data_25539 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25539 _Entry.PDB_ID 2N0X 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 25539 _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 VAL HA H 2 4.243 4.243 4.255 -0.012 25539 2 1 1 . 1 1 2 2 VAL H H 2 8.400 8.400 8.302 0.098 25539 3 1 1 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.247 0.045 25539 4 1 1 . 1 1 3 3 ARG H H 3 8.389 8.389 8.003 0.386 25539 5 1 1 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.840 -0.200 25539 6 1 1 . 1 1 4 4 TYR H H 4 8.389 8.389 7.288 1.101 25539 7 1 1 . 1 1 5 5 THR HA H 5 4.601 4.601 4.344 0.257 25539 8 1 1 . 1 1 5 5 THR H H 5 8.181 8.181 8.346 -0.165 25539 9 1 1 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.118 0.122 25539 10 1 1 . 1 1 6 6 LYS H H 6 8.449 8.449 8.577 -0.128 25539 11 1 1 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.335 -0.043 25539 12 1 1 . 1 1 7 7 LYS H H 7 8.356 8.356 7.444 0.912 25539 13 1 1 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.037 0.368 25539 14 1 1 . 1 1 8 8 VAL H H 8 8.202 8.202 8.339 -0.137 25539 15 1 1 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.326 0.032 25539 16 1 1 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.380 -0.061 25539 17 1 1 . 1 1 10 10 GLN H H 10 8.428 8.428 7.677 0.751 25539 18 1 1 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.894 0.276 25539 19 1 1 . 1 1 11 11 VAL H H 11 8.214 8.214 8.147 0.067 25539 20 1 1 . 1 1 12 12 SER HA H 12 4.508 4.508 4.650 -0.142 25539 21 1 1 . 1 1 12 12 SER H H 12 8.435 8.435 7.806 0.629 25539 22 1 1 . 1 1 13 13 THR HA H 13 4.263 4.263 4.659 -0.396 25539 23 1 1 . 1 1 13 13 THR H H 13 8.187 8.187 7.742 0.445 25539 24 1 1 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.491 -0.026 25539 25 1 1 . 1 1 15 15 THR HA H 15 4.291 4.291 4.520 -0.229 25539 26 1 1 . 1 1 15 15 THR H H 15 8.265 8.265 8.262 0.003 25539 27 1 2 . 1 1 2 2 VAL HA H 2 4.243 4.243 3.834 0.409 25539 28 1 2 . 1 1 2 2 VAL H H 2 8.400 8.400 8.206 0.194 25539 29 1 2 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.236 0.056 25539 30 1 2 . 1 1 3 3 ARG H H 3 8.389 8.389 8.277 0.112 25539 31 1 2 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.684 -0.044 25539 32 1 2 . 1 1 4 4 TYR H H 4 8.389 8.389 7.476 0.913 25539 33 1 2 . 1 1 5 5 THR HA H 5 4.601 4.601 4.216 0.385 25539 34 1 2 . 1 1 5 5 THR H H 5 8.181 8.181 8.504 -0.323 25539 35 1 2 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.354 -0.114 25539 36 1 2 . 1 1 6 6 LYS H H 6 8.449 8.449 8.657 -0.208 25539 37 1 2 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.353 -0.061 25539 38 1 2 . 1 1 7 7 LYS H H 7 8.356 8.356 7.868 0.488 25539 39 1 2 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.106 0.299 25539 40 1 2 . 1 1 8 8 VAL H H 8 8.202 8.202 8.477 -0.275 25539 41 1 2 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.427 -0.069 25539 42 1 2 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.555 -0.236 25539 43 1 2 . 1 1 10 10 GLN H H 10 8.428 8.428 7.891 0.537 25539 44 1 2 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.863 0.307 25539 45 1 2 . 1 1 11 11 VAL H H 11 8.214 8.214 8.224 -0.010 25539 46 1 2 . 1 1 12 12 SER HA H 12 4.508 4.508 4.511 -0.003 25539 47 1 2 . 1 1 12 12 SER H H 12 8.435 8.435 7.782 0.653 25539 48 1 2 . 1 1 13 13 THR HA H 13 4.263 4.263 4.593 -0.330 25539 49 1 2 . 1 1 13 13 THR H H 13 8.187 8.187 7.936 0.251 25539 50 1 2 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.559 -0.094 25539 51 1 2 . 1 1 15 15 THR HA H 15 4.291 4.291 4.300 -0.009 25539 52 1 2 . 1 1 15 15 THR H H 15 8.265 8.265 8.258 0.007 25539 53 1 3 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.116 0.127 25539 54 1 3 . 1 1 2 2 VAL H H 2 8.400 8.400 7.928 0.472 25539 55 1 3 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.029 0.263 25539 56 1 3 . 1 1 3 3 ARG H H 3 8.389 8.389 8.091 0.298 25539 57 1 3 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.765 -0.125 25539 58 1 3 . 1 1 4 4 TYR H H 4 8.389 8.389 7.221 1.168 25539 59 1 3 . 1 1 5 5 THR HA H 5 4.601 4.601 4.257 0.344 25539 60 1 3 . 1 1 5 5 THR H H 5 8.181 8.181 8.406 -0.225 25539 61 1 3 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.122 0.118 25539 62 1 3 . 1 1 6 6 LYS H H 6 8.449 8.449 8.590 -0.141 25539 63 1 3 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.351 -0.059 25539 64 1 3 . 1 1 7 7 LYS H H 7 8.356 8.356 7.432 0.924 25539 65 1 3 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.045 0.360 25539 66 1 3 . 1 1 8 8 VAL H H 8 8.202 8.202 8.342 -0.140 25539 67 1 3 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.504 -0.146 25539 68 1 3 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.433 -0.114 25539 69 1 3 . 1 1 10 10 GLN H H 10 8.428 8.428 7.795 0.633 25539 70 1 3 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.864 0.306 25539 71 1 3 . 1 1 11 11 VAL H H 11 8.214 8.214 8.259 -0.045 25539 72 1 3 . 1 1 12 12 SER HA H 12 4.508 4.508 4.524 -0.016 25539 73 1 3 . 1 1 12 12 SER H H 12 8.435 8.435 8.052 0.383 25539 74 1 3 . 1 1 13 13 THR HA H 13 4.263 4.263 4.774 -0.511 25539 75 1 3 . 1 1 13 13 THR H H 13 8.187 8.187 7.676 0.511 25539 76 1 3 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.493 -0.028 25539 77 1 3 . 1 1 15 15 THR HA H 15 4.291 4.291 4.540 -0.249 25539 78 1 3 . 1 1 15 15 THR H H 15 8.265 8.265 8.068 0.197 25539 79 1 4 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.114 0.129 25539 80 1 4 . 1 1 2 2 VAL H H 2 8.400 8.400 8.041 0.359 25539 81 1 4 . 1 1 3 3 ARG HA H 3 4.292 4.292 3.951 0.341 25539 82 1 4 . 1 1 3 3 ARG H H 3 8.389 8.389 8.000 0.389 25539 83 1 4 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.760 -0.120 25539 84 1 4 . 1 1 4 4 TYR H H 4 8.389 8.389 7.260 1.129 25539 85 1 4 . 1 1 5 5 THR HA H 5 4.601 4.601 4.206 0.395 25539 86 1 4 . 1 1 5 5 THR H H 5 8.181 8.181 8.372 -0.191 25539 87 1 4 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.176 0.064 25539 88 1 4 . 1 1 6 6 LYS H H 6 8.449 8.449 8.532 -0.083 25539 89 1 4 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.362 -0.070 25539 90 1 4 . 1 1 7 7 LYS H H 7 8.356 8.356 7.465 0.891 25539 91 1 4 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.018 0.387 25539 92 1 4 . 1 1 8 8 VAL H H 8 8.202 8.202 8.363 -0.161 25539 93 1 4 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.493 -0.135 25539 94 1 4 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.509 -0.190 25539 95 1 4 . 1 1 10 10 GLN H H 10 8.428 8.428 7.867 0.561 25539 96 1 4 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.930 0.240 25539 97 1 4 . 1 1 11 11 VAL H H 11 8.214 8.214 8.283 -0.069 25539 98 1 4 . 1 1 12 12 SER HA H 12 4.508 4.508 4.632 -0.124 25539 99 1 4 . 1 1 12 12 SER H H 12 8.435 8.435 7.746 0.689 25539 100 1 4 . 1 1 13 13 THR HA H 13 4.263 4.263 4.853 -0.590 25539 101 1 4 . 1 1 13 13 THR H H 13 8.187 8.187 8.050 0.137 25539 102 1 4 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.710 -0.245 25539 103 1 4 . 1 1 15 15 THR HA H 15 4.291 4.291 4.558 -0.267 25539 104 1 4 . 1 1 15 15 THR H H 15 8.265 8.265 8.331 -0.066 25539 105 1 5 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.147 0.096 25539 106 1 5 . 1 1 2 2 VAL H H 2 8.400 8.400 8.447 -0.047 25539 107 1 5 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.251 0.041 25539 108 1 5 . 1 1 3 3 ARG H H 3 8.389 8.389 8.129 0.260 25539 109 1 5 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.783 -0.143 25539 110 1 5 . 1 1 4 4 TYR H H 4 8.389 8.389 7.237 1.152 25539 111 1 5 . 1 1 5 5 THR HA H 5 4.601 4.601 4.264 0.337 25539 112 1 5 . 1 1 5 5 THR H H 5 8.181 8.181 8.418 -0.237 25539 113 1 5 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.095 0.145 25539 114 1 5 . 1 1 6 6 LYS H H 6 8.449 8.449 8.616 -0.167 25539 115 1 5 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.373 -0.081 25539 116 1 5 . 1 1 7 7 LYS H H 7 8.356 8.356 7.393 0.963 25539 117 1 5 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.067 0.338 25539 118 1 5 . 1 1 8 8 VAL H H 8 8.202 8.202 8.324 -0.122 25539 119 1 5 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.503 -0.145 25539 120 1 5 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.462 -0.143 25539 121 1 5 . 1 1 10 10 GLN H H 10 8.428 8.428 8.022 0.406 25539 122 1 5 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.953 0.217 25539 123 1 5 . 1 1 11 11 VAL H H 11 8.214 8.214 8.233 -0.019 25539 124 1 5 . 1 1 12 12 SER HA H 12 4.508 4.508 4.655 -0.147 25539 125 1 5 . 1 1 12 12 SER H H 12 8.435 8.435 7.928 0.507 25539 126 1 5 . 1 1 13 13 THR HA H 13 4.263 4.263 4.807 -0.544 25539 127 1 5 . 1 1 13 13 THR H H 13 8.187 8.187 7.672 0.515 25539 128 1 5 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.460 0.005 25539 129 1 5 . 1 1 15 15 THR HA H 15 4.291 4.291 4.616 -0.325 25539 130 1 5 . 1 1 15 15 THR H H 15 8.265 8.265 8.320 -0.055 25539 131 1 6 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.443 -0.200 25539 132 1 6 . 1 1 2 2 VAL H H 2 8.400 8.400 8.304 0.096 25539 133 1 6 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.165 0.127 25539 134 1 6 . 1 1 3 3 ARG H H 3 8.389 8.389 8.118 0.271 25539 135 1 6 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.689 -0.049 25539 136 1 6 . 1 1 4 4 TYR H H 4 8.389 8.389 7.875 0.514 25539 137 1 6 . 1 1 5 5 THR HA H 5 4.601 4.601 4.598 0.003 25539 138 1 6 . 1 1 5 5 THR H H 5 8.181 8.181 7.755 0.426 25539 139 1 6 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.122 0.118 25539 140 1 6 . 1 1 6 6 LYS H H 6 8.449 8.449 8.621 -0.172 25539 141 1 6 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.304 -0.012 25539 142 1 6 . 1 1 7 7 LYS H H 7 8.356 8.356 7.907 0.449 25539 143 1 6 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.153 0.252 25539 144 1 6 . 1 1 8 8 VAL H H 8 8.202 8.202 8.331 -0.129 25539 145 1 6 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.583 -0.225 25539 146 1 6 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.340 -0.021 25539 147 1 6 . 1 1 10 10 GLN H H 10 8.428 8.428 8.812 -0.384 25539 148 1 6 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.201 -0.031 25539 149 1 6 . 1 1 11 11 VAL H H 11 8.214 8.214 8.384 -0.170 25539 150 1 6 . 1 1 12 12 SER HA H 12 4.508 4.508 4.527 -0.019 25539 151 1 6 . 1 1 12 12 SER H H 12 8.435 8.435 8.415 0.020 25539 152 1 6 . 1 1 13 13 THR HA H 13 4.263 4.263 4.691 -0.428 25539 153 1 6 . 1 1 13 13 THR H H 13 8.187 8.187 7.743 0.444 25539 154 1 6 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.518 -0.052 25539 155 1 6 . 1 1 15 15 THR HA H 15 4.291 4.291 4.618 -0.327 25539 156 1 6 . 1 1 15 15 THR H H 15 8.265 8.265 8.132 0.133 25539 157 1 7 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.386 -0.143 25539 158 1 7 . 1 1 2 2 VAL H H 2 8.400 8.400 7.980 0.420 25539 159 1 7 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.004 0.288 25539 160 1 7 . 1 1 3 3 ARG H H 3 8.389 8.389 7.946 0.443 25539 161 1 7 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.818 -0.178 25539 162 1 7 . 1 1 4 4 TYR H H 4 8.389 8.389 7.183 1.206 25539 163 1 7 . 1 1 5 5 THR HA H 5 4.601 4.601 4.189 0.412 25539 164 1 7 . 1 1 5 5 THR H H 5 8.181 8.181 8.432 -0.251 25539 165 1 7 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.117 0.123 25539 166 1 7 . 1 1 6 6 LYS H H 6 8.449 8.449 8.619 -0.170 25539 167 1 7 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.362 -0.070 25539 168 1 7 . 1 1 7 7 LYS H H 7 8.356 8.356 7.410 0.946 25539 169 1 7 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.038 0.367 25539 170 1 7 . 1 1 8 8 VAL H H 8 8.202 8.202 8.337 -0.135 25539 171 1 7 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.531 -0.173 25539 172 1 7 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.391 -0.072 25539 173 1 7 . 1 1 10 10 GLN H H 10 8.428 8.428 7.902 0.526 25539 174 1 7 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.885 0.285 25539 175 1 7 . 1 1 11 11 VAL H H 11 8.214 8.214 8.329 -0.115 25539 176 1 7 . 1 1 12 12 SER HA H 12 4.508 4.508 4.610 -0.102 25539 177 1 7 . 1 1 12 12 SER H H 12 8.435 8.435 8.106 0.329 25539 178 1 7 . 1 1 13 13 THR HA H 13 4.263 4.263 4.794 -0.531 25539 179 1 7 . 1 1 13 13 THR H H 13 8.187 8.187 7.539 0.648 25539 180 1 7 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.457 0.008 25539 181 1 7 . 1 1 15 15 THR HA H 15 4.291 4.291 4.590 -0.299 25539 182 1 7 . 1 1 15 15 THR H H 15 8.265 8.265 8.316 -0.051 25539 183 1 8 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.417 -0.174 25539 184 1 8 . 1 1 2 2 VAL H H 2 8.400 8.400 8.197 0.203 25539 185 1 8 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.015 0.277 25539 186 1 8 . 1 1 3 3 ARG H H 3 8.389 8.389 8.096 0.293 25539 187 1 8 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.836 -0.196 25539 188 1 8 . 1 1 4 4 TYR H H 4 8.389 8.389 7.223 1.166 25539 189 1 8 . 1 1 5 5 THR HA H 5 4.601 4.601 4.222 0.379 25539 190 1 8 . 1 1 5 5 THR H H 5 8.181 8.181 8.432 -0.251 25539 191 1 8 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.095 0.145 25539 192 1 8 . 1 1 6 6 LYS H H 6 8.449 8.449 8.551 -0.102 25539 193 1 8 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.392 -0.100 25539 194 1 8 . 1 1 7 7 LYS H H 7 8.356 8.356 7.433 0.923 25539 195 1 8 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.092 0.313 25539 196 1 8 . 1 1 8 8 VAL H H 8 8.202 8.202 8.349 -0.147 25539 197 1 8 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.523 -0.165 25539 198 1 8 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.565 -0.246 25539 199 1 8 . 1 1 10 10 GLN H H 10 8.428 8.428 8.234 0.194 25539 200 1 8 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.740 0.430 25539 201 1 8 . 1 1 11 11 VAL H H 11 8.214 8.214 8.337 -0.123 25539 202 1 8 . 1 1 12 12 SER HA H 12 4.508 4.508 4.684 -0.176 25539 203 1 8 . 1 1 12 12 SER H H 12 8.435 8.435 7.949 0.486 25539 204 1 8 . 1 1 13 13 THR HA H 13 4.263 4.263 4.656 -0.393 25539 205 1 8 . 1 1 13 13 THR H H 13 8.187 8.187 8.171 0.016 25539 206 1 8 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.503 -0.038 25539 207 1 8 . 1 1 15 15 THR HA H 15 4.291 4.291 4.543 -0.252 25539 208 1 8 . 1 1 15 15 THR H H 15 8.265 8.265 8.314 -0.049 25539 209 1 9 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.135 0.108 25539 210 1 9 . 1 1 2 2 VAL H H 2 8.400 8.400 8.518 -0.118 25539 211 1 9 . 1 1 3 3 ARG HA H 3 4.292 4.292 3.830 0.462 25539 212 1 9 . 1 1 3 3 ARG H H 3 8.389 8.389 8.117 0.272 25539 213 1 9 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.695 -0.055 25539 214 1 9 . 1 1 4 4 TYR H H 4 8.389 8.389 7.727 0.662 25539 215 1 9 . 1 1 5 5 THR HA H 5 4.601 4.601 4.558 0.043 25539 216 1 9 . 1 1 5 5 THR H H 5 8.181 8.181 7.821 0.360 25539 217 1 9 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.288 -0.048 25539 218 1 9 . 1 1 6 6 LYS H H 6 8.449 8.449 8.526 -0.077 25539 219 1 9 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.309 -0.017 25539 220 1 9 . 1 1 7 7 LYS H H 7 8.356 8.356 7.466 0.890 25539 221 1 9 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.090 0.315 25539 222 1 9 . 1 1 8 8 VAL H H 8 8.202 8.202 8.205 -0.003 25539 223 1 9 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.576 -0.218 25539 224 1 9 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.430 -0.111 25539 225 1 9 . 1 1 10 10 GLN H H 10 8.428 8.428 8.308 0.120 25539 226 1 9 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.758 0.412 25539 227 1 9 . 1 1 11 11 VAL H H 11 8.214 8.214 8.217 -0.003 25539 228 1 9 . 1 1 12 12 SER HA H 12 4.508 4.508 4.596 -0.088 25539 229 1 9 . 1 1 12 12 SER H H 12 8.435 8.435 7.827 0.608 25539 230 1 9 . 1 1 13 13 THR HA H 13 4.263 4.263 4.692 -0.429 25539 231 1 9 . 1 1 13 13 THR H H 13 8.187 8.187 8.071 0.116 25539 232 1 9 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.555 -0.090 25539 233 1 9 . 1 1 15 15 THR HA H 15 4.291 4.291 4.555 -0.264 25539 234 1 9 . 1 1 15 15 THR H H 15 8.265 8.265 8.337 -0.072 25539 235 1 10 . 1 1 2 2 VAL HA H 2 4.243 4.243 3.882 0.361 25539 236 1 10 . 1 1 2 2 VAL H H 2 8.400 8.400 8.169 0.231 25539 237 1 10 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.000 0.292 25539 238 1 10 . 1 1 3 3 ARG H H 3 8.389 8.389 7.950 0.439 25539 239 1 10 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.685 -0.045 25539 240 1 10 . 1 1 4 4 TYR H H 4 8.389 8.389 7.364 1.025 25539 241 1 10 . 1 1 5 5 THR HA H 5 4.601 4.601 4.199 0.402 25539 242 1 10 . 1 1 5 5 THR H H 5 8.181 8.181 8.545 -0.364 25539 243 1 10 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.284 -0.044 25539 244 1 10 . 1 1 6 6 LYS H H 6 8.449 8.449 8.641 -0.192 25539 245 1 10 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.372 -0.080 25539 246 1 10 . 1 1 7 7 LYS H H 7 8.356 8.356 7.816 0.540 25539 247 1 10 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.081 0.324 25539 248 1 10 . 1 1 8 8 VAL H H 8 8.202 8.202 8.277 -0.075 25539 249 1 10 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.577 -0.219 25539 250 1 10 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.522 -0.203 25539 251 1 10 . 1 1 10 10 GLN H H 10 8.428 8.428 8.506 -0.078 25539 252 1 10 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.265 -0.095 25539 253 1 10 . 1 1 11 11 VAL H H 11 8.214 8.214 8.362 -0.148 25539 254 1 10 . 1 1 12 12 SER HA H 12 4.508 4.508 4.599 -0.091 25539 255 1 10 . 1 1 12 12 SER H H 12 8.435 8.435 8.209 0.226 25539 256 1 10 . 1 1 13 13 THR HA H 13 4.263 4.263 4.758 -0.495 25539 257 1 10 . 1 1 13 13 THR H H 13 8.187 8.187 7.897 0.290 25539 258 1 10 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.537 -0.072 25539 259 1 10 . 1 1 15 15 THR HA H 15 4.291 4.291 4.469 -0.178 25539 260 1 10 . 1 1 15 15 THR H H 15 8.265 8.265 8.244 0.021 25539 261 1 11 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.346 -0.103 25539 262 1 11 . 1 1 2 2 VAL H H 2 8.400 8.400 8.053 0.347 25539 263 1 11 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.017 0.275 25539 264 1 11 . 1 1 3 3 ARG H H 3 8.389 8.389 7.906 0.483 25539 265 1 11 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.686 -0.046 25539 266 1 11 . 1 1 4 4 TYR H H 4 8.389 8.389 7.245 1.144 25539 267 1 11 . 1 1 5 5 THR HA H 5 4.601 4.601 4.208 0.393 25539 268 1 11 . 1 1 5 5 THR H H 5 8.181 8.181 8.401 -0.220 25539 269 1 11 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.124 0.116 25539 270 1 11 . 1 1 6 6 LYS H H 6 8.449 8.449 8.620 -0.171 25539 271 1 11 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.503 -0.211 25539 272 1 11 . 1 1 7 7 LYS H H 7 8.356 8.356 7.456 0.900 25539 273 1 11 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.006 0.399 25539 274 1 11 . 1 1 8 8 VAL H H 8 8.202 8.202 8.341 -0.139 25539 275 1 11 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.513 -0.155 25539 276 1 11 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.546 -0.227 25539 277 1 11 . 1 1 10 10 GLN H H 10 8.428 8.428 8.351 0.077 25539 278 1 11 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.916 0.254 25539 279 1 11 . 1 1 11 11 VAL H H 11 8.214 8.214 8.282 -0.068 25539 280 1 11 . 1 1 12 12 SER HA H 12 4.508 4.508 4.724 -0.216 25539 281 1 11 . 1 1 12 12 SER H H 12 8.435 8.435 7.786 0.649 25539 282 1 11 . 1 1 13 13 THR HA H 13 4.263 4.263 4.639 -0.376 25539 283 1 11 . 1 1 13 13 THR H H 13 8.187 8.187 8.244 -0.057 25539 284 1 11 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.479 -0.014 25539 285 1 11 . 1 1 15 15 THR HA H 15 4.291 4.291 4.510 -0.219 25539 286 1 11 . 1 1 15 15 THR H H 15 8.265 8.265 8.251 0.014 25539 287 1 12 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.478 -0.235 25539 288 1 12 . 1 1 2 2 VAL H H 2 8.400 8.400 8.292 0.108 25539 289 1 12 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.381 -0.089 25539 290 1 12 . 1 1 3 3 ARG H H 3 8.389 8.389 8.110 0.279 25539 291 1 12 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.595 0.045 25539 292 1 12 . 1 1 4 4 TYR H H 4 8.389 8.389 7.606 0.783 25539 293 1 12 . 1 1 5 5 THR HA H 5 4.601 4.601 4.498 0.103 25539 294 1 12 . 1 1 5 5 THR H H 5 8.181 8.181 7.479 0.702 25539 295 1 12 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.174 0.066 25539 296 1 12 . 1 1 6 6 LYS H H 6 8.449 8.449 8.471 -0.022 25539 297 1 12 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.310 -0.018 25539 298 1 12 . 1 1 7 7 LYS H H 7 8.356 8.356 7.963 0.393 25539 299 1 12 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.101 0.304 25539 300 1 12 . 1 1 8 8 VAL H H 8 8.202 8.202 8.405 -0.203 25539 301 1 12 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.609 -0.251 25539 302 1 12 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.419 -0.100 25539 303 1 12 . 1 1 10 10 GLN H H 10 8.428 8.428 8.428 0.000 25539 304 1 12 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.191 -0.021 25539 305 1 12 . 1 1 11 11 VAL H H 11 8.214 8.214 8.258 -0.044 25539 306 1 12 . 1 1 12 12 SER HA H 12 4.508 4.508 4.490 0.018 25539 307 1 12 . 1 1 12 12 SER H H 12 8.435 8.435 8.373 0.062 25539 308 1 12 . 1 1 13 13 THR HA H 13 4.263 4.263 4.706 -0.443 25539 309 1 12 . 1 1 13 13 THR H H 13 8.187 8.187 8.106 0.081 25539 310 1 12 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.612 -0.147 25539 311 1 12 . 1 1 15 15 THR HA H 15 4.291 4.291 4.060 0.231 25539 312 1 12 . 1 1 15 15 THR H H 15 8.265 8.265 8.243 0.022 25539 313 1 13 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.431 -0.188 25539 314 1 13 . 1 1 2 2 VAL H H 2 8.400 8.400 8.436 -0.036 25539 315 1 13 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.083 0.209 25539 316 1 13 . 1 1 3 3 ARG H H 3 8.389 8.389 8.158 0.231 25539 317 1 13 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.654 -0.014 25539 318 1 13 . 1 1 4 4 TYR H H 4 8.389 8.389 7.887 0.502 25539 319 1 13 . 1 1 5 5 THR HA H 5 4.601 4.601 4.541 0.060 25539 320 1 13 . 1 1 5 5 THR H H 5 8.181 8.181 7.741 0.440 25539 321 1 13 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.150 0.090 25539 322 1 13 . 1 1 6 6 LYS H H 6 8.449 8.449 8.543 -0.094 25539 323 1 13 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.372 -0.080 25539 324 1 13 . 1 1 7 7 LYS H H 7 8.356 8.356 7.539 0.817 25539 325 1 13 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.081 0.324 25539 326 1 13 . 1 1 8 8 VAL H H 8 8.202 8.202 8.329 -0.127 25539 327 1 13 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.582 -0.224 25539 328 1 13 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.419 -0.100 25539 329 1 13 . 1 1 10 10 GLN H H 10 8.428 8.428 8.363 0.065 25539 330 1 13 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.812 0.358 25539 331 1 13 . 1 1 11 11 VAL H H 11 8.214 8.214 8.463 -0.249 25539 332 1 13 . 1 1 12 12 SER HA H 12 4.508 4.508 4.592 -0.084 25539 333 1 13 . 1 1 12 12 SER H H 12 8.435 8.435 7.778 0.657 25539 334 1 13 . 1 1 13 13 THR HA H 13 4.263 4.263 4.764 -0.501 25539 335 1 13 . 1 1 13 13 THR H H 13 8.187 8.187 8.224 -0.037 25539 336 1 13 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.567 -0.102 25539 337 1 13 . 1 1 15 15 THR HA H 15 4.291 4.291 4.040 0.251 25539 338 1 13 . 1 1 15 15 THR H H 15 8.265 8.265 8.224 0.041 25539 339 1 14 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.216 0.027 25539 340 1 14 . 1 1 2 2 VAL H H 2 8.400 8.400 8.685 -0.285 25539 341 1 14 . 1 1 3 3 ARG HA H 3 4.292 4.292 3.971 0.321 25539 342 1 14 . 1 1 3 3 ARG H H 3 8.389 8.389 8.245 0.144 25539 343 1 14 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.556 0.084 25539 344 1 14 . 1 1 4 4 TYR H H 4 8.389 8.389 7.864 0.525 25539 345 1 14 . 1 1 5 5 THR HA H 5 4.601 4.601 4.526 0.075 25539 346 1 14 . 1 1 5 5 THR H H 5 8.181 8.181 8.048 0.133 25539 347 1 14 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.318 -0.078 25539 348 1 14 . 1 1 6 6 LYS H H 6 8.449 8.449 8.530 -0.081 25539 349 1 14 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.333 -0.041 25539 350 1 14 . 1 1 7 7 LYS H H 7 8.356 8.356 7.362 0.994 25539 351 1 14 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.018 0.387 25539 352 1 14 . 1 1 8 8 VAL H H 8 8.202 8.202 8.381 -0.179 25539 353 1 14 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.503 -0.145 25539 354 1 14 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.366 -0.047 25539 355 1 14 . 1 1 10 10 GLN H H 10 8.428 8.428 8.274 0.154 25539 356 1 14 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.821 0.349 25539 357 1 14 . 1 1 11 11 VAL H H 11 8.214 8.214 8.152 0.062 25539 358 1 14 . 1 1 12 12 SER HA H 12 4.508 4.508 4.656 -0.148 25539 359 1 14 . 1 1 12 12 SER H H 12 8.435 8.435 7.912 0.523 25539 360 1 14 . 1 1 13 13 THR HA H 13 4.263 4.263 4.683 -0.420 25539 361 1 14 . 1 1 13 13 THR H H 13 8.187 8.187 8.046 0.141 25539 362 1 14 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.667 -0.202 25539 363 1 14 . 1 1 15 15 THR HA H 15 4.291 4.291 4.618 -0.327 25539 364 1 14 . 1 1 15 15 THR H H 15 8.265 8.265 8.267 -0.002 25539 365 1 15 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.347 -0.104 25539 366 1 15 . 1 1 2 2 VAL H H 2 8.400 8.400 8.582 -0.182 25539 367 1 15 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.172 0.120 25539 368 1 15 . 1 1 3 3 ARG H H 3 8.389 8.389 8.075 0.314 25539 369 1 15 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.664 -0.024 25539 370 1 15 . 1 1 4 4 TYR H H 4 8.389 8.389 8.224 0.165 25539 371 1 15 . 1 1 5 5 THR HA H 5 4.601 4.601 4.538 0.063 25539 372 1 15 . 1 1 5 5 THR H H 5 8.181 8.181 8.155 0.026 25539 373 1 15 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.107 0.133 25539 374 1 15 . 1 1 6 6 LYS H H 6 8.449 8.449 8.696 -0.247 25539 375 1 15 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.445 -0.153 25539 376 1 15 . 1 1 7 7 LYS H H 7 8.356 8.356 7.323 1.033 25539 377 1 15 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.057 0.348 25539 378 1 15 . 1 1 8 8 VAL H H 8 8.202 8.202 8.365 -0.163 25539 379 1 15 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.547 -0.189 25539 380 1 15 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.592 -0.273 25539 381 1 15 . 1 1 10 10 GLN H H 10 8.428 8.428 8.514 -0.086 25539 382 1 15 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.062 0.108 25539 383 1 15 . 1 1 11 11 VAL H H 11 8.214 8.214 8.310 -0.096 25539 384 1 15 . 1 1 12 12 SER HA H 12 4.508 4.508 4.654 -0.146 25539 385 1 15 . 1 1 12 12 SER H H 12 8.435 8.435 8.306 0.130 25539 386 1 15 . 1 1 13 13 THR HA H 13 4.263 4.263 4.796 -0.533 25539 387 1 15 . 1 1 13 13 THR H H 13 8.187 8.187 8.212 -0.025 25539 388 1 15 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.719 -0.254 25539 389 1 15 . 1 1 15 15 THR HA H 15 4.291 4.291 4.465 -0.174 25539 390 1 15 . 1 1 15 15 THR H H 15 8.265 8.265 8.061 0.204 25539 391 1 16 . 1 1 2 2 VAL HA H 2 4.243 4.243 3.634 0.609 25539 392 1 16 . 1 1 2 2 VAL H H 2 8.400 8.400 8.317 0.083 25539 393 1 16 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.169 0.123 25539 394 1 16 . 1 1 3 3 ARG H H 3 8.389 8.389 8.112 0.277 25539 395 1 16 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.666 -0.026 25539 396 1 16 . 1 1 4 4 TYR H H 4 8.389 8.389 7.856 0.533 25539 397 1 16 . 1 1 5 5 THR HA H 5 4.601 4.601 4.575 0.026 25539 398 1 16 . 1 1 5 5 THR H H 5 8.181 8.181 8.224 -0.043 25539 399 1 16 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.077 0.163 25539 400 1 16 . 1 1 6 6 LYS H H 6 8.449 8.449 8.635 -0.186 25539 401 1 16 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.574 -0.282 25539 402 1 16 . 1 1 7 7 LYS H H 7 8.356 8.356 7.488 0.868 25539 403 1 16 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.169 0.236 25539 404 1 16 . 1 1 8 8 VAL H H 8 8.202 8.202 8.273 -0.071 25539 405 1 16 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.635 -0.277 25539 406 1 16 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.290 0.029 25539 407 1 16 . 1 1 10 10 GLN H H 10 8.428 8.428 8.915 -0.487 25539 408 1 16 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.299 -0.129 25539 409 1 16 . 1 1 11 11 VAL H H 11 8.214 8.214 8.245 -0.031 25539 410 1 16 . 1 1 12 12 SER HA H 12 4.508 4.508 4.733 -0.225 25539 411 1 16 . 1 1 12 12 SER H H 12 8.435 8.435 8.171 0.264 25539 412 1 16 . 1 1 13 13 THR HA H 13 4.263 4.263 4.841 -0.578 25539 413 1 16 . 1 1 13 13 THR H H 13 8.187 8.187 8.193 -0.006 25539 414 1 16 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.595 -0.130 25539 415 1 16 . 1 1 15 15 THR HA H 15 4.291 4.291 4.049 0.242 25539 416 1 16 . 1 1 15 15 THR H H 15 8.265 8.265 8.540 -0.275 25539 417 1 17 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.564 -0.321 25539 418 1 17 . 1 1 2 2 VAL H H 2 8.400 8.400 8.196 0.204 25539 419 1 17 . 1 1 3 3 ARG HA H 3 4.292 4.292 3.998 0.294 25539 420 1 17 . 1 1 3 3 ARG H H 3 8.389 8.389 8.055 0.334 25539 421 1 17 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.325 0.315 25539 422 1 17 . 1 1 4 4 TYR H H 4 8.389 8.389 7.506 0.883 25539 423 1 17 . 1 1 5 5 THR HA H 5 4.601 4.601 4.615 -0.014 25539 424 1 17 . 1 1 5 5 THR H H 5 8.181 8.181 8.152 0.029 25539 425 1 17 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.040 0.200 25539 426 1 17 . 1 1 6 6 LYS H H 6 8.449 8.449 8.612 -0.163 25539 427 1 17 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.423 -0.131 25539 428 1 17 . 1 1 7 7 LYS H H 7 8.356 8.356 7.454 0.902 25539 429 1 17 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.122 0.283 25539 430 1 17 . 1 1 8 8 VAL H H 8 8.202 8.202 8.280 -0.078 25539 431 1 17 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.584 -0.226 25539 432 1 17 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.315 0.004 25539 433 1 17 . 1 1 10 10 GLN H H 10 8.428 8.428 8.928 -0.500 25539 434 1 17 . 1 1 11 11 VAL HA H 11 4.170 4.170 4.243 -0.073 25539 435 1 17 . 1 1 11 11 VAL H H 11 8.214 8.214 8.219 -0.005 25539 436 1 17 . 1 1 12 12 SER HA H 12 4.508 4.508 4.729 -0.221 25539 437 1 17 . 1 1 12 12 SER H H 12 8.435 8.435 8.042 0.393 25539 438 1 17 . 1 1 13 13 THR HA H 13 4.263 4.263 4.801 -0.538 25539 439 1 17 . 1 1 13 13 THR H H 13 8.187 8.187 8.376 -0.188 25539 440 1 17 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.538 -0.073 25539 441 1 17 . 1 1 15 15 THR HA H 15 4.291 4.291 4.202 0.089 25539 442 1 17 . 1 1 15 15 THR H H 15 8.265 8.265 7.987 0.278 25539 443 1 18 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.128 0.115 25539 444 1 18 . 1 1 2 2 VAL H H 2 8.400 8.400 8.128 0.272 25539 445 1 18 . 1 1 3 3 ARG HA H 3 4.292 4.292 3.966 0.326 25539 446 1 18 . 1 1 3 3 ARG H H 3 8.389 8.389 8.249 0.140 25539 447 1 18 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.791 -0.151 25539 448 1 18 . 1 1 4 4 TYR H H 4 8.389 8.389 7.492 0.897 25539 449 1 18 . 1 1 5 5 THR HA H 5 4.601 4.601 4.559 0.042 25539 450 1 18 . 1 1 5 5 THR H H 5 8.181 8.181 7.699 0.482 25539 451 1 18 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.312 -0.072 25539 452 1 18 . 1 1 6 6 LYS H H 6 8.449 8.449 8.504 -0.055 25539 453 1 18 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.544 -0.252 25539 454 1 18 . 1 1 7 7 LYS H H 7 8.356 8.356 7.523 0.833 25539 455 1 18 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.012 0.393 25539 456 1 18 . 1 1 8 8 VAL H H 8 8.202 8.202 8.348 -0.146 25539 457 1 18 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.541 -0.183 25539 458 1 18 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.386 -0.067 25539 459 1 18 . 1 1 10 10 GLN H H 10 8.428 8.428 8.499 -0.071 25539 460 1 18 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.683 0.487 25539 461 1 18 . 1 1 11 11 VAL H H 11 8.214 8.214 8.286 -0.072 25539 462 1 18 . 1 1 12 12 SER HA H 12 4.508 4.508 4.689 -0.181 25539 463 1 18 . 1 1 12 12 SER H H 12 8.435 8.435 7.686 0.749 25539 464 1 18 . 1 1 13 13 THR HA H 13 4.263 4.263 4.721 -0.458 25539 465 1 18 . 1 1 13 13 THR H H 13 8.187 8.187 8.200 -0.013 25539 466 1 18 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.482 -0.017 25539 467 1 18 . 1 1 15 15 THR HA H 15 4.291 4.291 4.578 -0.287 25539 468 1 18 . 1 1 15 15 THR H H 15 8.265 8.265 8.207 0.058 25539 469 1 19 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.259 -0.016 25539 470 1 19 . 1 1 2 2 VAL H H 2 8.400 8.400 8.410 -0.010 25539 471 1 19 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.060 0.232 25539 472 1 19 . 1 1 3 3 ARG H H 3 8.389 8.389 8.018 0.371 25539 473 1 19 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.676 -0.036 25539 474 1 19 . 1 1 4 4 TYR H H 4 8.389 8.389 7.152 1.237 25539 475 1 19 . 1 1 5 5 THR HA H 5 4.601 4.601 4.195 0.406 25539 476 1 19 . 1 1 5 5 THR H H 5 8.181 8.181 8.349 -0.168 25539 477 1 19 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.205 0.035 25539 478 1 19 . 1 1 6 6 LYS H H 6 8.449 8.449 8.546 -0.097 25539 479 1 19 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.406 -0.114 25539 480 1 19 . 1 1 7 7 LYS H H 7 8.356 8.356 7.261 1.095 25539 481 1 19 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.031 0.374 25539 482 1 19 . 1 1 8 8 VAL H H 8 8.202 8.202 8.285 -0.083 25539 483 1 19 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.445 -0.087 25539 484 1 19 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.524 -0.205 25539 485 1 19 . 1 1 10 10 GLN H H 10 8.428 8.428 8.007 0.421 25539 486 1 19 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.872 0.298 25539 487 1 19 . 1 1 11 11 VAL H H 11 8.214 8.214 8.346 -0.132 25539 488 1 19 . 1 1 12 12 SER HA H 12 4.508 4.508 4.627 -0.119 25539 489 1 19 . 1 1 12 12 SER H H 12 8.435 8.435 8.003 0.432 25539 490 1 19 . 1 1 13 13 THR HA H 13 4.263 4.263 4.698 -0.435 25539 491 1 19 . 1 1 13 13 THR H H 13 8.187 8.187 7.740 0.447 25539 492 1 19 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.590 -0.125 25539 493 1 19 . 1 1 15 15 THR HA H 15 4.291 4.291 4.644 -0.352 25539 494 1 19 . 1 1 15 15 THR H H 15 8.265 8.265 8.344 -0.079 25539 495 1 20 . 1 1 2 2 VAL HA H 2 4.243 4.243 4.370 -0.127 25539 496 1 20 . 1 1 2 2 VAL H H 2 8.400 8.400 8.561 -0.161 25539 497 1 20 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.262 0.030 25539 498 1 20 . 1 1 3 3 ARG H H 3 8.389 8.389 8.281 0.108 25539 499 1 20 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.684 -0.044 25539 500 1 20 . 1 1 4 4 TYR H H 4 8.389 8.389 7.814 0.575 25539 501 1 20 . 1 1 5 5 THR HA H 5 4.601 4.601 4.539 0.062 25539 502 1 20 . 1 1 5 5 THR H H 5 8.181 8.181 7.797 0.384 25539 503 1 20 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.131 0.109 25539 504 1 20 . 1 1 6 6 LYS H H 6 8.449 8.449 8.681 -0.233 25539 505 1 20 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.399 -0.107 25539 506 1 20 . 1 1 7 7 LYS H H 7 8.356 8.356 7.385 0.971 25539 507 1 20 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.027 0.378 25539 508 1 20 . 1 1 8 8 VAL H H 8 8.202 8.202 8.375 -0.173 25539 509 1 20 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.503 -0.145 25539 510 1 20 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.463 -0.144 25539 511 1 20 . 1 1 10 10 GLN H H 10 8.428 8.428 8.341 0.087 25539 512 1 20 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.776 0.394 25539 513 1 20 . 1 1 11 11 VAL H H 11 8.214 8.214 8.229 -0.015 25539 514 1 20 . 1 1 12 12 SER HA H 12 4.508 4.508 4.550 -0.042 25539 515 1 20 . 1 1 12 12 SER H H 12 8.435 8.435 7.833 0.602 25539 516 1 20 . 1 1 13 13 THR HA H 13 4.263 4.263 4.768 -0.505 25539 517 1 20 . 1 1 13 13 THR H H 13 8.187 8.187 8.040 0.147 25539 518 1 20 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.626 -0.161 25539 519 1 20 . 1 1 15 15 THR HA H 15 4.291 4.291 4.124 0.167 25539 520 1 20 . 1 1 15 15 THR H H 15 8.265 8.265 7.951 0.314 25539 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 25539 2 1 1 "Average Difference" HA 14 0.202 0.001 0.210 25539 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25539 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25539 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25539 6 1 1 "Average Difference" HN 12 0.534 -0.330 0.439 25539 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25539 8 1 2 "Average Difference" HA 14 0.224 -0.035 0.229 25539 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25539 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25539 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25539 12 1 2 "Average Difference" HN 12 0.421 -0.195 0.389 25539 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25539 14 1 3 "Average Difference" HA 14 0.242 -0.019 0.250 25539 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25539 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25539 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25539 18 1 3 "Average Difference" HN 12 0.538 -0.336 0.438 25539 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25539 20 1 4 "Average Difference" HA 14 0.276 0.013 0.286 25539 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25539 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25539 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25539 24 1 4 "Average Difference" HN 12 0.519 -0.299 0.443 25539 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25539 26 1 5 "Average Difference" HA 14 0.239 0.025 0.246 25539 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25539 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25539 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25539 30 1 5 "Average Difference" HN 12 0.509 -0.263 0.456 25539 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25539 32 1 6 "Average Difference" HA 14 0.185 0.062 0.181 25539 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25539 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25539 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25539 36 1 6 "Average Difference" HN 12 0.312 -0.125 0.299 25539 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25539 38 1 7 "Average Difference" HA 14 0.262 0.006 0.271 25539 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25539 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25539 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25539 42 1 7 "Average Difference" HN 12 0.552 -0.316 0.472 25539 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25539 44 1 8 "Average Difference" HA 14 0.259 0.014 0.269 25539 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25539 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25539 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25539 48 1 8 "Average Difference" HN 12 0.476 -0.217 0.443 25539 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25539 50 1 9 "Average Difference" HA 14 0.244 -0.002 0.253 25539 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25539 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25539 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25539 54 1 9 "Average Difference" HN 12 0.393 -0.229 0.334 25539 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25539 56 1 10 "Average Difference" HA 14 0.251 0.010 0.260 25539 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25539 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25539 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25539 60 1 10 "Average Difference" HN 12 0.401 -0.159 0.384 25539 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25539 62 1 11 "Average Difference" HA 14 0.245 0.009 0.254 25539 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25539 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25539 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25539 66 1 11 "Average Difference" HN 12 0.500 -0.246 0.455 25539 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25539 68 1 12 "Average Difference" HA 14 0.192 0.038 0.196 25539 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25539 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25539 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25539 72 1 12 "Average Difference" HN 12 0.342 -0.180 0.304 25539 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25539 74 1 13 "Average Difference" HA 14 0.227 0.000 0.236 25539 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25539 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25539 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25539 78 1 13 "Average Difference" HN 12 0.376 -0.184 0.342 25539 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25539 80 1 14 "Average Difference" HA 14 0.234 0.012 0.242 25539 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25539 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25539 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25539 84 1 14 "Average Difference" HN 12 0.381 -0.178 0.352 25539 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25539 86 1 15 "Average Difference" HA 14 0.226 0.077 0.220 25539 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25539 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25539 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25539 90 1 15 "Average Difference" HN 12 0.340 -0.089 0.343 25539 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25539 92 1 16 "Average Difference" HA 14 0.281 0.015 0.291 25539 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25539 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25539 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25539 96 1 16 "Average Difference" HN 12 0.359 -0.077 0.366 25539 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25539 98 1 17 "Average Difference" HA 14 0.244 0.030 0.251 25539 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25539 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25539 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25539 102 1 17 "Average Difference" HN 12 0.437 -0.174 0.419 25539 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25539 104 1 18 "Average Difference" HA 14 0.263 0.022 0.272 25539 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25539 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25539 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25539 108 1 18 "Average Difference" HN 12 0.449 -0.256 0.385 25539 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25539 110 1 19 "Average Difference" HA 14 0.247 0.010 0.256 25539 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25539 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25539 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25539 114 1 19 "Average Difference" HN 12 0.540 -0.286 0.478 25539 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25539 116 1 20 "Average Difference" HA 14 0.223 0.010 0.231 25539 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25539 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25539 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25539 120 1 20 "Average Difference" HN 12 0.412 -0.217 0.365 25539 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 25539 _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 VAL HA H 2 4.243 4.243 4.225 0.018 25539 2 1 . 1 1 2 2 VAL H H 2 8.400 8.400 8.288 0.112 25539 3 1 . 1 1 3 3 ARG HA H 3 4.292 4.292 4.090 0.202 25539 4 1 . 1 1 3 3 ARG H H 3 8.389 8.389 8.097 0.292 25539 5 1 . 1 1 4 4 TYR HA H 4 4.640 4.640 4.693 -0.053 25539 6 1 . 1 1 4 4 TYR H H 4 8.389 8.389 7.525 0.864 25539 7 1 . 1 1 5 5 THR HA H 5 4.601 4.601 4.392 0.209 25539 8 1 . 1 1 5 5 THR H H 5 8.181 8.181 8.154 0.027 25539 9 1 . 1 1 6 6 LYS HA H 6 4.240 4.240 4.170 0.070 25539 10 1 . 1 1 6 6 LYS H H 6 8.449 8.449 8.588 -0.139 25539 11 1 . 1 1 7 7 LYS HA H 7 4.292 4.292 4.391 -0.099 25539 12 1 . 1 1 7 7 LYS H H 7 8.356 8.356 7.519 0.837 25539 13 1 . 1 1 8 8 VAL HA H 8 4.405 4.405 4.068 0.337 25539 14 1 . 1 1 8 8 VAL H H 8 8.202 8.202 8.336 -0.134 25539 15 1 . 1 1 9 9 PRO HA H 9 4.358 4.358 4.525 -0.167 25539 16 1 . 1 1 10 10 GLN HA H 10 4.319 4.319 4.445 -0.126 25539 17 1 . 1 1 10 10 GLN H H 10 8.428 8.428 8.282 0.146 25539 18 1 . 1 1 11 11 VAL HA H 11 4.170 4.170 3.951 0.219 25539 19 1 . 1 1 11 11 VAL H H 11 8.214 8.214 8.278 -0.064 25539 20 1 . 1 1 12 12 SER HA H 12 4.508 4.508 4.622 -0.114 25539 21 1 . 1 1 12 12 SER H H 12 8.435 8.435 7.986 0.450 25539 22 1 . 1 1 13 13 THR HA H 13 4.263 4.263 4.735 -0.472 25539 23 1 . 1 1 13 13 THR H H 13 8.187 8.187 7.994 0.193 25539 24 1 . 1 1 14 14 PRO HA H 14 4.465 4.465 4.558 -0.093 25539 25 1 . 1 1 15 15 THR HA H 15 4.291 4.291 4.430 -0.139 25539 26 1 . 1 1 15 15 THR H H 15 8.265 8.265 8.233 0.032 25539 stop_ save_