 . 1 1 18 18 GLU H H 18 8.149 8.149 7.716 0.433 25343 60 1 2 . 1 1 19 19 MET HA H 19 4.286 4.286 4.134 0.152 25343 61 1 2 . 1 1 19 19 MET H H 19 8.256 8.256 8.629 -0.373 25343 62 1 2 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.388 0.055 25343 63 1 2 . 1 1 20 20 ASP H H 20 8.166 8.166 7.846 0.320 25343 64 1 2 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.236 -0.113 25343 65 1 2 . 1 1 21 21 LEU H H 21 8.000 8.000 8.104 -0.104 25343 66 1 2 . 1 1 23 23 THR HA H 23 4.122 4.122 4.492 -0.370 25343 67 1 2 . 1 1 23 23 THR H H 23 7.902 7.902 7.472 0.430 25343 68 1 2 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.903 0.317 25343 69 1 2 . 1 1 24 24 GLN H H 24 8.105 8.105 8.612 -0.507 25343 70 1 2 . 1 1 25 25 SER HA H 25 4.335 4.335 4.062 0.273 25343 71 1 2 . 1 1 25 25 SER H H 25 8.210 8.210 8.343 -0.133 25343 72 1 2 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.508 -0.390 25343 73 1 2 . 1 1 26 26 LEU H H 26 8.150 8.150 8.064 0.086 25343 74 1 2 . 1 1 27 27 GLY H H 27 8.266 8.266 7.841 0.425 25343 75 1 2 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.786 0.312 25343 76 1 2 . 1 1 28 28 VAL H H 28 7.853 7.853 7.896 -0.043 25343 77 1 2 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.345 0.259 25343 78 1 2 . 1 1 29 29 ASP H H 29 8.400 8.400 8.016 0.384 25343 79 1 3 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.250 -0.185 25343 80 1 3 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.826 -0.376 25343 81 1 3 . 1 1 9 9 ASP H H 9 8.333 8.333 8.623 -0.290 25343 82 1 3 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.199 -0.073 25343 83 1 3 . 1 1 10 10 GLN H H 10 8.245 8.245 8.592 -0.347 25343 84 1 3 . 1 1 11 11 MET HA H 11 4.217 4.217 3.804 0.413 25343 85 1 3 . 1 1 11 11 MET H H 11 8.282 8.282 8.193 0.089 25343 86 1 3 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.064 0.426 25343 87 1 3 . 1 1 12 12 PHE H H 12 8.110 8.110 7.107 1.003 25343 88 1 3 . 1 1 13 13 SER HA H 13 4.299 4.299 4.249 0.050 25343 89 1 3 . 1 1 13 13 SER H H 13 8.115 8.115 8.465 -0.350 25343 90 1 3 . 1 1 14 14 THR HA H 14 4.179 4.179 3.921 0.258 25343 91 1 3 . 1 1 14 14 THR H H 14 8.048 8.048 8.460 -0.412 25343 92 1 3 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.235 -0.112 25343 93 1 3 . 1 1 15 15 LEU H H 15 7.900 7.900 8.428 -0.528 25343 94 1 3 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.055 0.158 25343 95 1 3 . 1 1 16 16 LEU H H 16 8.048 8.048 8.857 -0.809 25343 96 1 3 . 1 1 17 17 GLY H H 17 8.208 8.208 8.773 -0.565 25343 97 1 3 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.108 0.015 25343 98 1 3 . 1 1 18 18 GLU H H 18 8.149 8.149 7.577 0.572 25343 99 1 3 . 1 1 19 19 MET HA H 19 4.286 4.286 4.160 0.126 25343 100 1 3 . 1 1 19 19 MET H H 19 8.256 8.256 8.638 -0.382 25343 101 1 3 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.360 0.083 25343 102 1 3 . 1 1 20 20 ASP H H 20 8.166 8.166 7.836 0.330 25343 103 1 3 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.207 -0.084 25343 104 1 3 . 1 1 21 21 LEU H H 21 8.000 8.000 7.706 0.294 25343 105 1 3 . 1 1 23 23 THR HA H 23 4.122 4.122 4.437 -0.315 25343 106 1 3 . 1 1 23 23 THR H H 23 7.902 7.902 7.510 0.392 25343 107 1 3 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.961 0.259 25343 108 1 3 . 1 1 24 24 GLN H H 24 8.105 8.105 8.461 -0.356 25343 109 1 3 . 1 1 25 25 SER HA H 25 4.335 4.335 4.468 -0.133 25343 110 1 3 . 1 1 25 25 SER H H 25 8.210 8.210 8.351 -0.141 25343 111 1 3 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.115 0.003 25343 112 1 3 . 1 1 26 26 LEU H H 26 8.150 8.150 7.748 0.402 25343 113 1 3 . 1 1 27 27 GLY H H 27 8.266 8.266 8.604 -0.338 25343 114 1 3 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.164 -0.066 25343 115 1 3 . 1 1 28 28 VAL H H 28 7.853 7.853 7.888 -0.035 25343 116 1 3 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.510 0.094 25343 117 1 3 . 1 1 29 29 ASP H H 29 8.400 8.400 8.168 0.232 25343 118 1 4 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.854 0.211 25343 119 1 4 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.930 -0.480 25343 120 1 4 . 1 1 9 9 ASP H H 9 8.333 8.333 8.152 0.181 25343 121 1 4 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.463 -0.337 25343 122 1 4 . 1 1 10 10 GLN H H 10 8.245 8.245 7.562 0.683 25343 123 1 4 . 1 1 11 11 MET HA H 11 4.217 4.217 3.738 0.479 25343 124 1 4 . 1 1 11 11 MET H H 11 8.282 8.282 7.951 0.331 25343 125 1 4 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.056 0.434 25343 126 1 4 . 1 1 12 12 PHE H H 12 8.110 8.110 6.998 1.112 25343 127 1 4 . 1 1 13 13 SER HA H 13 4.299 4.299 4.243 0.056 25343 128 1 4 . 1 1 13 13 SER H H 13 8.115 8.115 8.391 -0.276 25343 129 1 4 . 1 1 14 14 THR HA H 14 4.179 4.179 4.000 0.179 25343 130 1 4 . 1 1 14 14 THR H H 14 8.048 8.048 8.478 -0.430 25343 131 1 4 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.255 -0.132 25343 132 1 4 . 1 1 15 15 LEU H H 15 7.900 7.900 8.493 -0.593 25343 133 1 4 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.071 0.142 25343 134 1 4 . 1 1 16 16 LEU H H 16 8.048 8.048 8.824 -0.776 25343 135 1 4 . 1 1 17 17 GLY H H 17 8.208 8.208 8.702 -0.494 25343 136 1 4 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.126 -0.003 25343 137 1 4 . 1 1 18 18 GLU H H 18 8.149 8.149 7.569 0.580 25343 138 1 4 . 1 1 19 19 MET HA H 19 4.286 4.286 4.143 0.143 25343 139 1 4 . 1 1 19 19 MET H H 19 8.256 8.256 8.613 -0.357 25343 140 1 4 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.382 0.061 25343 141 1 4 . 1 1 20 20 ASP H H 20 8.166 8.166 7.827 0.339 25343 142 1 4 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.253 -0.130 25343 143 1 4 . 1 1 21 21 LEU H H 21 8.000 8.000 7.782 0.218 25343 144 1 4 . 1 1 23 23 THR HA H 23 4.122 4.122 4.458 -0.336 25343 145 1 4 . 1 1 23 23 THR H H 23 7.902 7.902 7.476 0.426 25343 146 1 4 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.894 0.326 25343 147 1 4 . 1 1 24 24 GLN H H 24 8.105 8.105 8.031 0.074 25343 148 1 4 . 1 1 25 25 SER HA H 25 4.335 4.335 4.472 -0.137 25343 149 1 4 . 1 1 25 25 SER H H 25 8.210 8.210 7.950 0.260 25343 150 1 4 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.378 -0.261 25343 151 1 4 . 1 1 26 26 LEU H H 26 8.150 8.150 8.320 -0.170 25343 152 1 4 . 1 1 27 27 GLY H H 27 8.266 8.266 8.560 -0.294 25343 153 1 4 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.133 -0.035 25343 154 1 4 . 1 1 28 28 VAL H H 28 7.853 7.853 7.830 0.023 25343 155 1 4 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.766 -0.162 25343 156 1 4 . 1 1 29 29 ASP H H 29 8.400 8.400 8.266 0.134 25343 157 1 5 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.827 0.238 25343 158 1 5 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.858 -0.408 25343 159 1 5 . 1 1 9 9 ASP H H 9 8.333 8.333 8.355 -0.022 25343 160 1 5 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.411 -0.285 25343 161 1 5 . 1 1 10 10 GLN H H 10 8.245 8.245 8.210 0.035 25343 162 1 5 . 1 1 11 11 MET HA H 11 4.217 4.217 3.884 0.333 25343 163 1 5 . 1 1 11 11 MET H H 11 8.282 8.282 8.346 -0.064 25343 164 1 5 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.095 0.395 25343 165 1 5 . 1 1 12 12 PHE H H 12 8.110 8.110 7.273 0.837 25343 166 1 5 . 1 1 13 13 SER HA H 13 4.299 4.299 4.266 0.033 25343 167 1 5 . 1 1 13 13 SER H H 13 8.115 8.115 8.456 -0.341 25343 168 1 5 . 1 1 14 14 THR HA H 14 4.179 4.179 3.978 0.201 25343 169 1 5 . 1 1 14 14 THR H H 14 8.048 8.048 8.548 -0.500 25343 170 1 5 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.325 -0.202 25343 171 1 5 . 1 1 15 15 LEU H H 15 7.900 7.900 8.442 -0.542 25343 172 1 5 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.054 0.159 25343 173 1 5 . 1 1 16 16 LEU H H 16 8.048 8.048 8.687 -0.639 25343 174 1 5 . 1 1 17 17 GLY H H 17 8.208 8.208 8.695 -0.487 25343 175 1 5 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.047 0.076 25343 176 1 5 . 1 1 18 18 GLU H H 18 8.149 8.149 7.581 0.568 25343 177 1 5 . 1 1 19 19 MET HA H 19 4.286 4.286 4.104 0.182 25343 178 1 5 . 1 1 19 19 MET H H 19 8.256 8.256 8.688 -0.432 25343 179 1 5 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.358 0.085 25343 180 1 5 . 1 1 20 20 ASP H H 20 8.166 8.166 7.807 0.359 25343 181 1 5 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.209 -0.086 25343 182 1 5 . 1 1 21 21 LEU H H 21 8.000 8.000 7.936 0.064 25343 183 1 5 . 1 1 23 23 THR HA H 23 4.122 4.122 4.428 -0.306 25343 184 1 5 . 1 1 23 23 THR H H 23 7.902 7.902 7.515 0.387 25343 185 1 5 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.060 0.160 25343 186 1 5 . 1 1 24 24 GLN H H 24 8.105 8.105 7.961 0.144 25343 187 1 5 . 1 1 25 25 SER HA H 25 4.335 4.335 4.443 -0.108 25343 188 1 5 . 1 1 25 25 SER H H 25 8.210 8.210 7.788 0.422 25343 189 1 5 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.088 0.030 25343 190 1 5 . 1 1 26 26 LEU H H 26 8.150 8.150 8.602 -0.452 25343 191 1 5 . 1 1 27 27 GLY H H 27 8.266 8.266 7.995 0.271 25343 192 1 5 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.206 -0.108 25343 193 1 5 . 1 1 28 28 VAL H H 28 7.853 7.853 7.852 0.001 25343 194 1 5 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.776 -0.172 25343 195 1 5 . 1 1 29 29 ASP H H 29 8.400 8.400 8.158 0.242 25343 196 1 6 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.302 -0.237 25343 197 1 6 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.876 -0.426 25343 198 1 6 . 1 1 9 9 ASP H H 9 8.333 8.333 8.635 -0.302 25343 199 1 6 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.263 -0.137 25343 200 1 6 . 1 1 10 10 GLN H H 10 8.245 8.245 8.537 -0.292 25343 201 1 6 . 1 1 11 11 MET HA H 11 4.217 4.217 3.815 0.402 25343 202 1 6 . 1 1 11 11 MET H H 11 8.282 8.282 8.196 0.086 25343 203 1 6 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.060 0.430 25343 204 1 6 . 1 1 12 12 PHE H H 12 8.110 8.110 7.104 1.006 25343 205 1 6 . 1 1 13 13 SER HA H 13 4.299 4.299 4.255 0.044 25343 206 1 6 . 1 1 13 13 SER H H 13 8.115 8.115 8.459 -0.344 25343 207 1 6 . 1 1 14 14 THR HA H 14 4.179 4.179 3.927 0.252 25343 208 1 6 . 1 1 14 14 THR H H 14 8.048 8.048 8.482 -0.434 25343 209 1 6 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.280 -0.157 25343 210 1 6 . 1 1 15 15 LEU H H 15 7.900 7.900 8.544 -0.644 25343 211 1 6 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.049 0.164 25343 212 1 6 . 1 1 16 16 LEU H H 16 8.048 8.048 8.720 -0.672 25343 213 1 6 . 1 1 17 17 GLY H H 17 8.208 8.208 8.723 -0.515 25343 214 1 6 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.052 0.071 25343 215 1 6 . 1 1 18 18 GLU H H 18 8.149 8.149 7.578 0.571 25343 216 1 6 . 1 1 19 19 MET HA H 19 4.286 4.286 4.119 0.167 25343 217 1 6 . 1 1 19 19 MET H H 19 8.256 8.256 8.660 -0.404 25343 218 1 6 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.368 0.075 25343 219 1 6 . 1 1 20 20 ASP H H 20 8.166 8.166 7.844 0.322 25343 220 1 6 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.203 -0.080 25343 221 1 6 . 1 1 21 21 LEU H H 21 8.000 8.000 7.861 0.139 25343 222 1 6 . 1 1 23 23 THR HA H 23 4.122 4.122 4.369 -0.247 25343 223 1 6 . 1 1 23 23 THR H H 23 7.902 7.902 7.429 0.473 25343 224 1 6 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.051 0.169 25343 225 1 6 . 1 1 24 24 GLN H H 24 8.105 8.105 7.903 0.202 25343 226 1 6 . 1 1 25 25 SER HA H 25 4.335 4.335 4.367 -0.032 25343 227 1 6 . 1 1 25 25 SER H H 25 8.210 8.210 8.321 -0.111 25343 228 1 6 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.322 -0.204 25343 229 1 6 . 1 1 26 26 LEU H H 26 8.150 8.150 7.909 0.241 25343 230 1 6 . 1 1 27 27 GLY H H 27 8.266 8.266 8.326 -0.060 25343 231 1 6 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.998 0.100 25343 232 1 6 . 1 1 28 28 VAL H H 28 7.853 7.853 8.164 -0.311 25343 233 1 6 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.439 0.165 25343 234 1 6 . 1 1 29 29 ASP H H 29 8.400 8.400 8.967 -0.567 25343 235 1 7 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.109 -0.044 25343 236 1 7 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.469 -0.019 25343 237 1 7 . 1 1 9 9 ASP H H 9 8.333 8.333 9.020 -0.687 25343 238 1 7 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.184 -0.058 25343 239 1 7 . 1 1 10 10 GLN H H 10 8.245 8.245 8.548 -0.303 25343 240 1 7 . 1 1 11 11 MET HA H 11 4.217 4.217 3.783 0.434 25343 241 1 7 . 1 1 11 11 MET H H 11 8.282 8.282 8.022 0.260 25343 242 1 7 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.038 0.452 25343 243 1 7 . 1 1 12 12 PHE H H 12 8.110 8.110 7.118 0.992 25343 244 1 7 . 1 1 13 13 SER HA H 13 4.299 4.299 4.237 0.062 25343 245 1 7 . 1 1 13 13 SER H H 13 8.115 8.115 8.553 -0.438 25343 246 1 7 . 1 1 14 14 THR HA H 14 4.179 4.179 4.025 0.154 25343 247 1 7 . 1 1 14 14 THR H H 14 8.048 8.048 8.536 -0.488 25343 248 1 7 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.541 -0.418 25343 249 1 7 . 1 1 15 15 LEU H H 15 7.900 7.900 8.306 -0.406 25343 250 1 7 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.070 0.143 25343 251 1 7 . 1 1 16 16 LEU H H 16 8.048 8.048 8.704 -0.656 25343 252 1 7 . 1 1 17 17 GLY H H 17 8.208 8.208 8.482 -0.274 25343 253 1 7 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.120 0.003 25343 254 1 7 . 1 1 18 18 GLU H H 18 8.149 8.149 7.693 0.456 25343 255 1 7 . 1 1 19 19 MET HA H 19 4.286 4.286 4.140 0.146 25343 256 1 7 . 1 1 19 19 MET H H 19 8.256 8.256 8.586 -0.330 25343 257 1 7 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.350 0.093 25343 258 1 7 . 1 1 20 20 ASP H H 20 8.166 8.166 7.953 0.213 25343 259 1 7 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.271 -0.148 25343 260 1 7 . 1 1 21 21 LEU H H 21 8.000 8.000 7.759 0.241 25343 261 1 7 . 1 1 23 23 THR HA H 23 4.122 4.122 4.332 -0.210 25343 262 1 7 . 1 1 23 23 THR H H 23 7.902 7.902 7.366 0.536 25343 263 1 7 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.824 0.396 25343 264 1 7 . 1 1 24 24 GLN H H 24 8.105 8.105 8.131 -0.026 25343 265 1 7 . 1 1 25 25 SER HA H 25 4.335 4.335 3.973 0.362 25343 266 1 7 . 1 1 25 25 SER H H 25 8.210 8.210 8.670 -0.460 25343 267 1 7 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.080 0.038 25343 268 1 7 . 1 1 26 26 LEU H H 26 8.150 8.150 8.005 0.145 25343 269 1 7 . 1 1 27 27 GLY H H 27 8.266 8.266 8.142 0.124 25343 270 1 7 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.930 0.168 25343 271 1 7 . 1 1 28 28 VAL H H 28 7.853 7.853 8.424 -0.571 25343 272 1 7 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.921 -0.317 25343 273 1 7 . 1 1 29 29 ASP H H 29 8.400 8.400 8.371 0.029 25343 274 1 8 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.772 0.293 25343 275 1 8 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.751 -0.301 25343 276 1 8 . 1 1 9 9 ASP H H 9 8.333 8.333 8.136 0.197 25343 277 1 8 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.514 -0.388 25343 278 1 8 . 1 1 10 10 GLN H H 10 8.245 8.245 8.009 0.236 25343 279 1 8 . 1 1 11 11 MET HA H 11 4.217 4.217 3.795 0.422 25343 280 1 8 . 1 1 11 11 MET H H 11 8.282 8.282 8.287 -0.005 25343 281 1 8 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.056 0.434 25343 282 1 8 . 1 1 12 12 PHE H H 12 8.110 8.110 6.970 1.140 25343 283 1 8 . 1 1 13 13 SER HA H 13 4.299 4.299 4.370 -0.071 25343 284 1 8 . 1 1 13 13 SER H H 13 8.115 8.115 8.553 -0.438 25343 285 1 8 . 1 1 14 14 THR HA H 14 4.179 4.179 4.123 0.056 25343 286 1 8 . 1 1 14 14 THR H H 14 8.048 8.048 8.233 -0.185 25343 287 1 8 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.543 -0.420 25343 288 1 8 . 1 1 15 15 LEU H H 15 7.900 7.900 8.180 -0.280 25343 289 1 8 . 1 1 16 16 LEU HA H 16 4.213 4.213 3.979 0.234 25343 290 1 8 . 1 1 16 16 LEU H H 16 8.048 8.048 9.008 -0.960 25343 291 1 8 . 1 1 17 17 GLY H H 17 8.208 8.208 7.891 0.317 25343 292 1 8 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.162 -0.039 25343 293 1 8 . 1 1 18 18 GLU H H 18 8.149 8.149 8.041 0.108 25343 294 1 8 . 1 1 19 19 MET HA H 19 4.286 4.286 4.144 0.142 25343 295 1 8 . 1 1 19 19 MET H H 19 8.256 8.256 8.586 -0.330 25343 296 1 8 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.374 0.069 25343 297 1 8 . 1 1 20 20 ASP H H 20 8.166 8.166 7.840 0.326 25343 298 1 8 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.215 -0.092 25343 299 1 8 . 1 1 21 21 LEU H H 21 8.000 8.000 7.793 0.207 25343 300 1 8 . 1 1 23 23 THR HA H 23 4.122 4.122 4.538 -0.416 25343 301 1 8 . 1 1 23 23 THR H H 23 7.902 7.902 7.553 0.349 25343 302 1 8 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.979 0.241 25343 303 1 8 . 1 1 24 24 GLN H H 24 8.105 8.105 8.471 -0.366 25343 304 1 8 . 1 1 25 25 SER HA H 25 4.335 4.335 4.472 -0.137 25343 305 1 8 . 1 1 25 25 SER H H 25 8.210 8.210 8.221 -0.011 25343 306 1 8 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.033 0.085 25343 307 1 8 . 1 1 26 26 LEU H H 26 8.150 8.150 7.971 0.179 25343 308 1 8 . 1 1 27 27 GLY H H 27 8.266 8.266 8.345 -0.079 25343 309 1 8 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.299 -0.201 25343 310 1 8 . 1 1 28 28 VAL H H 28 7.853 7.853 7.794 0.059 25343 311 1 8 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.901 -0.297 25343 312 1 8 . 1 1 29 29 ASP H H 29 8.400 8.400 8.381 0.019 25343 313 1 9 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.820 0.245 25343 314 1 9 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.937 -0.487 25343 315 1 9 . 1 1 9 9 ASP H H 9 8.333 8.333 8.182 0.151 25343 316 1 9 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.442 -0.316 25343 317 1 9 . 1 1 10 10 GLN H H 10 8.245 8.245 7.497 0.748 25343 318 1 9 . 1 1 11 11 MET HA H 11 4.217 4.217 3.801 0.416 25343 319 1 9 . 1 1 11 11 MET H H 11 8.282 8.282 7.896 0.386 25343 320 1 9 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.098 0.392 25343 321 1 9 . 1 1 12 12 PHE H H 12 8.110 8.110 7.092 1.018 25343 322 1 9 . 1 1 13 13 SER HA H 13 4.299 4.299 4.217 0.082 25343 323 1 9 . 1 1 13 13 SER H H 13 8.115 8.115 8.276 -0.161 25343 324 1 9 . 1 1 14 14 THR HA H 14 4.179 4.179 3.931 0.248 25343 325 1 9 . 1 1 14 14 THR H H 14 8.048 8.048 8.483 -0.435 25343 326 1 9 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.292 -0.169 25343 327 1 9 . 1 1 15 15 LEU H H 15 7.900 7.900 8.456 -0.556 25343 328 1 9 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.058 0.155 25343 329 1 9 . 1 1 16 16 LEU H H 16 8.048 8.048 8.867 -0.819 25343 330 1 9 . 1 1 17 17 GLY H H 17 8.208 8.208 8.709 -0.501 25343 331 1 9 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.028 0.095 25343 332 1 9 . 1 1 18 18 GLU H H 18 8.149 8.149 7.610 0.539 25343 333 1 9 . 1 1 19 19 MET HA H 19 4.286 4.286 4.162 0.124 25343 334 1 9 . 1 1 19 19 MET H H 19 8.256 8.256 8.589 -0.333 25343 335 1 9 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.364 0.079 25343 336 1 9 . 1 1 20 20 ASP H H 20 8.166 8.166 7.847 0.319 25343 337 1 9 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.206 -0.083 25343 338 1 9 . 1 1 21 21 LEU H H 21 8.000 8.000 7.573 0.427 25343 339 1 9 . 1 1 23 23 THR HA H 23 4.122 4.122 4.390 -0.268 25343 340 1 9 . 1 1 23 23 THR H H 23 7.902 7.902 7.509 0.393 25343 341 1 9 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.917 0.303 25343 342 1 9 . 1 1 24 24 GLN H H 24 8.105 8.105 8.357 -0.252 25343 343 1 9 . 1 1 25 25 SER HA H 25 4.335 4.335 4.462 -0.127 25343 344 1 9 . 1 1 25 25 SER H H 25 8.210 8.210 8.251 -0.041 25343 345 1 9 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.042 0.076 25343 346 1 9 . 1 1 26 26 LEU H H 26 8.150 8.150 7.609 0.541 25343 347 1 9 . 1 1 27 27 GLY H H 27 8.266 8.266 7.814 0.452 25343 348 1 9 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.145 -0.047 25343 349 1 9 . 1 1 28 28 VAL H H 28 7.853 7.853 7.693 0.160 25343 350 1 9 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.527 0.077 25343 351 1 9 . 1 1 29 29 ASP H H 29 8.400 8.400 8.450 -0.050 25343 352 1 10 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.871 0.194 25343 353 1 10 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.947 -0.497 25343 354 1 10 . 1 1 9 9 ASP H H 9 8.333 8.333 8.156 0.177 25343 355 1 10 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.441 -0.315 25343 356 1 10 . 1 1 10 10 GLN H H 10 8.245 8.245 7.564 0.681 25343 357 1 10 . 1 1 11 11 MET HA H 11 4.217 4.217 3.737 0.480 25343 358 1 10 . 1 1 11 11 MET H H 11 8.282 8.282 7.940 0.342 25343 359 1 10 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.054 0.436 25343 360 1 10 . 1 1 12 12 PHE H H 12 8.110 8.110 6.987 1.123 25343 361 1 10 . 1 1 13 13 SER HA H 13 4.299 4.299 4.234 0.065 25343 362 1 10 . 1 1 13 13 SER H H 13 8.115 8.115 8.354 -0.239 25343 363 1 10 . 1 1 14 14 THR HA H 14 4.179 4.179 3.989 0.190 25343 364 1 10 . 1 1 14 14 THR H H 14 8.048 8.048 8.481 -0.433 25343 365 1 10 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.321 -0.198 25343 366 1 10 . 1 1 15 15 LEU H H 15 7.900 7.900 8.555 -0.655 25343 367 1 10 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.059 0.154 25343 368 1 10 . 1 1 16 16 LEU H H 16 8.048 8.048 8.878 -0.830 25343 369 1 10 . 1 1 17 17 GLY H H 17 8.208 8.208 8.689 -0.481 25343 370 1 10 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.014 0.109 25343 371 1 10 . 1 1 18 18 GLU H H 18 8.149 8.149 7.612 0.537 25343 372 1 10 . 1 1 19 19 MET HA H 19 4.286 4.286 4.152 0.134 25343 373 1 10 . 1 1 19 19 MET H H 19 8.256 8.256 8.591 -0.335 25343 374 1 10 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.380 0.063 25343 375 1 10 . 1 1 20 20 ASP H H 20 8.166 8.166 7.963 0.203 25343 376 1 10 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.237 -0.114 25343 377 1 10 . 1 1 21 21 LEU H H 21 8.000 8.000 7.589 0.411 25343 378 1 10 . 1 1 23 23 THR HA H 23 4.122 4.122 4.416 -0.294 25343 379 1 10 . 1 1 23 23 THR H H 23 7.902 7.902 7.386 0.516 25343 380 1 10 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.924 0.296 25343 381 1 10 . 1 1 24 24 GLN H H 24 8.105 8.105 8.592 -0.487 25343 382 1 10 . 1 1 25 25 SER HA H 25 4.335 4.335 4.251 0.084 25343 383 1 10 . 1 1 25 25 SER H H 25 8.210 8.210 8.645 -0.435 25343 384 1 10 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.007 0.111 25343 385 1 10 . 1 1 26 26 LEU H H 26 8.150 8.150 7.940 0.210 25343 386 1 10 . 1 1 27 27 GLY H H 27 8.266 8.266 7.915 0.351 25343 387 1 10 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.105 -0.007 25343 388 1 10 . 1 1 28 28 VAL H H 28 7.853 7.853 7.896 -0.043 25343 389 1 10 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.664 -0.060 25343 390 1 10 . 1 1 29 29 ASP H H 29 8.400 8.400 7.655 0.745 25343 391 1 11 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.809 0.256 25343 392 1 11 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.726 -0.276 25343 393 1 11 . 1 1 9 9 ASP H H 9 8.333 8.333 8.652 -0.319 25343 394 1 11 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.483 -0.357 25343 395 1 11 . 1 1 10 10 GLN H H 10 8.245 8.245 8.315 -0.070 25343 396 1 11 . 1 1 11 11 MET HA H 11 4.217 4.217 3.803 0.414 25343 397 1 11 . 1 1 11 11 MET H H 11 8.282 8.282 8.164 0.118 25343 398 1 11 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.047 0.443 25343 399 1 11 . 1 1 12 12 PHE H H 12 8.110 8.110 7.141 0.969 25343 400 1 11 . 1 1 13 13 SER HA H 13 4.299 4.299 4.237 0.062 25343 401 1 11 . 1 1 13 13 SER H H 13 8.115 8.115 8.539 -0.424 25343 402 1 11 . 1 1 14 14 THR HA H 14 4.179 4.179 3.948 0.231 25343 403 1 11 . 1 1 14 14 THR H H 14 8.048 8.048 8.388 -0.340 25343 404 1 11 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.240 -0.117 25343 405 1 11 . 1 1 15 15 LEU H H 15 7.900 7.900 8.486 -0.586 25343 406 1 11 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.062 0.151 25343 407 1 11 . 1 1 16 16 LEU H H 16 8.048 8.048 8.836 -0.788 25343 408 1 11 . 1 1 17 17 GLY H H 17 8.208 8.208 8.719 -0.511 25343 409 1 11 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.097 0.026 25343 410 1 11 . 1 1 18 18 GLU H H 18 8.149 8.149 7.595 0.554 25343 411 1 11 . 1 1 19 19 MET HA H 19 4.286 4.286 4.169 0.117 25343 412 1 11 . 1 1 19 19 MET H H 19 8.256 8.256 8.593 -0.337 25343 413 1 11 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.375 0.068 25343 414 1 11 . 1 1 20 20 ASP H H 20 8.166 8.166 7.867 0.299 25343 415 1 11 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.202 -0.079 25343 416 1 11 . 1 1 21 21 LEU H H 21 8.000 8.000 7.613 0.387 25343 417 1 11 . 1 1 23 23 THR HA H 23 4.122 4.122 4.505 -0.383 25343 418 1 11 . 1 1 23 23 THR H H 23 7.902 7.902 7.514 0.388 25343 419 1 11 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.949 0.271 25343 420 1 11 . 1 1 24 24 GLN H H 24 8.105 8.105 8.495 -0.390 25343 421 1 11 . 1 1 25 25 SER HA H 25 4.335 4.335 4.458 -0.123 25343 422 1 11 . 1 1 25 25 SER H H 25 8.210 8.210 8.201 0.009 25343 423 1 11 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.079 0.039 25343 424 1 11 . 1 1 26 26 LEU H H 26 8.150 8.150 7.627 0.523 25343 425 1 11 . 1 1 27 27 GLY H H 27 8.266 8.266 8.341 -0.075 25343 426 1 11 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.901 0.197 25343 427 1 11 . 1 1 28 28 VAL H H 28 7.853 7.853 8.158 -0.305 25343 428 1 11 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.492 0.112 25343 429 1 11 . 1 1 29 29 ASP H H 29 8.400 8.400 8.205 0.195 25343 430 1 12 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.866 0.199 25343 431 1 12 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.768 -0.318 25343 432 1 12 . 1 1 9 9 ASP H H 9 8.333 8.333 8.688 -0.355 25343 433 1 12 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.383 -0.257 25343 434 1 12 . 1 1 10 10 GLN H H 10 8.245 8.245 8.327 -0.082 25343 435 1 12 . 1 1 11 11 MET HA H 11 4.217 4.217 3.790 0.427 25343 436 1 12 . 1 1 11 11 MET H H 11 8.282 8.282 8.178 0.104 25343 437 1 12 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.042 0.448 25343 438 1 12 . 1 1 12 12 PHE H H 12 8.110 8.110 7.119 0.991 25343 439 1 12 . 1 1 13 13 SER HA H 13 4.299 4.299 4.162 0.137 25343 440 1 12 . 1 1 13 13 SER H H 13 8.115 8.115 8.367 -0.252 25343 441 1 12 . 1 1 14 14 THR HA H 14 4.179 4.179 3.988 0.191 25343 442 1 12 . 1 1 14 14 THR H H 14 8.048 8.048 8.326 -0.279 25343 443 1 12 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.289 -0.166 25343 444 1 12 . 1 1 15 15 LEU H H 15 7.900 7.900 8.339 -0.439 25343 445 1 12 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.085 0.128 25343 446 1 12 . 1 1 16 16 LEU H H 16 8.048 8.048 8.971 -0.923 25343 447 1 12 . 1 1 17 17 GLY H H 17 8.208 8.208 8.502 -0.294 25343 448 1 12 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.026 0.097 25343 449 1 12 . 1 1 18 18 GLU H H 18 8.149 8.149 7.636 0.513 25343 450 1 12 . 1 1 19 19 MET HA H 19 4.286 4.286 4.222 0.064 25343 451 1 12 . 1 1 19 19 MET H H 19 8.256 8.256 8.308 -0.052 25343 452 1 12 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.383 0.060 25343 453 1 12 . 1 1 20 20 ASP H H 20 8.166 8.166 8.222 -0.056 25343 454 1 12 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.151 -0.028 25343 455 1 12 . 1 1 21 21 LEU H H 21 8.000 8.000 7.513 0.487 25343 456 1 12 . 1 1 23 23 THR HA H 23 4.122 4.122 4.457 -0.335 25343 457 1 12 . 1 1 23 23 THR H H 23 7.902 7.902 7.666 0.236 25343 458 1 12 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.027 0.193 25343 459 1 12 . 1 1 24 24 GLN H H 24 8.105 8.105 8.747 -0.642 25343 460 1 12 . 1 1 25 25 SER HA H 25 4.335 4.335 4.531 -0.196 25343 461 1 12 . 1 1 25 25 SER H H 25 8.210 8.210 8.106 0.104 25343 462 1 12 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.255 -0.137 25343 463 1 12 . 1 1 26 26 LEU H H 26 8.150 8.150 7.656 0.494 25343 464 1 12 . 1 1 27 27 GLY H H 27 8.266 8.266 8.289 -0.023 25343 465 1 12 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.168 -0.070 25343 466 1 12 . 1 1 28 28 VAL H H 28 7.853 7.853 7.488 0.365 25343 467 1 12 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.419 0.185 25343 468 1 12 . 1 1 29 29 ASP H H 29 8.400 8.400 8.241 0.159 25343 469 1 13 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.606 0.459 25343 470 1 13 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.450 0.000 25343 471 1 13 . 1 1 9 9 ASP H H 9 8.333 8.333 9.043 -0.710 25343 472 1 13 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.217 -0.091 25343 473 1 13 . 1 1 10 10 GLN H H 10 8.245 8.245 8.191 0.054 25343 474 1 13 . 1 1 11 11 MET HA H 11 4.217 4.217 3.738 0.479 25343 475 1 13 . 1 1 11 11 MET H H 11 8.282 8.282 8.112 0.170 25343 476 1 13 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.049 0.441 25343 477 1 13 . 1 1 12 12 PHE H H 12 8.110 8.110 6.997 1.113 25343 478 1 13 . 1 1 13 13 SER HA H 13 4.299 4.299 4.334 -0.035 25343 479 1 13 . 1 1 13 13 SER H H 13 8.115 8.115 8.455 -0.340 25343 480 1 13 . 1 1 14 14 THR HA H 14 4.179 4.179 4.047 0.132 25343 481 1 13 . 1 1 14 14 THR H H 14 8.048 8.048 8.475 -0.427 25343 482 1 13 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.460 -0.338 25343 483 1 13 . 1 1 15 15 LEU H H 15 7.900 7.900 8.232 -0.332 25343 484 1 13 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.062 0.151 25343 485 1 13 . 1 1 16 16 LEU H H 16 8.048 8.048 8.714 -0.666 25343 486 1 13 . 1 1 17 17 GLY H H 17 8.208 8.208 8.538 -0.330 25343 487 1 13 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.173 -0.050 25343 488 1 13 . 1 1 18 18 GLU H H 18 8.149 8.149 7.664 0.485 25343 489 1 13 . 1 1 19 19 MET HA H 19 4.286 4.286 4.141 0.145 25343 490 1 13 . 1 1 19 19 MET H H 19 8.256 8.256 8.610 -0.354 25343 491 1 13 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.356 0.087 25343 492 1 13 . 1 1 20 20 ASP H H 20 8.166 8.166 7.995 0.171 25343 493 1 13 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.235 -0.112 25343 494 1 13 . 1 1 21 21 LEU H H 21 8.000 8.000 7.846 0.154 25343 495 1 13 . 1 1 23 23 THR HA H 23 4.122 4.122 4.375 -0.253 25343 496 1 13 . 1 1 23 23 THR H H 23 7.902 7.902 7.465 0.437 25343 497 1 13 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.882 0.338 25343 498 1 13 . 1 1 24 24 GLN H H 24 8.105 8.105 8.395 -0.290 25343 499 1 13 . 1 1 25 25 SER HA H 25 4.335 4.335 4.475 -0.140 25343 500 1 13 . 1 1 25 25 SER H H 25 8.210 8.210 8.199 0.011 25343 501 1 13 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.204 -0.086 25343 502 1 13 . 1 1 26 26 LEU H H 26 8.150 8.150 7.928 0.222 25343 503 1 13 . 1 1 27 27 GLY H H 27 8.266 8.266 7.876 0.390 25343 504 1 13 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.596 0.502 25343 505 1 13 . 1 1 28 28 VAL H H 28 7.853 7.853 7.795 0.058 25343 506 1 13 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.748 -0.144 25343 507 1 13 . 1 1 29 29 ASP H H 29 8.400 8.400 8.000 0.400 25343 508 1 14 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.230 -0.165 25343 509 1 14 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.682 -0.232 25343 510 1 14 . 1 1 9 9 ASP H H 9 8.333 8.333 8.449 -0.116 25343 511 1 14 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.598 -0.472 25343 512 1 14 . 1 1 10 10 GLN H H 10 8.245 8.245 8.021 0.224 25343 513 1 14 . 1 1 11 11 MET HA H 11 4.217 4.217 3.762 0.455 25343 514 1 14 . 1 1 11 11 MET H H 11 8.282 8.282 8.339 -0.057 25343 515 1 14 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.066 0.424 25343 516 1 14 . 1 1 12 12 PHE H H 12 8.110 8.110 7.154 0.956 25343 517 1 14 . 1 1 13 13 SER HA H 13 4.299 4.299 4.217 0.082 25343 518 1 14 . 1 1 13 13 SER H H 13 8.115 8.115 8.451 -0.336 25343 519 1 14 . 1 1 14 14 THR HA H 14 4.179 4.179 3.925 0.254 25343 520 1 14 . 1 1 14 14 THR H H 14 8.048 8.048 8.438 -0.390 25343 521 1 14 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.235 -0.112 25343 522 1 14 . 1 1 15 15 LEU H H 15 7.900 7.900 8.449 -0.549 25343 523 1 14 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.016 0.197 25343 524 1 14 . 1 1 16 16 LEU H H 16 8.048 8.048 8.821 -0.773 25343 525 1 14 . 1 1 17 17 GLY H H 17 8.208 8.208 8.818 -0.610 25343 526 1 14 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.047 0.076 25343 527 1 14 . 1 1 18 18 GLU H H 18 8.149 8.149 7.722 0.427 25343 528 1 14 . 1 1 19 19 MET HA H 19 4.286 4.286 4.144 0.142 25343 529 1 14 . 1 1 19 19 MET H H 19 8.256 8.256 8.692 -0.436 25343 530 1 14 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.305 0.138 25343 531 1 14 . 1 1 20 20 ASP H H 20 8.166 8.166 8.041 0.125 25343 532 1 14 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.204 -0.081 25343 533 1 14 . 1 1 21 21 LEU H H 21 8.000 8.000 7.704 0.296 25343 534 1 14 . 1 1 23 23 THR HA H 23 4.122 4.122 4.475 -0.353 25343 535 1 14 . 1 1 23 23 THR H H 23 7.902 7.902 7.482 0.420 25343 536 1 14 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.917 0.303 25343 537 1 14 . 1 1 24 24 GLN H H 24 8.105 8.105 8.501 -0.396 25343 538 1 14 . 1 1 25 25 SER HA H 25 4.335 4.335 4.506 -0.171 25343 539 1 14 . 1 1 25 25 SER H H 25 8.210 8.210 8.431 -0.221 25343 540 1 14 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.045 0.073 25343 541 1 14 . 1 1 26 26 LEU H H 26 8.150 8.150 7.994 0.156 25343 542 1 14 . 1 1 27 27 GLY H H 27 8.266 8.266 8.263 0.003 25343 543 1 14 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.303 -0.205 25343 544 1 14 . 1 1 28 28 VAL H H 28 7.853 7.853 8.041 -0.188 25343 545 1 14 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.494 0.110 25343 546 1 14 . 1 1 29 29 ASP H H 29 8.400 8.400 8.248 0.152 25343 547 1 15 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.202 -0.137 25343 548 1 15 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.651 -0.201 25343 549 1 15 . 1 1 9 9 ASP H H 9 8.333 8.333 8.593 -0.260 25343 550 1 15 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.625 -0.499 25343 551 1 15 . 1 1 10 10 GLN H H 10 8.245 8.245 8.291 -0.046 25343 552 1 15 . 1 1 11 11 MET HA H 11 4.217 4.217 3.787 0.430 25343 553 1 15 . 1 1 11 11 MET H H 11 8.282 8.282 8.277 0.005 25343 554 1 15 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.051 0.439 25343 555 1 15 . 1 1 12 12 PHE H H 12 8.110 8.110 7.032 1.078 25343 556 1 15 . 1 1 13 13 SER HA H 13 4.299 4.299 4.295 0.004 25343 557 1 15 . 1 1 13 13 SER H H 13 8.115 8.115 8.613 -0.498 25343 558 1 15 . 1 1 14 14 THR HA H 14 4.179 4.179 4.037 0.142 25343 559 1 15 . 1 1 14 14 THR H H 14 8.048 8.048 8.348 -0.300 25343 560 1 15 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.458 -0.335 25343 561 1 15 . 1 1 15 15 LEU H H 15 7.900 7.900 8.264 -0.364 25343 562 1 15 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.075 0.138 25343 563 1 15 . 1 1 16 16 LEU H H 16 8.048 8.048 8.858 -0.810 25343 564 1 15 . 1 1 17 17 GLY H H 17 8.208 8.208 8.605 -0.397 25343 565 1 15 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.169 -0.046 25343 566 1 15 . 1 1 18 18 GLU H H 18 8.149 8.149 7.643 0.506 25343 567 1 15 . 1 1 19 19 MET HA H 19 4.286 4.286 4.146 0.140 25343 568 1 15 . 1 1 19 19 MET H H 19 8.256 8.256 8.588 -0.332 25343 569 1 15 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.361 0.082 25343 570 1 15 . 1 1 20 20 ASP H H 20 8.166 8.166 7.903 0.263 25343 571 1 15 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.215 -0.092 25343 572 1 15 . 1 1 21 21 LEU H H 21 8.000 8.000 7.809 0.191 25343 573 1 15 . 1 1 23 23 THR HA H 23 4.122 4.122 4.446 -0.324 25343 574 1 15 . 1 1 23 23 THR H H 23 7.902 7.902 7.489 0.413 25343 575 1 15 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.958 0.262 25343 576 1 15 . 1 1 24 24 GLN H H 24 8.105 8.105 8.434 -0.329 25343 577 1 15 . 1 1 25 25 SER HA H 25 4.335 4.335 4.487 -0.152 25343 578 1 15 . 1 1 25 25 SER H H 25 8.210 8.210 8.278 -0.068 25343 579 1 15 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.137 -0.019 25343 580 1 15 . 1 1 26 26 LEU H H 26 8.150 8.150 7.697 0.453 25343 581 1 15 . 1 1 27 27 GLY H H 27 8.266 8.266 8.538 -0.272 25343 582 1 15 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.201 -0.103 25343 583 1 15 . 1 1 28 28 VAL H H 28 7.853 7.853 7.451 0.402 25343 584 1 15 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.795 -0.191 25343 585 1 15 . 1 1 29 29 ASP H H 29 8.400 8.400 9.118 -0.718 25343 586 1 16 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.207 -0.142 25343 587 1 16 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.634 -0.184 25343 588 1 16 . 1 1 9 9 ASP H H 9 8.333 8.333 8.640 -0.307 25343 589 1 16 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.533 -0.407 25343 590 1 16 . 1 1 10 10 GLN H H 10 8.245 8.245 8.464 -0.219 25343 591 1 16 . 1 1 11 11 MET HA H 11 4.217 4.217 3.788 0.429 25343 592 1 16 . 1 1 11 11 MET H H 11 8.282 8.282 8.220 0.062 25343 593 1 16 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.059 0.431 25343 594 1 16 . 1 1 12 12 PHE H H 12 8.110 8.110 7.091 1.019 25343 595 1 16 . 1 1 13 13 SER HA H 13 4.299 4.299 4.262 0.037 25343 596 1 16 . 1 1 13 13 SER H H 13 8.115 8.115 8.534 -0.419 25343 597 1 16 . 1 1 14 14 THR HA H 14 4.179 4.179 3.960 0.219 25343 598 1 16 . 1 1 14 14 THR H H 14 8.048 8.048 8.115 -0.067 25343 599 1 16 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.272 -0.149 25343 600 1 16 . 1 1 15 15 LEU H H 15 7.900 7.900 8.787 -0.887 25343 601 1 16 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.051 0.162 25343 602 1 16 . 1 1 16 16 LEU H H 16 8.048 8.048 8.868 -0.820 25343 603 1 16 . 1 1 17 17 GLY H H 17 8.208 8.208 8.427 -0.219 25343 604 1 16 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.042 0.081 25343 605 1 16 . 1 1 18 18 GLU H H 18 8.149 8.149 7.577 0.572 25343 606 1 16 . 1 1 19 19 MET HA H 19 4.286 4.286 4.128 0.158 25343 607 1 16 . 1 1 19 19 MET H H 19 8.256 8.256 8.651 -0.395 25343 608 1 16 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.401 0.042 25343 609 1 16 . 1 1 20 20 ASP H H 20 8.166 8.166 7.885 0.281 25343 610 1 16 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.167 -0.044 25343 611 1 16 . 1 1 21 21 LEU H H 21 8.000 8.000 7.844 0.156 25343 612 1 16 . 1 1 23 23 THR HA H 23 4.122 4.122 4.430 -0.308 25343 613 1 16 . 1 1 23 23 THR H H 23 7.902 7.902 7.643 0.259 25343 614 1 16 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.125 0.095 25343 615 1 16 . 1 1 24 24 GLN H H 24 8.105 8.105 7.751 0.354 25343 616 1 16 . 1 1 25 25 SER HA H 25 4.335 4.335 4.248 0.087 25343 617 1 16 . 1 1 25 25 SER H H 25 8.210 8.210 8.232 -0.022 25343 618 1 16 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.084 0.034 25343 619 1 16 . 1 1 26 26 LEU H H 26 8.150 8.150 8.201 -0.051 25343 620 1 16 . 1 1 27 27 GLY H H 27 8.266 8.266 8.480 -0.214 25343 621 1 16 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.969 0.129 25343 622 1 16 . 1 1 28 28 VAL H H 28 7.853 7.853 7.903 -0.050 25343 623 1 16 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.691 -0.087 25343 624 1 16 . 1 1 29 29 ASP H H 29 8.400 8.400 8.661 -0.261 25343 625 1 17 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.228 0.837 25343 626 1 17 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.309 0.141 25343 627 1 17 . 1 1 9 9 ASP H H 9 8.333 8.333 8.748 -0.415 25343 628 1 17 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.214 -0.088 25343 629 1 17 . 1 1 10 10 GLN H H 10 8.245 8.245 8.324 -0.079 25343 630 1 17 . 1 1 11 11 MET HA H 11 4.217 4.217 3.751 0.466 25343 631 1 17 . 1 1 11 11 MET H H 11 8.282 8.282 7.536 0.746 25343 632 1 17 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.060 0.430 25343 633 1 17 . 1 1 12 12 PHE H H 12 8.110 8.110 6.983 1.127 25343 634 1 17 . 1 1 13 13 SER HA H 13 4.299 4.299 4.361 -0.062 25343 635 1 17 . 1 1 13 13 SER H H 13 8.115 8.115 8.592 -0.477 25343 636 1 17 . 1 1 14 14 THR HA H 14 4.179 4.179 4.127 0.052 25343 637 1 17 . 1 1 14 14 THR H H 14 8.048 8.048 8.207 -0.159 25343 638 1 17 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.555 -0.432 25343 639 1 17 . 1 1 15 15 LEU H H 15 7.900 7.900 8.114 -0.214 25343 640 1 17 . 1 1 16 16 LEU HA H 16 4.213 4.213 3.998 0.215 25343 641 1 17 . 1 1 16 16 LEU H H 16 8.048 8.048 9.111 -1.063 25343 642 1 17 . 1 1 17 17 GLY H H 17 8.208 8.208 7.769 0.439 25343 643 1 17 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.192 -0.069 25343 644 1 17 . 1 1 18 18 GLU H H 18 8.149 8.149 7.982 0.167 25343 645 1 17 . 1 1 19 19 MET HA H 19 4.286 4.286 4.108 0.178 25343 646 1 17 . 1 1 19 19 MET H H 19 8.256 8.256 8.630 -0.374 25343 647 1 17 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.380 0.063 25343 648 1 17 . 1 1 20 20 ASP H H 20 8.166 8.166 7.902 0.264 25343 649 1 17 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.234 -0.111 25343 650 1 17 . 1 1 21 21 LEU H H 21 8.000 8.000 8.184 -0.184 25343 651 1 17 . 1 1 23 23 THR HA H 23 4.122 4.122 4.370 -0.248 25343 652 1 17 . 1 1 23 23 THR H H 23 7.902 7.902 7.377 0.525 25343 653 1 17 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.009 0.211 25343 654 1 17 . 1 1 24 24 GLN H H 24 8.105 8.105 7.894 0.211 25343 655 1 17 . 1 1 25 25 SER HA H 25 4.335 4.335 4.377 -0.042 25343 656 1 17 . 1 1 25 25 SER H H 25 8.210 8.210 8.403 -0.193 25343 657 1 17 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.326 -0.208 25343 658 1 17 . 1 1 26 26 LEU H H 26 8.150 8.150 7.972 0.178 25343 659 1 17 . 1 1 27 27 GLY H H 27 8.266 8.266 8.240 0.026 25343 660 1 17 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.985 0.113 25343 661 1 17 . 1 1 28 28 VAL H H 28 7.853 7.853 8.224 -0.371 25343 662 1 17 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.464 0.140 25343 663 1 17 . 1 1 29 29 ASP H H 29 8.400 8.400 8.759 -0.359 25343 664 1 18 . 1 1 8 8 ILE HA H 8 4.065 4.065 4.252 -0.187 25343 665 1 18 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.673 -0.223 25343 666 1 18 . 1 1 9 9 ASP H H 9 8.333 8.333 7.811 0.522 25343 667 1 18 . 1 1 10 10 GLN HA H 10 4.126 4.126 3.983 0.143 25343 668 1 18 . 1 1 10 10 GLN H H 10 8.245 8.245 8.631 -0.386 25343 669 1 18 . 1 1 11 11 MET HA H 11 4.217 4.217 3.825 0.392 25343 670 1 18 . 1 1 11 11 MET H H 11 8.282 8.282 7.816 0.466 25343 671 1 18 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.082 0.408 25343 672 1 18 . 1 1 12 12 PHE H H 12 8.110 8.110 7.032 1.078 25343 673 1 18 . 1 1 13 13 SER HA H 13 4.299 4.299 4.144 0.155 25343 674 1 18 . 1 1 13 13 SER H H 13 8.115 8.115 8.991 -0.876 25343 675 1 18 . 1 1 14 14 THR HA H 14 4.179 4.179 4.039 0.140 25343 676 1 18 . 1 1 14 14 THR H H 14 8.048 8.048 8.274 -0.226 25343 677 1 18 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.323 -0.200 25343 678 1 18 . 1 1 15 15 LEU H H 15 7.900 7.900 8.381 -0.481 25343 679 1 18 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.100 0.113 25343 680 1 18 . 1 1 16 16 LEU H H 16 8.048 8.048 9.072 -1.024 25343 681 1 18 . 1 1 17 17 GLY H H 17 8.208 8.208 8.287 -0.079 25343 682 1 18 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.016 0.107 25343 683 1 18 . 1 1 18 18 GLU H H 18 8.149 8.149 7.642 0.507 25343 684 1 18 . 1 1 19 19 MET HA H 19 4.286 4.286 4.230 0.056 25343 685 1 18 . 1 1 19 19 MET H H 19 8.256 8.256 8.383 -0.127 25343 686 1 18 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.396 0.047 25343 687 1 18 . 1 1 20 20 ASP H H 20 8.166 8.166 8.212 -0.046 25343 688 1 18 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.147 -0.024 25343 689 1 18 . 1 1 21 21 LEU H H 21 8.000 8.000 7.498 0.502 25343 690 1 18 . 1 1 23 23 THR HA H 23 4.122 4.122 4.411 -0.289 25343 691 1 18 . 1 1 23 23 THR H H 23 7.902 7.902 7.592 0.310 25343 692 1 18 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.048 0.172 25343 693 1 18 . 1 1 24 24 GLN H H 24 8.105 8.105 8.600 -0.495 25343 694 1 18 . 1 1 25 25 SER HA H 25 4.335 4.335 4.515 -0.180 25343 695 1 18 . 1 1 25 25 SER H H 25 8.210 8.210 8.055 0.155 25343 696 1 18 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.652 -0.534 25343 697 1 18 . 1 1 26 26 LEU H H 26 8.150 8.150 8.032 0.118 25343 698 1 18 . 1 1 27 27 GLY H H 27 8.266 8.266 8.583 -0.317 25343 699 1 18 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.168 -0.070 25343 700 1 18 . 1 1 28 28 VAL H H 28 7.853 7.853 7.712 0.141 25343 701 1 18 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.710 -0.106 25343 702 1 18 . 1 1 29 29 ASP H H 29 8.400 8.400 7.967 0.433 25343 703 1 19 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.411 0.654 25343 704 1 19 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.388 0.062 25343 705 1 19 . 1 1 9 9 ASP H H 9 8.333 8.333 8.753 -0.420 25343 706 1 19 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.059 0.067 25343 707 1 19 . 1 1 10 10 GLN H H 10 8.245 8.245 8.458 -0.213 25343 708 1 19 . 1 1 11 11 MET HA H 11 4.217 4.217 3.792 0.425 25343 709 1 19 . 1 1 11 11 MET H H 11 8.282 8.282 7.618 0.664 25343 710 1 19 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.069 0.421 25343 711 1 19 . 1 1 12 12 PHE H H 12 8.110 8.110 7.162 0.948 25343 712 1 19 . 1 1 13 13 SER HA H 13 4.299 4.299 4.272 0.027 25343 713 1 19 . 1 1 13 13 SER H H 13 8.115 8.115 8.352 -0.237 25343 714 1 19 . 1 1 14 14 THR HA H 14 4.179 4.179 3.960 0.219 25343 715 1 19 . 1 1 14 14 THR H H 14 8.048 8.048 8.583 -0.535 25343 716 1 19 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.323 -0.200 25343 717 1 19 . 1 1 15 15 LEU H H 15 7.900 7.900 8.503 -0.603 25343 718 1 19 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.046 0.167 25343 719 1 19 . 1 1 16 16 LEU H H 16 8.048 8.048 8.593 -0.545 25343 720 1 19 . 1 1 17 17 GLY H H 17 8.208 8.208 8.745 -0.537 25343 721 1 19 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.017 0.106 25343 722 1 19 . 1 1 18 18 GLU H H 18 8.149 8.149 7.601 0.548 25343 723 1 19 . 1 1 19 19 MET HA H 19 4.286 4.286 4.126 0.160 25343 724 1 19 . 1 1 19 19 MET H H 19 8.256 8.256 8.612 -0.356 25343 725 1 19 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.357 0.086 25343 726 1 19 . 1 1 20 20 ASP H H 20 8.166 8.166 7.838 0.328 25343 727 1 19 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.240 -0.117 25343 728 1 19 . 1 1 21 21 LEU H H 21 8.000 8.000 7.675 0.325 25343 729 1 19 . 1 1 23 23 THR HA H 23 4.122 4.122 4.409 -0.287 25343 730 1 19 . 1 1 23 23 THR H H 23 7.902 7.902 7.353 0.549 25343 731 1 19 . 1 1 24 24 GLN HA H 24 4.220 4.220 3.835 0.385 25343 732 1 19 . 1 1 24 24 GLN H H 24 8.105 8.105 8.012 0.093 25343 733 1 19 . 1 1 25 25 SER HA H 25 4.335 4.335 3.912 0.423 25343 734 1 19 . 1 1 25 25 SER H H 25 8.210 8.210 8.614 -0.404 25343 735 1 19 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.060 0.058 25343 736 1 19 . 1 1 26 26 LEU H H 26 8.150 8.150 8.121 0.029 25343 737 1 19 . 1 1 27 27 GLY H H 27 8.266 8.266 8.076 0.190 25343 738 1 19 . 1 1 28 28 VAL HA H 28 4.098 4.098 3.837 0.261 25343 739 1 19 . 1 1 28 28 VAL H H 28 7.853 7.853 7.794 0.059 25343 740 1 19 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.779 -0.175 25343 741 1 19 . 1 1 29 29 ASP H H 29 8.400 8.400 8.100 0.300 25343 742 1 20 . 1 1 8 8 ILE HA H 8 4.065 4.065 3.675 0.390 25343 743 1 20 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.656 -0.206 25343 744 1 20 . 1 1 9 9 ASP H H 9 8.333 8.333 8.350 -0.017 25343 745 1 20 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.495 -0.369 25343 746 1 20 . 1 1 10 10 GLN H H 10 8.245 8.245 8.420 -0.175 25343 747 1 20 . 1 1 11 11 MET HA H 11 4.217 4.217 3.766 0.451 25343 748 1 20 . 1 1 11 11 MET H H 11 8.282 8.282 8.158 0.124 25343 749 1 20 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.067 0.423 25343 750 1 20 . 1 1 12 12 PHE H H 12 8.110 8.110 6.862 1.248 25343 751 1 20 . 1 1 13 13 SER HA H 13 4.299 4.299 4.343 -0.044 25343 752 1 20 . 1 1 13 13 SER H H 13 8.115 8.115 8.803 -0.688 25343 753 1 20 . 1 1 14 14 THR HA H 14 4.179 4.179 4.159 0.020 25343 754 1 20 . 1 1 14 14 THR H H 14 8.048 8.048 7.892 0.156 25343 755 1 20 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.735 -0.612 25343 756 1 20 . 1 1 15 15 LEU H H 15 7.900 7.900 8.340 -0.440 25343 757 1 20 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.103 0.110 25343 758 1 20 . 1 1 16 16 LEU H H 16 8.048 8.048 8.821 -0.773 25343 759 1 20 . 1 1 17 17 GLY H H 17 8.208 8.208 8.015 0.193 25343 760 1 20 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.122 0.001 25343 761 1 20 . 1 1 18 18 GLU H H 18 8.149 8.149 7.769 0.380 25343 762 1 20 . 1 1 19 19 MET HA H 19 4.286 4.286 4.107 0.179 25343 763 1 20 . 1 1 19 19 MET H H 19 8.256 8.256 8.534 -0.278 25343 764 1 20 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.374 0.069 25343 765 1 20 . 1 1 20 20 ASP H H 20 8.166 8.166 7.827 0.339 25343 766 1 20 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.228 -0.105 25343 767 1 20 . 1 1 21 21 LEU H H 21 8.000 8.000 7.992 0.008 25343 768 1 20 . 1 1 23 23 THR HA H 23 4.122 4.122 4.427 -0.305 25343 769 1 20 . 1 1 23 23 THR H H 23 7.902 7.902 7.603 0.299 25343 770 1 20 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.670 -0.450 25343 771 1 20 . 1 1 24 24 GLN H H 24 8.105 8.105 7.675 0.430 25343 772 1 20 . 1 1 25 25 SER HA H 25 4.335 4.335 4.392 -0.057 25343 773 1 20 . 1 1 25 25 SER H H 25 8.210 8.210 8.881 -0.671 25343 774 1 20 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.424 -0.306 25343 775 1 20 . 1 1 26 26 LEU H H 26 8.150 8.150 8.487 -0.337 25343 776 1 20 . 1 1 27 27 GLY H H 27 8.266 8.266 8.400 -0.134 25343 777 1 20 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.146 -0.048 25343 778 1 20 . 1 1 28 28 VAL H H 28 7.853 7.853 7.589 0.264 25343 779 1 20 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.601 0.003 25343 780 1 20 . 1 1 29 29 ASP H H 29 8.400 8.400 7.988 0.412 25343 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 25343 2 1 1 "Average Difference" HA 22 0.222 0.007 0.227 25343 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25343 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25343 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25343 6 1 1 "Average Difference" HN 20 0.426 0.079 0.429 25343 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25343 8 1 2 "Average Difference" HA 22 0.266 -0.043 0.268 25343 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25343 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25343 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25343 12 1 2 "Average Difference" HN 20 0.447 0.031 0.457 25343 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25343 14 1 3 "Average Difference" HA 22 0.207 -0.046 0.206 25343 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25343 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25343 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25343 18 1 3 "Average Difference" HN 20 0.451 0.062 0.458 25343 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25343 20 1 4 "Average Difference" HA 22 0.247 -0.024 0.251 25343 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25343 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25343 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25343 24 1 4 "Average Difference" HN 20 0.465 -0.049 0.474 25343 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25343 26 1 5 "Average Difference" HA 22 0.228 -0.047 0.229 25343 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25343 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25343 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25343 30 1 5 "Average Difference" HN 20 0.409 0.007 0.419 25343 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25343 32 1 6 "Average Difference" HA 22 0.213 -0.042 0.213 25343 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25343 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25343 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25343 36 1 6 "Average Difference" HN 20 0.447 0.081 0.451 25343 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25343 38 1 7 "Average Difference" HA 22 0.239 -0.084 0.230 25343 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25343 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25343 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25343 42 1 7 "Average Difference" HN 20 0.447 0.082 0.451 25343 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25343 44 1 8 "Average Difference" HA 22 0.251 0.013 0.256 25343 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25343 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25343 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25343 48 1 8 "Average Difference" HN 20 0.406 -0.024 0.415 25343 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25343 50 1 9 "Average Difference" HA 22 0.232 -0.062 0.229 25343 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25343 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25343 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25343 54 1 9 "Average Difference" HN 20 0.482 -0.099 0.484 25343 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25343 56 1 10 "Average Difference" HA 22 0.239 -0.064 0.236 25343 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25343 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25343 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25343 60 1 10 "Average Difference" HN 20 0.524 -0.068 0.533 25343 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25343 62 1 11 "Average Difference" HA 22 0.223 -0.064 0.218 25343 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25343 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25343 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25343 66 1 11 "Average Difference" HN 20 0.445 0.035 0.455 25343 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25343 68 1 12 "Average Difference" HA 22 0.215 -0.048 0.215 25343 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25343 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25343 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25343 72 1 12 "Average Difference" HN 20 0.435 -0.003 0.446 25343 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25343 74 1 13 "Average Difference" HA 22 0.256 -0.094 0.243 25343 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25343 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25343 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25343 78 1 13 "Average Difference" HN 20 0.435 -0.011 0.446 25343 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25343 80 1 14 "Average Difference" HA 22 0.234 -0.024 0.238 25343 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25343 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25343 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25343 84 1 14 "Average Difference" HN 20 0.416 0.066 0.421 25343 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25343 86 1 15 "Average Difference" HA 22 0.239 -0.008 0.244 25343 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25343 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25343 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25343 90 1 15 "Average Difference" HN 20 0.460 0.054 0.468 25343 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25343 92 1 16 "Average Difference" HA 22 0.204 -0.044 0.204 25343 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25343 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25343 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25343 96 1 16 "Average Difference" HN 20 0.434 0.061 0.441 25343 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25343 98 1 17 "Average Difference" HA 22 0.274 -0.088 0.266 25343 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25343 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25343 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25343 102 1 17 "Average Difference" HN 20 0.477 0.010 0.490 25343 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25343 104 1 18 "Average Difference" HA 22 0.232 -0.031 0.235 25343 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25343 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25343 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25343 108 1 18 "Average Difference" HN 20 0.506 -0.009 0.519 25343 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25343 110 1 19 "Average Difference" HA 22 0.262 -0.135 0.230 25343 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25343 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25343 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25343 114 1 19 "Average Difference" HN 20 0.453 -0.009 0.464 25343 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25343 116 1 20 "Average Difference" HA 22 0.268 0.026 0.273 25343 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25343 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25343 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25343 120 1 20 "Average Difference" HN 20 0.467 -0.017 0.479 25343 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 25343 _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 8 8 ILE HA H 8 4.065 4.065 3.938 0.127 25343 2 1 . 1 1 9 9 ASP HA H 9 4.450 4.450 4.693 -0.243 25343 3 1 . 1 1 9 9 ASP H H 9 8.333 8.333 8.525 -0.192 25343 4 1 . 1 1 10 10 GLN HA H 10 4.126 4.126 4.379 -0.253 25343 5 1 . 1 1 10 10 GLN H H 10 8.245 8.245 8.251 -0.006 25343 6 1 . 1 1 11 11 MET HA H 11 4.217 4.217 3.783 0.434 25343 7 1 . 1 1 11 11 MET H H 11 8.282 8.282 8.085 0.197 25343 8 1 . 1 1 12 12 PHE HA H 12 4.490 4.490 4.062 0.428 25343 9 1 . 1 1 12 12 PHE H H 12 8.110 8.110 7.057 1.053 25343 10 1 . 1 1 13 13 SER HA H 13 4.299 4.299 4.267 0.032 25343 11 1 . 1 1 13 13 SER H H 13 8.115 8.115 8.525 -0.410 25343 12 1 . 1 1 14 14 THR HA H 14 4.179 4.179 4.012 0.167 25343 13 1 . 1 1 14 14 THR H H 14 8.048 8.048 8.355 -0.307 25343 14 1 . 1 1 15 15 LEU HA H 15 4.123 4.123 4.383 -0.260 25343 15 1 . 1 1 15 15 LEU H H 15 7.900 7.900 8.390 -0.490 25343 16 1 . 1 1 16 16 LEU HA H 16 4.213 4.213 4.057 0.156 25343 17 1 . 1 1 16 16 LEU H H 16 8.048 8.048 8.845 -0.797 25343 18 1 . 1 1 17 17 GLY H H 17 8.208 8.208 8.484 -0.276 25343 19 1 . 1 1 18 18 GLU HA H 18 4.123 4.123 4.097 0.026 25343 20 1 . 1 1 18 18 GLU H H 18 8.149 8.149 7.679 0.470 25343 21 1 . 1 1 19 19 MET HA H 19 4.286 4.286 4.145 0.141 25343 22 1 . 1 1 19 19 MET H H 19 8.256 8.256 8.591 -0.335 25343 23 1 . 1 1 20 20 ASP HA H 20 4.443 4.443 4.369 0.074 25343 24 1 . 1 1 20 20 ASP H H 20 8.166 8.166 7.914 0.252 25343 25 1 . 1 1 21 21 LEU HA H 21 4.123 4.123 4.212 -0.089 25343 26 1 . 1 1 21 21 LEU H H 21 8.000 8.000 7.794 0.206 25343 27 1 . 1 1 23 23 THR HA H 23 4.122 4.122 4.428 -0.306 25343 28 1 . 1 1 23 23 THR H H 23 7.902 7.902 7.497 0.405 25343 29 1 . 1 1 24 24 GLN HA H 24 4.220 4.220 4.000 0.220 25343 30 1 . 1 1 24 24 GLN H H 24 8.105 8.105 8.248 -0.143 25343 31 1 . 1 1 25 25 SER HA H 25 4.335 4.335 4.363 -0.028 25343 32 1 . 1 1 25 25 SER H H 25 8.210 8.210 8.316 -0.106 25343 33 1 . 1 1 26 26 LEU HA H 26 4.118 4.118 4.204 -0.086 25343 34 1 . 1 1 26 26 LEU H H 26 8.150 8.150 8.002 0.148 25343 35 1 . 1 1 27 27 GLY H H 27 8.266 8.266 8.264 0.002 25343 36 1 . 1 1 28 28 VAL HA H 28 4.098 4.098 4.069 0.030 25343 37 1 . 1 1 28 28 VAL H H 28 7.853 7.853 7.883 -0.030 25343 38 1 . 1 1 29 29 ASP HA H 29 4.604 4.604 4.623 -0.019 25343 39 1 . 1 1 29 29 ASP H H 29 8.400 8.400 8.322 0.078 25343 stop_ save_