data_16018_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16018
_Entry.PDB_ID 2KAA
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 1 A 2 2 PRO HA H 2 4.900 4.495 0.405 1
1 10 . 1 1 1 A 3 3 ILE H H 3 8.774 7.495 1.279 1
1 11 . 1 1 1 A 3 3 ILE HA H 3 5.499 4.102 1.397 1
1 20 . 1 1 1 A 4 4 VAL H H 4 9.501 9.295 0.206 1
1 21 . 1 1 1 A 4 4 VAL HA H 4 4.944 5.172 -0.228 1
1 29 . 1 1 1 A 5 5 THR H H 5 9.243 8.820 0.423 1
1 30 . 1 1 1 A 5 5 THR HA H 5 5.278 5.331 -0.053 1
1 35 . 1 1 1 A 6 6 CYS H H 6 9.815 8.859 0.956 1
1 36 . 1 1 1 A 6 6 CYS HA H 6 5.310 4.674 0.636 1
1 38 . 1 1 1 A 7 7 ARG H H 7 9.154 8.315 0.839 1
1 41 . 1 1 1 A 8 8 PRO HA H 8 4.594 4.909 -0.315 1
1 47 . 1 1 1 A 9 9 LYS H H 9 8.179 8.541 -0.362 1
1 48 . 1 1 1 A 9 9 LYS HA H 9 4.857 4.785 0.072 1
1 52 . 1 1 1 A 10 10 LEU H H 10 9.108 8.510 0.598 1
1 53 . 1 1 1 A 10 10 LEU HA H 10 5.147 4.262 0.885 1
1 63 . 1 1 1 A 11 11 ASP H H 11 9.835 8.282 1.553 1
1 64 . 1 1 1 A 11 11 ASP HA H 11 4.471 4.876 -0.405 1
1 67 . 1 1 1 A 12 12 GLY H H 12 8.847 7.975 0.872 1
1 68 . 1 1 1 A 12 12 GLY HA2 H 12 3.782 4.021 -0.239 1
1 69 . 1 1 1 A 12 12 GLY HA3 H 12 4.427 4.025 0.402 1
1 70 . 1 1 1 A 13 13 ARG H H 13 7.933 7.758 0.175 1
1 71 . 1 1 1 A 13 13 ARG HA H 13 4.886 4.584 0.302 1
1 77 . 1 1 1 A 14 14 GLU H H 14 9.179 8.597 0.582 1
1 78 . 1 1 1 A 14 14 GLU HA H 14 4.178 4.846 -0.668 1
1 82 . 1 1 1 A 15 15 LYS H H 15 9.078 8.921 0.157 1
1 83 . 1 1 1 A 15 15 LYS HA H 15 4.890 4.750 0.140 1
1 84 . 1 1 1 A 16 16 PRO HA H 16 5.144 4.938 0.206 1
1 91 . 1 1 1 A 17 17 PHE H H 17 9.487 8.559 0.928 1
1 92 . 1 1 1 A 17 17 PHE HA H 17 4.760 4.597 0.163 1
1 100 . 1 1 1 A 18 18 LYS H H 18 9.315 8.755 0.560 1
1 101 . 1 1 1 A 18 18 LYS HA H 18 5.197 4.178 1.019 1
1 108 . 1 1 1 A 19 19 VAL H H 19 9.643 8.614 1.029 1
1 109 . 1 1 1 A 19 19 VAL HA H 19 4.796 4.856 -0.060 1
1 117 . 1 1 1 A 20 20 ASP H H 20 9.555 8.634 0.921 1
1 118 . 1 1 1 A 20 20 ASP HA H 20 5.151 5.095 0.056 1
1 121 . 1 1 1 A 21 21 VAL H H 21 9.607 8.935 0.672 1
1 122 . 1 1 1 A 21 21 VAL HA H 21 3.611 3.469 0.142 1
1 130 . 1 1 1 A 22 22 ALA H H 22 8.531 8.209 0.322 1
1 131 . 1 1 1 A 22 22 ALA HA H 22 4.299 3.894 0.405 1
1 135 . 1 1 1 A 23 23 THR H H 23 7.294 7.865 -0.571 1
1 136 . 1 1 1 A 23 23 THR HA H 23 4.264 3.852 0.412 1
1 141 . 1 1 1 A 24 24 ALA H H 24 8.346 7.854 0.492 1
1 142 . 1 1 1 A 24 24 ALA HA H 24 4.082 4.015 0.067 1
1 146 . 1 1 1 A 25 25 GLN H H 25 8.866 8.101 0.765 1
1 147 . 1 1 1 A 25 25 GLN HA H 25 3.804 3.919 -0.115 1
1 153 . 1 1 1 A 26 26 ALA H H 26 7.767 8.033 -0.266 1
1 154 . 1 1 1 A 26 26 ALA HA H 26 4.208 3.936 0.272 1
1 158 . 1 1 1 A 27 27 GLN H H 27 8.881 8.613 0.268 1
1 159 . 1 1 1 A 27 27 GLN HA H 27 4.041 3.959 0.082 1
1 165 . 1 1 1 A 28 28 ALA H H 28 8.142 7.870 0.272 1
1 166 . 1 1 1 A 28 28 ALA HA H 28 3.475 3.449 0.026 1
1 170 . 1 1 1 A 29 29 ARG H H 29 7.291 7.602 -0.311 1
1 171 . 1 1 1 A 29 29 ARG HA H 29 3.688 3.842 -0.154 1
1 174 . 1 1 1 A 30 30 LYS H H 30 7.768 7.936 -0.168 1
1 175 . 1 1 1 A 30 30 LYS HA H 30 4.038 3.943 0.095 1
1 179 . 1 1 1 A 31 31 ALA H H 31 8.127 7.510 0.617 1
1 180 . 1 1 1 A 31 31 ALA HA H 31 3.656 3.897 -0.241 1
1 184 . 1 1 1 A 32 32 GLY H H 32 7.670 7.797 -0.127 1
1 185 . 1 1 1 A 32 32 GLY HA2 H 32 3.380 3.746 -0.366 1
1 186 . 1 1 1 A 32 32 GLY HA3 H 32 3.844 3.773 0.071 1
1 187 . 1 1 1 A 33 33 LEU H H 33 8.057 8.188 -0.131 1
1 188 . 1 1 1 A 33 33 LEU HA H 33 3.259 3.141 0.118 1
1 197 . 1 1 1 A 34 34 THR H H 34 6.862 7.267 -0.405 1
1 198 . 1 1 1 A 34 34 THR HA H 34 4.738 5.137 -0.399 1
1 203 . 1 1 1 A 35 35 THR H H 35 9.161 8.912 0.249 1
1 204 . 1 1 1 A 35 35 THR HA H 35 4.247 5.199 -0.952 1
1 209 . 1 1 1 A 36 36 GLY H H 36 8.407 8.375 0.032 1
1 210 . 1 1 1 A 36 36 GLY HA2 H 36 4.349 4.030 0.319 1
1 211 . 1 1 1 A 36 36 GLY HA3 H 36 4.967 4.037 0.930 1
1 212 . 1 1 1 A 37 37 LYS H H 37 10.152 8.317 1.835 1
1 213 . 1 1 1 A 37 37 LYS HA H 37 4.383 4.120 0.263 1
1 221 . 1 1 1 A 38 38 SER H H 38 9.085 8.113 0.972 1
1 222 . 1 1 1 A 38 38 SER HA H 38 4.338 4.739 -0.401 1
1 226 . 1 1 1 A 39 39 GLY H H 39 8.474 7.684 0.790 1
1 227 . 1 1 1 A 39 39 GLY HA2 H 39 3.840 4.095 -0.255 1
1 228 . 1 1 1 A 40 40 ASP H H 40 9.424 7.738 1.686 1
1 229 . 1 1 1 A 40 40 ASP HA H 40 5.374 4.519 0.855 1
1 231 . 1 1 1 A 41 41 PRO HA H 41 5.624 4.592 1.032 1
1 238 . 1 1 1 A 42 42 HIS H H 42 8.343 8.641 -0.298 1
1 239 . 1 1 1 A 42 42 HIS HA H 42 5.189 5.200 -0.011 1
1 244 . 1 1 1 A 43 43 ARG H H 43 8.634 8.203 0.431 1
1 245 . 1 1 1 A 43 43 ARG HA H 43 3.654 3.420 0.234 1
1 252 . 1 1 1 A 44 44 TYR H H 44 8.188 8.758 -0.570 1
1 253 . 1 1 1 A 44 44 TYR HA H 44 5.021 4.870 0.151 1
1 260 . 1 1 1 A 45 45 PHE H H 45 8.728 8.476 0.252 1
1 261 . 1 1 1 A 45 45 PHE HA H 45 4.480 5.223 -0.743 1
1 268 . 1 1 1 A 46 46 ALA H H 46 5.979 8.069 -2.090 1
1 269 . 1 1 1 A 46 46 ALA HA H 46 3.797 4.196 -0.399 1
1 273 . 1 1 1 A 47 47 GLY H H 47 8.510 8.190 0.320 1
1 274 . 1 1 1 A 47 47 GLY HA2 H 47 3.953 4.250 -0.297 1
1 275 . 1 1 1 A 47 47 GLY HA3 H 47 4.075 4.253 -0.178 1
1 276 . 1 1 1 A 48 48 ASP H H 48 7.504 7.901 -0.397 1
1 277 . 1 1 1 A 48 48 ASP HA H 48 5.020 4.884 0.136 1
1 280 . 1 1 1 A 49 49 HIS H H 49 8.240 8.326 -0.086 1
1 281 . 1 1 1 A 49 49 HIS HA H 49 4.373 4.194 0.179 1
1 285 . 1 1 1 A 50 50 ILE H H 50 8.468 8.052 0.416 1
1 286 . 1 1 1 A 50 50 ILE HA H 50 3.651 4.181 -0.530 1
1 296 . 1 1 1 A 51 51 ARG H H 51 8.404 8.138 0.266 1
1 297 . 1 1 1 A 51 51 ARG HA H 51 4.450 4.633 -0.183 1
1 303 . 1 1 1 A 52 52 TRP H H 52 11.176 7.748 3.428 1
1 304 . 1 1 1 A 52 52 TRP HA H 52 4.423 4.217 0.206 1
1 312 . 1 1 1 A 53 53 GLY H H 53 10.422 8.745 1.677 1
1 313 . 1 1 1 A 53 53 GLY HA2 H 53 3.832 3.914 -0.082 1
1 314 . 1 1 1 A 53 53 GLY HA3 H 53 4.411 3.935 0.476 1
1 315 . 1 1 1 A 54 54 VAL H H 54 7.040 7.660 -0.620 1
1 316 . 1 1 1 A 54 54 VAL HA H 54 4.489 4.535 -0.046 1
1 324 . 1 1 1 A 55 55 ASN H H 55 9.530 8.961 0.569 1
1 325 . 1 1 1 A 55 55 ASN HA H 55 4.569 4.313 0.256 1
1 330 . 1 1 1 A 56 56 ASN H H 56 9.175 8.262 0.913 1
1 331 . 1 1 1 A 56 56 ASN HA H 56 4.649 4.327 0.322 1
1 336 . 1 1 1 A 57 57 CYS H H 57 7.613 8.445 -0.832 1
1 337 . 1 1 1 A 57 57 CYS HA H 57 4.645 4.202 0.443 1
1 340 . 1 1 1 A 58 58 ASP H H 58 7.626 8.475 -0.849 1
1 341 . 1 1 1 A 58 58 ASP HA H 58 5.206 4.330 0.876 1
1 344 . 1 1 1 A 59 59 LYS H H 59 7.349 7.248 0.101 1
1 345 . 1 1 1 A 59 59 LYS HA H 59 4.548 4.265 0.283 1
1 350 . 1 1 1 A 60 60 ALA H H 60 9.155 8.688 0.467 1
1 351 . 1 1 1 A 60 60 ALA HA H 60 4.330 4.182 0.148 1
1 355 . 1 1 1 A 61 61 ASP H H 61 8.548 8.161 0.387 1
1 356 . 1 1 1 A 61 61 ASP HA H 61 4.827 4.522 0.305 1
1 359 . 1 1 1 A 62 62 ALA H H 62 7.463 7.335 0.128 1
1 360 . 1 1 1 A 62 62 ALA HA H 62 4.217 4.356 -0.139 1
1 364 . 1 1 1 A 63 63 ILE H H 63 9.302 8.608 0.694 1
1 365 . 1 1 1 A 63 63 ILE HA H 63 4.332 4.658 -0.326 1
1 374 . 1 1 1 A 64 64 LEU H H 64 8.724 9.089 -0.365 1
1 375 . 1 1 1 A 64 64 LEU HA H 64 5.463 5.127 0.336 1
1 385 . 1 1 1 A 65 65 TRP H H 65 9.621 8.235 1.386 1
1 386 . 1 1 1 A 65 65 TRP HA H 65 4.605 5.419 -0.814 1
1 395 . 1 1 1 A 66 66 GLU H H 66 8.388 9.289 -0.901 1
1 396 . 1 1 1 A 66 66 GLU HA H 66 6.014 5.805 0.209 1
1 401 . 1 1 1 A 67 67 TYR H H 67 8.766 9.030 -0.264 1
1 402 . 1 1 1 A 67 67 TYR HA H 67 5.204 5.160 0.044 1
1 405 . 1 1 1 A 68 68 PRO HA H 68 4.523 4.369 0.154 1
1 412 . 1 1 1 A 69 69 ILE H H 69 7.308 8.428 -1.120 1
1 413 . 1 1 1 A 69 69 ILE HA H 69 4.870 4.803 0.067 1
1 414 . 1 1 1 A 70 70 TYR H H 70 9.219 9.038 0.181 1
1 415 . 1 1 1 A 70 70 TYR HA H 70 4.854 4.760 0.094 1
1 423 . 1 1 1 A 71 71 TRP H H 71 6.662 8.071 -1.409 1
1 424 . 1 1 1 A 71 71 TRP HA H 71 5.496 4.791 0.705 1
1 432 . 1 1 1 A 72 72 VAL H H 72 9.510 9.020 0.490 1
1 433 . 1 1 1 A 72 72 VAL HA H 72 3.999 3.672 0.327 1
1 441 . 1 1 1 A 73 73 GLY H H 73 9.221 8.488 0.733 1
1 442 . 1 1 1 A 73 73 GLY HA2 H 73 3.877 3.958 -0.081 1
1 443 . 1 1 1 A 73 73 GLY HA3 H 73 4.682 3.991 0.691 1
1 444 . 1 1 1 A 74 74 LYS H H 74 7.962 7.521 0.441 1
1 445 . 1 1 1 A 74 74 LYS HA H 74 4.469 4.377 0.092 1
1 457 . 1 1 1 A 75 75 ASN H H 75 8.928 8.862 0.066 1
1 458 . 1 1 1 A 75 75 ASN HA H 75 4.837 5.087 -0.250 1
1 463 . 1 1 1 A 76 76 ALA H H 76 7.544 7.561 -0.017 1
1 464 . 1 1 1 A 76 76 ALA HA H 76 4.555 4.531 0.024 1
1 468 . 1 1 1 A 77 77 GLU H H 77 8.290 8.318 -0.028 1
1 469 . 1 1 1 A 77 77 GLU HA H 77 4.900 4.460 0.440 1
1 474 . 1 1 1 A 78 78 TRP H H 78 10.065 9.088 0.977 1
1 475 . 1 1 1 A 78 78 TRP HA H 78 4.600 5.073 -0.473 1
1 484 . 1 1 1 A 79 79 ALA H H 79 9.850 8.184 1.666 1
1 485 . 1 1 1 A 79 79 ALA HA H 79 5.022 4.738 0.284 1
1 489 . 1 1 1 A 80 80 LYS H H 80 9.255 8.721 0.534 1
1 490 . 1 1 1 A 80 80 LYS HA H 80 4.511 4.534 -0.023 1
1 494 . 1 1 1 A 81 81 ASP H H 81 9.332 7.735 1.597 1
1 495 . 1 1 1 A 81 81 ASP HA H 81 5.429 4.807 0.622 1
1 498 . 1 1 1 A 82 82 VAL H H 82 7.226 7.583 -0.357 1
1 499 . 1 1 1 A 82 82 VAL HA H 82 4.248 4.611 -0.363 1
1 507 . 1 1 1 A 83 83 LYS H H 83 8.407 8.767 -0.360 1
1 508 . 1 1 1 A 83 83 LYS HA H 83 4.356 4.629 -0.273 1
1 510 . 1 1 1 A 84 84 THR H H 84 9.088 9.114 -0.026 1
1 511 . 1 1 1 A 84 84 THR HA H 84 3.989 4.224 -0.235 1
1 516 . 1 1 1 A 85 85 SER H H 85 8.391 8.566 -0.175 1
1 517 . 1 1 1 A 85 85 SER HA H 85 4.442 4.173 0.269 1
1 520 . 1 1 1 A 86 86 GLN H H 86 7.974 8.154 -0.180 1
1 521 . 1 1 1 A 86 86 GLN HA H 86 4.585 4.016 0.569 1
1 527 . 1 1 1 A 87 87 GLN H H 87 7.083 7.727 -0.644 1
1 528 . 1 1 1 A 87 87 GLN HA H 87 3.903 3.832 0.071 1
1 534 . 1 1 1 A 88 88 LYS H H 88 9.453 8.416 1.037 1
1 535 . 1 1 1 A 88 88 LYS HA H 88 4.114 4.392 -0.278 1
1 539 . 1 1 1 A 89 89 GLY H H 89 9.466 8.096 1.370 1
1 540 . 1 1 1 A 89 89 GLY HA2 H 89 3.965 3.809 0.156 1
1 541 . 1 1 1 A 89 89 GLY HA3 H 89 3.148 3.837 -0.689 1
1 542 . 1 1 1 A 90 90 GLY H H 90 7.228 7.506 -0.278 1
1 543 . 1 1 1 A 90 90 GLY HA2 H 90 4.290 4.066 0.224 1
1 544 . 1 1 1 A 90 90 GLY HA3 H 90 4.682 4.072 0.610 1
1 545 . 1 1 1 A 91 91 PRO HA H 91 4.902 4.799 0.103 1
1 552 . 1 1 1 A 92 92 THR H H 92 8.585 8.632 -0.047 1
1 553 . 1 1 1 A 92 92 THR HA H 92 5.701 4.972 0.729 1
1 559 . 1 1 1 A 93 93 PRO HA H 93 5.551 4.138 1.413 1
1 563 . 1 1 1 A 94 94 ILE H H 94 8.155 7.540 0.615 1
1 564 . 1 1 1 A 94 94 ILE HA H 94 4.794 4.408 0.386 1
1 571 . 1 1 1 A 95 95 ARG H H 95 9.538 9.073 0.465 1
1 572 . 1 1 1 A 95 95 ARG HA H 95 5.278 5.343 -0.065 1
1 576 . 1 1 1 A 96 96 VAL H H 96 9.276 9.006 0.270 1
1 577 . 1 1 1 A 96 96 VAL HA H 96 5.222 4.312 0.910 1
1 585 . 1 1 1 A 97 97 VAL H H 97 8.739 9.194 -0.455 1
1 586 . 1 1 1 A 97 97 VAL HA H 97 5.160 5.382 -0.222 1
1 594 . 1 1 1 A 98 98 TYR H H 98 8.596 8.287 0.309 1
1 595 . 1 1 1 A 98 98 TYR HA H 98 5.266 4.907 0.359 1
1 603 . 1 1 1 A 99 99 ALA H H 99 9.685 8.601 1.084 1
1 604 . 1 1 1 A 99 99 ALA HA H 99 5.680 4.536 1.144 1
1 608 . 1 1 1 A 100 100 ASN H H 100 8.468 9.456 -0.988 1
1 609 . 1 1 1 A 100 100 ASN HA H 100 4.885 4.585 0.300 1
1 614 . 1 1 1 A 101 101 SER H H 101 9.342 8.102 1.240 1
1 615 . 1 1 1 A 101 101 SER HA H 101 4.993 4.130 0.863 1
1 618 . 1 1 1 A 102 102 ARG H H 102 9.349 8.545 0.804 1
1 619 . 1 1 1 A 102 102 ARG HA H 102 4.068 4.020 0.048 1
1 620 . 1 1 1 A 103 103 GLY H H 103 8.632 8.856 -0.224 1
1 621 . 1 1 1 A 103 103 GLY HA2 H 103 3.691 3.841 -0.150 1
1 622 . 1 1 1 A 103 103 GLY HA3 H 103 4.341 3.859 0.482 1
1 623 . 1 1 1 A 104 104 ALA H H 104 7.820 8.026 -0.206 1
1 624 . 1 1 1 A 104 104 ALA HA H 104 4.775 4.867 -0.092 1
1 628 . 1 1 1 A 105 105 VAL H H 105 8.402 8.696 -0.294 1
1 629 . 1 1 1 A 105 105 VAL HA H 105 4.218 5.156 -0.938 1
1 637 . 1 1 1 A 106 106 GLN H H 106 9.352 8.358 0.994 1
1 638 . 1 1 1 A 106 106 GLN HA H 106 4.900 4.630 0.270 1
1 645 . 1 1 1 A 107 107 TYR H H 107 9.075 8.009 1.066 1
1 646 . 1 1 1 A 107 107 TYR HA H 107 4.007 4.094 -0.087 1
1 653 . 1 1 1 A 108 108 CYS H H 108 8.197 7.753 0.444 1
1 654 . 1 1 1 A 108 108 CYS HA H 108 4.823 4.034 0.789 1
1 657 . 1 1 1 A 109 109 GLY H H 109 6.856 6.689 0.167 1
1 658 . 1 1 1 A 109 109 GLY HA2 H 109 3.983 3.276 0.707 1
1 659 . 1 1 1 A 109 109 GLY HA3 H 109 4.422 3.325 1.097 1
1 660 . 1 1 1 A 110 110 VAL H H 110 9.418 8.807 0.611 1
1 661 . 1 1 1 A 110 110 VAL HA H 110 5.073 5.231 -0.158 1
1 669 . 1 1 1 A 111 111 MET H H 111 9.327 9.625 -0.298 1
1 670 . 1 1 1 A 111 111 MET HA H 111 5.678 5.673 0.005 1
1 678 . 1 1 1 A 112 112 THR H H 112 9.310 9.175 0.135 1
1 679 . 1 1 1 A 112 112 THR HA H 112 5.726 4.590 1.136 1
1 685 . 1 1 1 A 113 113 HIS H H 113 8.960 8.457 0.503 1
1 686 . 1 1 1 A 113 113 HIS HA H 113 3.876 4.484 -0.608 1
1 691 . 1 1 1 A 114 114 SER H H 114 8.367 8.609 -0.242 1
1 692 . 1 1 1 A 114 114 SER HA H 114 4.024 4.568 -0.544 1
1 695 . 1 1 1 A 115 115 LYS H H 115 8.140 7.447 0.693 1
1 696 . 1 1 1 A 115 115 LYS HA H 115 5.403 4.613 0.790 1
1 699 . 1 1 1 A 116 116 VAL H H 116 8.525 8.164 0.361 1
1 700 . 1 1 1 A 116 116 VAL HA H 116 5.378 4.465 0.913 1
1 708 . 1 1 1 A 117 117 ASP H H 117 8.025 8.516 -0.491 1
1 709 . 1 1 1 A 117 117 ASP HA H 117 5.243 4.370 0.873 1
1 712 . 1 1 1 A 118 118 LYS H H 118 8.930 7.855 1.075 1
1 713 . 1 1 1 A 118 118 LYS HA H 118 4.216 4.603 -0.387 1
1 716 . 1 1 1 A 119 119 ASN H H 119 8.425 7.495 0.930 1
1 717 . 1 1 1 A 119 119 ASN HA H 119 5.061 4.921 0.140 1
1 722 . 1 1 1 A 120 120 ASN H H 120 8.061 8.170 -0.109 1
1 723 . 1 1 1 A 120 120 ASN HA H 120 4.212 4.468 -0.256 1
1 728 . 1 1 1 A 121 121 GLN H H 121 8.359 8.032 0.327 1
1 729 . 1 1 1 A 121 121 GLN HA H 121 4.373 4.133 0.240 1
1 735 . 1 1 1 A 122 122 GLY H H 122 8.770 7.729 1.041 1
1 736 . 1 1 1 A 122 122 GLY HA2 H 122 3.182 3.973 -0.791 1
1 737 . 1 1 1 A 122 122 GLY HA3 H 122 5.268 3.980 1.288 1
1 738 . 1 1 1 A 123 123 LYS H H 123 8.587 8.489 0.098 1
1 739 . 1 1 1 A 123 123 LYS HA H 123 4.016 4.453 -0.437 1
1 745 . 1 1 1 A 124 124 GLU H H 124 8.527 7.642 0.885 1
1 746 . 1 1 1 A 124 124 GLU HA H 124 4.152 4.477 -0.325 1
1 750 . 1 1 1 A 125 125 PHE H H 125 7.936 8.748 -0.812 1
1 751 . 1 1 1 A 125 125 PHE HA H 125 4.670 4.730 -0.060 1
1 758 . 1 1 1 A 126 126 PHE H H 126 8.214 8.451 -0.237 1
1 759 . 1 1 1 A 126 126 PHE HA H 126 5.177 5.019 0.158 1
1 767 . 1 1 1 A 127 127 GLU H H 127 9.169 7.941 1.228 1
1 768 . 1 1 1 A 127 127 GLU HA H 127 4.852 3.737 1.115 1
1 773 . 1 1 1 A 128 128 LYS H H 128 9.000 8.297 0.703 1
1 774 . 1 1 1 A 128 128 LYS HA H 128 4.191 4.051 0.140 1
1 777 . 1 1 1 A 129 129 CYS H H 129 8.938 9.047 -0.109 1
1 778 . 1 1 1 A 129 129 CYS HA H 129 5.268 4.926 0.342 1
1 5 . 2 1 1 A 2 2 PRO HA H 2 4.900 4.526 0.374 1
1 10 . 2 1 1 A 3 3 ILE H H 3 8.774 7.478 1.296 1
1 11 . 2 1 1 A 3 3 ILE HA H 3 5.499 4.577 0.922 1
1 20 . 2 1 1 A 4 4 VAL H H 4 9.501 9.350 0.151 1
1 21 . 2 1 1 A 4 4 VAL HA H 4 4.944 5.183 -0.239 1
1 29 . 2 1 1 A 5 5 THR H H 5 9.243 9.091 0.152 1
1 30 . 2 1 1 A 5 5 THR HA H 5 5.278 5.319 -0.041 1
1 35 . 2 1 1 A 6 6 CYS H H 6 9.815 8.928 0.887 1
1 36 . 2 1 1 A 6 6 CYS HA H 6 5.310 4.623 0.687 1
1 38 . 2 1 1 A 7 7 ARG H H 7 9.154 8.532 0.622 1
1 41 . 2 1 1 A 8 8 PRO HA H 8 4.594 4.546 0.048 1
1 47 . 2 1 1 A 9 9 LYS H H 9 8.179 8.392 -0.213 1
1 48 . 2 1 1 A 9 9 LYS HA H 9 4.857 4.755 0.102 1
1 52 . 2 1 1 A 10 10 LEU H H 10 9.108 8.774 0.334 1
1 53 . 2 1 1 A 10 10 LEU HA H 10 5.147 4.407 0.740 1
1 63 . 2 1 1 A 11 11 ASP H H 11 9.835 8.149 1.686 1
1 64 . 2 1 1 A 11 11 ASP HA H 11 4.471 4.828 -0.357 1
1 67 . 2 1 1 A 12 12 GLY H H 12 8.847 8.063 0.784 1
1 68 . 2 1 1 A 12 12 GLY HA2 H 12 3.782 4.018 -0.236 1
1 69 . 2 1 1 A 12 12 GLY HA3 H 12 4.427 4.023 0.404 1
1 70 . 2 1 1 A 13 13 ARG H H 13 7.933 7.777 0.156 1
1 71 . 2 1 1 A 13 13 ARG HA H 13 4.886 4.536 0.350 1
1 77 . 2 1 1 A 14 14 GLU H H 14 9.179 8.578 0.601 1
1 78 . 2 1 1 A 14 14 GLU HA H 14 4.178 4.902 -0.724 1
1 82 . 2 1 1 A 15 15 LYS H H 15 9.078 9.003 0.075 1
1 83 . 2 1 1 A 15 15 LYS HA H 15 4.890 4.757 0.133 1
1 84 . 2 1 1 A 16 16 PRO HA H 16 5.144 4.966 0.178 1
1 91 . 2 1 1 A 17 17 PHE H H 17 9.487 8.712 0.775 1
1 92 . 2 1 1 A 17 17 PHE HA H 17 4.760 4.535 0.225 1
1 100 . 2 1 1 A 18 18 LYS H H 18 9.315 8.741 0.574 1
1 101 . 2 1 1 A 18 18 LYS HA H 18 5.197 4.268 0.929 1
1 108 . 2 1 1 A 19 19 VAL H H 19 9.643 8.688 0.955 1
1 109 . 2 1 1 A 19 19 VAL HA H 19 4.796 4.935 -0.139 1
1 117 . 2 1 1 A 20 20 ASP H H 20 9.555 8.695 0.860 1
1 118 . 2 1 1 A 20 20 ASP HA H 20 5.151 5.128 0.023 1
1 121 . 2 1 1 A 21 21 VAL H H 21 9.607 8.672 0.935 1
1 122 . 2 1 1 A 21 21 VAL HA H 21 3.611 3.771 -0.160 1
1 130 . 2 1 1 A 22 22 ALA H H 22 8.531 8.234 0.297 1
1 131 . 2 1 1 A 22 22 ALA HA H 22 4.299 3.890 0.409 1
1 135 . 2 1 1 A 23 23 THR H H 23 7.294 8.383 -1.089 1
1 136 . 2 1 1 A 23 23 THR HA H 23 4.264 3.913 0.351 1
1 141 . 2 1 1 A 24 24 ALA H H 24 8.346 8.144 0.202 1
1 142 . 2 1 1 A 24 24 ALA HA H 24 4.082 4.036 0.046 1
1 146 . 2 1 1 A 25 25 GLN H H 25 8.866 8.420 0.446 1
1 147 . 2 1 1 A 25 25 GLN HA H 25 3.804 3.937 -0.133 1
1 153 . 2 1 1 A 26 26 ALA H H 26 7.767 8.226 -0.459 1
1 154 . 2 1 1 A 26 26 ALA HA H 26 4.208 4.017 0.191 1
1 158 . 2 1 1 A 27 27 GLN H H 27 8.881 8.465 0.416 1
1 159 . 2 1 1 A 27 27 GLN HA H 27 4.041 3.912 0.129 1
1 165 . 2 1 1 A 28 28 ALA H H 28 8.142 7.977 0.165 1
1 166 . 2 1 1 A 28 28 ALA HA H 28 3.475 3.517 -0.042 1
1 170 . 2 1 1 A 29 29 ARG H H 29 7.291 7.566 -0.275 1
1 171 . 2 1 1 A 29 29 ARG HA H 29 3.688 3.892 -0.204 1
1 174 . 2 1 1 A 30 30 LYS H H 30 7.768 7.961 -0.193 1
1 175 . 2 1 1 A 30 30 LYS HA H 30 4.038 3.954 0.084 1
1 179 . 2 1 1 A 31 31 ALA H H 31 8.127 7.518 0.609 1
1 180 . 2 1 1 A 31 31 ALA HA H 31 3.656 3.996 -0.340 1
1 184 . 2 1 1 A 32 32 GLY H H 32 7.670 7.653 0.017 1
1 185 . 2 1 1 A 32 32 GLY HA2 H 32 3.380 3.837 -0.457 1
1 186 . 2 1 1 A 32 32 GLY HA3 H 32 3.844 3.865 -0.021 1
1 187 . 2 1 1 A 33 33 LEU H H 33 8.057 8.100 -0.043 1
1 188 . 2 1 1 A 33 33 LEU HA H 33 3.259 3.028 0.231 1
1 197 . 2 1 1 A 34 34 THR H H 34 6.862 7.022 -0.160 1
1 198 . 2 1 1 A 34 34 THR HA H 34 4.738 4.825 -0.087 1
1 203 . 2 1 1 A 35 35 THR H H 35 9.161 8.945 0.216 1
1 204 . 2 1 1 A 35 35 THR HA H 35 4.247 5.163 -0.916 1
1 209 . 2 1 1 A 36 36 GLY H H 36 8.407 8.438 -0.031 1
1 210 . 2 1 1 A 36 36 GLY HA2 H 36 4.349 4.024 0.325 1
1 211 . 2 1 1 A 36 36 GLY HA3 H 36 4.967 4.032 0.935 1
1 212 . 2 1 1 A 37 37 LYS H H 37 10.152 8.304 1.848 1
1 213 . 2 1 1 A 37 37 LYS HA H 37 4.383 4.101 0.282 1
1 221 . 2 1 1 A 38 38 SER H H 38 9.085 8.225 0.860 1
1 222 . 2 1 1 A 38 38 SER HA H 38 4.338 4.774 -0.436 1
1 226 . 2 1 1 A 39 39 GLY H H 39 8.474 7.720 0.754 1
1 227 . 2 1 1 A 39 39 GLY HA2 H 39 3.840 4.156 -0.316 1
1 228 . 2 1 1 A 40 40 ASP H H 40 9.424 7.811 1.613 1
1 229 . 2 1 1 A 40 40 ASP HA H 40 5.374 4.655 0.719 1
1 231 . 2 1 1 A 41 41 PRO HA H 41 5.624 4.653 0.971 1
1 238 . 2 1 1 A 42 42 HIS H H 42 8.343 8.661 -0.318 1
1 239 . 2 1 1 A 42 42 HIS HA H 42 5.189 5.193 -0.004 1
1 244 . 2 1 1 A 43 43 ARG H H 43 8.634 8.350 0.284 1
1 245 . 2 1 1 A 43 43 ARG HA H 43 3.654 3.353 0.301 1
1 252 . 2 1 1 A 44 44 TYR H H 44 8.188 8.707 -0.519 1
1 253 . 2 1 1 A 44 44 TYR HA H 44 5.021 4.509 0.512 1
1 260 . 2 1 1 A 45 45 PHE H H 45 8.728 7.867 0.861 1
1 261 . 2 1 1 A 45 45 PHE HA H 45 4.480 5.467 -0.987 1
1 268 . 2 1 1 A 46 46 ALA H H 46 5.979 8.795 -2.816 1
1 269 . 2 1 1 A 46 46 ALA HA H 46 3.797 4.246 -0.449 1
1 273 . 2 1 1 A 47 47 GLY H H 47 8.510 8.249 0.261 1
1 274 . 2 1 1 A 47 47 GLY HA2 H 47 3.953 3.960 -0.007 1
1 275 . 2 1 1 A 47 47 GLY HA3 H 47 4.075 3.986 0.089 1
1 276 . 2 1 1 A 48 48 ASP H H 48 7.504 7.511 -0.007 1
1 277 . 2 1 1 A 48 48 ASP HA H 48 5.020 4.578 0.442 1
1 280 . 2 1 1 A 49 49 HIS H H 49 8.240 8.779 -0.539 1
1 281 . 2 1 1 A 49 49 HIS HA H 49 4.373 4.647 -0.274 1
1 285 . 2 1 1 A 50 50 ILE H H 50 8.468 8.161 0.307 1
1 286 . 2 1 1 A 50 50 ILE HA H 50 3.651 4.750 -1.099 1
1 296 . 2 1 1 A 51 51 ARG H H 51 8.404 8.556 -0.152 1
1 297 . 2 1 1 A 51 51 ARG HA H 51 4.450 4.869 -0.419 1
1 303 . 2 1 1 A 52 52 TRP H H 52 11.176 8.746 2.430 1
1 304 . 2 1 1 A 52 52 TRP HA H 52 4.423 4.646 -0.223 1
1 312 . 2 1 1 A 53 53 GLY H H 53 10.422 8.074 2.348 1
1 313 . 2 1 1 A 53 53 GLY HA2 H 53 3.832 4.013 -0.181 1
1 314 . 2 1 1 A 53 53 GLY HA3 H 53 4.411 4.040 0.371 1
1 315 . 2 1 1 A 54 54 VAL H H 54 7.040 7.888 -0.848 1
1 316 . 2 1 1 A 54 54 VAL HA H 54 4.489 4.244 0.245 1
1 324 . 2 1 1 A 55 55 ASN H H 55 9.530 9.102 0.428 1
1 325 . 2 1 1 A 55 55 ASN HA H 55 4.569 4.326 0.243 1
1 330 . 2 1 1 A 56 56 ASN H H 56 9.175 8.395 0.780 1
1 331 . 2 1 1 A 56 56 ASN HA H 56 4.649 4.371 0.278 1
1 336 . 2 1 1 A 57 57 CYS H H 57 7.613 7.742 -0.129 1
1 337 . 2 1 1 A 57 57 CYS HA H 57 4.645 4.860 -0.215 1
1 340 . 2 1 1 A 58 58 ASP H H 58 7.626 8.540 -0.914 1
1 341 . 2 1 1 A 58 58 ASP HA H 58 5.206 4.987 0.219 1
1 344 . 2 1 1 A 59 59 LYS H H 59 7.349 7.112 0.237 1
1 345 . 2 1 1 A 59 59 LYS HA H 59 4.548 4.375 0.173 1
1 350 . 2 1 1 A 60 60 ALA H H 60 9.155 8.622 0.533 1
1 351 . 2 1 1 A 60 60 ALA HA H 60 4.330 4.271 0.059 1
1 355 . 2 1 1 A 61 61 ASP H H 61 8.548 7.867 0.681 1
1 356 . 2 1 1 A 61 61 ASP HA H 61 4.827 4.756 0.071 1
1 359 . 2 1 1 A 62 62 ALA H H 62 7.463 7.414 0.049 1
1 360 . 2 1 1 A 62 62 ALA HA H 62 4.217 4.296 -0.079 1
1 364 . 2 1 1 A 63 63 ILE H H 63 9.302 8.745 0.557 1
1 365 . 2 1 1 A 63 63 ILE HA H 63 4.332 4.572 -0.240 1
1 374 . 2 1 1 A 64 64 LEU H H 64 8.724 9.154 -0.430 1
1 375 . 2 1 1 A 64 64 LEU HA H 64 5.463 5.184 0.279 1
1 385 . 2 1 1 A 65 65 TRP H H 65 9.621 8.422 1.199 1
1 386 . 2 1 1 A 65 65 TRP HA H 65 4.605 5.447 -0.842 1
1 395 . 2 1 1 A 66 66 GLU H H 66 8.388 9.150 -0.762 1
1 396 . 2 1 1 A 66 66 GLU HA H 66 6.014 5.734 0.280 1
1 401 . 2 1 1 A 67 67 TYR H H 67 8.766 9.157 -0.391 1
1 402 . 2 1 1 A 67 67 TYR HA H 67 5.204 5.174 0.030 1
1 405 . 2 1 1 A 68 68 PRO HA H 68 4.523 4.398 0.125 1
1 412 . 2 1 1 A 69 69 ILE H H 69 7.308 8.371 -1.063 1
1 413 . 2 1 1 A 69 69 ILE HA H 69 4.870 5.109 -0.239 1
1 414 . 2 1 1 A 70 70 TYR H H 70 9.219 8.913 0.306 1
1 415 . 2 1 1 A 70 70 TYR HA H 70 4.854 4.620 0.234 1
1 423 . 2 1 1 A 71 71 TRP H H 71 6.662 8.343 -1.681 1
1 424 . 2 1 1 A 71 71 TRP HA H 71 5.496 4.853 0.643 1
1 432 . 2 1 1 A 72 72 VAL H H 72 9.510 8.988 0.522 1
1 433 . 2 1 1 A 72 72 VAL HA H 72 3.999 3.901 0.098 1
1 441 . 2 1 1 A 73 73 GLY H H 73 9.221 8.566 0.655 1
1 442 . 2 1 1 A 73 73 GLY HA2 H 73 3.877 4.050 -0.173 1
1 443 . 2 1 1 A 73 73 GLY HA3 H 73 4.682 4.093 0.589 1
1 444 . 2 1 1 A 74 74 LYS H H 74 7.962 7.792 0.170 1
1 445 . 2 1 1 A 74 74 LYS HA H 74 4.469 4.626 -0.157 1
1 457 . 2 1 1 A 75 75 ASN H H 75 8.928 8.794 0.134 1
1 458 . 2 1 1 A 75 75 ASN HA H 75 4.837 5.111 -0.274 1
1 463 . 2 1 1 A 76 76 ALA H H 76 7.544 7.633 -0.089 1
1 464 . 2 1 1 A 76 76 ALA HA H 76 4.555 4.530 0.025 1
1 468 . 2 1 1 A 77 77 GLU H H 77 8.290 8.368 -0.078 1
1 469 . 2 1 1 A 77 77 GLU HA H 77 4.900 3.803 1.097 1
1 474 . 2 1 1 A 78 78 TRP H H 78 10.065 8.814 1.251 1
1 475 . 2 1 1 A 78 78 TRP HA H 78 4.600 4.898 -0.298 1
1 484 . 2 1 1 A 79 79 ALA H H 79 9.850 8.413 1.437 1
1 485 . 2 1 1 A 79 79 ALA HA H 79 5.022 4.582 0.440 1
1 489 . 2 1 1 A 80 80 LYS H H 80 9.255 8.676 0.579 1
1 490 . 2 1 1 A 80 80 LYS HA H 80 4.511 4.471 0.040 1
1 494 . 2 1 1 A 81 81 ASP H H 81 9.332 8.304 1.028 1
1 495 . 2 1 1 A 81 81 ASP HA H 81 5.429 4.729 0.700 1
1 498 . 2 1 1 A 82 82 VAL H H 82 7.226 7.542 -0.316 1
1 499 . 2 1 1 A 82 82 VAL HA H 82 4.248 4.731 -0.483 1
1 507 . 2 1 1 A 83 83 LYS H H 83 8.407 8.659 -0.252 1
1 508 . 2 1 1 A 83 83 LYS HA H 83 4.356 4.497 -0.141 1
1 510 . 2 1 1 A 84 84 THR H H 84 9.088 9.116 -0.028 1
1 511 . 2 1 1 A 84 84 THR HA H 84 3.989 4.057 -0.068 1
1 516 . 2 1 1 A 85 85 SER H H 85 8.391 8.123 0.268 1
1 517 . 2 1 1 A 85 85 SER HA H 85 4.442 4.076 0.366 1
1 520 . 2 1 1 A 86 86 GLN H H 86 7.974 8.251 -0.277 1
1 521 . 2 1 1 A 86 86 GLN HA H 86 4.585 3.983 0.602 1
1 527 . 2 1 1 A 87 87 GLN H H 87 7.083 7.667 -0.584 1
1 528 . 2 1 1 A 87 87 GLN HA H 87 3.903 3.887 0.016 1
1 534 . 2 1 1 A 88 88 LYS H H 88 9.453 8.273 1.180 1
1 535 . 2 1 1 A 88 88 LYS HA H 88 4.114 4.100 0.014 1
1 539 . 2 1 1 A 89 89 GLY H H 89 9.466 8.238 1.228 1
1 540 . 2 1 1 A 89 89 GLY HA2 H 89 3.965 3.916 0.049 1
1 541 . 2 1 1 A 89 89 GLY HA3 H 89 3.148 3.931 -0.783 1
1 542 . 2 1 1 A 90 90 GLY H H 90 7.228 7.516 -0.288 1
1 543 . 2 1 1 A 90 90 GLY HA2 H 90 4.290 4.049 0.241 1
1 544 . 2 1 1 A 90 90 GLY HA3 H 90 4.682 4.059 0.623 1
1 545 . 2 1 1 A 91 91 PRO HA H 91 4.902 4.877 0.025 1
1 552 . 2 1 1 A 92 92 THR H H 92 8.585 8.596 -0.011 1
1 553 . 2 1 1 A 92 92 THR HA H 92 5.701 4.975 0.726 1
1 559 . 2 1 1 A 93 93 PRO HA H 93 5.551 3.763 1.788 1
1 563 . 2 1 1 A 94 94 ILE H H 94 8.155 7.334 0.821 1
1 564 . 2 1 1 A 94 94 ILE HA H 94 4.794 4.262 0.532 1
1 571 . 2 1 1 A 95 95 ARG H H 95 9.538 9.146 0.392 1
1 572 . 2 1 1 A 95 95 ARG HA H 95 5.278 5.421 -0.143 1
1 576 . 2 1 1 A 96 96 VAL H H 96 9.276 9.085 0.191 1
1 577 . 2 1 1 A 96 96 VAL HA H 96 5.222 4.479 0.743 1
1 585 . 2 1 1 A 97 97 VAL H H 97 8.739 9.090 -0.351 1
1 586 . 2 1 1 A 97 97 VAL HA H 97 5.160 5.189 -0.029 1
1 594 . 2 1 1 A 98 98 TYR H H 98 8.596 8.643 -0.047 1
1 595 . 2 1 1 A 98 98 TYR HA H 98 5.266 5.074 0.192 1
1 603 . 2 1 1 A 99 99 ALA H H 99 9.685 8.577 1.108 1
1 604 . 2 1 1 A 99 99 ALA HA H 99 5.680 4.604 1.076 1
1 608 . 2 1 1 A 100 100 ASN H H 100 8.468 8.605 -0.137 1
1 609 . 2 1 1 A 100 100 ASN HA H 100 4.885 4.798 0.087 1
1 614 . 2 1 1 A 101 101 SER H H 101 9.342 8.567 0.775 1
1 615 . 2 1 1 A 101 101 SER HA H 101 4.993 4.800 0.193 1
1 618 . 2 1 1 A 102 102 ARG H H 102 9.349 9.485 -0.136 1
1 619 . 2 1 1 A 102 102 ARG HA H 102 4.068 4.046 0.022 1
1 620 . 2 1 1 A 103 103 GLY H H 103 8.632 8.467 0.165 1
1 621 . 2 1 1 A 103 103 GLY HA2 H 103 3.691 3.836 -0.145 1
1 622 . 2 1 1 A 103 103 GLY HA3 H 103 4.341 3.857 0.484 1
1 623 . 2 1 1 A 104 104 ALA H H 104 7.820 7.651 0.169 1
1 624 . 2 1 1 A 104 104 ALA HA H 104 4.775 4.358 0.417 1
1 628 . 2 1 1 A 105 105 VAL H H 105 8.402 8.613 -0.211 1
1 629 . 2 1 1 A 105 105 VAL HA H 105 4.218 4.662 -0.444 1
1 637 . 2 1 1 A 106 106 GLN H H 106 9.352 8.349 1.003 1
1 638 . 2 1 1 A 106 106 GLN HA H 106 4.900 4.643 0.257 1
1 645 . 2 1 1 A 107 107 TYR H H 107 9.075 8.061 1.014 1
1 646 . 2 1 1 A 107 107 TYR HA H 107 4.007 4.111 -0.104 1
1 653 . 2 1 1 A 108 108 CYS H H 108 8.197 7.762 0.435 1
1 654 . 2 1 1 A 108 108 CYS HA H 108 4.823 4.078 0.745 1
1 657 . 2 1 1 A 109 109 GLY H H 109 6.856 6.715 0.141 1
1 658 . 2 1 1 A 109 109 GLY HA2 H 109 3.983 3.236 0.747 1
1 659 . 2 1 1 A 109 109 GLY HA3 H 109 4.422 3.256 1.166 1
1 660 . 2 1 1 A 110 110 VAL H H 110 9.418 8.676 0.742 1
1 661 . 2 1 1 A 110 110 VAL HA H 110 5.073 4.986 0.087 1
1 669 . 2 1 1 A 111 111 MET H H 111 9.327 9.711 -0.384 1
1 670 . 2 1 1 A 111 111 MET HA H 111 5.678 5.427 0.251 1
1 678 . 2 1 1 A 112 112 THR H H 112 9.310 9.360 -0.050 1
1 679 . 2 1 1 A 112 112 THR HA H 112 5.726 4.562 1.164 1
1 685 . 2 1 1 A 113 113 HIS H H 113 8.960 8.054 0.906 1
1 686 . 2 1 1 A 113 113 HIS HA H 113 3.876 4.185 -0.309 1
1 691 . 2 1 1 A 114 114 SER H H 114 8.367 8.649 -0.282 1
1 692 . 2 1 1 A 114 114 SER HA H 114 4.024 4.181 -0.157 1
1 695 . 2 1 1 A 115 115 LYS H H 115 8.140 7.472 0.668 1
1 696 . 2 1 1 A 115 115 LYS HA H 115 5.403 4.471 0.932 1
1 699 . 2 1 1 A 116 116 VAL H H 116 8.525 8.213 0.312 1
1 700 . 2 1 1 A 116 116 VAL HA H 116 5.378 4.575 0.803 1
1 708 . 2 1 1 A 117 117 ASP H H 117 8.025 8.787 -0.762 1
1 709 . 2 1 1 A 117 117 ASP HA H 117 5.243 4.367 0.876 1
1 712 . 2 1 1 A 118 118 LYS H H 118 8.930 7.923 1.007 1
1 713 . 2 1 1 A 118 118 LYS HA H 118 4.216 4.613 -0.397 1
1 716 . 2 1 1 A 119 119 ASN H H 119 8.425 7.473 0.952 1
1 717 . 2 1 1 A 119 119 ASN HA H 119 5.061 4.843 0.218 1
1 722 . 2 1 1 A 120 120 ASN H H 120 8.061 8.059 0.002 1
1 723 . 2 1 1 A 120 120 ASN HA H 120 4.212 4.337 -0.125 1
1 728 . 2 1 1 A 121 121 GLN H H 121 8.359 7.964 0.395 1
1 729 . 2 1 1 A 121 121 GLN HA H 121 4.373 4.431 -0.058 1
1 735 . 2 1 1 A 122 122 GLY H H 122 8.770 8.690 0.080 1
1 736 . 2 1 1 A 122 122 GLY HA2 H 122 3.182 3.983 -0.801 1
1 737 . 2 1 1 A 122 122 GLY HA3 H 122 5.268 4.177 1.091 1
1 738 . 2 1 1 A 123 123 LYS H H 123 8.587 8.515 0.072 1
1 739 . 2 1 1 A 123 123 LYS HA H 123 4.016 4.417 -0.401 1
1 745 . 2 1 1 A 124 124 GLU H H 124 8.527 7.674 0.853 1
1 746 . 2 1 1 A 124 124 GLU HA H 124 4.152 4.546 -0.394 1
1 750 . 2 1 1 A 125 125 PHE H H 125 7.936 9.036 -1.100 1
1 751 . 2 1 1 A 125 125 PHE HA H 125 4.670 4.628 0.042 1
1 758 . 2 1 1 A 126 126 PHE H H 126 8.214 9.116 -0.902 1
1 759 . 2 1 1 A 126 126 PHE HA H 126 5.177 4.999 0.178 1
1 767 . 2 1 1 A 127 127 GLU H H 127 9.169 8.929 0.240 1
1 768 . 2 1 1 A 127 127 GLU HA H 127 4.852 4.473 0.379 1
1 773 . 2 1 1 A 128 128 LYS H H 128 9.000 8.374 0.626 1
1 774 . 2 1 1 A 128 128 LYS HA H 128 4.191 4.078 0.113 1
1 777 . 2 1 1 A 129 129 CYS H H 129 8.938 9.104 -0.166 1
1 778 . 2 1 1 A 129 129 CYS HA H 129 5.268 5.574 -0.306 1
1 5 . 3 1 1 A 2 2 PRO HA H 2 4.900 4.552 0.348 1
1 10 . 3 1 1 A 3 3 ILE H H 3 8.774 7.418 1.356 1
1 11 . 3 1 1 A 3 3 ILE HA H 3 5.499 4.591 0.908 1
1 20 . 3 1 1 A 4 4 VAL H H 4 9.501 9.246 0.255 1
1 21 . 3 1 1 A 4 4 VAL HA H 4 4.944 5.090 -0.146 1
1 29 . 3 1 1 A 5 5 THR H H 5 9.243 8.988 0.255 1
1 30 . 3 1 1 A 5 5 THR HA H 5 5.278 5.328 -0.050 1
1 35 . 3 1 1 A 6 6 CYS H H 6 9.815 8.768 1.047 1
1 36 . 3 1 1 A 6 6 CYS HA H 6 5.310 4.664 0.646 1
1 38 . 3 1 1 A 7 7 ARG H H 7 9.154 8.311 0.843 1
1 41 . 3 1 1 A 8 8 PRO HA H 8 4.594 4.798 -0.204 1
1 47 . 3 1 1 A 9 9 LYS H H 9 8.179 8.493 -0.314 1
1 48 . 3 1 1 A 9 9 LYS HA H 9 4.857 4.500 0.357 1
1 52 . 3 1 1 A 10 10 LEU H H 10 9.108 8.555 0.553 1
1 53 . 3 1 1 A 10 10 LEU HA H 10 5.147 4.733 0.414 1
1 63 . 3 1 1 A 11 11 ASP H H 11 9.835 8.096 1.739 1
1 64 . 3 1 1 A 11 11 ASP HA H 11 4.471 4.791 -0.320 1
1 67 . 3 1 1 A 12 12 GLY H H 12 8.847 8.033 0.814 1
1 68 . 3 1 1 A 12 12 GLY HA2 H 12 3.782 3.940 -0.158 1
1 69 . 3 1 1 A 12 12 GLY HA3 H 12 4.427 3.947 0.480 1
1 70 . 3 1 1 A 13 13 ARG H H 13 7.933 7.725 0.208 1
1 71 . 3 1 1 A 13 13 ARG HA H 13 4.886 4.578 0.308 1
1 77 . 3 1 1 A 14 14 GLU H H 14 9.179 8.622 0.557 1
1 78 . 3 1 1 A 14 14 GLU HA H 14 4.178 4.719 -0.541 1
1 82 . 3 1 1 A 15 15 LYS H H 15 9.078 8.655 0.423 1
1 83 . 3 1 1 A 15 15 LYS HA H 15 4.890 4.678 0.212 1
1 84 . 3 1 1 A 16 16 PRO HA H 16 5.144 4.846 0.298 1
1 91 . 3 1 1 A 17 17 PHE H H 17 9.487 8.672 0.815 1
1 92 . 3 1 1 A 17 17 PHE HA H 17 4.760 4.542 0.218 1
1 100 . 3 1 1 A 18 18 LYS H H 18 9.315 8.662 0.653 1
1 101 . 3 1 1 A 18 18 LYS HA H 18 5.197 4.196 1.001 1
1 108 . 3 1 1 A 19 19 VAL H H 19 9.643 8.668 0.975 1
1 109 . 3 1 1 A 19 19 VAL HA H 19 4.796 4.906 -0.110 1
1 117 . 3 1 1 A 20 20 ASP H H 20 9.555 8.536 1.019 1
1 118 . 3 1 1 A 20 20 ASP HA H 20 5.151 5.547 -0.396 1
1 121 . 3 1 1 A 21 21 VAL H H 21 9.607 8.955 0.652 1
1 122 . 3 1 1 A 21 21 VAL HA H 21 3.611 3.805 -0.194 1
1 130 . 3 1 1 A 22 22 ALA H H 22 8.531 8.263 0.268 1
1 131 . 3 1 1 A 22 22 ALA HA H 22 4.299 3.895 0.404 1
1 135 . 3 1 1 A 23 23 THR H H 23 7.294 8.263 -0.969 1
1 136 . 3 1 1 A 23 23 THR HA H 23 4.264 3.860 0.404 1
1 141 . 3 1 1 A 24 24 ALA H H 24 8.346 8.255 0.091 1
1 142 . 3 1 1 A 24 24 ALA HA H 24 4.082 4.142 -0.060 1
1 146 . 3 1 1 A 25 25 GLN H H 25 8.866 8.358 0.508 1
1 147 . 3 1 1 A 25 25 GLN HA H 25 3.804 3.878 -0.074 1
1 153 . 3 1 1 A 26 26 ALA H H 26 7.767 8.143 -0.376 1
1 154 . 3 1 1 A 26 26 ALA HA H 26 4.208 4.027 0.181 1
1 158 . 3 1 1 A 27 27 GLN H H 27 8.881 8.307 0.574 1
1 159 . 3 1 1 A 27 27 GLN HA H 27 4.041 3.946 0.095 1
1 165 . 3 1 1 A 28 28 ALA H H 28 8.142 8.150 -0.008 1
1 166 . 3 1 1 A 28 28 ALA HA H 28 3.475 3.574 -0.099 1
1 170 . 3 1 1 A 29 29 ARG H H 29 7.291 7.667 -0.376 1
1 171 . 3 1 1 A 29 29 ARG HA H 29 3.688 3.833 -0.145 1
1 174 . 3 1 1 A 30 30 LYS H H 30 7.768 8.027 -0.259 1
1 175 . 3 1 1 A 30 30 LYS HA H 30 4.038 3.946 0.092 1
1 179 . 3 1 1 A 31 31 ALA H H 31 8.127 7.603 0.524 1
1 180 . 3 1 1 A 31 31 ALA HA H 31 3.656 3.911 -0.255 1
1 184 . 3 1 1 A 32 32 GLY H H 32 7.670 7.582 0.088 1
1 185 . 3 1 1 A 32 32 GLY HA2 H 32 3.380 3.764 -0.384 1
1 186 . 3 1 1 A 32 32 GLY HA3 H 32 3.844 3.800 0.044 1
1 187 . 3 1 1 A 33 33 LEU H H 33 8.057 8.119 -0.062 1
1 188 . 3 1 1 A 33 33 LEU HA H 33 3.259 2.793 0.466 1
1 197 . 3 1 1 A 34 34 THR H H 34 6.862 7.118 -0.256 1
1 198 . 3 1 1 A 34 34 THR HA H 34 4.738 5.029 -0.291 1
1 203 . 3 1 1 A 35 35 THR H H 35 9.161 9.238 -0.077 1
1 204 . 3 1 1 A 35 35 THR HA H 35 4.247 5.236 -0.989 1
1 209 . 3 1 1 A 36 36 GLY H H 36 8.407 8.470 -0.063 1
1 210 . 3 1 1 A 36 36 GLY HA2 H 36 4.349 4.035 0.314 1
1 211 . 3 1 1 A 36 36 GLY HA3 H 36 4.967 4.043 0.924 1
1 212 . 3 1 1 A 37 37 LYS H H 37 10.152 8.228 1.924 1
1 213 . 3 1 1 A 37 37 LYS HA H 37 4.383 4.105 0.278 1
1 221 . 3 1 1 A 38 38 SER H H 38 9.085 8.086 0.999 1
1 222 . 3 1 1 A 38 38 SER HA H 38 4.338 4.724 -0.386 1
1 226 . 3 1 1 A 39 39 GLY H H 39 8.474 7.735 0.739 1
1 227 . 3 1 1 A 39 39 GLY HA2 H 39 3.840 4.119 -0.279 1
1 228 . 3 1 1 A 40 40 ASP H H 40 9.424 8.014 1.410 1
1 229 . 3 1 1 A 40 40 ASP HA H 40 5.374 4.635 0.739 1
1 231 . 3 1 1 A 41 41 PRO HA H 41 5.624 4.680 0.944 1
1 238 . 3 1 1 A 42 42 HIS H H 42 8.343 8.636 -0.293 1
1 239 . 3 1 1 A 42 42 HIS HA H 42 5.189 5.242 -0.053 1
1 244 . 3 1 1 A 43 43 ARG H H 43 8.634 8.422 0.212 1
1 245 . 3 1 1 A 43 43 ARG HA H 43 3.654 3.139 0.515 1
1 252 . 3 1 1 A 44 44 TYR H H 44 8.188 8.627 -0.439 1
1 253 . 3 1 1 A 44 44 TYR HA H 44 5.021 4.651 0.370 1
1 260 . 3 1 1 A 45 45 PHE H H 45 8.728 7.608 1.120 1
1 261 . 3 1 1 A 45 45 PHE HA H 45 4.480 4.808 -0.328 1
1 268 . 3 1 1 A 46 46 ALA H H 46 5.979 6.507 -0.528 1
1 269 . 3 1 1 A 46 46 ALA HA H 46 3.797 4.404 -0.607 1
1 273 . 3 1 1 A 47 47 GLY H H 47 8.510 8.225 0.285 1
1 274 . 3 1 1 A 47 47 GLY HA2 H 47 3.953 3.876 0.077 1
1 275 . 3 1 1 A 47 47 GLY HA3 H 47 4.075 3.908 0.167 1
1 276 . 3 1 1 A 48 48 ASP H H 48 7.504 7.669 -0.165 1
1 277 . 3 1 1 A 48 48 ASP HA H 48 5.020 4.808 0.212 1
1 280 . 3 1 1 A 49 49 HIS H H 49 8.240 9.140 -0.900 1
1 281 . 3 1 1 A 49 49 HIS HA H 49 4.373 4.689 -0.316 1
1 285 . 3 1 1 A 50 50 ILE H H 50 8.468 8.926 -0.458 1
1 286 . 3 1 1 A 50 50 ILE HA H 50 3.651 4.864 -1.213 1
1 296 . 3 1 1 A 51 51 ARG H H 51 8.404 8.644 -0.240 1
1 297 . 3 1 1 A 51 51 ARG HA H 51 4.450 4.890 -0.440 1
1 303 . 3 1 1 A 52 52 TRP H H 52 11.176 8.687 2.489 1
1 304 . 3 1 1 A 52 52 TRP HA H 52 4.423 4.677 -0.254 1
1 312 . 3 1 1 A 53 53 GLY H H 53 10.422 7.978 2.444 1
1 313 . 3 1 1 A 53 53 GLY HA2 H 53 3.832 4.005 -0.173 1
1 314 . 3 1 1 A 53 53 GLY HA3 H 53 4.411 4.034 0.377 1
1 315 . 3 1 1 A 54 54 VAL H H 54 7.040 7.884 -0.844 1
1 316 . 3 1 1 A 54 54 VAL HA H 54 4.489 4.239 0.250 1
1 324 . 3 1 1 A 55 55 ASN H H 55 9.530 9.054 0.476 1
1 325 . 3 1 1 A 55 55 ASN HA H 55 4.569 4.330 0.239 1
1 330 . 3 1 1 A 56 56 ASN H H 56 9.175 8.388 0.787 1
1 331 . 3 1 1 A 56 56 ASN HA H 56 4.649 4.387 0.262 1
1 336 . 3 1 1 A 57 57 CYS H H 57 7.613 7.713 -0.100 1
1 337 . 3 1 1 A 57 57 CYS HA H 57 4.645 4.649 -0.004 1
1 340 . 3 1 1 A 58 58 ASP H H 58 7.626 8.260 -0.634 1
1 341 . 3 1 1 A 58 58 ASP HA H 58 5.206 4.912 0.294 1
1 344 . 3 1 1 A 59 59 LYS H H 59 7.349 7.494 -0.145 1
1 345 . 3 1 1 A 59 59 LYS HA H 59 4.548 4.716 -0.168 1
1 350 . 3 1 1 A 60 60 ALA H H 60 9.155 8.424 0.731 1
1 351 . 3 1 1 A 60 60 ALA HA H 60 4.330 4.315 0.015 1
1 355 . 3 1 1 A 61 61 ASP H H 61 8.548 7.866 0.682 1
1 356 . 3 1 1 A 61 61 ASP HA H 61 4.827 4.874 -0.047 1
1 359 . 3 1 1 A 62 62 ALA H H 62 7.463 7.388 0.075 1
1 360 . 3 1 1 A 62 62 ALA HA H 62 4.217 4.302 -0.085 1
1 364 . 3 1 1 A 63 63 ILE H H 63 9.302 8.386 0.916 1
1 365 . 3 1 1 A 63 63 ILE HA H 63 4.332 4.555 -0.223 1
1 374 . 3 1 1 A 64 64 LEU H H 64 8.724 8.980 -0.256 1
1 375 . 3 1 1 A 64 64 LEU HA H 64 5.463 5.147 0.316 1
1 385 . 3 1 1 A 65 65 TRP H H 65 9.621 8.420 1.201 1
1 386 . 3 1 1 A 65 65 TRP HA H 65 4.605 5.362 -0.757 1
1 395 . 3 1 1 A 66 66 GLU H H 66 8.388 9.312 -0.924 1
1 396 . 3 1 1 A 66 66 GLU HA H 66 6.014 5.694 0.320 1
1 401 . 3 1 1 A 67 67 TYR H H 67 8.766 9.120 -0.354 1
1 402 . 3 1 1 A 67 67 TYR HA H 67 5.204 5.118 0.086 1
1 405 . 3 1 1 A 68 68 PRO HA H 68 4.523 4.466 0.057 1
1 412 . 3 1 1 A 69 69 ILE H H 69 7.308 8.413 -1.105 1
1 413 . 3 1 1 A 69 69 ILE HA H 69 4.870 4.660 0.210 1
1 414 . 3 1 1 A 70 70 TYR H H 70 9.219 9.118 0.101 1
1 415 . 3 1 1 A 70 70 TYR HA H 70 4.854 4.522 0.332 1
1 423 . 3 1 1 A 71 71 TRP H H 71 6.662 8.042 -1.380 1
1 424 . 3 1 1 A 71 71 TRP HA H 71 5.496 4.874 0.622 1
1 432 . 3 1 1 A 72 72 VAL H H 72 9.510 8.951 0.559 1
1 433 . 3 1 1 A 72 72 VAL HA H 72 3.999 3.702 0.297 1
1 441 . 3 1 1 A 73 73 GLY H H 73 9.221 8.381 0.840 1
1 442 . 3 1 1 A 73 73 GLY HA2 H 73 3.877 4.020 -0.143 1
1 443 . 3 1 1 A 73 73 GLY HA3 H 73 4.682 4.053 0.629 1
1 444 . 3 1 1 A 74 74 LYS H H 74 7.962 7.599 0.363 1
1 445 . 3 1 1 A 74 74 LYS HA H 74 4.469 4.403 0.066 1
1 457 . 3 1 1 A 75 75 ASN H H 75 8.928 8.818 0.110 1
1 458 . 3 1 1 A 75 75 ASN HA H 75 4.837 5.063 -0.226 1
1 463 . 3 1 1 A 76 76 ALA H H 76 7.544 7.400 0.144 1
1 464 . 3 1 1 A 76 76 ALA HA H 76 4.555 4.613 -0.058 1
1 468 . 3 1 1 A 77 77 GLU H H 77 8.290 8.447 -0.157 1
1 469 . 3 1 1 A 77 77 GLU HA H 77 4.900 4.502 0.398 1
1 474 . 3 1 1 A 78 78 TRP H H 78 10.065 9.064 1.001 1
1 475 . 3 1 1 A 78 78 TRP HA H 78 4.600 5.000 -0.400 1
1 484 . 3 1 1 A 79 79 ALA H H 79 9.850 8.458 1.392 1
1 485 . 3 1 1 A 79 79 ALA HA H 79 5.022 4.465 0.557 1
1 489 . 3 1 1 A 80 80 LYS H H 80 9.255 8.838 0.417 1
1 490 . 3 1 1 A 80 80 LYS HA H 80 4.511 4.582 -0.071 1
1 494 . 3 1 1 A 81 81 ASP H H 81 9.332 7.912 1.420 1
1 495 . 3 1 1 A 81 81 ASP HA H 81 5.429 4.777 0.652 1
1 498 . 3 1 1 A 82 82 VAL H H 82 7.226 7.454 -0.228 1
1 499 . 3 1 1 A 82 82 VAL HA H 82 4.248 4.601 -0.353 1
1 507 . 3 1 1 A 83 83 LYS H H 83 8.407 8.803 -0.396 1
1 508 . 3 1 1 A 83 83 LYS HA H 83 4.356 4.626 -0.270 1
1 510 . 3 1 1 A 84 84 THR H H 84 9.088 9.163 -0.075 1
1 511 . 3 1 1 A 84 84 THR HA H 84 3.989 4.023 -0.034 1
1 516 . 3 1 1 A 85 85 SER H H 85 8.391 8.111 0.280 1
1 517 . 3 1 1 A 85 85 SER HA H 85 4.442 4.023 0.419 1
1 520 . 3 1 1 A 86 86 GLN H H 86 7.974 8.245 -0.271 1
1 521 . 3 1 1 A 86 86 GLN HA H 86 4.585 3.963 0.622 1
1 527 . 3 1 1 A 87 87 GLN H H 87 7.083 7.783 -0.700 1
1 528 . 3 1 1 A 87 87 GLN HA H 87 3.903 3.858 0.045 1
1 534 . 3 1 1 A 88 88 LYS H H 88 9.453 8.480 0.973 1
1 535 . 3 1 1 A 88 88 LYS HA H 88 4.114 4.510 -0.396 1
1 539 . 3 1 1 A 89 89 GLY H H 89 9.466 7.879 1.587 1
1 540 . 3 1 1 A 89 89 GLY HA2 H 89 3.965 4.150 -0.185 1
1 541 . 3 1 1 A 89 89 GLY HA3 H 89 3.148 4.169 -1.021 1
1 542 . 3 1 1 A 90 90 GLY H H 90 7.228 7.410 -0.182 1
1 543 . 3 1 1 A 90 90 GLY HA2 H 90 4.290 4.093 0.197 1
1 544 . 3 1 1 A 90 90 GLY HA3 H 90 4.682 4.108 0.574 1
1 545 . 3 1 1 A 91 91 PRO HA H 91 4.902 4.811 0.091 1
1 552 . 3 1 1 A 92 92 THR H H 92 8.585 8.516 0.069 1
1 553 . 3 1 1 A 92 92 THR HA H 92 5.701 4.912 0.789 1
1 559 . 3 1 1 A 93 93 PRO HA H 93 5.551 4.198 1.353 1
1 563 . 3 1 1 A 94 94 ILE H H 94 8.155 7.599 0.556 1
1 564 . 3 1 1 A 94 94 ILE HA H 94 4.794 4.431 0.363 1
1 571 . 3 1 1 A 95 95 ARG H H 95 9.538 9.391 0.147 1
1 572 . 3 1 1 A 95 95 ARG HA H 95 5.278 5.363 -0.085 1
1 576 . 3 1 1 A 96 96 VAL H H 96 9.276 9.041 0.235 1
1 577 . 3 1 1 A 96 96 VAL HA H 96 5.222 4.336 0.886 1
1 585 . 3 1 1 A 97 97 VAL H H 97 8.739 9.026 -0.287 1
1 586 . 3 1 1 A 97 97 VAL HA H 97 5.160 5.351 -0.191 1
1 594 . 3 1 1 A 98 98 TYR H H 98 8.596 8.219 0.377 1
1 595 . 3 1 1 A 98 98 TYR HA H 98 5.266 5.183 0.083 1
1 603 . 3 1 1 A 99 99 ALA H H 99 9.685 8.782 0.903 1
1 604 . 3 1 1 A 99 99 ALA HA H 99 5.680 4.992 0.688 1
1 608 . 3 1 1 A 100 100 ASN H H 100 8.468 8.976 -0.508 1
1 609 . 3 1 1 A 100 100 ASN HA H 100 4.885 4.926 -0.041 1
1 614 . 3 1 1 A 101 101 SER H H 101 9.342 8.304 1.038 1
1 615 . 3 1 1 A 101 101 SER HA H 101 4.993 4.287 0.706 1
1 618 . 3 1 1 A 102 102 ARG H H 102 9.349 7.744 1.605 1
1 619 . 3 1 1 A 102 102 ARG HA H 102 4.068 4.533 -0.465 1
1 620 . 3 1 1 A 103 103 GLY H H 103 8.632 8.105 0.527 1
1 621 . 3 1 1 A 103 103 GLY HA2 H 103 3.691 3.944 -0.253 1
1 622 . 3 1 1 A 103 103 GLY HA3 H 103 4.341 3.952 0.389 1
1 623 . 3 1 1 A 104 104 ALA H H 104 7.820 7.824 -0.004 1
1 624 . 3 1 1 A 104 104 ALA HA H 104 4.775 4.261 0.514 1
1 628 . 3 1 1 A 105 105 VAL H H 105 8.402 8.467 -0.065 1
1 629 . 3 1 1 A 105 105 VAL HA H 105 4.218 4.180 0.038 1
1 637 . 3 1 1 A 106 106 GLN H H 106 9.352 8.503 0.849 1
1 638 . 3 1 1 A 106 106 GLN HA H 106 4.900 4.611 0.289 1
1 645 . 3 1 1 A 107 107 TYR H H 107 9.075 8.088 0.987 1
1 646 . 3 1 1 A 107 107 TYR HA H 107 4.007 4.130 -0.123 1
1 653 . 3 1 1 A 108 108 CYS H H 108 8.197 7.742 0.455 1
1 654 . 3 1 1 A 108 108 CYS HA H 108 4.823 4.041 0.782 1
1 657 . 3 1 1 A 109 109 GLY H H 109 6.856 6.692 0.164 1
1 658 . 3 1 1 A 109 109 GLY HA2 H 109 3.983 3.205 0.778 1
1 659 . 3 1 1 A 109 109 GLY HA3 H 109 4.422 3.236 1.186 1
1 660 . 3 1 1 A 110 110 VAL H H 110 9.418 8.573 0.845 1
1 661 . 3 1 1 A 110 110 VAL HA H 110 5.073 4.685 0.388 1
1 669 . 3 1 1 A 111 111 MET H H 111 9.327 9.437 -0.110 1
1 670 . 3 1 1 A 111 111 MET HA H 111 5.678 5.476 0.202 1
1 678 . 3 1 1 A 112 112 THR H H 112 9.310 9.111 0.199 1
1 679 . 3 1 1 A 112 112 THR HA H 112 5.726 5.136 0.590 1
1 685 . 3 1 1 A 113 113 HIS H H 113 8.960 9.234 -0.274 1
1 686 . 3 1 1 A 113 113 HIS HA H 113 3.876 4.022 -0.146 1
1 691 . 3 1 1 A 114 114 SER H H 114 8.367 8.107 0.260 1
1 692 . 3 1 1 A 114 114 SER HA H 114 4.024 3.934 0.090 1
1 695 . 3 1 1 A 115 115 LYS H H 115 8.140 7.467 0.673 1
1 696 . 3 1 1 A 115 115 LYS HA H 115 5.403 4.709 0.694 1
1 699 . 3 1 1 A 116 116 VAL H H 116 8.525 8.642 -0.117 1
1 700 . 3 1 1 A 116 116 VAL HA H 116 5.378 4.773 0.605 1
1 708 . 3 1 1 A 117 117 ASP H H 117 8.025 8.751 -0.726 1
1 709 . 3 1 1 A 117 117 ASP HA H 117 5.243 4.725 0.518 1
1 712 . 3 1 1 A 118 118 LYS H H 118 8.930 7.976 0.954 1
1 713 . 3 1 1 A 118 118 LYS HA H 118 4.216 4.352 -0.136 1
1 716 . 3 1 1 A 119 119 ASN H H 119 8.425 7.638 0.787 1
1 717 . 3 1 1 A 119 119 ASN HA H 119 5.061 5.110 -0.049 1
1 722 . 3 1 1 A 120 120 ASN H H 120 8.061 8.986 -0.925 1
1 723 . 3 1 1 A 120 120 ASN HA H 120 4.212 4.831 -0.619 1
1 728 . 3 1 1 A 121 121 GLN H H 121 8.359 8.882 -0.523 1
1 729 . 3 1 1 A 121 121 GLN HA H 121 4.373 4.432 -0.059 1
1 735 . 3 1 1 A 122 122 GLY H H 122 8.770 7.761 1.009 1
1 736 . 3 1 1 A 122 122 GLY HA2 H 122 3.182 3.965 -0.783 1
1 737 . 3 1 1 A 122 122 GLY HA3 H 122 5.268 3.975 1.293 1
1 738 . 3 1 1 A 123 123 LYS H H 123 8.587 8.539 0.048 1
1 739 . 3 1 1 A 123 123 LYS HA H 123 4.016 4.560 -0.544 1
1 745 . 3 1 1 A 124 124 GLU H H 124 8.527 7.834 0.693 1
1 746 . 3 1 1 A 124 124 GLU HA H 124 4.152 4.445 -0.293 1
1 750 . 3 1 1 A 125 125 PHE H H 125 7.936 8.792 -0.856 1
1 751 . 3 1 1 A 125 125 PHE HA H 125 4.670 4.437 0.233 1
1 758 . 3 1 1 A 126 126 PHE H H 126 8.214 8.917 -0.703 1
1 759 . 3 1 1 A 126 126 PHE HA H 126 5.177 4.650 0.527 1
1 767 . 3 1 1 A 127 127 GLU H H 127 9.169 9.109 0.060 1
1 768 . 3 1 1 A 127 127 GLU HA H 127 4.852 4.487 0.365 1
1 773 . 3 1 1 A 128 128 LYS H H 128 9.000 8.226 0.774 1
1 774 . 3 1 1 A 128 128 LYS HA H 128 4.191 3.989 0.202 1
1 777 . 3 1 1 A 129 129 CYS H H 129 8.938 9.130 -0.192 1
1 778 . 3 1 1 A 129 129 CYS HA H 129 5.268 4.530 0.738 1
1 5 . 4 1 1 A 2 2 PRO HA H 2 4.900 4.488 0.412 1
1 10 . 4 1 1 A 3 3 ILE H H 3 8.774 7.472 1.302 1
1 11 . 4 1 1 A 3 3 ILE HA H 3 5.499 4.381 1.118 1
1 20 . 4 1 1 A 4 4 VAL H H 4 9.501 9.091 0.410 1
1 21 . 4 1 1 A 4 4 VAL HA H 4 4.944 5.221 -0.277 1
1 29 . 4 1 1 A 5 5 THR H H 5 9.243 8.751 0.492 1
1 30 . 4 1 1 A 5 5 THR HA H 5 5.278 5.150 0.128 1
1 35 . 4 1 1 A 6 6 CYS H H 6 9.815 8.666 1.149 1
1 36 . 4 1 1 A 6 6 CYS HA H 6 5.310 4.656 0.654 1
1 38 . 4 1 1 A 7 7 ARG H H 7 9.154 8.486 0.668 1
1 41 . 4 1 1 A 8 8 PRO HA H 8 4.594 4.558 0.036 1
1 47 . 4 1 1 A 9 9 LYS H H 9 8.179 8.416 -0.237 1
1 48 . 4 1 1 A 9 9 LYS HA H 9 4.857 4.837 0.020 1
1 52 . 4 1 1 A 10 10 LEU H H 10 9.108 8.279 0.829 1
1 53 . 4 1 1 A 10 10 LEU HA H 10 5.147 4.402 0.745 1
1 63 . 4 1 1 A 11 11 ASP H H 11 9.835 7.868 1.967 1
1 64 . 4 1 1 A 11 11 ASP HA H 11 4.471 4.678 -0.207 1
1 67 . 4 1 1 A 12 12 GLY H H 12 8.847 7.960 0.887 1
1 68 . 4 1 1 A 12 12 GLY HA2 H 12 3.782 3.852 -0.070 1
1 69 . 4 1 1 A 12 12 GLY HA3 H 12 4.427 3.857 0.570 1
1 70 . 4 1 1 A 13 13 ARG H H 13 7.933 7.899 0.034 1
1 71 . 4 1 1 A 13 13 ARG HA H 13 4.886 4.716 0.170 1
1 77 . 4 1 1 A 14 14 GLU H H 14 9.179 8.537 0.642 1
1 78 . 4 1 1 A 14 14 GLU HA H 14 4.178 4.471 -0.293 1
1 82 . 4 1 1 A 15 15 LYS H H 15 9.078 8.952 0.126 1
1 83 . 4 1 1 A 15 15 LYS HA H 15 4.890 4.730 0.160 1
1 84 . 4 1 1 A 16 16 PRO HA H 16 5.144 4.842 0.302 1
1 91 . 4 1 1 A 17 17 PHE H H 17 9.487 8.525 0.962 1
1 92 . 4 1 1 A 17 17 PHE HA H 17 4.760 4.687 0.073 1
1 100 . 4 1 1 A 18 18 LYS H H 18 9.315 8.826 0.489 1
1 101 . 4 1 1 A 18 18 LYS HA H 18 5.197 4.426 0.771 1
1 108 . 4 1 1 A 19 19 VAL H H 19 9.643 8.528 1.115 1
1 109 . 4 1 1 A 19 19 VAL HA H 19 4.796 4.927 -0.131 1
1 117 . 4 1 1 A 20 20 ASP H H 20 9.555 8.783 0.772 1
1 118 . 4 1 1 A 20 20 ASP HA H 20 5.151 4.928 0.223 1
1 121 . 4 1 1 A 21 21 VAL H H 21 9.607 8.527 1.080 1
1 122 . 4 1 1 A 21 21 VAL HA H 21 3.611 3.802 -0.191 1
1 130 . 4 1 1 A 22 22 ALA H H 22 8.531 8.244 0.287 1
1 131 . 4 1 1 A 22 22 ALA HA H 22 4.299 3.886 0.413 1
1 135 . 4 1 1 A 23 23 THR H H 23 7.294 8.939 -1.645 1
1 136 . 4 1 1 A 23 23 THR HA H 23 4.264 3.855 0.409 1
1 141 . 4 1 1 A 24 24 ALA H H 24 8.346 8.216 0.130 1
1 142 . 4 1 1 A 24 24 ALA HA H 24 4.082 4.116 -0.034 1
1 146 . 4 1 1 A 25 25 GLN H H 25 8.866 8.421 0.445 1
1 147 . 4 1 1 A 25 25 GLN HA H 25 3.804 3.829 -0.025 1
1 153 . 4 1 1 A 26 26 ALA H H 26 7.767 8.067 -0.300 1
1 154 . 4 1 1 A 26 26 ALA HA H 26 4.208 4.013 0.195 1
1 158 . 4 1 1 A 27 27 GLN H H 27 8.881 8.361 0.520 1
1 159 . 4 1 1 A 27 27 GLN HA H 27 4.041 3.984 0.057 1
1 165 . 4 1 1 A 28 28 ALA H H 28 8.142 8.013 0.129 1
1 166 . 4 1 1 A 28 28 ALA HA H 28 3.475 3.600 -0.125 1
1 170 . 4 1 1 A 29 29 ARG H H 29 7.291 7.712 -0.421 1
1 171 . 4 1 1 A 29 29 ARG HA H 29 3.688 3.858 -0.170 1
1 174 . 4 1 1 A 30 30 LYS H H 30 7.768 7.982 -0.214 1
1 175 . 4 1 1 A 30 30 LYS HA H 30 4.038 3.926 0.112 1
1 179 . 4 1 1 A 31 31 ALA H H 31 8.127 7.256 0.871 1
1 180 . 4 1 1 A 31 31 ALA HA H 31 3.656 3.969 -0.313 1
1 184 . 4 1 1 A 32 32 GLY H H 32 7.670 7.716 -0.046 1
1 185 . 4 1 1 A 32 32 GLY HA2 H 32 3.380 3.776 -0.396 1
1 186 . 4 1 1 A 32 32 GLY HA3 H 32 3.844 3.814 0.030 1
1 187 . 4 1 1 A 33 33 LEU H H 33 8.057 8.152 -0.095 1
1 188 . 4 1 1 A 33 33 LEU HA H 33 3.259 3.083 0.176 1
1 197 . 4 1 1 A 34 34 THR H H 34 6.862 7.069 -0.207 1
1 198 . 4 1 1 A 34 34 THR HA H 34 4.738 5.067 -0.329 1
1 203 . 4 1 1 A 35 35 THR H H 35 9.161 8.860 0.301 1
1 204 . 4 1 1 A 35 35 THR HA H 35 4.247 5.295 -1.048 1
1 209 . 4 1 1 A 36 36 GLY H H 36 8.407 8.612 -0.205 1
1 210 . 4 1 1 A 36 36 GLY HA2 H 36 4.349 4.152 0.197 1
1 211 . 4 1 1 A 36 36 GLY HA3 H 36 4.967 4.156 0.811 1
1 212 . 4 1 1 A 37 37 LYS H H 37 10.152 7.761 2.391 1
1 213 . 4 1 1 A 37 37 LYS HA H 37 4.383 4.597 -0.214 1
1 221 . 4 1 1 A 38 38 SER H H 38 9.085 8.210 0.875 1
1 222 . 4 1 1 A 38 38 SER HA H 38 4.338 4.784 -0.446 1
1 226 . 4 1 1 A 39 39 GLY H H 39 8.474 7.823 0.651 1
1 227 . 4 1 1 A 39 39 GLY HA2 H 39 3.840 4.137 -0.297 1
1 228 . 4 1 1 A 40 40 ASP H H 40 9.424 7.615 1.809 1
1 229 . 4 1 1 A 40 40 ASP HA H 40 5.374 4.419 0.955 1
1 231 . 4 1 1 A 41 41 PRO HA H 41 5.624 4.591 1.033 1
1 238 . 4 1 1 A 42 42 HIS H H 42 8.343 8.577 -0.234 1
1 239 . 4 1 1 A 42 42 HIS HA H 42 5.189 5.216 -0.027 1
1 244 . 4 1 1 A 43 43 ARG H H 43 8.634 8.172 0.462 1
1 245 . 4 1 1 A 43 43 ARG HA H 43 3.654 3.038 0.616 1
1 252 . 4 1 1 A 44 44 TYR H H 44 8.188 8.102 0.086 1
1 253 . 4 1 1 A 44 44 TYR HA H 44 5.021 4.695 0.326 1
1 260 . 4 1 1 A 45 45 PHE H H 45 8.728 8.328 0.400 1
1 261 . 4 1 1 A 45 45 PHE HA H 45 4.480 4.869 -0.389 1
1 268 . 4 1 1 A 46 46 ALA H H 46 5.979 8.885 -2.906 1
1 269 . 4 1 1 A 46 46 ALA HA H 46 3.797 4.399 -0.602 1
1 273 . 4 1 1 A 47 47 GLY H H 47 8.510 8.160 0.350 1
1 274 . 4 1 1 A 47 47 GLY HA2 H 47 3.953 3.856 0.097 1
1 275 . 4 1 1 A 47 47 GLY HA3 H 47 4.075 3.883 0.192 1
1 276 . 4 1 1 A 48 48 ASP H H 48 7.504 7.902 -0.398 1
1 277 . 4 1 1 A 48 48 ASP HA H 48 5.020 4.619 0.401 1
1 280 . 4 1 1 A 49 49 HIS H H 49 8.240 7.756 0.484 1
1 281 . 4 1 1 A 49 49 HIS HA H 49 4.373 4.164 0.209 1
1 285 . 4 1 1 A 50 50 ILE H H 50 8.468 7.655 0.813 1
1 286 . 4 1 1 A 50 50 ILE HA H 50 3.651 4.236 -0.585 1
1 296 . 4 1 1 A 51 51 ARG H H 51 8.404 8.288 0.116 1
1 297 . 4 1 1 A 51 51 ARG HA H 51 4.450 4.689 -0.239 1
1 303 . 4 1 1 A 52 52 TRP H H 52 11.176 7.771 3.405 1
1 304 . 4 1 1 A 52 52 TRP HA H 52 4.423 4.231 0.192 1
1 312 . 4 1 1 A 53 53 GLY H H 53 10.422 8.762 1.660 1
1 313 . 4 1 1 A 53 53 GLY HA2 H 53 3.832 3.918 -0.086 1
1 314 . 4 1 1 A 53 53 GLY HA3 H 53 4.411 3.943 0.468 1
1 315 . 4 1 1 A 54 54 VAL H H 54 7.040 7.730 -0.690 1
1 316 . 4 1 1 A 54 54 VAL HA H 54 4.489 4.438 0.051 1
1 324 . 4 1 1 A 55 55 ASN H H 55 9.530 9.039 0.491 1
1 325 . 4 1 1 A 55 55 ASN HA H 55 4.569 4.354 0.215 1
1 330 . 4 1 1 A 56 56 ASN H H 56 9.175 8.393 0.782 1
1 331 . 4 1 1 A 56 56 ASN HA H 56 4.649 4.391 0.258 1
1 336 . 4 1 1 A 57 57 CYS H H 57 7.613 8.304 -0.691 1
1 337 . 4 1 1 A 57 57 CYS HA H 57 4.645 4.239 0.406 1
1 340 . 4 1 1 A 58 58 ASP H H 58 7.626 8.235 -0.609 1
1 341 . 4 1 1 A 58 58 ASP HA H 58 5.206 4.777 0.429 1
1 344 . 4 1 1 A 59 59 LYS H H 59 7.349 7.481 -0.132 1
1 345 . 4 1 1 A 59 59 LYS HA H 59 4.548 4.369 0.179 1
1 350 . 4 1 1 A 60 60 ALA H H 60 9.155 8.440 0.715 1
1 351 . 4 1 1 A 60 60 ALA HA H 60 4.330 4.428 -0.098 1
1 355 . 4 1 1 A 61 61 ASP H H 61 8.548 8.547 0.001 1
1 356 . 4 1 1 A 61 61 ASP HA H 61 4.827 4.285 0.542 1
1 359 . 4 1 1 A 62 62 ALA H H 62 7.463 7.539 -0.076 1
1 360 . 4 1 1 A 62 62 ALA HA H 62 4.217 4.377 -0.160 1
1 364 . 4 1 1 A 63 63 ILE H H 63 9.302 8.567 0.735 1
1 365 . 4 1 1 A 63 63 ILE HA H 63 4.332 4.367 -0.035 1
1 374 . 4 1 1 A 64 64 LEU H H 64 8.724 8.479 0.245 1
1 375 . 4 1 1 A 64 64 LEU HA H 64 5.463 5.124 0.339 1
1 385 . 4 1 1 A 65 65 TRP H H 65 9.621 8.299 1.322 1
1 386 . 4 1 1 A 65 65 TRP HA H 65 4.605 5.223 -0.618 1
1 395 . 4 1 1 A 66 66 GLU H H 66 8.388 9.246 -0.858 1
1 396 . 4 1 1 A 66 66 GLU HA H 66 6.014 5.764 0.250 1
1 401 . 4 1 1 A 67 67 TYR H H 67 8.766 9.135 -0.369 1
1 402 . 4 1 1 A 67 67 TYR HA H 67 5.204 5.187 0.017 1
1 405 . 4 1 1 A 68 68 PRO HA H 68 4.523 4.440 0.083 1
1 412 . 4 1 1 A 69 69 ILE H H 69 7.308 8.043 -0.735 1
1 413 . 4 1 1 A 69 69 ILE HA H 69 4.870 4.990 -0.120 1
1 414 . 4 1 1 A 70 70 TYR H H 70 9.219 9.049 0.170 1
1 415 . 4 1 1 A 70 70 TYR HA H 70 4.854 4.559 0.295 1
1 423 . 4 1 1 A 71 71 TRP H H 71 6.662 8.314 -1.652 1
1 424 . 4 1 1 A 71 71 TRP HA H 71 5.496 4.815 0.681 1
1 432 . 4 1 1 A 72 72 VAL H H 72 9.510 9.049 0.461 1
1 433 . 4 1 1 A 72 72 VAL HA H 72 3.999 3.722 0.277 1
1 441 . 4 1 1 A 73 73 GLY H H 73 9.221 8.385 0.836 1
1 442 . 4 1 1 A 73 73 GLY HA2 H 73 3.877 3.816 0.061 1
1 443 . 4 1 1 A 73 73 GLY HA3 H 73 4.682 3.852 0.830 1
1 444 . 4 1 1 A 74 74 LYS H H 74 7.962 7.445 0.517 1
1 445 . 4 1 1 A 74 74 LYS HA H 74 4.469 4.371 0.098 1
1 457 . 4 1 1 A 75 75 ASN H H 75 8.928 9.076 -0.148 1
1 458 . 4 1 1 A 75 75 ASN HA H 75 4.837 4.859 -0.022 1
1 463 . 4 1 1 A 76 76 ALA H H 76 7.544 7.528 0.016 1
1 464 . 4 1 1 A 76 76 ALA HA H 76 4.555 4.083 0.472 1
1 468 . 4 1 1 A 77 77 GLU H H 77 8.290 8.327 -0.037 1
1 469 . 4 1 1 A 77 77 GLU HA H 77 4.900 4.356 0.544 1
1 474 . 4 1 1 A 78 78 TRP H H 78 10.065 8.888 1.177 1
1 475 . 4 1 1 A 78 78 TRP HA H 78 4.600 5.109 -0.509 1
1 484 . 4 1 1 A 79 79 ALA H H 79 9.850 8.143 1.707 1
1 485 . 4 1 1 A 79 79 ALA HA H 79 5.022 4.882 0.140 1
1 489 . 4 1 1 A 80 80 LYS H H 80 9.255 8.773 0.482 1
1 490 . 4 1 1 A 80 80 LYS HA H 80 4.511 4.578 -0.067 1
1 494 . 4 1 1 A 81 81 ASP H H 81 9.332 7.739 1.593 1
1 495 . 4 1 1 A 81 81 ASP HA H 81 5.429 4.783 0.646 1
1 498 . 4 1 1 A 82 82 VAL H H 82 7.226 7.701 -0.475 1
1 499 . 4 1 1 A 82 82 VAL HA H 82 4.248 4.660 -0.412 1
1 507 . 4 1 1 A 83 83 LYS H H 83 8.407 8.788 -0.381 1
1 508 . 4 1 1 A 83 83 LYS HA H 83 4.356 4.660 -0.304 1
1 510 . 4 1 1 A 84 84 THR H H 84 9.088 9.010 0.078 1
1 511 . 4 1 1 A 84 84 THR HA H 84 3.989 4.007 -0.018 1
1 516 . 4 1 1 A 85 85 SER H H 85 8.391 8.281 0.110 1
1 517 . 4 1 1 A 85 85 SER HA H 85 4.442 4.044 0.398 1
1 520 . 4 1 1 A 86 86 GLN H H 86 7.974 8.042 -0.068 1
1 521 . 4 1 1 A 86 86 GLN HA H 86 4.585 3.962 0.623 1
1 527 . 4 1 1 A 87 87 GLN H H 87 7.083 7.818 -0.735 1
1 528 . 4 1 1 A 87 87 GLN HA H 87 3.903 3.863 0.040 1
1 534 . 4 1 1 A 88 88 LYS H H 88 9.453 8.588 0.865 1
1 535 . 4 1 1 A 88 88 LYS HA H 88 4.114 4.548 -0.434 1
1 539 . 4 1 1 A 89 89 GLY H H 89 9.466 8.254 1.212 1
1 540 . 4 1 1 A 89 89 GLY HA2 H 89 3.965 4.040 -0.075 1
1 541 . 4 1 1 A 89 89 GLY HA3 H 89 3.148 4.047 -0.899 1
1 542 . 4 1 1 A 90 90 GLY H H 90 7.228 7.479 -0.251 1
1 543 . 4 1 1 A 90 90 GLY HA2 H 90 4.290 4.100 0.190 1
1 544 . 4 1 1 A 90 90 GLY HA3 H 90 4.682 4.104 0.578 1
1 545 . 4 1 1 A 91 91 PRO HA H 91 4.902 4.772 0.130 1
1 552 . 4 1 1 A 92 92 THR H H 92 8.585 8.599 -0.014 1
1 553 . 4 1 1 A 92 92 THR HA H 92 5.701 5.036 0.665 1
1 559 . 4 1 1 A 93 93 PRO HA H 93 5.551 3.829 1.722 1
1 563 . 4 1 1 A 94 94 ILE H H 94 8.155 7.010 1.145 1
1 564 . 4 1 1 A 94 94 ILE HA H 94 4.794 4.304 0.490 1
1 571 . 4 1 1 A 95 95 ARG H H 95 9.538 9.219 0.319 1
1 572 . 4 1 1 A 95 95 ARG HA H 95 5.278 5.285 -0.007 1
1 576 . 4 1 1 A 96 96 VAL H H 96 9.276 9.013 0.263 1
1 577 . 4 1 1 A 96 96 VAL HA H 96 5.222 4.267 0.955 1
1 585 . 4 1 1 A 97 97 VAL H H 97 8.739 8.914 -0.175 1
1 586 . 4 1 1 A 97 97 VAL HA H 97 5.160 5.319 -0.159 1
1 594 . 4 1 1 A 98 98 TYR H H 98 8.596 8.210 0.386 1
1 595 . 4 1 1 A 98 98 TYR HA H 98 5.266 5.094 0.172 1
1 603 . 4 1 1 A 99 99 ALA H H 99 9.685 8.647 1.038 1
1 604 . 4 1 1 A 99 99 ALA HA H 99 5.680 4.731 0.949 1
1 608 . 4 1 1 A 100 100 ASN H H 100 8.468 8.806 -0.338 1
1 609 . 4 1 1 A 100 100 ASN HA H 100 4.885 5.176 -0.291 1
1 614 . 4 1 1 A 101 101 SER H H 101 9.342 8.337 1.005 1
1 615 . 4 1 1 A 101 101 SER HA H 101 4.993 4.175 0.818 1
1 618 . 4 1 1 A 102 102 ARG H H 102 9.349 7.956 1.393 1
1 619 . 4 1 1 A 102 102 ARG HA H 102 4.068 4.504 -0.436 1
1 620 . 4 1 1 A 103 103 GLY H H 103 8.632 7.832 0.800 1
1 621 . 4 1 1 A 103 103 GLY HA2 H 103 3.691 3.942 -0.251 1
1 622 . 4 1 1 A 103 103 GLY HA3 H 103 4.341 3.945 0.396 1
1 623 . 4 1 1 A 104 104 ALA H H 104 7.820 7.688 0.132 1
1 624 . 4 1 1 A 104 104 ALA HA H 104 4.775 4.721 0.054 1
1 628 . 4 1 1 A 105 105 VAL H H 105 8.402 8.632 -0.230 1
1 629 . 4 1 1 A 105 105 VAL HA H 105 4.218 4.053 0.165 1
1 637 . 4 1 1 A 106 106 GLN H H 106 9.352 8.706 0.646 1
1 638 . 4 1 1 A 106 106 GLN HA H 106 4.900 4.522 0.378 1
1 645 . 4 1 1 A 107 107 TYR H H 107 9.075 8.005 1.070 1
1 646 . 4 1 1 A 107 107 TYR HA H 107 4.007 4.110 -0.103 1
1 653 . 4 1 1 A 108 108 CYS H H 108 8.197 7.729 0.468 1
1 654 . 4 1 1 A 108 108 CYS HA H 108 4.823 4.152 0.671 1
1 657 . 4 1 1 A 109 109 GLY H H 109 6.856 6.776 0.080 1
1 658 . 4 1 1 A 109 109 GLY HA2 H 109 3.983 3.329 0.654 1
1 659 . 4 1 1 A 109 109 GLY HA3 H 109 4.422 3.444 0.978 1
1 660 . 4 1 1 A 110 110 VAL H H 110 9.418 8.335 1.083 1
1 661 . 4 1 1 A 110 110 VAL HA H 110 5.073 4.851 0.222 1
1 669 . 4 1 1 A 111 111 MET H H 111 9.327 9.579 -0.252 1
1 670 . 4 1 1 A 111 111 MET HA H 111 5.678 5.613 0.065 1
1 678 . 4 1 1 A 112 112 THR H H 112 9.310 9.383 -0.073 1
1 679 . 4 1 1 A 112 112 THR HA H 112 5.726 4.797 0.929 1
1 685 . 4 1 1 A 113 113 HIS H H 113 8.960 8.398 0.562 1
1 686 . 4 1 1 A 113 113 HIS HA H 113 3.876 4.686 -0.810 1
1 691 . 4 1 1 A 114 114 SER H H 114 8.367 8.213 0.154 1
1 692 . 4 1 1 A 114 114 SER HA H 114 4.024 4.463 -0.439 1
1 695 . 4 1 1 A 115 115 LYS H H 115 8.140 7.450 0.690 1
1 696 . 4 1 1 A 115 115 LYS HA H 115 5.403 4.551 0.852 1
1 699 . 4 1 1 A 116 116 VAL H H 116 8.525 8.367 0.158 1
1 700 . 4 1 1 A 116 116 VAL HA H 116 5.378 4.794 0.584 1
1 708 . 4 1 1 A 117 117 ASP H H 117 8.025 8.389 -0.364 1
1 709 . 4 1 1 A 117 117 ASP HA H 117 5.243 4.631 0.612 1
1 712 . 4 1 1 A 118 118 LYS H H 118 8.930 8.142 0.788 1
1 713 . 4 1 1 A 118 118 LYS HA H 118 4.216 4.206 0.010 1
1 716 . 4 1 1 A 119 119 ASN H H 119 8.425 7.731 0.694 1
1 717 . 4 1 1 A 119 119 ASN HA H 119 5.061 5.103 -0.042 1
1 722 . 4 1 1 A 120 120 ASN H H 120 8.061 8.638 -0.577 1
1 723 . 4 1 1 A 120 120 ASN HA H 120 4.212 4.800 -0.588 1
1 728 . 4 1 1 A 121 121 GLN H H 121 8.359 8.486 -0.127 1
1 729 . 4 1 1 A 121 121 GLN HA H 121 4.373 5.142 -0.769 1
1 735 . 4 1 1 A 122 122 GLY H H 122 8.770 8.691 0.079 1
1 736 . 4 1 1 A 122 122 GLY HA2 H 122 3.182 3.756 -0.574 1
1 737 . 4 1 1 A 122 122 GLY HA3 H 122 5.268 4.106 1.162 1
1 738 . 4 1 1 A 123 123 LYS H H 123 8.587 8.711 -0.124 1
1 739 . 4 1 1 A 123 123 LYS HA H 123 4.016 4.454 -0.438 1
1 745 . 4 1 1 A 124 124 GLU H H 124 8.527 8.129 0.398 1
1 746 . 4 1 1 A 124 124 GLU HA H 124 4.152 4.259 -0.107 1
1 750 . 4 1 1 A 125 125 PHE H H 125 7.936 7.240 0.696 1
1 751 . 4 1 1 A 125 125 PHE HA H 125 4.670 5.129 -0.459 1
1 758 . 4 1 1 A 126 126 PHE H H 126 8.214 9.240 -1.026 1
1 759 . 4 1 1 A 126 126 PHE HA H 126 5.177 5.258 -0.081 1
1 767 . 4 1 1 A 127 127 GLU H H 127 9.169 8.565 0.604 1
1 768 . 4 1 1 A 127 127 GLU HA H 127 4.852 4.466 0.386 1
1 773 . 4 1 1 A 128 128 LYS H H 128 9.000 8.234 0.766 1
1 774 . 4 1 1 A 128 128 LYS HA H 128 4.191 3.793 0.398 1
1 777 . 4 1 1 A 129 129 CYS H H 129 8.938 9.021 -0.083 1
1 778 . 4 1 1 A 129 129 CYS HA H 129 5.268 4.575 0.693 1
1 5 . 5 1 1 A 2 2 PRO HA H 2 4.900 4.577 0.323 1
1 10 . 5 1 1 A 3 3 ILE H H 3 8.774 7.476 1.298 1
1 11 . 5 1 1 A 3 3 ILE HA H 3 5.499 4.595 0.904 1
1 20 . 5 1 1 A 4 4 VAL H H 4 9.501 9.176 0.325 1
1 21 . 5 1 1 A 4 4 VAL HA H 4 4.944 5.206 -0.262 1
1 29 . 5 1 1 A 5 5 THR H H 5 9.243 8.846 0.397 1
1 30 . 5 1 1 A 5 5 THR HA H 5 5.278 5.296 -0.018 1
1 35 . 5 1 1 A 6 6 CYS H H 6 9.815 8.999 0.816 1
1 36 . 5 1 1 A 6 6 CYS HA H 6 5.310 4.635 0.675 1
1 38 . 5 1 1 A 7 7 ARG H H 7 9.154 8.599 0.555 1
1 41 . 5 1 1 A 8 8 PRO HA H 8 4.594 4.598 -0.004 1
1 47 . 5 1 1 A 9 9 LYS H H 9 8.179 8.503 -0.324 1
1 48 . 5 1 1 A 9 9 LYS HA H 9 4.857 4.878 -0.021 1
1 52 . 5 1 1 A 10 10 LEU H H 10 9.108 8.380 0.728 1
1 53 . 5 1 1 A 10 10 LEU HA H 10 5.147 4.664 0.483 1
1 63 . 5 1 1 A 11 11 ASP H H 11 9.835 7.982 1.853 1
1 64 . 5 1 1 A 11 11 ASP HA H 11 4.471 4.585 -0.114 1
1 67 . 5 1 1 A 12 12 GLY H H 12 8.847 7.941 0.906 1
1 68 . 5 1 1 A 12 12 GLY HA2 H 12 3.782 3.855 -0.073 1
1 69 . 5 1 1 A 12 12 GLY HA3 H 12 4.427 3.862 0.565 1
1 70 . 5 1 1 A 13 13 ARG H H 13 7.933 7.644 0.289 1
1 71 . 5 1 1 A 13 13 ARG HA H 13 4.886 4.879 0.007 1
1 77 . 5 1 1 A 14 14 GLU H H 14 9.179 8.439 0.740 1
1 78 . 5 1 1 A 14 14 GLU HA H 14 4.178 4.640 -0.462 1
1 82 . 5 1 1 A 15 15 LYS H H 15 9.078 8.962 0.116 1
1 83 . 5 1 1 A 15 15 LYS HA H 15 4.890 4.771 0.119 1
1 84 . 5 1 1 A 16 16 PRO HA H 16 5.144 4.930 0.214 1
1 91 . 5 1 1 A 17 17 PHE H H 17 9.487 8.641 0.846 1
1 92 . 5 1 1 A 17 17 PHE HA H 17 4.760 4.665 0.095 1
1 100 . 5 1 1 A 18 18 LYS H H 18 9.315 8.835 0.480 1
1 101 . 5 1 1 A 18 18 LYS HA H 18 5.197 4.246 0.951 1
1 108 . 5 1 1 A 19 19 VAL H H 19 9.643 8.683 0.960 1
1 109 . 5 1 1 A 19 19 VAL HA H 19 4.796 5.088 -0.292 1
1 117 . 5 1 1 A 20 20 ASP H H 20 9.555 8.779 0.776 1
1 118 . 5 1 1 A 20 20 ASP HA H 20 5.151 5.510 -0.359 1
1 121 . 5 1 1 A 21 21 VAL H H 21 9.607 8.695 0.912 1
1 122 . 5 1 1 A 21 21 VAL HA H 21 3.611 3.918 -0.307 1
1 130 . 5 1 1 A 22 22 ALA H H 22 8.531 7.739 0.792 1
1 131 . 5 1 1 A 22 22 ALA HA H 22 4.299 3.865 0.434 1
1 135 . 5 1 1 A 23 23 THR H H 23 7.294 8.236 -0.942 1
1 136 . 5 1 1 A 23 23 THR HA H 23 4.264 3.796 0.468 1
1 141 . 5 1 1 A 24 24 ALA H H 24 8.346 8.211 0.135 1
1 142 . 5 1 1 A 24 24 ALA HA H 24 4.082 4.104 -0.022 1
1 146 . 5 1 1 A 25 25 GLN H H 25 8.866 7.963 0.903 1
1 147 . 5 1 1 A 25 25 GLN HA H 25 3.804 3.718 0.086 1
1 153 . 5 1 1 A 26 26 ALA H H 26 7.767 8.065 -0.298 1
1 154 . 5 1 1 A 26 26 ALA HA H 26 4.208 3.989 0.219 1
1 158 . 5 1 1 A 27 27 GLN H H 27 8.881 8.128 0.753 1
1 159 . 5 1 1 A 27 27 GLN HA H 27 4.041 3.909 0.132 1
1 165 . 5 1 1 A 28 28 ALA H H 28 8.142 8.064 0.078 1
1 166 . 5 1 1 A 28 28 ALA HA H 28 3.475 3.321 0.154 1
1 170 . 5 1 1 A 29 29 ARG H H 29 7.291 7.586 -0.295 1
1 171 . 5 1 1 A 29 29 ARG HA H 29 3.688 3.836 -0.148 1
1 174 . 5 1 1 A 30 30 LYS H H 30 7.768 7.813 -0.045 1
1 175 . 5 1 1 A 30 30 LYS HA H 30 4.038 3.943 0.095 1
1 179 . 5 1 1 A 31 31 ALA H H 31 8.127 7.817 0.310 1
1 180 . 5 1 1 A 31 31 ALA HA H 31 3.656 3.856 -0.200 1
1 184 . 5 1 1 A 32 32 GLY H H 32 7.670 7.517 0.153 1
1 185 . 5 1 1 A 32 32 GLY HA2 H 32 3.380 3.762 -0.382 1
1 186 . 5 1 1 A 32 32 GLY HA3 H 32 3.844 3.812 0.032 1
1 187 . 5 1 1 A 33 33 LEU H H 33 8.057 8.248 -0.191 1
1 188 . 5 1 1 A 33 33 LEU HA H 33 3.259 3.051 0.208 1
1 197 . 5 1 1 A 34 34 THR H H 34 6.862 7.197 -0.335 1
1 198 . 5 1 1 A 34 34 THR HA H 34 4.738 5.260 -0.522 1
1 203 . 5 1 1 A 35 35 THR H H 35 9.161 8.921 0.240 1
1 204 . 5 1 1 A 35 35 THR HA H 35 4.247 4.992 -0.745 1
1 209 . 5 1 1 A 36 36 GLY H H 36 8.407 8.551 -0.144 1
1 210 . 5 1 1 A 36 36 GLY HA2 H 36 4.349 4.043 0.306 1
1 211 . 5 1 1 A 36 36 GLY HA3 H 36 4.967 4.049 0.918 1
1 212 . 5 1 1 A 37 37 LYS H H 37 10.152 8.220 1.932 1
1 213 . 5 1 1 A 37 37 LYS HA H 37 4.383 4.103 0.280 1
1 221 . 5 1 1 A 38 38 SER H H 38 9.085 7.959 1.126 1
1 222 . 5 1 1 A 38 38 SER HA H 38 4.338 4.799 -0.461 1
1 226 . 5 1 1 A 39 39 GLY H H 39 8.474 7.935 0.539 1
1 227 . 5 1 1 A 39 39 GLY HA2 H 39 3.840 4.174 -0.334 1
1 228 . 5 1 1 A 40 40 ASP H H 40 9.424 8.053 1.371 1
1 229 . 5 1 1 A 40 40 ASP HA H 40 5.374 4.394 0.980 1
1 231 . 5 1 1 A 41 41 PRO HA H 41 5.624 4.627 0.997 1
1 238 . 5 1 1 A 42 42 HIS H H 42 8.343 8.730 -0.387 1
1 239 . 5 1 1 A 42 42 HIS HA H 42 5.189 5.231 -0.042 1
1 244 . 5 1 1 A 43 43 ARG H H 43 8.634 8.301 0.333 1
1 245 . 5 1 1 A 43 43 ARG HA H 43 3.654 3.088 0.566 1
1 252 . 5 1 1 A 44 44 TYR H H 44 8.188 8.475 -0.287 1
1 253 . 5 1 1 A 44 44 TYR HA H 44 5.021 5.294 -0.273 1
1 260 . 5 1 1 A 45 45 PHE H H 45 8.728 8.949 -0.221 1
1 261 . 5 1 1 A 45 45 PHE HA H 45 4.480 4.790 -0.310 1
1 268 . 5 1 1 A 46 46 ALA H H 46 5.979 8.996 -3.017 1
1 269 . 5 1 1 A 46 46 ALA HA H 46 3.797 4.613 -0.816 1
1 273 . 5 1 1 A 47 47 GLY H H 47 8.510 8.176 0.334 1
1 274 . 5 1 1 A 47 47 GLY HA2 H 47 3.953 4.004 -0.051 1
1 275 . 5 1 1 A 47 47 GLY HA3 H 47 4.075 4.029 0.046 1
1 276 . 5 1 1 A 48 48 ASP H H 48 7.504 7.711 -0.207 1
1 277 . 5 1 1 A 48 48 ASP HA H 48 5.020 4.723 0.297 1
1 280 . 5 1 1 A 49 49 HIS H H 49 8.240 8.431 -0.191 1
1 281 . 5 1 1 A 49 49 HIS HA H 49 4.373 4.412 -0.039 1
1 285 . 5 1 1 A 50 50 ILE H H 50 8.468 7.476 0.992 1
1 286 . 5 1 1 A 50 50 ILE HA H 50 3.651 3.980 -0.329 1
1 296 . 5 1 1 A 51 51 ARG H H 51 8.404 8.172 0.232 1
1 297 . 5 1 1 A 51 51 ARG HA H 51 4.450 4.722 -0.272 1
1 303 . 5 1 1 A 52 52 TRP H H 52 11.176 8.797 2.379 1
1 304 . 5 1 1 A 52 52 TRP HA H 52 4.423 4.706 -0.283 1
1 312 . 5 1 1 A 53 53 GLY H H 53 10.422 7.961 2.461 1
1 313 . 5 1 1 A 53 53 GLY HA2 H 53 3.832 3.997 -0.165 1
1 314 . 5 1 1 A 53 53 GLY HA3 H 53 4.411 4.027 0.384 1
1 315 . 5 1 1 A 54 54 VAL H H 54 7.040 7.897 -0.857 1
1 316 . 5 1 1 A 54 54 VAL HA H 54 4.489 4.264 0.225 1
1 324 . 5 1 1 A 55 55 ASN H H 55 9.530 9.076 0.454 1
1 325 . 5 1 1 A 55 55 ASN HA H 55 4.569 4.368 0.201 1
1 330 . 5 1 1 A 56 56 ASN H H 56 9.175 8.126 1.049 1
1 331 . 5 1 1 A 56 56 ASN HA H 56 4.649 4.433 0.216 1
1 336 . 5 1 1 A 57 57 CYS H H 57 7.613 8.024 -0.411 1
1 337 . 5 1 1 A 57 57 CYS HA H 57 4.645 4.136 0.509 1
1 340 . 5 1 1 A 58 58 ASP H H 58 7.626 8.309 -0.683 1
1 341 . 5 1 1 A 58 58 ASP HA H 58 5.206 4.881 0.325 1
1 344 . 5 1 1 A 59 59 LYS H H 59 7.349 7.399 -0.050 1
1 345 . 5 1 1 A 59 59 LYS HA H 59 4.548 4.425 0.123 1
1 350 . 5 1 1 A 60 60 ALA H H 60 9.155 8.412 0.743 1
1 351 . 5 1 1 A 60 60 ALA HA H 60 4.330 4.346 -0.016 1
1 355 . 5 1 1 A 61 61 ASP H H 61 8.548 7.894 0.654 1
1 356 . 5 1 1 A 61 61 ASP HA H 61 4.827 4.857 -0.030 1
1 359 . 5 1 1 A 62 62 ALA H H 62 7.463 7.362 0.101 1
1 360 . 5 1 1 A 62 62 ALA HA H 62 4.217 4.272 -0.055 1
1 364 . 5 1 1 A 63 63 ILE H H 63 9.302 8.510 0.792 1
1 365 . 5 1 1 A 63 63 ILE HA H 63 4.332 4.335 -0.003 1
1 374 . 5 1 1 A 64 64 LEU H H 64 8.724 8.993 -0.269 1
1 375 . 5 1 1 A 64 64 LEU HA H 64 5.463 5.200 0.263 1
1 385 . 5 1 1 A 65 65 TRP H H 65 9.621 8.290 1.331 1
1 386 . 5 1 1 A 65 65 TRP HA H 65 4.605 5.276 -0.671 1
1 395 . 5 1 1 A 66 66 GLU H H 66 8.388 9.414 -1.026 1
1 396 . 5 1 1 A 66 66 GLU HA H 66 6.014 5.673 0.341 1
1 401 . 5 1 1 A 67 67 TYR H H 67 8.766 9.018 -0.252 1
1 402 . 5 1 1 A 67 67 TYR HA H 67 5.204 5.163 0.041 1
1 405 . 5 1 1 A 68 68 PRO HA H 68 4.523 4.466 0.057 1
1 412 . 5 1 1 A 69 69 ILE H H 69 7.308 7.970 -0.662 1
1 413 . 5 1 1 A 69 69 ILE HA H 69 4.870 4.712 0.158 1
1 414 . 5 1 1 A 70 70 TYR H H 70 9.219 8.998 0.221 1
1 415 . 5 1 1 A 70 70 TYR HA H 70 4.854 4.677 0.177 1
1 423 . 5 1 1 A 71 71 TRP H H 71 6.662 8.115 -1.453 1
1 424 . 5 1 1 A 71 71 TRP HA H 71 5.496 4.743 0.753 1
1 432 . 5 1 1 A 72 72 VAL H H 72 9.510 9.027 0.483 1
1 433 . 5 1 1 A 72 72 VAL HA H 72 3.999 3.684 0.315 1
1 441 . 5 1 1 A 73 73 GLY H H 73 9.221 8.427 0.794 1
1 442 . 5 1 1 A 73 73 GLY HA2 H 73 3.877 4.041 -0.164 1
1 443 . 5 1 1 A 73 73 GLY HA3 H 73 4.682 4.076 0.606 1
1 444 . 5 1 1 A 74 74 LYS H H 74 7.962 7.722 0.240 1
1 445 . 5 1 1 A 74 74 LYS HA H 74 4.469 4.477 -0.008 1
1 457 . 5 1 1 A 75 75 ASN H H 75 8.928 8.832 0.096 1
1 458 . 5 1 1 A 75 75 ASN HA H 75 4.837 5.083 -0.246 1
1 463 . 5 1 1 A 76 76 ALA H H 76 7.544 7.570 -0.026 1
1 464 . 5 1 1 A 76 76 ALA HA H 76 4.555 4.588 -0.033 1
1 468 . 5 1 1 A 77 77 GLU H H 77 8.290 8.007 0.283 1
1 469 . 5 1 1 A 77 77 GLU HA H 77 4.900 4.301 0.599 1
1 474 . 5 1 1 A 78 78 TRP H H 78 10.065 8.984 1.081 1
1 475 . 5 1 1 A 78 78 TRP HA H 78 4.600 5.127 -0.527 1
1 484 . 5 1 1 A 79 79 ALA H H 79 9.850 8.269 1.581 1
1 485 . 5 1 1 A 79 79 ALA HA H 79 5.022 4.610 0.412 1
1 489 . 5 1 1 A 80 80 LYS H H 80 9.255 8.779 0.476 1
1 490 . 5 1 1 A 80 80 LYS HA H 80 4.511 4.593 -0.082 1
1 494 . 5 1 1 A 81 81 ASP H H 81 9.332 7.695 1.637 1
1 495 . 5 1 1 A 81 81 ASP HA H 81 5.429 4.787 0.642 1
1 498 . 5 1 1 A 82 82 VAL H H 82 7.226 7.551 -0.325 1
1 499 . 5 1 1 A 82 82 VAL HA H 82 4.248 4.590 -0.342 1
1 507 . 5 1 1 A 83 83 LYS H H 83 8.407 8.698 -0.291 1
1 508 . 5 1 1 A 83 83 LYS HA H 83 4.356 4.622 -0.266 1
1 510 . 5 1 1 A 84 84 THR H H 84 9.088 9.124 -0.036 1
1 511 . 5 1 1 A 84 84 THR HA H 84 3.989 4.183 -0.194 1
1 516 . 5 1 1 A 85 85 SER H H 85 8.391 8.345 0.046 1
1 517 . 5 1 1 A 85 85 SER HA H 85 4.442 4.167 0.275 1
1 520 . 5 1 1 A 86 86 GLN H H 86 7.974 7.578 0.396 1
1 521 . 5 1 1 A 86 86 GLN HA H 86 4.585 4.212 0.373 1
1 527 . 5 1 1 A 87 87 GLN H H 87 7.083 7.370 -0.287 1
1 528 . 5 1 1 A 87 87 GLN HA H 87 3.903 4.065 -0.162 1
1 534 . 5 1 1 A 88 88 LYS H H 88 9.453 8.039 1.414 1
1 535 . 5 1 1 A 88 88 LYS HA H 88 4.114 3.957 0.157 1
1 539 . 5 1 1 A 89 89 GLY H H 89 9.466 8.168 1.298 1
1 540 . 5 1 1 A 89 89 GLY HA2 H 89 3.965 3.922 0.043 1
1 541 . 5 1 1 A 89 89 GLY HA3 H 89 3.148 3.944 -0.796 1
1 542 . 5 1 1 A 90 90 GLY H H 90 7.228 7.589 -0.361 1
1 543 . 5 1 1 A 90 90 GLY HA2 H 90 4.290 4.036 0.254 1
1 544 . 5 1 1 A 90 90 GLY HA3 H 90 4.682 4.055 0.627 1
1 545 . 5 1 1 A 91 91 PRO HA H 91 4.902 4.930 -0.028 1
1 552 . 5 1 1 A 92 92 THR H H 92 8.585 8.629 -0.044 1
1 553 . 5 1 1 A 92 92 THR HA H 92 5.701 5.029 0.672 1
1 559 . 5 1 1 A 93 93 PRO HA H 93 5.551 4.452 1.099 1
1 563 . 5 1 1 A 94 94 ILE H H 94 8.155 7.664 0.491 1
1 564 . 5 1 1 A 94 94 ILE HA H 94 4.794 4.443 0.351 1
1 571 . 5 1 1 A 95 95 ARG H H 95 9.538 8.957 0.581 1
1 572 . 5 1 1 A 95 95 ARG HA H 95 5.278 5.165 0.113 1
1 576 . 5 1 1 A 96 96 VAL H H 96 9.276 9.001 0.275 1
1 577 . 5 1 1 A 96 96 VAL HA H 96 5.222 4.320 0.902 1
1 585 . 5 1 1 A 97 97 VAL H H 97 8.739 8.936 -0.197 1
1 586 . 5 1 1 A 97 97 VAL HA H 97 5.160 5.181 -0.021 1
1 594 . 5 1 1 A 98 98 TYR H H 98 8.596 8.192 0.404 1
1 595 . 5 1 1 A 98 98 TYR HA H 98 5.266 5.292 -0.026 1
1 603 . 5 1 1 A 99 99 ALA H H 99 9.685 8.590 1.095 1
1 604 . 5 1 1 A 99 99 ALA HA H 99 5.680 4.776 0.904 1
1 608 . 5 1 1 A 100 100 ASN H H 100 8.468 8.994 -0.526 1
1 609 . 5 1 1 A 100 100 ASN HA H 100 4.885 5.144 -0.259 1
1 614 . 5 1 1 A 101 101 SER H H 101 9.342 7.397 1.945 1
1 615 . 5 1 1 A 101 101 SER HA H 101 4.993 4.431 0.562 1
1 618 . 5 1 1 A 102 102 ARG H H 102 9.349 9.142 0.207 1
1 619 . 5 1 1 A 102 102 ARG HA H 102 4.068 4.029 0.039 1
1 620 . 5 1 1 A 103 103 GLY H H 103 8.632 8.672 -0.040 1
1 621 . 5 1 1 A 103 103 GLY HA2 H 103 3.691 3.948 -0.257 1
1 622 . 5 1 1 A 103 103 GLY HA3 H 103 4.341 3.960 0.381 1
1 623 . 5 1 1 A 104 104 ALA H H 104 7.820 7.694 0.126 1
1 624 . 5 1 1 A 104 104 ALA HA H 104 4.775 4.909 -0.134 1
1 628 . 5 1 1 A 105 105 VAL H H 105 8.402 8.855 -0.453 1
1 629 . 5 1 1 A 105 105 VAL HA H 105 4.218 4.489 -0.271 1
1 637 . 5 1 1 A 106 106 GLN H H 106 9.352 8.425 0.927 1
1 638 . 5 1 1 A 106 106 GLN HA H 106 4.900 4.658 0.242 1
1 645 . 5 1 1 A 107 107 TYR H H 107 9.075 8.087 0.988 1
1 646 . 5 1 1 A 107 107 TYR HA H 107 4.007 4.103 -0.096 1
1 653 . 5 1 1 A 108 108 CYS H H 108 8.197 7.751 0.446 1
1 654 . 5 1 1 A 108 108 CYS HA H 108 4.823 4.018 0.805 1
1 657 . 5 1 1 A 109 109 GLY H H 109 6.856 6.734 0.122 1
1 658 . 5 1 1 A 109 109 GLY HA2 H 109 3.983 3.159 0.824 1
1 659 . 5 1 1 A 109 109 GLY HA3 H 109 4.422 3.240 1.182 1
1 660 . 5 1 1 A 110 110 VAL H H 110 9.418 8.501 0.917 1
1 661 . 5 1 1 A 110 110 VAL HA H 110 5.073 4.708 0.365 1
1 669 . 5 1 1 A 111 111 MET H H 111 9.327 9.474 -0.147 1
1 670 . 5 1 1 A 111 111 MET HA H 111 5.678 5.503 0.175 1
1 678 . 5 1 1 A 112 112 THR H H 112 9.310 9.270 0.040 1
1 679 . 5 1 1 A 112 112 THR HA H 112 5.726 4.894 0.832 1
1 685 . 5 1 1 A 113 113 HIS H H 113 8.960 8.355 0.605 1
1 686 . 5 1 1 A 113 113 HIS HA H 113 3.876 4.426 -0.550 1
1 691 . 5 1 1 A 114 114 SER H H 114 8.367 8.690 -0.323 1
1 692 . 5 1 1 A 114 114 SER HA H 114 4.024 4.135 -0.111 1
1 695 . 5 1 1 A 115 115 LYS H H 115 8.140 7.526 0.614 1
1 696 . 5 1 1 A 115 115 LYS HA H 115 5.403 4.184 1.219 1
1 699 . 5 1 1 A 116 116 VAL H H 116 8.525 8.163 0.362 1
1 700 . 5 1 1 A 116 116 VAL HA H 116 5.378 4.741 0.637 1
1 708 . 5 1 1 A 117 117 ASP H H 117 8.025 8.891 -0.866 1
1 709 . 5 1 1 A 117 117 ASP HA H 117 5.243 4.705 0.538 1
1 712 . 5 1 1 A 118 118 LYS H H 118 8.930 7.972 0.958 1
1 713 . 5 1 1 A 118 118 LYS HA H 118 4.216 4.615 -0.399 1
1 716 . 5 1 1 A 119 119 ASN H H 119 8.425 8.007 0.418 1
1 717 . 5 1 1 A 119 119 ASN HA H 119 5.061 4.787 0.274 1
1 722 . 5 1 1 A 120 120 ASN H H 120 8.061 8.104 -0.043 1
1 723 . 5 1 1 A 120 120 ASN HA H 120 4.212 4.554 -0.342 1
1 728 . 5 1 1 A 121 121 GLN H H 121 8.359 8.417 -0.058 1
1 729 . 5 1 1 A 121 121 GLN HA H 121 4.373 4.171 0.202 1
1 735 . 5 1 1 A 122 122 GLY H H 122 8.770 7.791 0.979 1
1 736 . 5 1 1 A 122 122 GLY HA2 H 122 3.182 3.970 -0.788 1
1 737 . 5 1 1 A 122 122 GLY HA3 H 122 5.268 3.978 1.290 1
1 738 . 5 1 1 A 123 123 LYS H H 123 8.587 8.345 0.242 1
1 739 . 5 1 1 A 123 123 LYS HA H 123 4.016 4.416 -0.400 1
1 745 . 5 1 1 A 124 124 GLU H H 124 8.527 7.609 0.918 1
1 746 . 5 1 1 A 124 124 GLU HA H 124 4.152 4.424 -0.272 1
1 750 . 5 1 1 A 125 125 PHE H H 125 7.936 8.771 -0.835 1
1 751 . 5 1 1 A 125 125 PHE HA H 125 4.670 4.460 0.210 1
1 758 . 5 1 1 A 126 126 PHE H H 126 8.214 8.924 -0.710 1
1 759 . 5 1 1 A 126 126 PHE HA H 126 5.177 4.594 0.583 1
1 767 . 5 1 1 A 127 127 GLU H H 127 9.169 9.075 0.094 1
1 768 . 5 1 1 A 127 127 GLU HA H 127 4.852 4.797 0.055 1
1 773 . 5 1 1 A 128 128 LYS H H 128 9.000 8.330 0.670 1
1 774 . 5 1 1 A 128 128 LYS HA H 128 4.191 3.781 0.410 1
1 777 . 5 1 1 A 129 129 CYS H H 129 8.938 8.905 0.033 1
1 778 . 5 1 1 A 129 129 CYS HA H 129 5.268 4.578 0.690 1
1 5 . 6 1 1 A 2 2 PRO HA H 2 4.900 4.559 0.341 1
1 10 . 6 1 1 A 3 3 ILE H H 3 8.774 7.500 1.274 1
1 11 . 6 1 1 A 3 3 ILE HA H 3 5.499 4.763 0.736 1
1 20 . 6 1 1 A 4 4 VAL H H 4 9.501 9.171 0.330 1
1 21 . 6 1 1 A 4 4 VAL HA H 4 4.944 5.151 -0.207 1
1 29 . 6 1 1 A 5 5 THR H H 5 9.243 8.898 0.345 1
1 30 . 6 1 1 A 5 5 THR HA H 5 5.278 5.331 -0.053 1
1 35 . 6 1 1 A 6 6 CYS H H 6 9.815 8.932 0.883 1
1 36 . 6 1 1 A 6 6 CYS HA H 6 5.310 4.697 0.613 1
1 38 . 6 1 1 A 7 7 ARG H H 7 9.154 8.521 0.633 1
1 41 . 6 1 1 A 8 8 PRO HA H 8 4.594 4.903 -0.309 1
1 47 . 6 1 1 A 9 9 LYS H H 9 8.179 8.490 -0.311 1
1 48 . 6 1 1 A 9 9 LYS HA H 9 4.857 4.895 -0.038 1
1 52 . 6 1 1 A 10 10 LEU H H 10 9.108 8.345 0.763 1
1 53 . 6 1 1 A 10 10 LEU HA H 10 5.147 4.478 0.669 1
1 63 . 6 1 1 A 11 11 ASP H H 11 9.835 8.251 1.584 1
1 64 . 6 1 1 A 11 11 ASP HA H 11 4.471 4.865 -0.394 1
1 67 . 6 1 1 A 12 12 GLY H H 12 8.847 7.874 0.973 1
1 68 . 6 1 1 A 12 12 GLY HA2 H 12 3.782 4.043 -0.261 1
1 69 . 6 1 1 A 12 12 GLY HA3 H 12 4.427 4.052 0.375 1
1 70 . 6 1 1 A 13 13 ARG H H 13 7.933 7.777 0.156 1
1 71 . 6 1 1 A 13 13 ARG HA H 13 4.886 4.380 0.506 1
1 77 . 6 1 1 A 14 14 GLU H H 14 9.179 8.640 0.539 1
1 78 . 6 1 1 A 14 14 GLU HA H 14 4.178 4.893 -0.715 1
1 82 . 6 1 1 A 15 15 LYS H H 15 9.078 8.963 0.115 1
1 83 . 6 1 1 A 15 15 LYS HA H 15 4.890 4.814 0.076 1
1 84 . 6 1 1 A 16 16 PRO HA H 16 5.144 4.890 0.254 1
1 91 . 6 1 1 A 17 17 PHE H H 17 9.487 8.606 0.881 1
1 92 . 6 1 1 A 17 17 PHE HA H 17 4.760 4.596 0.164 1
1 100 . 6 1 1 A 18 18 LYS H H 18 9.315 8.818 0.497 1
1 101 . 6 1 1 A 18 18 LYS HA H 18 5.197 4.201 0.996 1
1 108 . 6 1 1 A 19 19 VAL H H 19 9.643 8.591 1.052 1
1 109 . 6 1 1 A 19 19 VAL HA H 19 4.796 4.853 -0.057 1
1 117 . 6 1 1 A 20 20 ASP H H 20 9.555 8.720 0.835 1
1 118 . 6 1 1 A 20 20 ASP HA H 20 5.151 5.116 0.035 1
1 121 . 6 1 1 A 21 21 VAL H H 21 9.607 9.019 0.588 1
1 122 . 6 1 1 A 21 21 VAL HA H 21 3.611 3.624 -0.013 1
1 130 . 6 1 1 A 22 22 ALA H H 22 8.531 7.784 0.747 1
1 131 . 6 1 1 A 22 22 ALA HA H 22 4.299 3.873 0.426 1
1 135 . 6 1 1 A 23 23 THR H H 23 7.294 8.231 -0.937 1
1 136 . 6 1 1 A 23 23 THR HA H 23 4.264 3.815 0.449 1
1 141 . 6 1 1 A 24 24 ALA H H 24 8.346 8.269 0.077 1
1 142 . 6 1 1 A 24 24 ALA HA H 24 4.082 3.990 0.092 1
1 146 . 6 1 1 A 25 25 GLN H H 25 8.866 8.173 0.693 1
1 147 . 6 1 1 A 25 25 GLN HA H 25 3.804 3.669 0.135 1
1 153 . 6 1 1 A 26 26 ALA H H 26 7.767 8.037 -0.270 1
1 154 . 6 1 1 A 26 26 ALA HA H 26 4.208 3.975 0.233 1
1 158 . 6 1 1 A 27 27 GLN H H 27 8.881 8.233 0.648 1
1 159 . 6 1 1 A 27 27 GLN HA H 27 4.041 3.859 0.182 1
1 165 . 6 1 1 A 28 28 ALA H H 28 8.142 7.844 0.298 1
1 166 . 6 1 1 A 28 28 ALA HA H 28 3.475 3.319 0.156 1
1 170 . 6 1 1 A 29 29 ARG H H 29 7.291 7.603 -0.312 1
1 171 . 6 1 1 A 29 29 ARG HA H 29 3.688 3.851 -0.163 1
1 174 . 6 1 1 A 30 30 LYS H H 30 7.768 8.152 -0.384 1
1 175 . 6 1 1 A 30 30 LYS HA H 30 4.038 3.902 0.136 1
1 179 . 6 1 1 A 31 31 ALA H H 31 8.127 7.289 0.838 1
1 180 . 6 1 1 A 31 31 ALA HA H 31 3.656 3.991 -0.335 1
1 184 . 6 1 1 A 32 32 GLY H H 32 7.670 7.670 0.000 1
1 185 . 6 1 1 A 32 32 GLY HA2 H 32 3.380 3.807 -0.427 1
1 186 . 6 1 1 A 32 32 GLY HA3 H 32 3.844 3.835 0.009 1
1 187 . 6 1 1 A 33 33 LEU H H 33 8.057 8.143 -0.086 1
1 188 . 6 1 1 A 33 33 LEU HA H 33 3.259 3.165 0.094 1
1 197 . 6 1 1 A 34 34 THR H H 34 6.862 7.037 -0.175 1
1 198 . 6 1 1 A 34 34 THR HA H 34 4.738 4.841 -0.103 1
1 203 . 6 1 1 A 35 35 THR H H 35 9.161 9.243 -0.082 1
1 204 . 6 1 1 A 35 35 THR HA H 35 4.247 5.162 -0.915 1
1 209 . 6 1 1 A 36 36 GLY H H 36 8.407 8.319 0.088 1
1 210 . 6 1 1 A 36 36 GLY HA2 H 36 4.349 4.037 0.312 1
1 211 . 6 1 1 A 36 36 GLY HA3 H 36 4.967 4.043 0.924 1
1 212 . 6 1 1 A 37 37 LYS H H 37 10.152 8.320 1.832 1
1 213 . 6 1 1 A 37 37 LYS HA H 37 4.383 4.116 0.267 1
1 221 . 6 1 1 A 38 38 SER H H 38 9.085 8.202 0.883 1
1 222 . 6 1 1 A 38 38 SER HA H 38 4.338 4.730 -0.392 1
1 226 . 6 1 1 A 39 39 GLY H H 39 8.474 7.705 0.769 1
1 227 . 6 1 1 A 39 39 GLY HA2 H 39 3.840 4.108 -0.268 1
1 228 . 6 1 1 A 40 40 ASP H H 40 9.424 8.120 1.304 1
1 229 . 6 1 1 A 40 40 ASP HA H 40 5.374 4.082 1.292 1
1 231 . 6 1 1 A 41 41 PRO HA H 41 5.624 4.680 0.944 1
1 238 . 6 1 1 A 42 42 HIS H H 42 8.343 8.515 -0.172 1
1 239 . 6 1 1 A 42 42 HIS HA H 42 5.189 5.234 -0.045 1
1 244 . 6 1 1 A 43 43 ARG H H 43 8.634 8.160 0.474 1
1 245 . 6 1 1 A 43 43 ARG HA H 43 3.654 3.171 0.483 1
1 252 . 6 1 1 A 44 44 TYR H H 44 8.188 8.733 -0.545 1
1 253 . 6 1 1 A 44 44 TYR HA H 44 5.021 4.695 0.326 1
1 260 . 6 1 1 A 45 45 PHE H H 45 8.728 8.660 0.068 1
1 261 . 6 1 1 A 45 45 PHE HA H 45 4.480 4.111 0.369 1
1 268 . 6 1 1 A 46 46 ALA H H 46 5.979 7.350 -1.371 1
1 269 . 6 1 1 A 46 46 ALA HA H 46 3.797 4.310 -0.513 1
1 273 . 6 1 1 A 47 47 GLY H H 47 8.510 7.920 0.590 1
1 274 . 6 1 1 A 47 47 GLY HA2 H 47 3.953 3.930 0.023 1
1 275 . 6 1 1 A 47 47 GLY HA3 H 47 4.075 3.932 0.143 1
1 276 . 6 1 1 A 48 48 ASP H H 48 7.504 7.768 -0.264 1
1 277 . 6 1 1 A 48 48 ASP HA H 48 5.020 4.691 0.329 1
1 280 . 6 1 1 A 49 49 HIS H H 49 8.240 7.878 0.362 1
1 281 . 6 1 1 A 49 49 HIS HA H 49 4.373 4.138 0.235 1
1 285 . 6 1 1 A 50 50 ILE H H 50 8.468 7.868 0.600 1
1 286 . 6 1 1 A 50 50 ILE HA H 50 3.651 4.088 -0.437 1
1 296 . 6 1 1 A 51 51 ARG H H 51 8.404 8.446 -0.042 1
1 297 . 6 1 1 A 51 51 ARG HA H 51 4.450 4.394 0.056 1
1 303 . 6 1 1 A 52 52 TRP H H 52 11.176 7.836 3.340 1
1 304 . 6 1 1 A 52 52 TRP HA H 52 4.423 4.265 0.158 1
1 312 . 6 1 1 A 53 53 GLY H H 53 10.422 8.754 1.668 1
1 313 . 6 1 1 A 53 53 GLY HA2 H 53 3.832 3.925 -0.093 1
1 314 . 6 1 1 A 53 53 GLY HA3 H 53 4.411 3.953 0.458 1
1 315 . 6 1 1 A 54 54 VAL H H 54 7.040 7.762 -0.722 1
1 316 . 6 1 1 A 54 54 VAL HA H 54 4.489 4.568 -0.079 1
1 324 . 6 1 1 A 55 55 ASN H H 55 9.530 8.938 0.592 1
1 325 . 6 1 1 A 55 55 ASN HA H 55 4.569 4.374 0.195 1
1 330 . 6 1 1 A 56 56 ASN H H 56 9.175 8.473 0.702 1
1 331 . 6 1 1 A 56 56 ASN HA H 56 4.649 4.383 0.266 1
1 336 . 6 1 1 A 57 57 CYS H H 57 7.613 7.847 -0.234 1
1 337 . 6 1 1 A 57 57 CYS HA H 57 4.645 4.627 0.018 1
1 340 . 6 1 1 A 58 58 ASP H H 58 7.626 7.944 -0.318 1
1 341 . 6 1 1 A 58 58 ASP HA H 58 5.206 4.993 0.213 1
1 344 . 6 1 1 A 59 59 LYS H H 59 7.349 7.500 -0.151 1
1 345 . 6 1 1 A 59 59 LYS HA H 59 4.548 4.752 -0.204 1
1 350 . 6 1 1 A 60 60 ALA H H 60 9.155 8.799 0.356 1
1 351 . 6 1 1 A 60 60 ALA HA H 60 4.330 4.089 0.241 1
1 355 . 6 1 1 A 61 61 ASP H H 61 8.548 7.979 0.569 1
1 356 . 6 1 1 A 61 61 ASP HA H 61 4.827 4.669 0.158 1
1 359 . 6 1 1 A 62 62 ALA H H 62 7.463 7.584 -0.121 1
1 360 . 6 1 1 A 62 62 ALA HA H 62 4.217 4.264 -0.047 1
1 364 . 6 1 1 A 63 63 ILE H H 63 9.302 7.889 1.413 1
1 365 . 6 1 1 A 63 63 ILE HA H 63 4.332 3.337 0.995 1
1 374 . 6 1 1 A 64 64 LEU H H 64 8.724 7.844 0.880 1
1 375 . 6 1 1 A 64 64 LEU HA H 64 5.463 4.698 0.765 1
1 385 . 6 1 1 A 65 65 TRP H H 65 9.621 8.447 1.174 1
1 386 . 6 1 1 A 65 65 TRP HA H 65 4.605 5.360 -0.755 1
1 395 . 6 1 1 A 66 66 GLU H H 66 8.388 9.121 -0.733 1
1 396 . 6 1 1 A 66 66 GLU HA H 66 6.014 5.688 0.326 1
1 401 . 6 1 1 A 67 67 TYR H H 67 8.766 8.995 -0.229 1
1 402 . 6 1 1 A 67 67 TYR HA H 67 5.204 5.056 0.148 1
1 405 . 6 1 1 A 68 68 PRO HA H 68 4.523 4.323 0.200 1
1 412 . 6 1 1 A 69 69 ILE H H 69 7.308 8.230 -0.922 1
1 413 . 6 1 1 A 69 69 ILE HA H 69 4.870 4.477 0.393 1
1 414 . 6 1 1 A 70 70 TYR H H 70 9.219 9.060 0.159 1
1 415 . 6 1 1 A 70 70 TYR HA H 70 4.854 4.574 0.280 1
1 423 . 6 1 1 A 71 71 TRP H H 71 6.662 7.977 -1.315 1
1 424 . 6 1 1 A 71 71 TRP HA H 71 5.496 4.943 0.553 1
1 432 . 6 1 1 A 72 72 VAL H H 72 9.510 8.983 0.527 1
1 433 . 6 1 1 A 72 72 VAL HA H 72 3.999 3.678 0.321 1
1 441 . 6 1 1 A 73 73 GLY H H 73 9.221 8.727 0.494 1
1 442 . 6 1 1 A 73 73 GLY HA2 H 73 3.877 3.885 -0.008 1
1 443 . 6 1 1 A 73 73 GLY HA3 H 73 4.682 3.910 0.772 1
1 444 . 6 1 1 A 74 74 LYS H H 74 7.962 7.721 0.241 1
1 445 . 6 1 1 A 74 74 LYS HA H 74 4.469 4.339 0.130 1
1 457 . 6 1 1 A 75 75 ASN H H 75 8.928 8.978 -0.050 1
1 458 . 6 1 1 A 75 75 ASN HA H 75 4.837 4.779 0.058 1
1 463 . 6 1 1 A 76 76 ALA H H 76 7.544 7.395 0.149 1
1 464 . 6 1 1 A 76 76 ALA HA H 76 4.555 4.020 0.535 1
1 468 . 6 1 1 A 77 77 GLU H H 77 8.290 8.482 -0.192 1
1 469 . 6 1 1 A 77 77 GLU HA H 77 4.900 4.616 0.284 1
1 474 . 6 1 1 A 78 78 TRP H H 78 10.065 8.988 1.077 1
1 475 . 6 1 1 A 78 78 TRP HA H 78 4.600 5.146 -0.546 1
1 484 . 6 1 1 A 79 79 ALA H H 79 9.850 8.033 1.817 1
1 485 . 6 1 1 A 79 79 ALA HA H 79 5.022 4.463 0.559 1
1 489 . 6 1 1 A 80 80 LYS H H 80 9.255 8.713 0.542 1
1 490 . 6 1 1 A 80 80 LYS HA H 80 4.511 4.267 0.244 1
1 494 . 6 1 1 A 81 81 ASP H H 81 9.332 7.694 1.638 1
1 495 . 6 1 1 A 81 81 ASP HA H 81 5.429 4.848 0.581 1
1 498 . 6 1 1 A 82 82 VAL H H 82 7.226 7.128 0.098 1
1 499 . 6 1 1 A 82 82 VAL HA H 82 4.248 4.610 -0.362 1
1 507 . 6 1 1 A 83 83 LYS H H 83 8.407 8.698 -0.291 1
1 508 . 6 1 1 A 83 83 LYS HA H 83 4.356 4.804 -0.448 1
1 510 . 6 1 1 A 84 84 THR H H 84 9.088 9.078 0.010 1
1 511 . 6 1 1 A 84 84 THR HA H 84 3.989 4.471 -0.482 1
1 516 . 6 1 1 A 85 85 SER H H 85 8.391 8.386 0.005 1
1 517 . 6 1 1 A 85 85 SER HA H 85 4.442 4.190 0.252 1
1 520 . 6 1 1 A 86 86 GLN H H 86 7.974 7.896 0.078 1
1 521 . 6 1 1 A 86 86 GLN HA H 86 4.585 4.080 0.505 1
1 527 . 6 1 1 A 87 87 GLN H H 87 7.083 7.948 -0.865 1
1 528 . 6 1 1 A 87 87 GLN HA H 87 3.903 3.869 0.034 1
1 534 . 6 1 1 A 88 88 LYS H H 88 9.453 8.398 1.055 1
1 535 . 6 1 1 A 88 88 LYS HA H 88 4.114 4.585 -0.471 1
1 539 . 6 1 1 A 89 89 GLY H H 89 9.466 8.578 0.888 1
1 540 . 6 1 1 A 89 89 GLY HA2 H 89 3.965 4.094 -0.129 1
1 541 . 6 1 1 A 89 89 GLY HA3 H 89 3.148 4.097 -0.949 1
1 542 . 6 1 1 A 90 90 GLY H H 90 7.228 8.293 -1.065 1
1 543 . 6 1 1 A 90 90 GLY HA2 H 90 4.290 4.139 0.151 1
1 544 . 6 1 1 A 90 90 GLY HA3 H 90 4.682 4.234 0.448 1
1 545 . 6 1 1 A 91 91 PRO HA H 91 4.902 4.612 0.290 1
1 552 . 6 1 1 A 92 92 THR H H 92 8.585 7.494 1.091 1
1 553 . 6 1 1 A 92 92 THR HA H 92 5.701 4.441 1.260 1
1 559 . 6 1 1 A 93 93 PRO HA H 93 5.551 4.493 1.058 1
1 563 . 6 1 1 A 94 94 ILE H H 94 8.155 7.486 0.669 1
1 564 . 6 1 1 A 94 94 ILE HA H 94 4.794 4.517 0.277 1
1 571 . 6 1 1 A 95 95 ARG H H 95 9.538 9.125 0.413 1
1 572 . 6 1 1 A 95 95 ARG HA H 95 5.278 5.293 -0.015 1
1 576 . 6 1 1 A 96 96 VAL H H 96 9.276 8.863 0.413 1
1 577 . 6 1 1 A 96 96 VAL HA H 96 5.222 4.207 1.015 1
1 585 . 6 1 1 A 97 97 VAL H H 97 8.739 9.063 -0.324 1
1 586 . 6 1 1 A 97 97 VAL HA H 97 5.160 5.240 -0.080 1
1 594 . 6 1 1 A 98 98 TYR H H 98 8.596 8.575 0.021 1
1 595 . 6 1 1 A 98 98 TYR HA H 98 5.266 5.124 0.142 1
1 603 . 6 1 1 A 99 99 ALA H H 99 9.685 8.636 1.049 1
1 604 . 6 1 1 A 99 99 ALA HA H 99 5.680 4.576 1.104 1
1 608 . 6 1 1 A 100 100 ASN H H 100 8.468 8.333 0.135 1
1 609 . 6 1 1 A 100 100 ASN HA H 100 4.885 5.056 -0.171 1
1 614 . 6 1 1 A 101 101 SER H H 101 9.342 7.795 1.547 1
1 615 . 6 1 1 A 101 101 SER HA H 101 4.993 4.391 0.602 1
1 618 . 6 1 1 A 102 102 ARG H H 102 9.349 9.552 -0.203 1
1 619 . 6 1 1 A 102 102 ARG HA H 102 4.068 4.020 0.048 1
1 620 . 6 1 1 A 103 103 GLY H H 103 8.632 8.522 0.110 1
1 621 . 6 1 1 A 103 103 GLY HA2 H 103 3.691 3.850 -0.159 1
1 622 . 6 1 1 A 103 103 GLY HA3 H 103 4.341 3.873 0.468 1
1 623 . 6 1 1 A 104 104 ALA H H 104 7.820 7.916 -0.096 1
1 624 . 6 1 1 A 104 104 ALA HA H 104 4.775 4.272 0.503 1
1 628 . 6 1 1 A 105 105 VAL H H 105 8.402 8.489 -0.087 1
1 629 . 6 1 1 A 105 105 VAL HA H 105 4.218 4.438 -0.220 1
1 637 . 6 1 1 A 106 106 GLN H H 106 9.352 8.479 0.873 1
1 638 . 6 1 1 A 106 106 GLN HA H 106 4.900 4.625 0.275 1
1 645 . 6 1 1 A 107 107 TYR H H 107 9.075 8.104 0.971 1
1 646 . 6 1 1 A 107 107 TYR HA H 107 4.007 4.123 -0.116 1
1 653 . 6 1 1 A 108 108 CYS H H 108 8.197 7.885 0.312 1
1 654 . 6 1 1 A 108 108 CYS HA H 108 4.823 4.158 0.665 1
1 657 . 6 1 1 A 109 109 GLY H H 109 6.856 7.020 -0.164 1
1 658 . 6 1 1 A 109 109 GLY HA2 H 109 3.983 3.439 0.544 1
1 659 . 6 1 1 A 109 109 GLY HA3 H 109 4.422 3.579 0.843 1
1 660 . 6 1 1 A 110 110 VAL H H 110 9.418 8.438 0.980 1
1 661 . 6 1 1 A 110 110 VAL HA H 110 5.073 4.862 0.211 1
1 669 . 6 1 1 A 111 111 MET H H 111 9.327 9.305 0.022 1
1 670 . 6 1 1 A 111 111 MET HA H 111 5.678 5.611 0.067 1
1 678 . 6 1 1 A 112 112 THR H H 112 9.310 9.323 -0.013 1
1 679 . 6 1 1 A 112 112 THR HA H 112 5.726 4.741 0.985 1
1 685 . 6 1 1 A 113 113 HIS H H 113 8.960 8.672 0.288 1
1 686 . 6 1 1 A 113 113 HIS HA H 113 3.876 5.007 -1.131 1
1 691 . 6 1 1 A 114 114 SER H H 114 8.367 8.322 0.045 1
1 692 . 6 1 1 A 114 114 SER HA H 114 4.024 4.501 -0.477 1
1 695 . 6 1 1 A 115 115 LYS H H 115 8.140 7.457 0.683 1
1 696 . 6 1 1 A 115 115 LYS HA H 115 5.403 4.485 0.918 1
1 699 . 6 1 1 A 116 116 VAL H H 116 8.525 7.470 1.055 1
1 700 . 6 1 1 A 116 116 VAL HA H 116 5.378 4.323 1.055 1
1 708 . 6 1 1 A 117 117 ASP H H 117 8.025 8.765 -0.740 1
1 709 . 6 1 1 A 117 117 ASP HA H 117 5.243 4.768 0.475 1
1 712 . 6 1 1 A 118 118 LYS H H 118 8.930 8.266 0.664 1
1 713 . 6 1 1 A 118 118 LYS HA H 118 4.216 4.416 -0.200 1
1 716 . 6 1 1 A 119 119 ASN H H 119 8.425 8.311 0.114 1
1 717 . 6 1 1 A 119 119 ASN HA H 119 5.061 4.941 0.120 1
1 722 . 6 1 1 A 120 120 ASN H H 120 8.061 8.229 -0.168 1
1 723 . 6 1 1 A 120 120 ASN HA H 120 4.212 4.524 -0.312 1
1 728 . 6 1 1 A 121 121 GLN H H 121 8.359 8.289 0.070 1
1 729 . 6 1 1 A 121 121 GLN HA H 121 4.373 4.024 0.349 1
1 735 . 6 1 1 A 122 122 GLY H H 122 8.770 7.701 1.069 1
1 736 . 6 1 1 A 122 122 GLY HA2 H 122 3.182 3.928 -0.746 1
1 737 . 6 1 1 A 122 122 GLY HA3 H 122 5.268 3.933 1.335 1
1 738 . 6 1 1 A 123 123 LYS H H 123 8.587 7.852 0.735 1
1 739 . 6 1 1 A 123 123 LYS HA H 123 4.016 4.318 -0.302 1
1 745 . 6 1 1 A 124 124 GLU H H 124 8.527 8.036 0.491 1
1 746 . 6 1 1 A 124 124 GLU HA H 124 4.152 4.100 0.052 1
1 750 . 6 1 1 A 125 125 PHE H H 125 7.936 7.092 0.844 1
1 751 . 6 1 1 A 125 125 PHE HA H 125 4.670 4.796 -0.126 1
1 758 . 6 1 1 A 126 126 PHE H H 126 8.214 9.249 -1.035 1
1 759 . 6 1 1 A 126 126 PHE HA H 126 5.177 5.340 -0.163 1
1 767 . 6 1 1 A 127 127 GLU H H 127 9.169 8.670 0.499 1
1 768 . 6 1 1 A 127 127 GLU HA H 127 4.852 4.633 0.219 1
1 773 . 6 1 1 A 128 128 LYS H H 128 9.000 8.255 0.745 1
1 774 . 6 1 1 A 128 128 LYS HA H 128 4.191 3.750 0.441 1
1 777 . 6 1 1 A 129 129 CYS H H 129 8.938 9.029 -0.091 1
1 778 . 6 1 1 A 129 129 CYS HA H 129 5.268 4.602 0.666 1
1 5 . 7 1 1 A 2 2 PRO HA H 2 4.900 4.524 0.376 1
1 10 . 7 1 1 A 3 3 ILE H H 3 8.774 7.441 1.333 1
1 11 . 7 1 1 A 3 3 ILE HA H 3 5.499 4.660 0.839 1
1 20 . 7 1 1 A 4 4 VAL H H 4 9.501 9.239 0.262 1
1 21 . 7 1 1 A 4 4 VAL HA H 4 4.944 5.202 -0.258 1
1 29 . 7 1 1 A 5 5 THR H H 5 9.243 9.014 0.229 1
1 30 . 7 1 1 A 5 5 THR HA H 5 5.278 5.307 -0.029 1
1 35 . 7 1 1 A 6 6 CYS H H 6 9.815 8.935 0.880 1
1 36 . 7 1 1 A 6 6 CYS HA H 6 5.310 4.675 0.635 1
1 38 . 7 1 1 A 7 7 ARG H H 7 9.154 8.385 0.769 1
1 41 . 7 1 1 A 8 8 PRO HA H 8 4.594 4.601 -0.007 1
1 47 . 7 1 1 A 9 9 LYS H H 9 8.179 8.532 -0.353 1
1 48 . 7 1 1 A 9 9 LYS HA H 9 4.857 4.629 0.228 1
1 52 . 7 1 1 A 10 10 LEU H H 10 9.108 8.341 0.767 1
1 53 . 7 1 1 A 10 10 LEU HA H 10 5.147 4.682 0.465 1
1 63 . 7 1 1 A 11 11 ASP H H 11 9.835 7.973 1.862 1
1 64 . 7 1 1 A 11 11 ASP HA H 11 4.471 4.642 -0.171 1
1 67 . 7 1 1 A 12 12 GLY H H 12 8.847 7.841 1.006 1
1 68 . 7 1 1 A 12 12 GLY HA2 H 12 3.782 3.876 -0.094 1
1 69 . 7 1 1 A 12 12 GLY HA3 H 12 4.427 3.879 0.548 1
1 70 . 7 1 1 A 13 13 ARG H H 13 7.933 7.773 0.160 1
1 71 . 7 1 1 A 13 13 ARG HA H 13 4.886 4.790 0.096 1
1 77 . 7 1 1 A 14 14 GLU H H 14 9.179 8.606 0.573 1
1 78 . 7 1 1 A 14 14 GLU HA H 14 4.178 4.448 -0.270 1
1 82 . 7 1 1 A 15 15 LYS H H 15 9.078 8.811 0.267 1
1 83 . 7 1 1 A 15 15 LYS HA H 15 4.890 4.776 0.114 1
1 84 . 7 1 1 A 16 16 PRO HA H 16 5.144 4.915 0.229 1
1 91 . 7 1 1 A 17 17 PHE H H 17 9.487 8.648 0.839 1
1 92 . 7 1 1 A 17 17 PHE HA H 17 4.760 4.584 0.176 1
1 100 . 7 1 1 A 18 18 LYS H H 18 9.315 8.524 0.791 1
1 101 . 7 1 1 A 18 18 LYS HA H 18 5.197 4.258 0.939 1
1 108 . 7 1 1 A 19 19 VAL H H 19 9.643 8.535 1.108 1
1 109 . 7 1 1 A 19 19 VAL HA H 19 4.796 4.920 -0.124 1
1 117 . 7 1 1 A 20 20 ASP H H 20 9.555 8.544 1.011 1
1 118 . 7 1 1 A 20 20 ASP HA H 20 5.151 5.149 0.002 1
1 121 . 7 1 1 A 21 21 VAL H H 21 9.607 8.662 0.945 1
1 122 . 7 1 1 A 21 21 VAL HA H 21 3.611 3.780 -0.169 1
1 130 . 7 1 1 A 22 22 ALA H H 22 8.531 8.305 0.226 1
1 131 . 7 1 1 A 22 22 ALA HA H 22 4.299 3.904 0.395 1
1 135 . 7 1 1 A 23 23 THR H H 23 7.294 8.439 -1.145 1
1 136 . 7 1 1 A 23 23 THR HA H 23 4.264 3.873 0.391 1
1 141 . 7 1 1 A 24 24 ALA H H 24 8.346 8.110 0.236 1
1 142 . 7 1 1 A 24 24 ALA HA H 24 4.082 4.093 -0.011 1
1 146 . 7 1 1 A 25 25 GLN H H 25 8.866 8.501 0.365 1
1 147 . 7 1 1 A 25 25 GLN HA H 25 3.804 3.823 -0.019 1
1 153 . 7 1 1 A 26 26 ALA H H 26 7.767 8.158 -0.391 1
1 154 . 7 1 1 A 26 26 ALA HA H 26 4.208 4.007 0.201 1
1 158 . 7 1 1 A 27 27 GLN H H 27 8.881 8.487 0.394 1
1 159 . 7 1 1 A 27 27 GLN HA H 27 4.041 3.911 0.130 1
1 165 . 7 1 1 A 28 28 ALA H H 28 8.142 7.952 0.190 1
1 166 . 7 1 1 A 28 28 ALA HA H 28 3.475 3.515 -0.040 1
1 170 . 7 1 1 A 29 29 ARG H H 29 7.291 7.897 -0.606 1
1 171 . 7 1 1 A 29 29 ARG HA H 29 3.688 3.829 -0.141 1
1 174 . 7 1 1 A 30 30 LYS H H 30 7.768 7.866 -0.098 1
1 175 . 7 1 1 A 30 30 LYS HA H 30 4.038 3.948 0.090 1
1 179 . 7 1 1 A 31 31 ALA H H 31 8.127 7.526 0.601 1
1 180 . 7 1 1 A 31 31 ALA HA H 31 3.656 3.953 -0.297 1
1 184 . 7 1 1 A 32 32 GLY H H 32 7.670 7.872 -0.202 1
1 185 . 7 1 1 A 32 32 GLY HA2 H 32 3.380 3.710 -0.330 1
1 186 . 7 1 1 A 32 32 GLY HA3 H 32 3.844 3.741 0.103 1
1 187 . 7 1 1 A 33 33 LEU H H 33 8.057 8.214 -0.157 1
1 188 . 7 1 1 A 33 33 LEU HA H 33 3.259 3.419 -0.160 1
1 197 . 7 1 1 A 34 34 THR H H 34 6.862 7.070 -0.208 1
1 198 . 7 1 1 A 34 34 THR HA H 34 4.738 4.780 -0.042 1
1 203 . 7 1 1 A 35 35 THR H H 35 9.161 8.832 0.329 1
1 204 . 7 1 1 A 35 35 THR HA H 35 4.247 5.161 -0.914 1
1 209 . 7 1 1 A 36 36 GLY H H 36 8.407 8.489 -0.082 1
1 210 . 7 1 1 A 36 36 GLY HA2 H 36 4.349 4.024 0.325 1
1 211 . 7 1 1 A 36 36 GLY HA3 H 36 4.967 4.027 0.940 1
1 212 . 7 1 1 A 37 37 LYS H H 37 10.152 8.257 1.895 1
1 213 . 7 1 1 A 37 37 LYS HA H 37 4.383 4.118 0.265 1
1 221 . 7 1 1 A 38 38 SER H H 38 9.085 8.177 0.908 1
1 222 . 7 1 1 A 38 38 SER HA H 38 4.338 4.691 -0.353 1
1 226 . 7 1 1 A 39 39 GLY H H 39 8.474 7.701 0.773 1
1 227 . 7 1 1 A 39 39 GLY HA2 H 39 3.840 4.142 -0.302 1
1 228 . 7 1 1 A 40 40 ASP H H 40 9.424 8.218 1.206 1
1 229 . 7 1 1 A 40 40 ASP HA H 40 5.374 4.434 0.940 1
1 231 . 7 1 1 A 41 41 PRO HA H 41 5.624 4.587 1.037 1
1 238 . 7 1 1 A 42 42 HIS H H 42 8.343 8.638 -0.295 1
1 239 . 7 1 1 A 42 42 HIS HA H 42 5.189 5.210 -0.021 1
1 244 . 7 1 1 A 43 43 ARG H H 43 8.634 8.291 0.343 1
1 245 . 7 1 1 A 43 43 ARG HA H 43 3.654 3.296 0.358 1
1 252 . 7 1 1 A 44 44 TYR H H 44 8.188 8.647 -0.459 1
1 253 . 7 1 1 A 44 44 TYR HA H 44 5.021 4.867 0.154 1
1 260 . 7 1 1 A 45 45 PHE H H 45 8.728 8.588 0.140 1
1 261 . 7 1 1 A 45 45 PHE HA H 45 4.480 5.167 -0.687 1
1 268 . 7 1 1 A 46 46 ALA H H 46 5.979 8.356 -2.377 1
1 269 . 7 1 1 A 46 46 ALA HA H 46 3.797 4.102 -0.305 1
1 273 . 7 1 1 A 47 47 GLY H H 47 8.510 8.267 0.243 1
1 274 . 7 1 1 A 47 47 GLY HA2 H 47 3.953 3.696 0.257 1
1 275 . 7 1 1 A 47 47 GLY HA3 H 47 4.075 3.736 0.339 1
1 276 . 7 1 1 A 48 48 ASP H H 48 7.504 7.322 0.182 1
1 277 . 7 1 1 A 48 48 ASP HA H 48 5.020 4.630 0.390 1
1 280 . 7 1 1 A 49 49 HIS H H 49 8.240 8.990 -0.750 1
1 281 . 7 1 1 A 49 49 HIS HA H 49 4.373 4.651 -0.278 1
1 285 . 7 1 1 A 50 50 ILE H H 50 8.468 7.979 0.489 1
1 286 . 7 1 1 A 50 50 ILE HA H 50 3.651 4.734 -1.083 1
1 296 . 7 1 1 A 51 51 ARG H H 51 8.404 8.606 -0.202 1
1 297 . 7 1 1 A 51 51 ARG HA H 51 4.450 4.901 -0.451 1
1 303 . 7 1 1 A 52 52 TRP H H 52 11.176 8.276 2.900 1
1 304 . 7 1 1 A 52 52 TRP HA H 52 4.423 4.553 -0.130 1
1 312 . 7 1 1 A 53 53 GLY H H 53 10.422 8.092 2.330 1
1 313 . 7 1 1 A 53 53 GLY HA2 H 53 3.832 3.996 -0.164 1
1 314 . 7 1 1 A 53 53 GLY HA3 H 53 4.411 4.021 0.390 1
1 315 . 7 1 1 A 54 54 VAL H H 54 7.040 7.645 -0.605 1
1 316 . 7 1 1 A 54 54 VAL HA H 54 4.489 3.977 0.512 1
1 324 . 7 1 1 A 55 55 ASN H H 55 9.530 8.786 0.744 1
1 325 . 7 1 1 A 55 55 ASN HA H 55 4.569 4.316 0.253 1
1 330 . 7 1 1 A 56 56 ASN H H 56 9.175 8.271 0.904 1
1 331 . 7 1 1 A 56 56 ASN HA H 56 4.649 4.399 0.250 1
1 336 . 7 1 1 A 57 57 CYS H H 57 7.613 8.402 -0.789 1
1 337 . 7 1 1 A 57 57 CYS HA H 57 4.645 4.250 0.395 1
1 340 . 7 1 1 A 58 58 ASP H H 58 7.626 8.483 -0.857 1
1 341 . 7 1 1 A 58 58 ASP HA H 58 5.206 4.399 0.807 1
1 344 . 7 1 1 A 59 59 LYS H H 59 7.349 7.406 -0.057 1
1 345 . 7 1 1 A 59 59 LYS HA H 59 4.548 4.255 0.293 1
1 350 . 7 1 1 A 60 60 ALA H H 60 9.155 8.718 0.437 1
1 351 . 7 1 1 A 60 60 ALA HA H 60 4.330 4.026 0.304 1
1 355 . 7 1 1 A 61 61 ASP H H 61 8.548 8.220 0.328 1
1 356 . 7 1 1 A 61 61 ASP HA H 61 4.827 4.640 0.187 1
1 359 . 7 1 1 A 62 62 ALA H H 62 7.463 7.285 0.178 1
1 360 . 7 1 1 A 62 62 ALA HA H 62 4.217 4.401 -0.184 1
1 364 . 7 1 1 A 63 63 ILE H H 63 9.302 8.629 0.673 1
1 365 . 7 1 1 A 63 63 ILE HA H 63 4.332 4.723 -0.391 1
1 374 . 7 1 1 A 64 64 LEU H H 64 8.724 9.064 -0.340 1
1 375 . 7 1 1 A 64 64 LEU HA H 64 5.463 5.148 0.315 1
1 385 . 7 1 1 A 65 65 TRP H H 65 9.621 8.479 1.142 1
1 386 . 7 1 1 A 65 65 TRP HA H 65 4.605 5.294 -0.689 1
1 395 . 7 1 1 A 66 66 GLU H H 66 8.388 9.381 -0.993 1
1 396 . 7 1 1 A 66 66 GLU HA H 66 6.014 5.735 0.279 1
1 401 . 7 1 1 A 67 67 TYR H H 67 8.766 9.152 -0.386 1
1 402 . 7 1 1 A 67 67 TYR HA H 67 5.204 5.061 0.143 1
1 405 . 7 1 1 A 68 68 PRO HA H 68 4.523 4.510 0.013 1
1 412 . 7 1 1 A 69 69 ILE H H 69 7.308 7.899 -0.591 1
1 413 . 7 1 1 A 69 69 ILE HA H 69 4.870 5.426 -0.556 1
1 414 . 7 1 1 A 70 70 TYR H H 70 9.219 9.051 0.168 1
1 415 . 7 1 1 A 70 70 TYR HA H 70 4.854 4.673 0.181 1
1 423 . 7 1 1 A 71 71 TRP H H 71 6.662 8.450 -1.788 1
1 424 . 7 1 1 A 71 71 TRP HA H 71 5.496 4.911 0.585 1
1 432 . 7 1 1 A 72 72 VAL H H 72 9.510 9.070 0.440 1
1 433 . 7 1 1 A 72 72 VAL HA H 72 3.999 3.686 0.313 1
1 441 . 7 1 1 A 73 73 GLY H H 73 9.221 8.503 0.718 1
1 442 . 7 1 1 A 73 73 GLY HA2 H 73 3.877 3.924 -0.047 1
1 443 . 7 1 1 A 73 73 GLY HA3 H 73 4.682 3.962 0.720 1
1 444 . 7 1 1 A 74 74 LYS H H 74 7.962 7.411 0.551 1
1 445 . 7 1 1 A 74 74 LYS HA H 74 4.469 4.342 0.127 1
1 457 . 7 1 1 A 75 75 ASN H H 75 8.928 8.775 0.153 1
1 458 . 7 1 1 A 75 75 ASN HA H 75 4.837 5.105 -0.268 1
1 463 . 7 1 1 A 76 76 ALA H H 76 7.544 7.737 -0.193 1
1 464 . 7 1 1 A 76 76 ALA HA H 76 4.555 4.841 -0.286 1
1 468 . 7 1 1 A 77 77 GLU H H 77 8.290 8.175 0.115 1
1 469 . 7 1 1 A 77 77 GLU HA H 77 4.900 3.867 1.033 1
1 474 . 7 1 1 A 78 78 TRP H H 78 10.065 8.793 1.272 1
1 475 . 7 1 1 A 78 78 TRP HA H 78 4.600 4.985 -0.385 1
1 484 . 7 1 1 A 79 79 ALA H H 79 9.850 8.528 1.322 1
1 485 . 7 1 1 A 79 79 ALA HA H 79 5.022 4.461 0.561 1
1 489 . 7 1 1 A 80 80 LYS H H 80 9.255 8.828 0.427 1
1 490 . 7 1 1 A 80 80 LYS HA H 80 4.511 4.537 -0.026 1
1 494 . 7 1 1 A 81 81 ASP H H 81 9.332 7.715 1.617 1
1 495 . 7 1 1 A 81 81 ASP HA H 81 5.429 4.855 0.574 1
1 498 . 7 1 1 A 82 82 VAL H H 82 7.226 7.560 -0.334 1
1 499 . 7 1 1 A 82 82 VAL HA H 82 4.248 4.693 -0.445 1
1 507 . 7 1 1 A 83 83 LYS H H 83 8.407 8.809 -0.402 1
1 508 . 7 1 1 A 83 83 LYS HA H 83 4.356 4.722 -0.366 1
1 510 . 7 1 1 A 84 84 THR H H 84 9.088 9.070 0.018 1
1 511 . 7 1 1 A 84 84 THR HA H 84 3.989 4.190 -0.201 1
1 516 . 7 1 1 A 85 85 SER H H 85 8.391 8.202 0.189 1
1 517 . 7 1 1 A 85 85 SER HA H 85 4.442 4.042 0.400 1
1 520 . 7 1 1 A 86 86 GLN H H 86 7.974 8.136 -0.162 1
1 521 . 7 1 1 A 86 86 GLN HA H 86 4.585 3.942 0.643 1
1 527 . 7 1 1 A 87 87 GLN H H 87 7.083 7.833 -0.750 1
1 528 . 7 1 1 A 87 87 GLN HA H 87 3.903 3.833 0.070 1
1 534 . 7 1 1 A 88 88 LYS H H 88 9.453 8.421 1.032 1
1 535 . 7 1 1 A 88 88 LYS HA H 88 4.114 4.424 -0.310 1
1 539 . 7 1 1 A 89 89 GLY H H 89 9.466 7.924 1.542 1
1 540 . 7 1 1 A 89 89 GLY HA2 H 89 3.965 4.010 -0.045 1
1 541 . 7 1 1 A 89 89 GLY HA3 H 89 3.148 4.079 -0.931 1
1 542 . 7 1 1 A 90 90 GLY H H 90 7.228 7.352 -0.124 1
1 543 . 7 1 1 A 90 90 GLY HA2 H 90 4.290 4.042 0.248 1
1 544 . 7 1 1 A 90 90 GLY HA3 H 90 4.682 4.074 0.608 1
1 545 . 7 1 1 A 91 91 PRO HA H 91 4.902 4.755 0.147 1
1 552 . 7 1 1 A 92 92 THR H H 92 8.585 7.763 0.822 1
1 553 . 7 1 1 A 92 92 THR HA H 92 5.701 4.433 1.268 1
1 559 . 7 1 1 A 93 93 PRO HA H 93 5.551 4.214 1.337 1
1 563 . 7 1 1 A 94 94 ILE H H 94 8.155 7.455 0.700 1
1 564 . 7 1 1 A 94 94 ILE HA H 94 4.794 4.301 0.493 1
1 571 . 7 1 1 A 95 95 ARG H H 95 9.538 9.013 0.525 1
1 572 . 7 1 1 A 95 95 ARG HA H 95 5.278 5.279 -0.001 1
1 576 . 7 1 1 A 96 96 VAL H H 96 9.276 9.053 0.223 1
1 577 . 7 1 1 A 96 96 VAL HA H 96 5.222 4.263 0.959 1
1 585 . 7 1 1 A 97 97 VAL H H 97 8.739 8.806 -0.067 1
1 586 . 7 1 1 A 97 97 VAL HA H 97 5.160 5.407 -0.247 1
1 594 . 7 1 1 A 98 98 TYR H H 98 8.596 8.495 0.101 1
1 595 . 7 1 1 A 98 98 TYR HA H 98 5.266 4.944 0.322 1
1 603 . 7 1 1 A 99 99 ALA H H 99 9.685 8.533 1.152 1
1 604 . 7 1 1 A 99 99 ALA HA H 99 5.680 4.474 1.206 1
1 608 . 7 1 1 A 100 100 ASN H H 100 8.468 8.497 -0.029 1
1 609 . 7 1 1 A 100 100 ASN HA H 100 4.885 5.148 -0.263 1
1 614 . 7 1 1 A 101 101 SER H H 101 9.342 7.645 1.697 1
1 615 . 7 1 1 A 101 101 SER HA H 101 4.993 4.381 0.612 1
1 618 . 7 1 1 A 102 102 ARG H H 102 9.349 9.397 -0.048 1
1 619 . 7 1 1 A 102 102 ARG HA H 102 4.068 4.053 0.015 1
1 620 . 7 1 1 A 103 103 GLY H H 103 8.632 8.831 -0.199 1
1 621 . 7 1 1 A 103 103 GLY HA2 H 103 3.691 3.971 -0.280 1
1 622 . 7 1 1 A 103 103 GLY HA3 H 103 4.341 3.985 0.356 1
1 623 . 7 1 1 A 104 104 ALA H H 104 7.820 7.814 0.006 1
1 624 . 7 1 1 A 104 104 ALA HA H 104 4.775 4.824 -0.049 1
1 628 . 7 1 1 A 105 105 VAL H H 105 8.402 8.971 -0.569 1
1 629 . 7 1 1 A 105 105 VAL HA H 105 4.218 4.264 -0.046 1
1 637 . 7 1 1 A 106 106 GLN H H 106 9.352 8.612 0.740 1
1 638 . 7 1 1 A 106 106 GLN HA H 106 4.900 4.632 0.268 1
1 645 . 7 1 1 A 107 107 TYR H H 107 9.075 8.037 1.038 1
1 646 . 7 1 1 A 107 107 TYR HA H 107 4.007 4.084 -0.077 1
1 653 . 7 1 1 A 108 108 CYS H H 108 8.197 7.806 0.391 1
1 654 . 7 1 1 A 108 108 CYS HA H 108 4.823 4.092 0.731 1
1 657 . 7 1 1 A 109 109 GLY H H 109 6.856 6.918 -0.062 1
1 658 . 7 1 1 A 109 109 GLY HA2 H 109 3.983 3.506 0.477 1
1 659 . 7 1 1 A 109 109 GLY HA3 H 109 4.422 3.510 0.912 1
1 660 . 7 1 1 A 110 110 VAL H H 110 9.418 8.381 1.037 1
1 661 . 7 1 1 A 110 110 VAL HA H 110 5.073 4.862 0.211 1
1 669 . 7 1 1 A 111 111 MET H H 111 9.327 9.560 -0.233 1
1 670 . 7 1 1 A 111 111 MET HA H 111 5.678 5.484 0.194 1
1 678 . 7 1 1 A 112 112 THR H H 112 9.310 9.411 -0.101 1
1 679 . 7 1 1 A 112 112 THR HA H 112 5.726 4.565 1.161 1
1 685 . 7 1 1 A 113 113 HIS H H 113 8.960 8.386 0.574 1
1 686 . 7 1 1 A 113 113 HIS HA H 113 3.876 4.438 -0.562 1
1 691 . 7 1 1 A 114 114 SER H H 114 8.367 8.585 -0.218 1
1 692 . 7 1 1 A 114 114 SER HA H 114 4.024 4.144 -0.120 1
1 695 . 7 1 1 A 115 115 LYS H H 115 8.140 7.682 0.458 1
1 696 . 7 1 1 A 115 115 LYS HA H 115 5.403 4.353 1.050 1
1 699 . 7 1 1 A 116 116 VAL H H 116 8.525 8.250 0.275 1
1 700 . 7 1 1 A 116 116 VAL HA H 116 5.378 4.819 0.559 1
1 708 . 7 1 1 A 117 117 ASP H H 117 8.025 8.880 -0.855 1
1 709 . 7 1 1 A 117 117 ASP HA H 117 5.243 4.759 0.484 1
1 712 . 7 1 1 A 118 118 LYS H H 118 8.930 8.032 0.898 1
1 713 . 7 1 1 A 118 118 LYS HA H 118 4.216 4.539 -0.323 1
1 716 . 7 1 1 A 119 119 ASN H H 119 8.425 8.041 0.384 1
1 717 . 7 1 1 A 119 119 ASN HA H 119 5.061 4.722 0.339 1
1 722 . 7 1 1 A 120 120 ASN H H 120 8.061 8.103 -0.042 1
1 723 . 7 1 1 A 120 120 ASN HA H 120 4.212 4.588 -0.376 1
1 728 . 7 1 1 A 121 121 GLN H H 121 8.359 8.120 0.239 1
1 729 . 7 1 1 A 121 121 GLN HA H 121 4.373 4.213 0.160 1
1 735 . 7 1 1 A 122 122 GLY H H 122 8.770 7.817 0.953 1
1 736 . 7 1 1 A 122 122 GLY HA2 H 122 3.182 3.946 -0.764 1
1 737 . 7 1 1 A 122 122 GLY HA3 H 122 5.268 3.970 1.298 1
1 738 . 7 1 1 A 123 123 LYS H H 123 8.587 8.340 0.247 1
1 739 . 7 1 1 A 123 123 LYS HA H 123 4.016 4.370 -0.354 1
1 745 . 7 1 1 A 124 124 GLU H H 124 8.527 7.714 0.813 1
1 746 . 7 1 1 A 124 124 GLU HA H 124 4.152 4.428 -0.276 1
1 750 . 7 1 1 A 125 125 PHE H H 125 7.936 8.803 -0.867 1
1 751 . 7 1 1 A 125 125 PHE HA H 125 4.670 4.530 0.140 1
1 758 . 7 1 1 A 126 126 PHE H H 126 8.214 9.098 -0.884 1
1 759 . 7 1 1 A 126 126 PHE HA H 126 5.177 4.913 0.264 1
1 767 . 7 1 1 A 127 127 GLU H H 127 9.169 8.845 0.324 1
1 768 . 7 1 1 A 127 127 GLU HA H 127 4.852 4.471 0.381 1
1 773 . 7 1 1 A 128 128 LYS H H 128 9.000 8.398 0.602 1
1 774 . 7 1 1 A 128 128 LYS HA H 128 4.191 4.177 0.014 1
1 777 . 7 1 1 A 129 129 CYS H H 129 8.938 8.675 0.263 1
1 778 . 7 1 1 A 129 129 CYS HA H 129 5.268 5.052 0.216 1
1 5 . 8 1 1 A 2 2 PRO HA H 2 4.900 4.565 0.335 1
1 10 . 8 1 1 A 3 3 ILE H H 3 8.774 7.511 1.263 1
1 11 . 8 1 1 A 3 3 ILE HA H 3 5.499 4.496 1.003 1
1 20 . 8 1 1 A 4 4 VAL H H 4 9.501 9.376 0.125 1
1 21 . 8 1 1 A 4 4 VAL HA H 4 4.944 5.182 -0.238 1
1 29 . 8 1 1 A 5 5 THR H H 5 9.243 9.402 -0.159 1
1 30 . 8 1 1 A 5 5 THR HA H 5 5.278 5.318 -0.040 1
1 35 . 8 1 1 A 6 6 CYS H H 6 9.815 8.754 1.061 1
1 36 . 8 1 1 A 6 6 CYS HA H 6 5.310 4.635 0.675 1
1 38 . 8 1 1 A 7 7 ARG H H 7 9.154 8.536 0.618 1
1 41 . 8 1 1 A 8 8 PRO HA H 8 4.594 4.535 0.059 1
1 47 . 8 1 1 A 9 9 LYS H H 9 8.179 8.415 -0.236 1
1 48 . 8 1 1 A 9 9 LYS HA H 9 4.857 4.631 0.226 1
1 52 . 8 1 1 A 10 10 LEU H H 10 9.108 8.430 0.678 1
1 53 . 8 1 1 A 10 10 LEU HA H 10 5.147 4.490 0.657 1
1 63 . 8 1 1 A 11 11 ASP H H 11 9.835 8.083 1.752 1
1 64 . 8 1 1 A 11 11 ASP HA H 11 4.471 4.817 -0.346 1
1 67 . 8 1 1 A 12 12 GLY H H 12 8.847 8.039 0.808 1
1 68 . 8 1 1 A 12 12 GLY HA2 H 12 3.782 3.998 -0.216 1
1 69 . 8 1 1 A 12 12 GLY HA3 H 12 4.427 4.007 0.420 1
1 70 . 8 1 1 A 13 13 ARG H H 13 7.933 7.772 0.161 1
1 71 . 8 1 1 A 13 13 ARG HA H 13 4.886 4.410 0.476 1
1 77 . 8 1 1 A 14 14 GLU H H 14 9.179 8.586 0.593 1
1 78 . 8 1 1 A 14 14 GLU HA H 14 4.178 4.733 -0.555 1
1 82 . 8 1 1 A 15 15 LYS H H 15 9.078 8.788 0.290 1
1 83 . 8 1 1 A 15 15 LYS HA H 15 4.890 4.731 0.159 1
1 84 . 8 1 1 A 16 16 PRO HA H 16 5.144 4.795 0.349 1
1 91 . 8 1 1 A 17 17 PHE H H 17 9.487 8.790 0.697 1
1 92 . 8 1 1 A 17 17 PHE HA H 17 4.760 4.495 0.265 1
1 100 . 8 1 1 A 18 18 LYS H H 18 9.315 8.592 0.723 1
1 101 . 8 1 1 A 18 18 LYS HA H 18 5.197 4.182 1.015 1
1 108 . 8 1 1 A 19 19 VAL H H 19 9.643 8.542 1.101 1
1 109 . 8 1 1 A 19 19 VAL HA H 19 4.796 4.841 -0.045 1
1 117 . 8 1 1 A 20 20 ASP H H 20 9.555 8.872 0.683 1
1 118 . 8 1 1 A 20 20 ASP HA H 20 5.151 5.213 -0.062 1
1 121 . 8 1 1 A 21 21 VAL H H 21 9.607 8.537 1.070 1
1 122 . 8 1 1 A 21 21 VAL HA H 21 3.611 3.908 -0.297 1
1 130 . 8 1 1 A 22 22 ALA H H 22 8.531 8.030 0.501 1
1 131 . 8 1 1 A 22 22 ALA HA H 22 4.299 3.918 0.381 1
1 135 . 8 1 1 A 23 23 THR H H 23 7.294 8.229 -0.935 1
1 136 . 8 1 1 A 23 23 THR HA H 23 4.264 3.829 0.435 1
1 141 . 8 1 1 A 24 24 ALA H H 24 8.346 8.260 0.086 1
1 142 . 8 1 1 A 24 24 ALA HA H 24 4.082 4.068 0.014 1
1 146 . 8 1 1 A 25 25 GLN H H 25 8.866 8.147 0.719 1
1 147 . 8 1 1 A 25 25 GLN HA H 25 3.804 3.423 0.381 1
1 153 . 8 1 1 A 26 26 ALA H H 26 7.767 8.041 -0.274 1
1 154 . 8 1 1 A 26 26 ALA HA H 26 4.208 3.978 0.230 1
1 158 . 8 1 1 A 27 27 GLN H H 27 8.881 8.285 0.596 1
1 159 . 8 1 1 A 27 27 GLN HA H 27 4.041 3.910 0.131 1
1 165 . 8 1 1 A 28 28 ALA H H 28 8.142 7.818 0.324 1
1 166 . 8 1 1 A 28 28 ALA HA H 28 3.475 3.590 -0.115 1
1 170 . 8 1 1 A 29 29 ARG H H 29 7.291 7.695 -0.404 1
1 171 . 8 1 1 A 29 29 ARG HA H 29 3.688 3.782 -0.094 1
1 174 . 8 1 1 A 30 30 LYS H H 30 7.768 8.060 -0.292 1
1 175 . 8 1 1 A 30 30 LYS HA H 30 4.038 3.888 0.150 1
1 179 . 8 1 1 A 31 31 ALA H H 31 8.127 7.546 0.581 1
1 180 . 8 1 1 A 31 31 ALA HA H 31 3.656 3.880 -0.224 1
1 184 . 8 1 1 A 32 32 GLY H H 32 7.670 7.568 0.102 1
1 185 . 8 1 1 A 32 32 GLY HA2 H 32 3.380 3.707 -0.327 1
1 186 . 8 1 1 A 32 32 GLY HA3 H 32 3.844 3.743 0.101 1
1 187 . 8 1 1 A 33 33 LEU H H 33 8.057 8.133 -0.076 1
1 188 . 8 1 1 A 33 33 LEU HA H 33 3.259 3.021 0.238 1
1 197 . 8 1 1 A 34 34 THR H H 34 6.862 7.043 -0.181 1
1 198 . 8 1 1 A 34 34 THR HA H 34 4.738 4.851 -0.113 1
1 203 . 8 1 1 A 35 35 THR H H 35 9.161 9.241 -0.080 1
1 204 . 8 1 1 A 35 35 THR HA H 35 4.247 5.262 -1.015 1
1 209 . 8 1 1 A 36 36 GLY H H 36 8.407 8.426 -0.019 1
1 210 . 8 1 1 A 36 36 GLY HA2 H 36 4.349 4.033 0.316 1
1 211 . 8 1 1 A 36 36 GLY HA3 H 36 4.967 4.038 0.929 1
1 212 . 8 1 1 A 37 37 LYS H H 37 10.152 8.225 1.927 1
1 213 . 8 1 1 A 37 37 LYS HA H 37 4.383 4.099 0.284 1
1 221 . 8 1 1 A 38 38 SER H H 38 9.085 8.109 0.976 1
1 222 . 8 1 1 A 38 38 SER HA H 38 4.338 4.738 -0.400 1
1 226 . 8 1 1 A 39 39 GLY H H 39 8.474 7.711 0.763 1
1 227 . 8 1 1 A 39 39 GLY HA2 H 39 3.840 4.110 -0.270 1
1 228 . 8 1 1 A 40 40 ASP H H 40 9.424 7.952 1.472 1
1 229 . 8 1 1 A 40 40 ASP HA H 40 5.374 4.482 0.892 1
1 231 . 8 1 1 A 41 41 PRO HA H 41 5.624 4.529 1.095 1
1 238 . 8 1 1 A 42 42 HIS H H 42 8.343 8.638 -0.295 1
1 239 . 8 1 1 A 42 42 HIS HA H 42 5.189 5.173 0.016 1
1 244 . 8 1 1 A 43 43 ARG H H 43 8.634 8.294 0.340 1
1 245 . 8 1 1 A 43 43 ARG HA H 43 3.654 3.307 0.347 1
1 252 . 8 1 1 A 44 44 TYR H H 44 8.188 8.548 -0.360 1
1 253 . 8 1 1 A 44 44 TYR HA H 44 5.021 4.692 0.329 1
1 260 . 8 1 1 A 45 45 PHE H H 45 8.728 7.915 0.813 1
1 261 . 8 1 1 A 45 45 PHE HA H 45 4.480 5.575 -1.095 1
1 268 . 8 1 1 A 46 46 ALA H H 46 5.979 8.735 -2.756 1
1 269 . 8 1 1 A 46 46 ALA HA H 46 3.797 4.083 -0.286 1
1 273 . 8 1 1 A 47 47 GLY H H 47 8.510 8.312 0.198 1
1 274 . 8 1 1 A 47 47 GLY HA2 H 47 3.953 3.922 0.031 1
1 275 . 8 1 1 A 47 47 GLY HA3 H 47 4.075 3.928 0.147 1
1 276 . 8 1 1 A 48 48 ASP H H 48 7.504 7.747 -0.243 1
1 277 . 8 1 1 A 48 48 ASP HA H 48 5.020 4.672 0.348 1
1 280 . 8 1 1 A 49 49 HIS H H 49 8.240 8.582 -0.342 1
1 281 . 8 1 1 A 49 49 HIS HA H 49 4.373 4.720 -0.347 1
1 285 . 8 1 1 A 50 50 ILE H H 50 8.468 8.443 0.025 1
1 286 . 8 1 1 A 50 50 ILE HA H 50 3.651 4.726 -1.075 1
1 296 . 8 1 1 A 51 51 ARG H H 51 8.404 8.334 0.070 1
1 297 . 8 1 1 A 51 51 ARG HA H 51 4.450 4.645 -0.195 1
1 303 . 8 1 1 A 52 52 TRP H H 52 11.176 8.854 2.322 1
1 304 . 8 1 1 A 52 52 TRP HA H 52 4.423 4.681 -0.258 1
1 312 . 8 1 1 A 53 53 GLY H H 53 10.422 7.925 2.497 1
1 313 . 8 1 1 A 53 53 GLY HA2 H 53 3.832 3.965 -0.133 1
1 314 . 8 1 1 A 53 53 GLY HA3 H 53 4.411 3.993 0.418 1
1 315 . 8 1 1 A 54 54 VAL H H 54 7.040 7.875 -0.835 1
1 316 . 8 1 1 A 54 54 VAL HA H 54 4.489 4.279 0.210 1
1 324 . 8 1 1 A 55 55 ASN H H 55 9.530 9.192 0.338 1
1 325 . 8 1 1 A 55 55 ASN HA H 55 4.569 4.384 0.185 1
1 330 . 8 1 1 A 56 56 ASN H H 56 9.175 7.856 1.319 1
1 331 . 8 1 1 A 56 56 ASN HA H 56 4.649 4.365 0.284 1
1 336 . 8 1 1 A 57 57 CYS H H 57 7.613 8.294 -0.681 1
1 337 . 8 1 1 A 57 57 CYS HA H 57 4.645 4.205 0.440 1
1 340 . 8 1 1 A 58 58 ASP H H 58 7.626 8.154 -0.528 1
1 341 . 8 1 1 A 58 58 ASP HA H 58 5.206 4.837 0.369 1
1 344 . 8 1 1 A 59 59 LYS H H 59 7.349 7.466 -0.117 1
1 345 . 8 1 1 A 59 59 LYS HA H 59 4.548 4.652 -0.104 1
1 350 . 8 1 1 A 60 60 ALA H H 60 9.155 8.573 0.582 1
1 351 . 8 1 1 A 60 60 ALA HA H 60 4.330 4.319 0.011 1
1 355 . 8 1 1 A 61 61 ASP H H 61 8.548 7.882 0.666 1
1 356 . 8 1 1 A 61 61 ASP HA H 61 4.827 4.779 0.048 1
1 359 . 8 1 1 A 62 62 ALA H H 62 7.463 7.404 0.059 1
1 360 . 8 1 1 A 62 62 ALA HA H 62 4.217 4.266 -0.049 1
1 364 . 8 1 1 A 63 63 ILE H H 63 9.302 8.805 0.497 1
1 365 . 8 1 1 A 63 63 ILE HA H 63 4.332 4.625 -0.293 1
1 374 . 8 1 1 A 64 64 LEU H H 64 8.724 9.002 -0.278 1
1 375 . 8 1 1 A 64 64 LEU HA H 64 5.463 5.184 0.279 1
1 385 . 8 1 1 A 65 65 TRP H H 65 9.621 8.500 1.121 1
1 386 . 8 1 1 A 65 65 TRP HA H 65 4.605 5.358 -0.753 1
1 395 . 8 1 1 A 66 66 GLU H H 66 8.388 9.354 -0.966 1
1 396 . 8 1 1 A 66 66 GLU HA H 66 6.014 5.730 0.284 1
1 401 . 8 1 1 A 67 67 TYR H H 67 8.766 9.084 -0.318 1
1 402 . 8 1 1 A 67 67 TYR HA H 67 5.204 5.140 0.064 1
1 405 . 8 1 1 A 68 68 PRO HA H 68 4.523 4.506 0.017 1
1 412 . 8 1 1 A 69 69 ILE H H 69 7.308 8.498 -1.190 1
1 413 . 8 1 1 A 69 69 ILE HA H 69 4.870 5.041 -0.171 1
1 414 . 8 1 1 A 70 70 TYR H H 70 9.219 9.119 0.100 1
1 415 . 8 1 1 A 70 70 TYR HA H 70 4.854 4.709 0.145 1
1 423 . 8 1 1 A 71 71 TRP H H 71 6.662 8.193 -1.531 1
1 424 . 8 1 1 A 71 71 TRP HA H 71 5.496 4.753 0.743 1
1 432 . 8 1 1 A 72 72 VAL H H 72 9.510 8.989 0.521 1
1 433 . 8 1 1 A 72 72 VAL HA H 72 3.999 3.712 0.287 1
1 441 . 8 1 1 A 73 73 GLY H H 73 9.221 8.438 0.783 1
1 442 . 8 1 1 A 73 73 GLY HA2 H 73 3.877 3.879 -0.002 1
1 443 . 8 1 1 A 73 73 GLY HA3 H 73 4.682 3.907 0.775 1
1 444 . 8 1 1 A 74 74 LYS H H 74 7.962 7.842 0.120 1
1 445 . 8 1 1 A 74 74 LYS HA H 74 4.469 4.320 0.149 1
1 457 . 8 1 1 A 75 75 ASN H H 75 8.928 8.890 0.038 1
1 458 . 8 1 1 A 75 75 ASN HA H 75 4.837 5.006 -0.169 1
1 463 . 8 1 1 A 76 76 ALA H H 76 7.544 7.609 -0.065 1
1 464 . 8 1 1 A 76 76 ALA HA H 76 4.555 4.220 0.335 1
1 468 . 8 1 1 A 77 77 GLU H H 77 8.290 8.286 0.004 1
1 469 . 8 1 1 A 77 77 GLU HA H 77 4.900 3.211 1.689 1
1 474 . 8 1 1 A 78 78 TRP H H 78 10.065 8.458 1.607 1
1 475 . 8 1 1 A 78 78 TRP HA H 78 4.600 4.817 -0.217 1
1 484 . 8 1 1 A 79 79 ALA H H 79 9.850 8.605 1.245 1
1 485 . 8 1 1 A 79 79 ALA HA H 79 5.022 4.656 0.366 1
1 489 . 8 1 1 A 80 80 LYS H H 80 9.255 8.591 0.664 1
1 490 . 8 1 1 A 80 80 LYS HA H 80 4.511 4.509 0.002 1
1 494 . 8 1 1 A 81 81 ASP H H 81 9.332 8.270 1.062 1
1 495 . 8 1 1 A 81 81 ASP HA H 81 5.429 4.696 0.733 1
1 498 . 8 1 1 A 82 82 VAL H H 82 7.226 7.157 0.069 1
1 499 . 8 1 1 A 82 82 VAL HA H 82 4.248 4.646 -0.398 1
1 507 . 8 1 1 A 83 83 LYS H H 83 8.407 8.604 -0.197 1
1 508 . 8 1 1 A 83 83 LYS HA H 83 4.356 4.460 -0.104 1
1 510 . 8 1 1 A 84 84 THR H H 84 9.088 9.225 -0.137 1
1 511 . 8 1 1 A 84 84 THR HA H 84 3.989 4.206 -0.217 1
1 516 . 8 1 1 A 85 85 SER H H 85 8.391 8.316 0.075 1
1 517 . 8 1 1 A 85 85 SER HA H 85 4.442 4.026 0.416 1
1 520 . 8 1 1 A 86 86 GLN H H 86 7.974 8.141 -0.167 1
1 521 . 8 1 1 A 86 86 GLN HA H 86 4.585 3.979 0.606 1
1 527 . 8 1 1 A 87 87 GLN H H 87 7.083 7.759 -0.676 1
1 528 . 8 1 1 A 87 87 GLN HA H 87 3.903 3.821 0.082 1
1 534 . 8 1 1 A 88 88 LYS H H 88 9.453 8.225 1.228 1
1 535 . 8 1 1 A 88 88 LYS HA H 88 4.114 4.278 -0.164 1
1 539 . 8 1 1 A 89 89 GLY H H 89 9.466 8.160 1.306 1
1 540 . 8 1 1 A 89 89 GLY HA2 H 89 3.965 3.912 0.053 1
1 541 . 8 1 1 A 89 89 GLY HA3 H 89 3.148 3.974 -0.826 1
1 542 . 8 1 1 A 90 90 GLY H H 90 7.228 7.275 -0.047 1
1 543 . 8 1 1 A 90 90 GLY HA2 H 90 4.290 3.981 0.309 1
1 544 . 8 1 1 A 90 90 GLY HA3 H 90 4.682 4.023 0.659 1
1 545 . 8 1 1 A 91 91 PRO HA H 91 4.902 4.663 0.239 1
1 552 . 8 1 1 A 92 92 THR H H 92 8.585 7.651 0.934 1
1 553 . 8 1 1 A 92 92 THR HA H 92 5.701 4.498 1.203 1
1 559 . 8 1 1 A 93 93 PRO HA H 93 5.551 4.561 0.990 1
1 563 . 8 1 1 A 94 94 ILE H H 94 8.155 7.586 0.569 1
1 564 . 8 1 1 A 94 94 ILE HA H 94 4.794 4.371 0.423 1
1 571 . 8 1 1 A 95 95 ARG H H 95 9.538 9.296 0.242 1
1 572 . 8 1 1 A 95 95 ARG HA H 95 5.278 5.360 -0.082 1
1 576 . 8 1 1 A 96 96 VAL H H 96 9.276 9.144 0.132 1
1 577 . 8 1 1 A 96 96 VAL HA H 96 5.222 4.382 0.840 1
1 585 . 8 1 1 A 97 97 VAL H H 97 8.739 9.068 -0.329 1
1 586 . 8 1 1 A 97 97 VAL HA H 97 5.160 5.400 -0.240 1
1 594 . 8 1 1 A 98 98 TYR H H 98 8.596 8.544 0.052 1
1 595 . 8 1 1 A 98 98 TYR HA H 98 5.266 5.263 0.003 1
1 603 . 8 1 1 A 99 99 ALA H H 99 9.685 8.824 0.861 1
1 604 . 8 1 1 A 99 99 ALA HA H 99 5.680 4.970 0.710 1
1 608 . 8 1 1 A 100 100 ASN H H 100 8.468 8.811 -0.343 1
1 609 . 8 1 1 A 100 100 ASN HA H 100 4.885 4.913 -0.028 1
1 614 . 8 1 1 A 101 101 SER H H 101 9.342 7.373 1.969 1
1 615 . 8 1 1 A 101 101 SER HA H 101 4.993 4.319 0.674 1
1 618 . 8 1 1 A 102 102 ARG H H 102 9.349 9.541 -0.192 1
1 619 . 8 1 1 A 102 102 ARG HA H 102 4.068 4.024 0.044 1
1 620 . 8 1 1 A 103 103 GLY H H 103 8.632 8.333 0.299 1
1 621 . 8 1 1 A 103 103 GLY HA2 H 103 3.691 3.931 -0.240 1
1 622 . 8 1 1 A 103 103 GLY HA3 H 103 4.341 3.933 0.408 1
1 623 . 8 1 1 A 104 104 ALA H H 104 7.820 7.437 0.383 1
1 624 . 8 1 1 A 104 104 ALA HA H 104 4.775 4.790 -0.015 1
1 628 . 8 1 1 A 105 105 VAL H H 105 8.402 8.697 -0.295 1
1 629 . 8 1 1 A 105 105 VAL HA H 105 4.218 4.218 0.000 1
1 637 . 8 1 1 A 106 106 GLN H H 106 9.352 8.213 1.139 1
1 638 . 8 1 1 A 106 106 GLN HA H 106 4.900 4.483 0.417 1
1 645 . 8 1 1 A 107 107 TYR H H 107 9.075 8.025 1.050 1
1 646 . 8 1 1 A 107 107 TYR HA H 107 4.007 4.135 -0.128 1
1 653 . 8 1 1 A 108 108 CYS H H 108 8.197 7.764 0.433 1
1 654 . 8 1 1 A 108 108 CYS HA H 108 4.823 4.158 0.665 1
1 657 . 8 1 1 A 109 109 GLY H H 109 6.856 6.796 0.060 1
1 658 . 8 1 1 A 109 109 GLY HA2 H 109 3.983 3.508 0.475 1
1 659 . 8 1 1 A 109 109 GLY HA3 H 109 4.422 3.540 0.882 1
1 660 . 8 1 1 A 110 110 VAL H H 110 9.418 8.447 0.971 1
1 661 . 8 1 1 A 110 110 VAL HA H 110 5.073 4.797 0.276 1
1 669 . 8 1 1 A 111 111 MET H H 111 9.327 9.562 -0.235 1
1 670 . 8 1 1 A 111 111 MET HA H 111 5.678 5.469 0.209 1
1 678 . 8 1 1 A 112 112 THR H H 112 9.310 9.467 -0.157 1
1 679 . 8 1 1 A 112 112 THR HA H 112 5.726 4.678 1.048 1
1 685 . 8 1 1 A 113 113 HIS H H 113 8.960 8.566 0.394 1
1 686 . 8 1 1 A 113 113 HIS HA H 113 3.876 4.860 -0.984 1
1 691 . 8 1 1 A 114 114 SER H H 114 8.367 8.502 -0.135 1
1 692 . 8 1 1 A 114 114 SER HA H 114 4.024 4.501 -0.477 1
1 695 . 8 1 1 A 115 115 LYS H H 115 8.140 7.368 0.772 1
1 696 . 8 1 1 A 115 115 LYS HA H 115 5.403 4.689 0.714 1
1 699 . 8 1 1 A 116 116 VAL H H 116 8.525 8.708 -0.183 1
1 700 . 8 1 1 A 116 116 VAL HA H 116 5.378 4.559 0.819 1
1 708 . 8 1 1 A 117 117 ASP H H 117 8.025 7.939 0.086 1
1 709 . 8 1 1 A 117 117 ASP HA H 117 5.243 4.291 0.952 1
1 712 . 8 1 1 A 118 118 LYS H H 118 8.930 7.919 1.011 1
1 713 . 8 1 1 A 118 118 LYS HA H 118 4.216 4.401 -0.185 1
1 716 . 8 1 1 A 119 119 ASN H H 119 8.425 7.649 0.776 1
1 717 . 8 1 1 A 119 119 ASN HA H 119 5.061 5.154 -0.093 1
1 722 . 8 1 1 A 120 120 ASN H H 120 8.061 9.067 -1.006 1
1 723 . 8 1 1 A 120 120 ASN HA H 120 4.212 4.885 -0.673 1
1 728 . 8 1 1 A 121 121 GLN H H 121 8.359 9.004 -0.645 1
1 729 . 8 1 1 A 121 121 GLN HA H 121 4.373 4.431 -0.058 1
1 735 . 8 1 1 A 122 122 GLY H H 122 8.770 7.644 1.126 1
1 736 . 8 1 1 A 122 122 GLY HA2 H 122 3.182 4.001 -0.819 1
1 737 . 8 1 1 A 122 122 GLY HA3 H 122 5.268 4.040 1.228 1
1 738 . 8 1 1 A 123 123 LYS H H 123 8.587 8.533 0.054 1
1 739 . 8 1 1 A 123 123 LYS HA H 123 4.016 4.402 -0.386 1
1 745 . 8 1 1 A 124 124 GLU H H 124 8.527 7.496 1.031 1
1 746 . 8 1 1 A 124 124 GLU HA H 124 4.152 4.435 -0.283 1
1 750 . 8 1 1 A 125 125 PHE H H 125 7.936 8.711 -0.775 1
1 751 . 8 1 1 A 125 125 PHE HA H 125 4.670 4.603 0.067 1
1 758 . 8 1 1 A 126 126 PHE H H 126 8.214 9.183 -0.969 1
1 759 . 8 1 1 A 126 126 PHE HA H 126 5.177 5.258 -0.081 1
1 767 . 8 1 1 A 127 127 GLU H H 127 9.169 9.300 -0.131 1
1 768 . 8 1 1 A 127 127 GLU HA H 127 4.852 5.136 -0.284 1
1 773 . 8 1 1 A 128 128 LYS H H 128 9.000 8.149 0.851 1
1 774 . 8 1 1 A 128 128 LYS HA H 128 4.191 4.119 0.072 1
1 777 . 8 1 1 A 129 129 CYS H H 129 8.938 8.747 0.191 1
1 778 . 8 1 1 A 129 129 CYS HA H 129 5.268 5.269 -0.001 1
1 5 . 9 1 1 A 2 2 PRO HA H 2 4.900 4.502 0.398 1
1 10 . 9 1 1 A 3 3 ILE H H 3 8.774 7.485 1.289 1
1 11 . 9 1 1 A 3 3 ILE HA H 3 5.499 4.798 0.701 1
1 20 . 9 1 1 A 4 4 VAL H H 4 9.501 9.401 0.100 1
1 21 . 9 1 1 A 4 4 VAL HA H 4 4.944 5.106 -0.162 1
1 29 . 9 1 1 A 5 5 THR H H 5 9.243 9.092 0.151 1
1 30 . 9 1 1 A 5 5 THR HA H 5 5.278 5.274 0.004 1
1 35 . 9 1 1 A 6 6 CYS H H 6 9.815 8.933 0.882 1
1 36 . 9 1 1 A 6 6 CYS HA H 6 5.310 4.653 0.657 1
1 38 . 9 1 1 A 7 7 ARG H H 7 9.154 8.542 0.612 1
1 41 . 9 1 1 A 8 8 PRO HA H 8 4.594 4.761 -0.167 1
1 47 . 9 1 1 A 9 9 LYS H H 9 8.179 8.595 -0.416 1
1 48 . 9 1 1 A 9 9 LYS HA H 9 4.857 4.819 0.038 1
1 52 . 9 1 1 A 10 10 LEU H H 10 9.108 8.286 0.822 1
1 53 . 9 1 1 A 10 10 LEU HA H 10 5.147 4.668 0.479 1
1 63 . 9 1 1 A 11 11 ASP H H 11 9.835 8.070 1.765 1
1 64 . 9 1 1 A 11 11 ASP HA H 11 4.471 4.752 -0.281 1
1 67 . 9 1 1 A 12 12 GLY H H 12 8.847 8.010 0.837 1
1 68 . 9 1 1 A 12 12 GLY HA2 H 12 3.782 3.919 -0.137 1
1 69 . 9 1 1 A 12 12 GLY HA3 H 12 4.427 3.927 0.500 1
1 70 . 9 1 1 A 13 13 ARG H H 13 7.933 7.694 0.239 1
1 71 . 9 1 1 A 13 13 ARG HA H 13 4.886 4.464 0.422 1
1 77 . 9 1 1 A 14 14 GLU H H 14 9.179 8.531 0.648 1
1 78 . 9 1 1 A 14 14 GLU HA H 14 4.178 4.753 -0.575 1
1 82 . 9 1 1 A 15 15 LYS H H 15 9.078 8.754 0.324 1
1 83 . 9 1 1 A 15 15 LYS HA H 15 4.890 4.754 0.136 1
1 84 . 9 1 1 A 16 16 PRO HA H 16 5.144 4.844 0.300 1
1 91 . 9 1 1 A 17 17 PHE H H 17 9.487 8.686 0.801 1
1 92 . 9 1 1 A 17 17 PHE HA H 17 4.760 4.609 0.151 1
1 100 . 9 1 1 A 18 18 LYS H H 18 9.315 8.771 0.544 1
1 101 . 9 1 1 A 18 18 LYS HA H 18 5.197 4.394 0.803 1
1 108 . 9 1 1 A 19 19 VAL H H 19 9.643 8.576 1.067 1
1 109 . 9 1 1 A 19 19 VAL HA H 19 4.796 4.882 -0.086 1
1 117 . 9 1 1 A 20 20 ASP H H 20 9.555 8.958 0.597 1
1 118 . 9 1 1 A 20 20 ASP HA H 20 5.151 5.214 -0.063 1
1 121 . 9 1 1 A 21 21 VAL H H 21 9.607 8.974 0.633 1
1 122 . 9 1 1 A 21 21 VAL HA H 21 3.611 3.581 0.030 1
1 130 . 9 1 1 A 22 22 ALA H H 22 8.531 7.901 0.630 1
1 131 . 9 1 1 A 22 22 ALA HA H 22 4.299 3.920 0.379 1
1 135 . 9 1 1 A 23 23 THR H H 23 7.294 8.161 -0.867 1
1 136 . 9 1 1 A 23 23 THR HA H 23 4.264 3.827 0.437 1
1 141 . 9 1 1 A 24 24 ALA H H 24 8.346 8.261 0.085 1
1 142 . 9 1 1 A 24 24 ALA HA H 24 4.082 4.084 -0.002 1
1 146 . 9 1 1 A 25 25 GLN H H 25 8.866 8.348 0.518 1
1 147 . 9 1 1 A 25 25 GLN HA H 25 3.804 3.724 0.080 1
1 153 . 9 1 1 A 26 26 ALA H H 26 7.767 8.091 -0.324 1
1 154 . 9 1 1 A 26 26 ALA HA H 26 4.208 3.973 0.235 1
1 158 . 9 1 1 A 27 27 GLN H H 27 8.881 8.230 0.651 1
1 159 . 9 1 1 A 27 27 GLN HA H 27 4.041 3.896 0.145 1
1 165 . 9 1 1 A 28 28 ALA H H 28 8.142 8.071 0.071 1
1 166 . 9 1 1 A 28 28 ALA HA H 28 3.475 3.627 -0.152 1
1 170 . 9 1 1 A 29 29 ARG H H 29 7.291 7.767 -0.476 1
1 171 . 9 1 1 A 29 29 ARG HA H 29 3.688 3.768 -0.080 1
1 174 . 9 1 1 A 30 30 LYS H H 30 7.768 8.098 -0.330 1
1 175 . 9 1 1 A 30 30 LYS HA H 30 4.038 3.904 0.134 1
1 179 . 9 1 1 A 31 31 ALA H H 31 8.127 7.469 0.658 1
1 180 . 9 1 1 A 31 31 ALA HA H 31 3.656 3.939 -0.283 1
1 184 . 9 1 1 A 32 32 GLY H H 32 7.670 7.646 0.024 1
1 185 . 9 1 1 A 32 32 GLY HA2 H 32 3.380 3.792 -0.412 1
1 186 . 9 1 1 A 32 32 GLY HA3 H 32 3.844 3.826 0.018 1
1 187 . 9 1 1 A 33 33 LEU H H 33 8.057 8.220 -0.163 1
1 188 . 9 1 1 A 33 33 LEU HA H 33 3.259 3.414 -0.155 1
1 197 . 9 1 1 A 34 34 THR H H 34 6.862 7.075 -0.213 1
1 198 . 9 1 1 A 34 34 THR HA H 34 4.738 4.957 -0.219 1
1 203 . 9 1 1 A 35 35 THR H H 35 9.161 8.781 0.380 1
1 204 . 9 1 1 A 35 35 THR HA H 35 4.247 4.997 -0.750 1
1 209 . 9 1 1 A 36 36 GLY H H 36 8.407 8.488 -0.081 1
1 210 . 9 1 1 A 36 36 GLY HA2 H 36 4.349 4.033 0.316 1
1 211 . 9 1 1 A 36 36 GLY HA3 H 36 4.967 4.037 0.930 1
1 212 . 9 1 1 A 37 37 LYS H H 37 10.152 8.336 1.816 1
1 213 . 9 1 1 A 37 37 LYS HA H 37 4.383 4.123 0.260 1
1 221 . 9 1 1 A 38 38 SER H H 38 9.085 8.186 0.899 1
1 222 . 9 1 1 A 38 38 SER HA H 38 4.338 4.764 -0.426 1
1 226 . 9 1 1 A 39 39 GLY H H 39 8.474 7.714 0.760 1
1 227 . 9 1 1 A 39 39 GLY HA2 H 39 3.840 4.152 -0.312 1
1 228 . 9 1 1 A 40 40 ASP H H 40 9.424 7.846 1.578 1
1 229 . 9 1 1 A 40 40 ASP HA H 40 5.374 4.491 0.883 1
1 231 . 9 1 1 A 41 41 PRO HA H 41 5.624 4.585 1.039 1
1 238 . 9 1 1 A 42 42 HIS H H 42 8.343 8.689 -0.346 1
1 239 . 9 1 1 A 42 42 HIS HA H 42 5.189 5.277 -0.088 1
1 244 . 9 1 1 A 43 43 ARG H H 43 8.634 8.408 0.226 1
1 245 . 9 1 1 A 43 43 ARG HA H 43 3.654 3.150 0.504 1
1 252 . 9 1 1 A 44 44 TYR H H 44 8.188 8.702 -0.514 1
1 253 . 9 1 1 A 44 44 TYR HA H 44 5.021 5.310 -0.289 1
1 260 . 9 1 1 A 45 45 PHE H H 45 8.728 8.802 -0.074 1
1 261 . 9 1 1 A 45 45 PHE HA H 45 4.480 4.878 -0.398 1
1 268 . 9 1 1 A 46 46 ALA H H 46 5.979 8.840 -2.861 1
1 269 . 9 1 1 A 46 46 ALA HA H 46 3.797 3.984 -0.187 1
1 273 . 9 1 1 A 47 47 GLY H H 47 8.510 7.425 1.085 1
1 274 . 9 1 1 A 47 47 GLY HA2 H 47 3.953 3.391 0.562 1
1 275 . 9 1 1 A 47 47 GLY HA3 H 47 4.075 3.484 0.591 1
1 276 . 9 1 1 A 48 48 ASP H H 48 7.504 7.422 0.082 1
1 277 . 9 1 1 A 48 48 ASP HA H 48 5.020 4.768 0.252 1
1 280 . 9 1 1 A 49 49 HIS H H 49 8.240 8.606 -0.366 1
1 281 . 9 1 1 A 49 49 HIS HA H 49 4.373 4.575 -0.202 1
1 285 . 9 1 1 A 50 50 ILE H H 50 8.468 8.643 -0.175 1
1 286 . 9 1 1 A 50 50 ILE HA H 50 3.651 4.777 -1.126 1
1 296 . 9 1 1 A 51 51 ARG H H 51 8.404 8.611 -0.207 1
1 297 . 9 1 1 A 51 51 ARG HA H 51 4.450 4.927 -0.477 1
1 303 . 9 1 1 A 52 52 TRP H H 52 11.176 8.607 2.569 1
1 304 . 9 1 1 A 52 52 TRP HA H 52 4.423 4.711 -0.288 1
1 312 . 9 1 1 A 53 53 GLY H H 53 10.422 7.898 2.524 1
1 313 . 9 1 1 A 53 53 GLY HA2 H 53 3.832 3.963 -0.131 1
1 314 . 9 1 1 A 53 53 GLY HA3 H 53 4.411 3.994 0.417 1
1 315 . 9 1 1 A 54 54 VAL H H 54 7.040 7.825 -0.785 1
1 316 . 9 1 1 A 54 54 VAL HA H 54 4.489 4.670 -0.181 1
1 324 . 9 1 1 A 55 55 ASN H H 55 9.530 9.247 0.283 1
1 325 . 9 1 1 A 55 55 ASN HA H 55 4.569 4.429 0.140 1
1 330 . 9 1 1 A 56 56 ASN H H 56 9.175 8.342 0.833 1
1 331 . 9 1 1 A 56 56 ASN HA H 56 4.649 4.333 0.316 1
1 336 . 9 1 1 A 57 57 CYS H H 57 7.613 8.442 -0.829 1
1 337 . 9 1 1 A 57 57 CYS HA H 57 4.645 4.168 0.477 1
1 340 . 9 1 1 A 58 58 ASP H H 58 7.626 8.761 -1.135 1
1 341 . 9 1 1 A 58 58 ASP HA H 58 5.206 4.366 0.840 1
1 344 . 9 1 1 A 59 59 LYS H H 59 7.349 7.454 -0.105 1
1 345 . 9 1 1 A 59 59 LYS HA H 59 4.548 4.298 0.250 1
1 350 . 9 1 1 A 60 60 ALA H H 60 9.155 8.828 0.327 1
1 351 . 9 1 1 A 60 60 ALA HA H 60 4.330 4.348 -0.018 1
1 355 . 9 1 1 A 61 61 ASP H H 61 8.548 7.969 0.579 1
1 356 . 9 1 1 A 61 61 ASP HA H 61 4.827 4.957 -0.130 1
1 359 . 9 1 1 A 62 62 ALA H H 62 7.463 7.368 0.095 1
1 360 . 9 1 1 A 62 62 ALA HA H 62 4.217 4.339 -0.122 1
1 364 . 9 1 1 A 63 63 ILE H H 63 9.302 8.600 0.702 1
1 365 . 9 1 1 A 63 63 ILE HA H 63 4.332 4.490 -0.158 1
1 374 . 9 1 1 A 64 64 LEU H H 64 8.724 9.131 -0.407 1
1 375 . 9 1 1 A 64 64 LEU HA H 64 5.463 5.100 0.363 1
1 385 . 9 1 1 A 65 65 TRP H H 65 9.621 8.559 1.062 1
1 386 . 9 1 1 A 65 65 TRP HA H 65 4.605 5.387 -0.782 1
1 395 . 9 1 1 A 66 66 GLU H H 66 8.388 9.407 -1.019 1
1 396 . 9 1 1 A 66 66 GLU HA H 66 6.014 5.675 0.339 1
1 401 . 9 1 1 A 67 67 TYR H H 67 8.766 9.077 -0.311 1
1 402 . 9 1 1 A 67 67 TYR HA H 67 5.204 5.152 0.052 1
1 405 . 9 1 1 A 68 68 PRO HA H 68 4.523 4.434 0.089 1
1 412 . 9 1 1 A 69 69 ILE H H 69 7.308 8.130 -0.822 1
1 413 . 9 1 1 A 69 69 ILE HA H 69 4.870 5.014 -0.144 1
1 414 . 9 1 1 A 70 70 TYR H H 70 9.219 9.003 0.216 1
1 415 . 9 1 1 A 70 70 TYR HA H 70 4.854 4.577 0.277 1
1 423 . 9 1 1 A 71 71 TRP H H 71 6.662 8.214 -1.552 1
1 424 . 9 1 1 A 71 71 TRP HA H 71 5.496 4.739 0.757 1
1 432 . 9 1 1 A 72 72 VAL H H 72 9.510 8.667 0.843 1
1 433 . 9 1 1 A 72 72 VAL HA H 72 3.999 3.693 0.306 1
1 441 . 9 1 1 A 73 73 GLY H H 73 9.221 9.139 0.082 1
1 442 . 9 1 1 A 73 73 GLY HA2 H 73 3.877 4.016 -0.139 1
1 443 . 9 1 1 A 73 73 GLY HA3 H 73 4.682 4.028 0.654 1
1 444 . 9 1 1 A 74 74 LYS H H 74 7.962 7.962 0.000 1
1 445 . 9 1 1 A 74 74 LYS HA H 74 4.469 4.341 0.128 1
1 457 . 9 1 1 A 75 75 ASN H H 75 8.928 8.103 0.825 1
1 458 . 9 1 1 A 75 75 ASN HA H 75 4.837 4.338 0.499 1
1 463 . 9 1 1 A 76 76 ALA H H 76 7.544 7.418 0.126 1
1 464 . 9 1 1 A 76 76 ALA HA H 76 4.555 4.734 -0.179 1
1 468 . 9 1 1 A 77 77 GLU H H 77 8.290 8.579 -0.289 1
1 469 . 9 1 1 A 77 77 GLU HA H 77 4.900 3.457 1.443 1
1 474 . 9 1 1 A 78 78 TRP H H 78 10.065 8.321 1.744 1
1 475 . 9 1 1 A 78 78 TRP HA H 78 4.600 5.204 -0.604 1
1 484 . 9 1 1 A 79 79 ALA H H 79 9.850 8.100 1.750 1
1 485 . 9 1 1 A 79 79 ALA HA H 79 5.022 4.930 0.092 1
1 489 . 9 1 1 A 80 80 LYS H H 80 9.255 8.964 0.291 1
1 490 . 9 1 1 A 80 80 LYS HA H 80 4.511 4.170 0.341 1
1 494 . 9 1 1 A 81 81 ASP H H 81 9.332 7.790 1.542 1
1 495 . 9 1 1 A 81 81 ASP HA H 81 5.429 4.793 0.636 1
1 498 . 9 1 1 A 82 82 VAL H H 82 7.226 7.469 -0.243 1
1 499 . 9 1 1 A 82 82 VAL HA H 82 4.248 4.597 -0.349 1
1 507 . 9 1 1 A 83 83 LYS H H 83 8.407 8.751 -0.344 1
1 508 . 9 1 1 A 83 83 LYS HA H 83 4.356 4.643 -0.287 1
1 510 . 9 1 1 A 84 84 THR H H 84 9.088 8.938 0.150 1
1 511 . 9 1 1 A 84 84 THR HA H 84 3.989 4.022 -0.033 1
1 516 . 9 1 1 A 85 85 SER H H 85 8.391 8.116 0.275 1
1 517 . 9 1 1 A 85 85 SER HA H 85 4.442 4.067 0.375 1
1 520 . 9 1 1 A 86 86 GLN H H 86 7.974 8.155 -0.181 1
1 521 . 9 1 1 A 86 86 GLN HA H 86 4.585 3.995 0.590 1
1 527 . 9 1 1 A 87 87 GLN H H 87 7.083 7.667 -0.584 1
1 528 . 9 1 1 A 87 87 GLN HA H 87 3.903 3.759 0.144 1
1 534 . 9 1 1 A 88 88 LYS H H 88 9.453 8.392 1.061 1
1 535 . 9 1 1 A 88 88 LYS HA H 88 4.114 4.533 -0.419 1
1 539 . 9 1 1 A 89 89 GLY H H 89 9.466 8.480 0.986 1
1 540 . 9 1 1 A 89 89 GLY HA2 H 89 3.965 4.011 -0.046 1
1 541 . 9 1 1 A 89 89 GLY HA3 H 89 3.148 4.034 -0.886 1
1 542 . 9 1 1 A 90 90 GLY H H 90 7.228 7.364 -0.136 1
1 543 . 9 1 1 A 90 90 GLY HA2 H 90 4.290 4.104 0.186 1
1 544 . 9 1 1 A 90 90 GLY HA3 H 90 4.682 4.114 0.568 1
1 545 . 9 1 1 A 91 91 PRO HA H 91 4.902 4.781 0.121 1
1 552 . 9 1 1 A 92 92 THR H H 92 8.585 8.600 -0.015 1
1 553 . 9 1 1 A 92 92 THR HA H 92 5.701 5.018 0.683 1
1 559 . 9 1 1 A 93 93 PRO HA H 93 5.551 4.330 1.221 1
1 563 . 9 1 1 A 94 94 ILE H H 94 8.155 7.214 0.941 1
1 564 . 9 1 1 A 94 94 ILE HA H 94 4.794 4.465 0.329 1
1 571 . 9 1 1 A 95 95 ARG H H 95 9.538 9.338 0.200 1
1 572 . 9 1 1 A 95 95 ARG HA H 95 5.278 5.377 -0.099 1
1 576 . 9 1 1 A 96 96 VAL H H 96 9.276 8.915 0.361 1
1 577 . 9 1 1 A 96 96 VAL HA H 96 5.222 4.276 0.946 1
1 585 . 9 1 1 A 97 97 VAL H H 97 8.739 8.643 0.096 1
1 586 . 9 1 1 A 97 97 VAL HA H 97 5.160 5.263 -0.103 1
1 594 . 9 1 1 A 98 98 TYR H H 98 8.596 8.439 0.157 1
1 595 . 9 1 1 A 98 98 TYR HA H 98 5.266 5.278 -0.012 1
1 603 . 9 1 1 A 99 99 ALA H H 99 9.685 8.605 1.080 1
1 604 . 9 1 1 A 99 99 ALA HA H 99 5.680 4.814 0.866 1
1 608 . 9 1 1 A 100 100 ASN H H 100 8.468 8.590 -0.122 1
1 609 . 9 1 1 A 100 100 ASN HA H 100 4.885 5.100 -0.215 1
1 614 . 9 1 1 A 101 101 SER H H 101 9.342 8.016 1.326 1
1 615 . 9 1 1 A 101 101 SER HA H 101 4.993 4.133 0.860 1
1 618 . 9 1 1 A 102 102 ARG H H 102 9.349 7.679 1.670 1
1 619 . 9 1 1 A 102 102 ARG HA H 102 4.068 4.567 -0.499 1
1 620 . 9 1 1 A 103 103 GLY H H 103 8.632 8.116 0.516 1
1 621 . 9 1 1 A 103 103 GLY HA2 H 103 3.691 3.945 -0.254 1
1 622 . 9 1 1 A 103 103 GLY HA3 H 103 4.341 3.947 0.394 1
1 623 . 9 1 1 A 104 104 ALA H H 104 7.820 7.777 0.043 1
1 624 . 9 1 1 A 104 104 ALA HA H 104 4.775 4.731 0.044 1
1 628 . 9 1 1 A 105 105 VAL H H 105 8.402 8.662 -0.260 1
1 629 . 9 1 1 A 105 105 VAL HA H 105 4.218 4.166 0.052 1
1 637 . 9 1 1 A 106 106 GLN H H 106 9.352 8.701 0.651 1
1 638 . 9 1 1 A 106 106 GLN HA H 106 4.900 4.541 0.359 1
1 645 . 9 1 1 A 107 107 TYR H H 107 9.075 8.017 1.058 1
1 646 . 9 1 1 A 107 107 TYR HA H 107 4.007 4.121 -0.114 1
1 653 . 9 1 1 A 108 108 CYS H H 108 8.197 7.714 0.483 1
1 654 . 9 1 1 A 108 108 CYS HA H 108 4.823 4.095 0.728 1
1 657 . 9 1 1 A 109 109 GLY H H 109 6.856 6.659 0.197 1
1 658 . 9 1 1 A 109 109 GLY HA2 H 109 3.983 3.278 0.705 1
1 659 . 9 1 1 A 109 109 GLY HA3 H 109 4.422 3.402 1.020 1
1 660 . 9 1 1 A 110 110 VAL H H 110 9.418 8.468 0.950 1
1 661 . 9 1 1 A 110 110 VAL HA H 110 5.073 4.725 0.348 1
1 669 . 9 1 1 A 111 111 MET H H 111 9.327 9.417 -0.090 1
1 670 . 9 1 1 A 111 111 MET HA H 111 5.678 5.382 0.296 1
1 678 . 9 1 1 A 112 112 THR H H 112 9.310 9.626 -0.316 1
1 679 . 9 1 1 A 112 112 THR HA H 112 5.726 4.916 0.810 1
1 685 . 9 1 1 A 113 113 HIS H H 113 8.960 8.396 0.564 1
1 686 . 9 1 1 A 113 113 HIS HA H 113 3.876 4.837 -0.961 1
1 691 . 9 1 1 A 114 114 SER H H 114 8.367 8.756 -0.389 1
1 692 . 9 1 1 A 114 114 SER HA H 114 4.024 4.082 -0.058 1
1 695 . 9 1 1 A 115 115 LYS H H 115 8.140 7.659 0.481 1
1 696 . 9 1 1 A 115 115 LYS HA H 115 5.403 4.379 1.024 1
1 699 . 9 1 1 A 116 116 VAL H H 116 8.525 8.012 0.513 1
1 700 . 9 1 1 A 116 116 VAL HA H 116 5.378 4.756 0.622 1
1 708 . 9 1 1 A 117 117 ASP H H 117 8.025 8.823 -0.798 1
1 709 . 9 1 1 A 117 117 ASP HA H 117 5.243 4.717 0.526 1
1 712 . 9 1 1 A 118 118 LYS H H 118 8.930 8.163 0.767 1
1 713 . 9 1 1 A 118 118 LYS HA H 118 4.216 4.405 -0.189 1
1 716 . 9 1 1 A 119 119 ASN H H 119 8.425 8.093 0.332 1
1 717 . 9 1 1 A 119 119 ASN HA H 119 5.061 4.841 0.220 1
1 722 . 9 1 1 A 120 120 ASN H H 120 8.061 8.156 -0.095 1
1 723 . 9 1 1 A 120 120 ASN HA H 120 4.212 4.400 -0.188 1
1 728 . 9 1 1 A 121 121 GLN H H 121 8.359 7.802 0.557 1
1 729 . 9 1 1 A 121 121 GLN HA H 121 4.373 4.842 -0.469 1
1 735 . 9 1 1 A 122 122 GLY H H 122 8.770 8.445 0.325 1
1 736 . 9 1 1 A 122 122 GLY HA2 H 122 3.182 3.721 -0.539 1
1 737 . 9 1 1 A 122 122 GLY HA3 H 122 5.268 3.830 1.438 1
1 738 . 9 1 1 A 123 123 LYS H H 123 8.587 8.572 0.015 1
1 739 . 9 1 1 A 123 123 LYS HA H 123 4.016 4.382 -0.366 1
1 745 . 9 1 1 A 124 124 GLU H H 124 8.527 8.442 0.085 1
1 746 . 9 1 1 A 124 124 GLU HA H 124 4.152 4.122 0.030 1
1 750 . 9 1 1 A 125 125 PHE H H 125 7.936 7.124 0.812 1
1 751 . 9 1 1 A 125 125 PHE HA H 125 4.670 4.930 -0.260 1
1 758 . 9 1 1 A 126 126 PHE H H 126 8.214 9.037 -0.823 1
1 759 . 9 1 1 A 126 126 PHE HA H 126 5.177 5.342 -0.165 1
1 767 . 9 1 1 A 127 127 GLU H H 127 9.169 9.168 0.001 1
1 768 . 9 1 1 A 127 127 GLU HA H 127 4.852 5.047 -0.195 1
1 773 . 9 1 1 A 128 128 LYS H H 128 9.000 8.336 0.664 1
1 774 . 9 1 1 A 128 128 LYS HA H 128 4.191 3.921 0.270 1
1 777 . 9 1 1 A 129 129 CYS H H 129 8.938 8.968 -0.030 1
1 778 . 9 1 1 A 129 129 CYS HA H 129 5.268 5.329 -0.061 1
1 5 . 10 1 1 A 2 2 PRO HA H 2 4.900 4.493 0.407 1
1 10 . 10 1 1 A 3 3 ILE H H 3 8.774 7.543 1.231 1
1 11 . 10 1 1 A 3 3 ILE HA H 3 5.499 4.734 0.765 1
1 20 . 10 1 1 A 4 4 VAL H H 4 9.501 8.851 0.650 1
1 21 . 10 1 1 A 4 4 VAL HA H 4 4.944 4.749 0.195 1
1 29 . 10 1 1 A 5 5 THR H H 5 9.243 9.380 -0.137 1
1 30 . 10 1 1 A 5 5 THR HA H 5 5.278 5.365 -0.087 1
1 35 . 10 1 1 A 6 6 CYS H H 6 9.815 8.867 0.948 1
1 36 . 10 1 1 A 6 6 CYS HA H 6 5.310 4.850 0.460 1
1 38 . 10 1 1 A 7 7 ARG H H 7 9.154 8.533 0.621 1
1 41 . 10 1 1 A 8 8 PRO HA H 8 4.594 4.577 0.017 1
1 47 . 10 1 1 A 9 9 LYS H H 9 8.179 8.405 -0.226 1
1 48 . 10 1 1 A 9 9 LYS HA H 9 4.857 4.904 -0.047 1
1 52 . 10 1 1 A 10 10 LEU H H 10 9.108 8.572 0.536 1
1 53 . 10 1 1 A 10 10 LEU HA H 10 5.147 4.665 0.482 1
1 63 . 10 1 1 A 11 11 ASP H H 11 9.835 8.033 1.802 1
1 64 . 10 1 1 A 11 11 ASP HA H 11 4.471 4.694 -0.223 1
1 67 . 10 1 1 A 12 12 GLY H H 12 8.847 8.055 0.792 1
1 68 . 10 1 1 A 12 12 GLY HA2 H 12 3.782 3.865 -0.083 1
1 69 . 10 1 1 A 12 12 GLY HA3 H 12 4.427 3.872 0.555 1
1 70 . 10 1 1 A 13 13 ARG H H 13 7.933 7.807 0.126 1
1 71 . 10 1 1 A 13 13 ARG HA H 13 4.886 4.673 0.213 1
1 77 . 10 1 1 A 14 14 GLU H H 14 9.179 8.514 0.665 1
1 78 . 10 1 1 A 14 14 GLU HA H 14 4.178 4.746 -0.568 1
1 82 . 10 1 1 A 15 15 LYS H H 15 9.078 8.936 0.142 1
1 83 . 10 1 1 A 15 15 LYS HA H 15 4.890 4.733 0.157 1
1 84 . 10 1 1 A 16 16 PRO HA H 16 5.144 4.902 0.242 1
1 91 . 10 1 1 A 17 17 PHE H H 17 9.487 8.463 1.024 1
1 92 . 10 1 1 A 17 17 PHE HA H 17 4.760 4.867 -0.107 1
1 100 . 10 1 1 A 18 18 LYS H H 18 9.315 8.913 0.402 1
1 101 . 10 1 1 A 18 18 LYS HA H 18 5.197 4.441 0.756 1
1 108 . 10 1 1 A 19 19 VAL H H 19 9.643 8.668 0.975 1
1 109 . 10 1 1 A 19 19 VAL HA H 19 4.796 4.708 0.088 1
1 117 . 10 1 1 A 20 20 ASP H H 20 9.555 8.738 0.817 1
1 118 . 10 1 1 A 20 20 ASP HA H 20 5.151 4.858 0.293 1
1 121 . 10 1 1 A 21 21 VAL H H 21 9.607 8.851 0.756 1
1 122 . 10 1 1 A 21 21 VAL HA H 21 3.611 3.774 -0.163 1
1 130 . 10 1 1 A 22 22 ALA H H 22 8.531 8.304 0.227 1
1 131 . 10 1 1 A 22 22 ALA HA H 22 4.299 3.933 0.366 1
1 135 . 10 1 1 A 23 23 THR H H 23 7.294 7.694 -0.400 1
1 136 . 10 1 1 A 23 23 THR HA H 23 4.264 3.889 0.375 1
1 141 . 10 1 1 A 24 24 ALA H H 24 8.346 8.121 0.225 1
1 142 . 10 1 1 A 24 24 ALA HA H 24 4.082 4.110 -0.028 1
1 146 . 10 1 1 A 25 25 GLN H H 25 8.866 8.569 0.297 1
1 147 . 10 1 1 A 25 25 GLN HA H 25 3.804 4.015 -0.211 1
1 153 . 10 1 1 A 26 26 ALA H H 26 7.767 8.102 -0.335 1
1 154 . 10 1 1 A 26 26 ALA HA H 26 4.208 3.985 0.223 1
1 158 . 10 1 1 A 27 27 GLN H H 27 8.881 8.614 0.267 1
1 159 . 10 1 1 A 27 27 GLN HA H 27 4.041 4.069 -0.028 1
1 165 . 10 1 1 A 28 28 ALA H H 28 8.142 8.171 -0.029 1
1 166 . 10 1 1 A 28 28 ALA HA H 28 3.475 3.513 -0.038 1
1 170 . 10 1 1 A 29 29 ARG H H 29 7.291 7.625 -0.334 1
1 171 . 10 1 1 A 29 29 ARG HA H 29 3.688 3.847 -0.159 1
1 174 . 10 1 1 A 30 30 LYS H H 30 7.768 8.184 -0.416 1
1 175 . 10 1 1 A 30 30 LYS HA H 30 4.038 3.965 0.073 1
1 179 . 10 1 1 A 31 31 ALA H H 31 8.127 7.190 0.937 1
1 180 . 10 1 1 A 31 31 ALA HA H 31 3.656 3.864 -0.208 1
1 184 . 10 1 1 A 32 32 GLY H H 32 7.670 7.599 0.071 1
1 185 . 10 1 1 A 32 32 GLY HA2 H 32 3.380 3.746 -0.366 1
1 186 . 10 1 1 A 32 32 GLY HA3 H 32 3.844 3.806 0.038 1
1 187 . 10 1 1 A 33 33 LEU H H 33 8.057 8.142 -0.085 1
1 188 . 10 1 1 A 33 33 LEU HA H 33 3.259 3.078 0.181 1
1 197 . 10 1 1 A 34 34 THR H H 34 6.862 7.091 -0.229 1
1 198 . 10 1 1 A 34 34 THR HA H 34 4.738 4.918 -0.180 1
1 203 . 10 1 1 A 35 35 THR H H 35 9.161 8.830 0.331 1
1 204 . 10 1 1 A 35 35 THR HA H 35 4.247 5.165 -0.918 1
1 209 . 10 1 1 A 36 36 GLY H H 36 8.407 8.514 -0.107 1
1 210 . 10 1 1 A 36 36 GLY HA2 H 36 4.349 4.030 0.319 1
1 211 . 10 1 1 A 36 36 GLY HA3 H 36 4.967 4.035 0.932 1
1 212 . 10 1 1 A 37 37 LYS H H 37 10.152 8.120 2.032 1
1 213 . 10 1 1 A 37 37 LYS HA H 37 4.383 4.092 0.291 1
1 221 . 10 1 1 A 38 38 SER H H 38 9.085 8.174 0.911 1
1 222 . 10 1 1 A 38 38 SER HA H 38 4.338 4.715 -0.377 1
1 226 . 10 1 1 A 39 39 GLY H H 39 8.474 7.720 0.754 1
1 227 . 10 1 1 A 39 39 GLY HA2 H 39 3.840 4.127 -0.287 1
1 228 . 10 1 1 A 40 40 ASP H H 40 9.424 7.773 1.651 1
1 229 . 10 1 1 A 40 40 ASP HA H 40 5.374 4.723 0.651 1
1 231 . 10 1 1 A 41 41 PRO HA H 41 5.624 4.772 0.852 1
1 238 . 10 1 1 A 42 42 HIS H H 42 8.343 8.626 -0.283 1
1 239 . 10 1 1 A 42 42 HIS HA H 42 5.189 5.277 -0.088 1
1 244 . 10 1 1 A 43 43 ARG H H 43 8.634 8.346 0.288 1
1 245 . 10 1 1 A 43 43 ARG HA H 43 3.654 3.225 0.429 1
1 252 . 10 1 1 A 44 44 TYR H H 44 8.188 8.609 -0.421 1
1 253 . 10 1 1 A 44 44 TYR HA H 44 5.021 5.240 -0.219 1
1 260 . 10 1 1 A 45 45 PHE H H 45 8.728 8.755 -0.027 1
1 261 . 10 1 1 A 45 45 PHE HA H 45 4.480 5.576 -1.096 1
1 268 . 10 1 1 A 46 46 ALA H H 46 5.979 8.665 -2.686 1
1 269 . 10 1 1 A 46 46 ALA HA H 46 3.797 4.143 -0.346 1
1 273 . 10 1 1 A 47 47 GLY H H 47 8.510 8.020 0.490 1
1 274 . 10 1 1 A 47 47 GLY HA2 H 47 3.953 3.774 0.179 1
1 275 . 10 1 1 A 47 47 GLY HA3 H 47 4.075 3.782 0.293 1
1 276 . 10 1 1 A 48 48 ASP H H 48 7.504 7.473 0.031 1
1 277 . 10 1 1 A 48 48 ASP HA H 48 5.020 4.645 0.375 1
1 280 . 10 1 1 A 49 49 HIS H H 49 8.240 8.576 -0.336 1
1 281 . 10 1 1 A 49 49 HIS HA H 49 4.373 4.723 -0.350 1
1 285 . 10 1 1 A 50 50 ILE H H 50 8.468 8.546 -0.078 1
1 286 . 10 1 1 A 50 50 ILE HA H 50 3.651 4.818 -1.167 1
1 296 . 10 1 1 A 51 51 ARG H H 51 8.404 8.634 -0.230 1
1 297 . 10 1 1 A 51 51 ARG HA H 51 4.450 4.926 -0.476 1
1 303 . 10 1 1 A 52 52 TRP H H 52 11.176 8.724 2.452 1
1 304 . 10 1 1 A 52 52 TRP HA H 52 4.423 4.694 -0.271 1
1 312 . 10 1 1 A 53 53 GLY H H 53 10.422 8.048 2.374 1
1 313 . 10 1 1 A 53 53 GLY HA2 H 53 3.832 3.996 -0.164 1
1 314 . 10 1 1 A 53 53 GLY HA3 H 53 4.411 4.020 0.391 1
1 315 . 10 1 1 A 54 54 VAL H H 54 7.040 7.810 -0.770 1
1 316 . 10 1 1 A 54 54 VAL HA H 54 4.489 4.103 0.386 1
1 324 . 10 1 1 A 55 55 ASN H H 55 9.530 9.309 0.221 1
1 325 . 10 1 1 A 55 55 ASN HA H 55 4.569 5.225 -0.656 1
1 330 . 10 1 1 A 56 56 ASN H H 56 9.175 8.100 1.075 1
1 331 . 10 1 1 A 56 56 ASN HA H 56 4.649 4.756 -0.107 1
1 336 . 10 1 1 A 57 57 CYS H H 57 7.613 8.251 -0.638 1
1 337 . 10 1 1 A 57 57 CYS HA H 57 4.645 4.367 0.278 1
1 340 . 10 1 1 A 58 58 ASP H H 58 7.626 8.345 -0.719 1
1 341 . 10 1 1 A 58 58 ASP HA H 58 5.206 4.483 0.723 1
1 344 . 10 1 1 A 59 59 LYS H H 59 7.349 7.572 -0.223 1
1 345 . 10 1 1 A 59 59 LYS HA H 59 4.548 4.316 0.232 1
1 350 . 10 1 1 A 60 60 ALA H H 60 9.155 8.729 0.426 1
1 351 . 10 1 1 A 60 60 ALA HA H 60 4.330 4.234 0.096 1
1 355 . 10 1 1 A 61 61 ASP H H 61 8.548 7.846 0.702 1
1 356 . 10 1 1 A 61 61 ASP HA H 61 4.827 4.821 0.006 1
1 359 . 10 1 1 A 62 62 ALA H H 62 7.463 7.371 0.092 1
1 360 . 10 1 1 A 62 62 ALA HA H 62 4.217 4.372 -0.155 1
1 364 . 10 1 1 A 63 63 ILE H H 63 9.302 8.700 0.602 1
1 365 . 10 1 1 A 63 63 ILE HA H 63 4.332 4.484 -0.152 1
1 374 . 10 1 1 A 64 64 LEU H H 64 8.724 9.171 -0.447 1
1 375 . 10 1 1 A 64 64 LEU HA H 64 5.463 5.257 0.206 1
1 385 . 10 1 1 A 65 65 TRP H H 65 9.621 8.405 1.216 1
1 386 . 10 1 1 A 65 65 TRP HA H 65 4.605 5.333 -0.728 1
1 395 . 10 1 1 A 66 66 GLU H H 66 8.388 9.229 -0.841 1
1 396 . 10 1 1 A 66 66 GLU HA H 66 6.014 5.643 0.371 1
1 401 . 10 1 1 A 67 67 TYR H H 67 8.766 9.176 -0.410 1
1 402 . 10 1 1 A 67 67 TYR HA H 67 5.204 5.168 0.036 1
1 405 . 10 1 1 A 68 68 PRO HA H 68 4.523 4.422 0.101 1
1 412 . 10 1 1 A 69 69 ILE H H 69 7.308 8.075 -0.767 1
1 413 . 10 1 1 A 69 69 ILE HA H 69 4.870 5.011 -0.141 1
1 414 . 10 1 1 A 70 70 TYR H H 70 9.219 9.177 0.042 1
1 415 . 10 1 1 A 70 70 TYR HA H 70 4.854 4.733 0.121 1
1 423 . 10 1 1 A 71 71 TRP H H 71 6.662 8.275 -1.613 1
1 424 . 10 1 1 A 71 71 TRP HA H 71 5.496 4.835 0.661 1
1 432 . 10 1 1 A 72 72 VAL H H 72 9.510 8.928 0.582 1
1 433 . 10 1 1 A 72 72 VAL HA H 72 3.999 3.889 0.110 1
1 441 . 10 1 1 A 73 73 GLY H H 73 9.221 8.494 0.727 1
1 442 . 10 1 1 A 73 73 GLY HA2 H 73 3.877 3.888 -0.011 1
1 443 . 10 1 1 A 73 73 GLY HA3 H 73 4.682 3.908 0.774 1
1 444 . 10 1 1 A 74 74 LYS H H 74 7.962 7.256 0.706 1
1 445 . 10 1 1 A 74 74 LYS HA H 74 4.469 4.321 0.148 1
1 457 . 10 1 1 A 75 75 ASN H H 75 8.928 9.046 -0.118 1
1 458 . 10 1 1 A 75 75 ASN HA H 75 4.837 4.828 0.009 1
1 463 . 10 1 1 A 76 76 ALA H H 76 7.544 7.535 0.009 1
1 464 . 10 1 1 A 76 76 ALA HA H 76 4.555 4.138 0.417 1
1 468 . 10 1 1 A 77 77 GLU H H 77 8.290 8.326 -0.036 1
1 469 . 10 1 1 A 77 77 GLU HA H 77 4.900 4.072 0.828 1
1 474 . 10 1 1 A 78 78 TRP H H 78 10.065 8.279 1.786 1
1 475 . 10 1 1 A 78 78 TRP HA H 78 4.600 5.051 -0.451 1
1 484 . 10 1 1 A 79 79 ALA H H 79 9.850 8.502 1.348 1
1 485 . 10 1 1 A 79 79 ALA HA H 79 5.022 4.688 0.334 1
1 489 . 10 1 1 A 80 80 LYS H H 80 9.255 8.640 0.615 1
1 490 . 10 1 1 A 80 80 LYS HA H 80 4.511 4.542 -0.031 1
1 494 . 10 1 1 A 81 81 ASP H H 81 9.332 8.286 1.046 1
1 495 . 10 1 1 A 81 81 ASP HA H 81 5.429 4.791 0.638 1
1 498 . 10 1 1 A 82 82 VAL H H 82 7.226 7.405 -0.179 1
1 499 . 10 1 1 A 82 82 VAL HA H 82 4.248 4.741 -0.493 1
1 507 . 10 1 1 A 83 83 LYS H H 83 8.407 8.788 -0.381 1
1 508 . 10 1 1 A 83 83 LYS HA H 83 4.356 4.581 -0.225 1
1 510 . 10 1 1 A 84 84 THR H H 84 9.088 9.115 -0.027 1
1 511 . 10 1 1 A 84 84 THR HA H 84 3.989 4.216 -0.227 1
1 516 . 10 1 1 A 85 85 SER H H 85 8.391 8.223 0.168 1
1 517 . 10 1 1 A 85 85 SER HA H 85 4.442 4.023 0.419 1
1 520 . 10 1 1 A 86 86 GLN H H 86 7.974 8.197 -0.223 1
1 521 . 10 1 1 A 86 86 GLN HA H 86 4.585 3.990 0.595 1
1 527 . 10 1 1 A 87 87 GLN H H 87 7.083 7.596 -0.513 1
1 528 . 10 1 1 A 87 87 GLN HA H 87 3.903 3.875 0.028 1
1 534 . 10 1 1 A 88 88 LYS H H 88 9.453 8.388 1.065 1
1 535 . 10 1 1 A 88 88 LYS HA H 88 4.114 3.979 0.135 1
1 539 . 10 1 1 A 89 89 GLY H H 89 9.466 8.173 1.293 1
1 540 . 10 1 1 A 89 89 GLY HA2 H 89 3.965 3.845 0.120 1
1 541 . 10 1 1 A 89 89 GLY HA3 H 89 3.148 3.851 -0.703 1
1 542 . 10 1 1 A 90 90 GLY H H 90 7.228 7.387 -0.159 1
1 543 . 10 1 1 A 90 90 GLY HA2 H 90 4.290 4.044 0.246 1
1 544 . 10 1 1 A 90 90 GLY HA3 H 90 4.682 4.059 0.623 1
1 545 . 10 1 1 A 91 91 PRO HA H 91 4.902 4.849 0.053 1
1 552 . 10 1 1 A 92 92 THR H H 92 8.585 8.687 -0.102 1
1 553 . 10 1 1 A 92 92 THR HA H 92 5.701 5.151 0.550 1
1 559 . 10 1 1 A 93 93 PRO HA H 93 5.551 4.251 1.300 1
1 563 . 10 1 1 A 94 94 ILE H H 94 8.155 7.461 0.694 1
1 564 . 10 1 1 A 94 94 ILE HA H 94 4.794 4.308 0.486 1
1 571 . 10 1 1 A 95 95 ARG H H 95 9.538 8.988 0.550 1
1 572 . 10 1 1 A 95 95 ARG HA H 95 5.278 5.342 -0.064 1
1 576 . 10 1 1 A 96 96 VAL H H 96 9.276 8.838 0.438 1
1 577 . 10 1 1 A 96 96 VAL HA H 96 5.222 4.171 1.051 1
1 585 . 10 1 1 A 97 97 VAL H H 97 8.739 8.822 -0.083 1
1 586 . 10 1 1 A 97 97 VAL HA H 97 5.160 5.322 -0.162 1
1 594 . 10 1 1 A 98 98 TYR H H 98 8.596 8.630 -0.034 1
1 595 . 10 1 1 A 98 98 TYR HA H 98 5.266 5.225 0.041 1
1 603 . 10 1 1 A 99 99 ALA H H 99 9.685 8.754 0.931 1
1 604 . 10 1 1 A 99 99 ALA HA H 99 5.680 5.054 0.626 1
1 608 . 10 1 1 A 100 100 ASN H H 100 8.468 8.846 -0.378 1
1 609 . 10 1 1 A 100 100 ASN HA H 100 4.885 4.928 -0.043 1
1 614 . 10 1 1 A 101 101 SER H H 101 9.342 8.246 1.096 1
1 615 . 10 1 1 A 101 101 SER HA H 101 4.993 4.249 0.744 1
1 618 . 10 1 1 A 102 102 ARG H H 102 9.349 7.575 1.774 1
1 619 . 10 1 1 A 102 102 ARG HA H 102 4.068 4.593 -0.525 1
1 620 . 10 1 1 A 103 103 GLY H H 103 8.632 8.170 0.462 1
1 621 . 10 1 1 A 103 103 GLY HA2 H 103 3.691 3.941 -0.250 1
1 622 . 10 1 1 A 103 103 GLY HA3 H 103 4.341 3.947 0.394 1
1 623 . 10 1 1 A 104 104 ALA H H 104 7.820 7.554 0.266 1
1 624 . 10 1 1 A 104 104 ALA HA H 104 4.775 4.809 -0.034 1
1 628 . 10 1 1 A 105 105 VAL H H 105 8.402 8.397 0.005 1
1 629 . 10 1 1 A 105 105 VAL HA H 105 4.218 4.760 -0.542 1
1 637 . 10 1 1 A 106 106 GLN H H 106 9.352 8.081 1.271 1
1 638 . 10 1 1 A 106 106 GLN HA H 106 4.900 4.502 0.398 1
1 645 . 10 1 1 A 107 107 TYR H H 107 9.075 8.071 1.004 1
1 646 . 10 1 1 A 107 107 TYR HA H 107 4.007 4.104 -0.097 1
1 653 . 10 1 1 A 108 108 CYS H H 108 8.197 7.757 0.440 1
1 654 . 10 1 1 A 108 108 CYS HA H 108 4.823 4.059 0.764 1
1 657 . 10 1 1 A 109 109 GLY H H 109 6.856 6.732 0.124 1
1 658 . 10 1 1 A 109 109 GLY HA2 H 109 3.983 3.285 0.698 1
1 659 . 10 1 1 A 109 109 GLY HA3 H 109 4.422 3.297 1.125 1
1 660 . 10 1 1 A 110 110 VAL H H 110 9.418 8.347 1.071 1
1 661 . 10 1 1 A 110 110 VAL HA H 110 5.073 4.739 0.334 1
1 669 . 10 1 1 A 111 111 MET H H 111 9.327 9.394 -0.067 1
1 670 . 10 1 1 A 111 111 MET HA H 111 5.678 5.555 0.123 1
1 678 . 10 1 1 A 112 112 THR H H 112 9.310 8.940 0.370 1
1 679 . 10 1 1 A 112 112 THR HA H 112 5.726 4.553 1.173 1
1 685 . 10 1 1 A 113 113 HIS H H 113 8.960 8.490 0.470 1
1 686 . 10 1 1 A 113 113 HIS HA H 113 3.876 4.546 -0.670 1
1 691 . 10 1 1 A 114 114 SER H H 114 8.367 8.593 -0.226 1
1 692 . 10 1 1 A 114 114 SER HA H 114 4.024 4.182 -0.158 1
1 695 . 10 1 1 A 115 115 LYS H H 115 8.140 7.425 0.715 1
1 696 . 10 1 1 A 115 115 LYS HA H 115 5.403 4.410 0.993 1
1 699 . 10 1 1 A 116 116 VAL H H 116 8.525 8.215 0.310 1
1 700 . 10 1 1 A 116 116 VAL HA H 116 5.378 4.808 0.570 1
1 708 . 10 1 1 A 117 117 ASP H H 117 8.025 8.967 -0.942 1
1 709 . 10 1 1 A 117 117 ASP HA H 117 5.243 4.717 0.526 1
1 712 . 10 1 1 A 118 118 LYS H H 118 8.930 8.012 0.918 1
1 713 . 10 1 1 A 118 118 LYS HA H 118 4.216 4.590 -0.374 1
1 716 . 10 1 1 A 119 119 ASN H H 119 8.425 7.939 0.486 1
1 717 . 10 1 1 A 119 119 ASN HA H 119 5.061 4.770 0.291 1
1 722 . 10 1 1 A 120 120 ASN H H 120 8.061 8.159 -0.098 1
1 723 . 10 1 1 A 120 120 ASN HA H 120 4.212 4.523 -0.311 1
1 728 . 10 1 1 A 121 121 GLN H H 121 8.359 8.126 0.233 1
1 729 . 10 1 1 A 121 121 GLN HA H 121 4.373 4.178 0.195 1
1 735 . 10 1 1 A 122 122 GLY H H 122 8.770 7.498 1.272 1
1 736 . 10 1 1 A 122 122 GLY HA2 H 122 3.182 3.941 -0.759 1
1 737 . 10 1 1 A 122 122 GLY HA3 H 122 5.268 3.953 1.315 1
1 738 . 10 1 1 A 123 123 LYS H H 123 8.587 8.401 0.186 1
1 739 . 10 1 1 A 123 123 LYS HA H 123 4.016 4.363 -0.347 1
1 745 . 10 1 1 A 124 124 GLU H H 124 8.527 7.733 0.794 1
1 746 . 10 1 1 A 124 124 GLU HA H 124 4.152 4.465 -0.313 1
1 750 . 10 1 1 A 125 125 PHE H H 125 7.936 8.900 -0.964 1
1 751 . 10 1 1 A 125 125 PHE HA H 125 4.670 4.624 0.046 1
1 758 . 10 1 1 A 126 126 PHE H H 126 8.214 9.117 -0.903 1
1 759 . 10 1 1 A 126 126 PHE HA H 126 5.177 5.153 0.024 1
1 767 . 10 1 1 A 127 127 GLU H H 127 9.169 8.753 0.416 1
1 768 . 10 1 1 A 127 127 GLU HA H 127 4.852 4.620 0.232 1
1 773 . 10 1 1 A 128 128 LYS H H 128 9.000 8.364 0.636 1
1 774 . 10 1 1 A 128 128 LYS HA H 128 4.191 4.023 0.168 1
1 777 . 10 1 1 A 129 129 CYS H H 129 8.938 8.934 0.004 1
1 778 . 10 1 1 A 129 129 CYS HA H 129 5.268 4.586 0.682 1
1 5 . 11 1 1 A 2 2 PRO HA H 2 4.900 4.448 0.452 1
1 10 . 11 1 1 A 3 3 ILE H H 3 8.774 7.483 1.291 1
1 11 . 11 1 1 A 3 3 ILE HA H 3 5.499 4.606 0.893 1
1 20 . 11 1 1 A 4 4 VAL H H 4 9.501 9.159 0.342 1
1 21 . 11 1 1 A 4 4 VAL HA H 4 4.944 5.216 -0.272 1
1 29 . 11 1 1 A 5 5 THR H H 5 9.243 8.881 0.362 1
1 30 . 11 1 1 A 5 5 THR HA H 5 5.278 5.346 -0.068 1
1 35 . 11 1 1 A 6 6 CYS H H 6 9.815 9.066 0.749 1
1 36 . 11 1 1 A 6 6 CYS HA H 6 5.310 4.662 0.648 1
1 38 . 11 1 1 A 7 7 ARG H H 7 9.154 8.333 0.821 1
1 41 . 11 1 1 A 8 8 PRO HA H 8 4.594 4.547 0.047 1
1 47 . 11 1 1 A 9 9 LYS H H 9 8.179 8.430 -0.251 1
1 48 . 11 1 1 A 9 9 LYS HA H 9 4.857 4.784 0.073 1
1 52 . 11 1 1 A 10 10 LEU H H 10 9.108 8.726 0.382 1
1 53 . 11 1 1 A 10 10 LEU HA H 10 5.147 4.734 0.413 1
1 63 . 11 1 1 A 11 11 ASP H H 11 9.835 7.970 1.865 1
1 64 . 11 1 1 A 11 11 ASP HA H 11 4.471 4.671 -0.200 1
1 67 . 11 1 1 A 12 12 GLY H H 12 8.847 8.173 0.674 1
1 68 . 11 1 1 A 12 12 GLY HA2 H 12 3.782 3.856 -0.074 1
1 69 . 11 1 1 A 12 12 GLY HA3 H 12 4.427 3.859 0.568 1
1 70 . 11 1 1 A 13 13 ARG H H 13 7.933 7.689 0.244 1
1 71 . 11 1 1 A 13 13 ARG HA H 13 4.886 4.682 0.204 1
1 77 . 11 1 1 A 14 14 GLU H H 14 9.179 8.501 0.678 1
1 78 . 11 1 1 A 14 14 GLU HA H 14 4.178 4.835 -0.657 1
1 82 . 11 1 1 A 15 15 LYS H H 15 9.078 9.046 0.032 1
1 83 . 11 1 1 A 15 15 LYS HA H 15 4.890 4.806 0.084 1
1 84 . 11 1 1 A 16 16 PRO HA H 16 5.144 4.971 0.173 1
1 91 . 11 1 1 A 17 17 PHE H H 17 9.487 8.732 0.755 1
1 92 . 11 1 1 A 17 17 PHE HA H 17 4.760 4.596 0.164 1
1 100 . 11 1 1 A 18 18 LYS H H 18 9.315 8.638 0.677 1
1 101 . 11 1 1 A 18 18 LYS HA H 18 5.197 4.237 0.960 1
1 108 . 11 1 1 A 19 19 VAL H H 19 9.643 8.651 0.992 1
1 109 . 11 1 1 A 19 19 VAL HA H 19 4.796 4.972 -0.176 1
1 117 . 11 1 1 A 20 20 ASP H H 20 9.555 9.006 0.549 1
1 118 . 11 1 1 A 20 20 ASP HA H 20 5.151 5.052 0.099 1
1 121 . 11 1 1 A 21 21 VAL H H 21 9.607 8.595 1.012 1
1 122 . 11 1 1 A 21 21 VAL HA H 21 3.611 3.843 -0.232 1
1 130 . 11 1 1 A 22 22 ALA H H 22 8.531 7.744 0.787 1
1 131 . 11 1 1 A 22 22 ALA HA H 22 4.299 3.898 0.401 1
1 135 . 11 1 1 A 23 23 THR H H 23 7.294 8.177 -0.883 1
1 136 . 11 1 1 A 23 23 THR HA H 23 4.264 3.818 0.446 1
1 141 . 11 1 1 A 24 24 ALA H H 24 8.346 8.248 0.098 1
1 142 . 11 1 1 A 24 24 ALA HA H 24 4.082 4.107 -0.025 1
1 146 . 11 1 1 A 25 25 GLN H H 25 8.866 8.459 0.407 1
1 147 . 11 1 1 A 25 25 GLN HA H 25 3.804 3.909 -0.105 1
1 153 . 11 1 1 A 26 26 ALA H H 26 7.767 8.218 -0.451 1
1 154 . 11 1 1 A 26 26 ALA HA H 26 4.208 4.000 0.208 1
1 158 . 11 1 1 A 27 27 GLN H H 27 8.881 7.966 0.915 1
1 159 . 11 1 1 A 27 27 GLN HA H 27 4.041 3.995 0.046 1
1 165 . 11 1 1 A 28 28 ALA H H 28 8.142 8.223 -0.081 1
1 166 . 11 1 1 A 28 28 ALA HA H 28 3.475 3.635 -0.160 1
1 170 . 11 1 1 A 29 29 ARG H H 29 7.291 7.793 -0.502 1
1 171 . 11 1 1 A 29 29 ARG HA H 29 3.688 3.782 -0.094 1
1 174 . 11 1 1 A 30 30 LYS H H 30 7.768 7.835 -0.067 1
1 175 . 11 1 1 A 30 30 LYS HA H 30 4.038 3.872 0.166 1
1 179 . 11 1 1 A 31 31 ALA H H 31 8.127 7.311 0.816 1
1 180 . 11 1 1 A 31 31 ALA HA H 31 3.656 3.927 -0.271 1
1 184 . 11 1 1 A 32 32 GLY H H 32 7.670 7.755 -0.085 1
1 185 . 11 1 1 A 32 32 GLY HA2 H 32 3.380 3.808 -0.428 1
1 186 . 11 1 1 A 32 32 GLY HA3 H 32 3.844 3.825 0.019 1
1 187 . 11 1 1 A 33 33 LEU H H 33 8.057 8.164 -0.107 1
1 188 . 11 1 1 A 33 33 LEU HA H 33 3.259 3.107 0.152 1
1 197 . 11 1 1 A 34 34 THR H H 34 6.862 7.133 -0.271 1
1 198 . 11 1 1 A 34 34 THR HA H 34 4.738 4.933 -0.195 1
1 203 . 11 1 1 A 35 35 THR H H 35 9.161 9.066 0.095 1
1 204 . 11 1 1 A 35 35 THR HA H 35 4.247 5.225 -0.978 1
1 209 . 11 1 1 A 36 36 GLY H H 36 8.407 8.457 -0.050 1
1 210 . 11 1 1 A 36 36 GLY HA2 H 36 4.349 4.022 0.327 1
1 211 . 11 1 1 A 36 36 GLY HA3 H 36 4.967 4.029 0.938 1
1 212 . 11 1 1 A 37 37 LYS H H 37 10.152 8.219 1.933 1
1 213 . 11 1 1 A 37 37 LYS HA H 37 4.383 4.097 0.286 1
1 221 . 11 1 1 A 38 38 SER H H 38 9.085 8.108 0.977 1
1 222 . 11 1 1 A 38 38 SER HA H 38 4.338 4.718 -0.380 1
1 226 . 11 1 1 A 39 39 GLY H H 39 8.474 7.716 0.758 1
1 227 . 11 1 1 A 39 39 GLY HA2 H 39 3.840 4.115 -0.275 1
1 228 . 11 1 1 A 40 40 ASP H H 40 9.424 7.741 1.683 1
1 229 . 11 1 1 A 40 40 ASP HA H 40 5.374 4.691 0.683 1
1 231 . 11 1 1 A 41 41 PRO HA H 41 5.624 4.589 1.035 1
1 238 . 11 1 1 A 42 42 HIS H H 42 8.343 8.688 -0.345 1
1 239 . 11 1 1 A 42 42 HIS HA H 42 5.189 5.217 -0.028 1
1 244 . 11 1 1 A 43 43 ARG H H 43 8.634 8.245 0.389 1
1 245 . 11 1 1 A 43 43 ARG HA H 43 3.654 3.293 0.361 1
1 252 . 11 1 1 A 44 44 TYR H H 44 8.188 8.702 -0.514 1
1 253 . 11 1 1 A 44 44 TYR HA H 44 5.021 4.842 0.179 1
1 260 . 11 1 1 A 45 45 PHE H H 45 8.728 8.510 0.218 1
1 261 . 11 1 1 A 45 45 PHE HA H 45 4.480 5.231 -0.751 1
1 268 . 11 1 1 A 46 46 ALA H H 46 5.979 8.248 -2.269 1
1 269 . 11 1 1 A 46 46 ALA HA H 46 3.797 4.250 -0.453 1
1 273 . 11 1 1 A 47 47 GLY H H 47 8.510 8.408 0.102 1
1 274 . 11 1 1 A 47 47 GLY HA2 H 47 3.953 4.235 -0.282 1
1 275 . 11 1 1 A 47 47 GLY HA3 H 47 4.075 4.265 -0.190 1
1 276 . 11 1 1 A 48 48 ASP H H 48 7.504 8.034 -0.530 1
1 277 . 11 1 1 A 48 48 ASP HA H 48 5.020 4.862 0.158 1
1 280 . 11 1 1 A 49 49 HIS H H 49 8.240 8.310 -0.070 1
1 281 . 11 1 1 A 49 49 HIS HA H 49 4.373 4.166 0.207 1
1 285 . 11 1 1 A 50 50 ILE H H 50 8.468 7.919 0.549 1
1 286 . 11 1 1 A 50 50 ILE HA H 50 3.651 4.145 -0.494 1
1 296 . 11 1 1 A 51 51 ARG H H 51 8.404 8.401 0.003 1
1 297 . 11 1 1 A 51 51 ARG HA H 51 4.450 4.191 0.259 1
1 303 . 11 1 1 A 52 52 TRP H H 52 11.176 7.841 3.335 1
1 304 . 11 1 1 A 52 52 TRP HA H 52 4.423 4.225 0.198 1
1 312 . 11 1 1 A 53 53 GLY H H 53 10.422 8.747 1.675 1
1 313 . 11 1 1 A 53 53 GLY HA2 H 53 3.832 3.910 -0.078 1
1 314 . 11 1 1 A 53 53 GLY HA3 H 53 4.411 3.931 0.480 1
1 315 . 11 1 1 A 54 54 VAL H H 54 7.040 7.521 -0.481 1
1 316 . 11 1 1 A 54 54 VAL HA H 54 4.489 4.656 -0.167 1
1 324 . 11 1 1 A 55 55 ASN H H 55 9.530 8.958 0.572 1
1 325 . 11 1 1 A 55 55 ASN HA H 55 4.569 4.527 0.042 1
1 330 . 11 1 1 A 56 56 ASN H H 56 9.175 8.446 0.729 1
1 331 . 11 1 1 A 56 56 ASN HA H 56 4.649 4.318 0.331 1
1 336 . 11 1 1 A 57 57 CYS H H 57 7.613 8.218 -0.605 1
1 337 . 11 1 1 A 57 57 CYS HA H 57 4.645 4.398 0.247 1
1 340 . 11 1 1 A 58 58 ASP H H 58 7.626 7.970 -0.344 1
1 341 . 11 1 1 A 58 58 ASP HA H 58 5.206 4.319 0.887 1
1 344 . 11 1 1 A 59 59 LYS H H 59 7.349 7.289 0.060 1
1 345 . 11 1 1 A 59 59 LYS HA H 59 4.548 4.272 0.276 1
1 350 . 11 1 1 A 60 60 ALA H H 60 9.155 8.391 0.764 1
1 351 . 11 1 1 A 60 60 ALA HA H 60 4.330 4.107 0.223 1
1 355 . 11 1 1 A 61 61 ASP H H 61 8.548 7.860 0.688 1
1 356 . 11 1 1 A 61 61 ASP HA H 61 4.827 4.846 -0.019 1
1 359 . 11 1 1 A 62 62 ALA H H 62 7.463 7.149 0.314 1
1 360 . 11 1 1 A 62 62 ALA HA H 62 4.217 4.338 -0.121 1
1 364 . 11 1 1 A 63 63 ILE H H 63 9.302 8.599 0.703 1
1 365 . 11 1 1 A 63 63 ILE HA H 63 4.332 4.691 -0.359 1
1 374 . 11 1 1 A 64 64 LEU H H 64 8.724 9.089 -0.365 1
1 375 . 11 1 1 A 64 64 LEU HA H 64 5.463 5.223 0.240 1
1 385 . 11 1 1 A 65 65 TRP H H 65 9.621 8.584 1.037 1
1 386 . 11 1 1 A 65 65 TRP HA H 65 4.605 5.221 -0.616 1
1 395 . 11 1 1 A 66 66 GLU H H 66 8.388 9.036 -0.648 1
1 396 . 11 1 1 A 66 66 GLU HA H 66 6.014 5.766 0.248 1
1 401 . 11 1 1 A 67 67 TYR H H 67 8.766 9.162 -0.396 1
1 402 . 11 1 1 A 67 67 TYR HA H 67 5.204 5.080 0.124 1
1 405 . 11 1 1 A 68 68 PRO HA H 68 4.523 4.380 0.143 1
1 412 . 11 1 1 A 69 69 ILE H H 69 7.308 7.903 -0.595 1
1 413 . 11 1 1 A 69 69 ILE HA H 69 4.870 4.923 -0.053 1
1 414 . 11 1 1 A 70 70 TYR H H 70 9.219 8.978 0.241 1
1 415 . 11 1 1 A 70 70 TYR HA H 70 4.854 4.803 0.051 1
1 423 . 11 1 1 A 71 71 TRP H H 71 6.662 8.211 -1.549 1
1 424 . 11 1 1 A 71 71 TRP HA H 71 5.496 4.906 0.590 1
1 432 . 11 1 1 A 72 72 VAL H H 72 9.510 9.018 0.492 1
1 433 . 11 1 1 A 72 72 VAL HA H 72 3.999 3.934 0.065 1
1 441 . 11 1 1 A 73 73 GLY H H 73 9.221 8.528 0.693 1
1 442 . 11 1 1 A 73 73 GLY HA2 H 73 3.877 3.873 0.004 1
1 443 . 11 1 1 A 73 73 GLY HA3 H 73 4.682 3.920 0.762 1
1 444 . 11 1 1 A 74 74 LYS H H 74 7.962 7.447 0.515 1
1 445 . 11 1 1 A 74 74 LYS HA H 74 4.469 4.407 0.062 1
1 457 . 11 1 1 A 75 75 ASN H H 75 8.928 9.104 -0.176 1
1 458 . 11 1 1 A 75 75 ASN HA H 75 4.837 4.851 -0.014 1
1 463 . 11 1 1 A 76 76 ALA H H 76 7.544 7.567 -0.023 1
1 464 . 11 1 1 A 76 76 ALA HA H 76 4.555 4.147 0.408 1
1 468 . 11 1 1 A 77 77 GLU H H 77 8.290 8.304 -0.014 1
1 469 . 11 1 1 A 77 77 GLU HA H 77 4.900 3.800 1.100 1
1 474 . 11 1 1 A 78 78 TRP H H 78 10.065 8.870 1.195 1
1 475 . 11 1 1 A 78 78 TRP HA H 78 4.600 5.157 -0.557 1
1 484 . 11 1 1 A 79 79 ALA H H 79 9.850 8.038 1.812 1
1 485 . 11 1 1 A 79 79 ALA HA H 79 5.022 4.819 0.203 1
1 489 . 11 1 1 A 80 80 LYS H H 80 9.255 8.684 0.571 1
1 490 . 11 1 1 A 80 80 LYS HA H 80 4.511 4.536 -0.025 1
1 494 . 11 1 1 A 81 81 ASP H H 81 9.332 8.245 1.087 1
1 495 . 11 1 1 A 81 81 ASP HA H 81 5.429 4.735 0.694 1
1 498 . 11 1 1 A 82 82 VAL H H 82 7.226 7.171 0.055 1
1 499 . 11 1 1 A 82 82 VAL HA H 82 4.248 4.643 -0.395 1
1 507 . 11 1 1 A 83 83 LYS H H 83 8.407 8.684 -0.277 1
1 508 . 11 1 1 A 83 83 LYS HA H 83 4.356 4.617 -0.261 1
1 510 . 11 1 1 A 84 84 THR H H 84 9.088 9.004 0.084 1
1 511 . 11 1 1 A 84 84 THR HA H 84 3.989 4.118 -0.129 1
1 516 . 11 1 1 A 85 85 SER H H 85 8.391 8.240 0.151 1
1 517 . 11 1 1 A 85 85 SER HA H 85 4.442 4.015 0.427 1
1 520 . 11 1 1 A 86 86 GLN H H 86 7.974 8.129 -0.155 1
1 521 . 11 1 1 A 86 86 GLN HA H 86 4.585 3.945 0.640 1
1 527 . 11 1 1 A 87 87 GLN H H 87 7.083 7.734 -0.651 1
1 528 . 11 1 1 A 87 87 GLN HA H 87 3.903 3.798 0.105 1
1 534 . 11 1 1 A 88 88 LYS H H 88 9.453 8.462 0.991 1
1 535 . 11 1 1 A 88 88 LYS HA H 88 4.114 4.532 -0.418 1
1 539 . 11 1 1 A 89 89 GLY H H 89 9.466 8.299 1.167 1
1 540 . 11 1 1 A 89 89 GLY HA2 H 89 3.965 4.081 -0.116 1
1 541 . 11 1 1 A 89 89 GLY HA3 H 89 3.148 4.095 -0.947 1
1 542 . 11 1 1 A 90 90 GLY H H 90 7.228 7.376 -0.148 1
1 543 . 11 1 1 A 90 90 GLY HA2 H 90 4.290 4.089 0.201 1
1 544 . 11 1 1 A 90 90 GLY HA3 H 90 4.682 4.094 0.588 1
1 545 . 11 1 1 A 91 91 PRO HA H 91 4.902 4.864 0.038 1
1 552 . 11 1 1 A 92 92 THR H H 92 8.585 8.606 -0.021 1
1 553 . 11 1 1 A 92 92 THR HA H 92 5.701 4.909 0.792 1
1 559 . 11 1 1 A 93 93 PRO HA H 93 5.551 4.283 1.268 1
1 563 . 11 1 1 A 94 94 ILE H H 94 8.155 7.546 0.609 1
1 564 . 11 1 1 A 94 94 ILE HA H 94 4.794 4.331 0.463 1
1 571 . 11 1 1 A 95 95 ARG H H 95 9.538 8.999 0.539 1
1 572 . 11 1 1 A 95 95 ARG HA H 95 5.278 5.272 0.006 1
1 576 . 11 1 1 A 96 96 VAL H H 96 9.276 8.985 0.291 1
1 577 . 11 1 1 A 96 96 VAL HA H 96 5.222 4.254 0.968 1
1 585 . 11 1 1 A 97 97 VAL H H 97 8.739 8.730 0.009 1
1 586 . 11 1 1 A 97 97 VAL HA H 97 5.160 5.254 -0.094 1
1 594 . 11 1 1 A 98 98 TYR H H 98 8.596 8.559 0.037 1
1 595 . 11 1 1 A 98 98 TYR HA H 98 5.266 5.067 0.199 1
1 603 . 11 1 1 A 99 99 ALA H H 99 9.685 8.588 1.097 1
1 604 . 11 1 1 A 99 99 ALA HA H 99 5.680 4.747 0.933 1
1 608 . 11 1 1 A 100 100 ASN H H 100 8.468 8.910 -0.442 1
1 609 . 11 1 1 A 100 100 ASN HA H 100 4.885 4.866 0.019 1
1 614 . 11 1 1 A 101 101 SER H H 101 9.342 8.295 1.047 1
1 615 . 11 1 1 A 101 101 SER HA H 101 4.993 4.985 0.008 1
1 618 . 11 1 1 A 102 102 ARG H H 102 9.349 9.085 0.264 1
1 619 . 11 1 1 A 102 102 ARG HA H 102 4.068 3.985 0.083 1
1 620 . 11 1 1 A 103 103 GLY H H 103 8.632 8.519 0.113 1
1 621 . 11 1 1 A 103 103 GLY HA2 H 103 3.691 3.836 -0.145 1
1 622 . 11 1 1 A 103 103 GLY HA3 H 103 4.341 3.854 0.487 1
1 623 . 11 1 1 A 104 104 ALA H H 104 7.820 7.751 0.069 1
1 624 . 11 1 1 A 104 104 ALA HA H 104 4.775 4.265 0.510 1
1 628 . 11 1 1 A 105 105 VAL H H 105 8.402 8.427 -0.025 1
1 629 . 11 1 1 A 105 105 VAL HA H 105 4.218 4.220 -0.002 1
1 637 . 11 1 1 A 106 106 GLN H H 106 9.352 8.523 0.829 1
1 638 . 11 1 1 A 106 106 GLN HA H 106 4.900 4.506 0.394 1
1 645 . 11 1 1 A 107 107 TYR H H 107 9.075 8.083 0.992 1
1 646 . 11 1 1 A 107 107 TYR HA H 107 4.007 4.115 -0.108 1
1 653 . 11 1 1 A 108 108 CYS H H 108 8.197 7.745 0.452 1
1 654 . 11 1 1 A 108 108 CYS HA H 108 4.823 4.078 0.745 1
1 657 . 11 1 1 A 109 109 GLY H H 109 6.856 6.742 0.114 1
1 658 . 11 1 1 A 109 109 GLY HA2 H 109 3.983 3.279 0.704 1
1 659 . 11 1 1 A 109 109 GLY HA3 H 109 4.422 3.304 1.118 1
1 660 . 11 1 1 A 110 110 VAL H H 110 9.418 8.324 1.094 1
1 661 . 11 1 1 A 110 110 VAL HA H 110 5.073 4.800 0.273 1
1 669 . 11 1 1 A 111 111 MET H H 111 9.327 9.513 -0.186 1
1 670 . 11 1 1 A 111 111 MET HA H 111 5.678 5.581 0.097 1
1 678 . 11 1 1 A 112 112 THR H H 112 9.310 9.029 0.281 1
1 679 . 11 1 1 A 112 112 THR HA H 112 5.726 4.611 1.115 1
1 685 . 11 1 1 A 113 113 HIS H H 113 8.960 8.256 0.704 1
1 686 . 11 1 1 A 113 113 HIS HA H 113 3.876 4.469 -0.593 1
1 691 . 11 1 1 A 114 114 SER H H 114 8.367 8.712 -0.345 1
1 692 . 11 1 1 A 114 114 SER HA H 114 4.024 4.261 -0.237 1
1 695 . 11 1 1 A 115 115 LYS H H 115 8.140 7.540 0.600 1
1 696 . 11 1 1 A 115 115 LYS HA H 115 5.403 4.274 1.129 1
1 699 . 11 1 1 A 116 116 VAL H H 116 8.525 8.462 0.063 1
1 700 . 11 1 1 A 116 116 VAL HA H 116 5.378 4.842 0.536 1
1 708 . 11 1 1 A 117 117 ASP H H 117 8.025 8.775 -0.750 1
1 709 . 11 1 1 A 117 117 ASP HA H 117 5.243 4.749 0.494 1
1 712 . 11 1 1 A 118 118 LYS H H 118 8.930 8.243 0.687 1
1 713 . 11 1 1 A 118 118 LYS HA H 118 4.216 4.453 -0.237 1
1 716 . 11 1 1 A 119 119 ASN H H 119 8.425 8.147 0.278 1
1 717 . 11 1 1 A 119 119 ASN HA H 119 5.061 4.711 0.350 1
1 722 . 11 1 1 A 120 120 ASN H H 120 8.061 8.078 -0.017 1
1 723 . 11 1 1 A 120 120 ASN HA H 120 4.212 4.549 -0.337 1
1 728 . 11 1 1 A 121 121 GLN H H 121 8.359 8.528 -0.169 1
1 729 . 11 1 1 A 121 121 GLN HA H 121 4.373 4.181 0.192 1
1 735 . 11 1 1 A 122 122 GLY H H 122 8.770 7.795 0.975 1
1 736 . 11 1 1 A 122 122 GLY HA2 H 122 3.182 3.988 -0.806 1
1 737 . 11 1 1 A 122 122 GLY HA3 H 122 5.268 3.996 1.272 1
1 738 . 11 1 1 A 123 123 LYS H H 123 8.587 8.446 0.141 1
1 739 . 11 1 1 A 123 123 LYS HA H 123 4.016 4.366 -0.350 1
1 745 . 11 1 1 A 124 124 GLU H H 124 8.527 7.670 0.857 1
1 746 . 11 1 1 A 124 124 GLU HA H 124 4.152 4.391 -0.239 1
1 750 . 11 1 1 A 125 125 PHE H H 125 7.936 8.746 -0.810 1
1 751 . 11 1 1 A 125 125 PHE HA H 125 4.670 4.467 0.203 1
1 758 . 11 1 1 A 126 126 PHE H H 126 8.214 9.008 -0.794 1
1 759 . 11 1 1 A 126 126 PHE HA H 126 5.177 4.599 0.578 1
1 767 . 11 1 1 A 127 127 GLU H H 127 9.169 8.671 0.498 1
1 768 . 11 1 1 A 127 127 GLU HA H 127 4.852 4.553 0.299 1
1 773 . 11 1 1 A 128 128 LYS H H 128 9.000 8.353 0.647 1
1 774 . 11 1 1 A 128 128 LYS HA H 128 4.191 3.831 0.360 1
1 777 . 11 1 1 A 129 129 CYS H H 129 8.938 8.944 -0.006 1
1 778 . 11 1 1 A 129 129 CYS HA H 129 5.268 4.567 0.701 1
1 5 . 12 1 1 A 2 2 PRO HA H 2 4.900 4.468 0.432 1
1 10 . 12 1 1 A 3 3 ILE H H 3 8.774 7.470 1.304 1
1 11 . 12 1 1 A 3 3 ILE HA H 3 5.499 4.827 0.672 1
1 20 . 12 1 1 A 4 4 VAL H H 4 9.501 9.213 0.288 1
1 21 . 12 1 1 A 4 4 VAL HA H 4 4.944 4.959 -0.015 1
1 29 . 12 1 1 A 5 5 THR H H 5 9.243 8.944 0.299 1
1 30 . 12 1 1 A 5 5 THR HA H 5 5.278 5.306 -0.028 1
1 35 . 12 1 1 A 6 6 CYS H H 6 9.815 9.203 0.612 1
1 36 . 12 1 1 A 6 6 CYS HA H 6 5.310 4.670 0.640 1
1 38 . 12 1 1 A 7 7 ARG H H 7 9.154 8.379 0.775 1
1 41 . 12 1 1 A 8 8 PRO HA H 8 4.594 4.574 0.020 1
1 47 . 12 1 1 A 9 9 LYS H H 9 8.179 8.385 -0.206 1
1 48 . 12 1 1 A 9 9 LYS HA H 9 4.857 4.846 0.011 1
1 52 . 12 1 1 A 10 10 LEU H H 10 9.108 8.374 0.734 1
1 53 . 12 1 1 A 10 10 LEU HA H 10 5.147 4.735 0.412 1
1 63 . 12 1 1 A 11 11 ASP H H 11 9.835 8.206 1.629 1
1 64 . 12 1 1 A 11 11 ASP HA H 11 4.471 4.824 -0.353 1
1 67 . 12 1 1 A 12 12 GLY H H 12 8.847 8.012 0.835 1
1 68 . 12 1 1 A 12 12 GLY HA2 H 12 3.782 3.947 -0.165 1
1 69 . 12 1 1 A 12 12 GLY HA3 H 12 4.427 3.954 0.473 1
1 70 . 12 1 1 A 13 13 ARG H H 13 7.933 7.710 0.223 1
1 71 . 12 1 1 A 13 13 ARG HA H 13 4.886 4.557 0.329 1
1 77 . 12 1 1 A 14 14 GLU H H 14 9.179 8.494 0.685 1
1 78 . 12 1 1 A 14 14 GLU HA H 14 4.178 4.536 -0.358 1
1 82 . 12 1 1 A 15 15 LYS H H 15 9.078 8.784 0.294 1
1 83 . 12 1 1 A 15 15 LYS HA H 15 4.890 4.753 0.137 1
1 84 . 12 1 1 A 16 16 PRO HA H 16 5.144 4.961 0.183 1
1 91 . 12 1 1 A 17 17 PHE H H 17 9.487 8.690 0.797 1
1 92 . 12 1 1 A 17 17 PHE HA H 17 4.760 4.845 -0.085 1
1 100 . 12 1 1 A 18 18 LYS H H 18 9.315 8.789 0.526 1
1 101 . 12 1 1 A 18 18 LYS HA H 18 5.197 4.367 0.830 1
1 108 . 12 1 1 A 19 19 VAL H H 19 9.643 8.759 0.884 1
1 109 . 12 1 1 A 19 19 VAL HA H 19 4.796 4.694 0.102 1
1 117 . 12 1 1 A 20 20 ASP H H 20 9.555 8.697 0.858 1
1 118 . 12 1 1 A 20 20 ASP HA H 20 5.151 5.244 -0.093 1
1 121 . 12 1 1 A 21 21 VAL H H 21 9.607 8.797 0.810 1
1 122 . 12 1 1 A 21 21 VAL HA H 21 3.611 3.867 -0.256 1
1 130 . 12 1 1 A 22 22 ALA H H 22 8.531 8.314 0.217 1
1 131 . 12 1 1 A 22 22 ALA HA H 22 4.299 3.889 0.410 1
1 135 . 12 1 1 A 23 23 THR H H 23 7.294 8.245 -0.951 1
1 136 . 12 1 1 A 23 23 THR HA H 23 4.264 3.848 0.416 1
1 141 . 12 1 1 A 24 24 ALA H H 24 8.346 8.256 0.090 1
1 142 . 12 1 1 A 24 24 ALA HA H 24 4.082 4.054 0.028 1
1 146 . 12 1 1 A 25 25 GLN H H 25 8.866 8.329 0.537 1
1 147 . 12 1 1 A 25 25 GLN HA H 25 3.804 3.885 -0.081 1
1 153 . 12 1 1 A 26 26 ALA H H 26 7.767 8.301 -0.534 1
1 154 . 12 1 1 A 26 26 ALA HA H 26 4.208 4.017 0.191 1
1 158 . 12 1 1 A 27 27 GLN H H 27 8.881 8.287 0.594 1
1 159 . 12 1 1 A 27 27 GLN HA H 27 4.041 3.871 0.170 1
1 165 . 12 1 1 A 28 28 ALA H H 28 8.142 8.075 0.067 1
1 166 . 12 1 1 A 28 28 ALA HA H 28 3.475 3.499 -0.024 1
1 170 . 12 1 1 A 29 29 ARG H H 29 7.291 7.615 -0.324 1
1 171 . 12 1 1 A 29 29 ARG HA H 29 3.688 3.843 -0.155 1
1 174 . 12 1 1 A 30 30 LYS H H 30 7.768 7.925 -0.157 1
1 175 . 12 1 1 A 30 30 LYS HA H 30 4.038 3.943 0.095 1
1 179 . 12 1 1 A 31 31 ALA H H 31 8.127 7.726 0.401 1
1 180 . 12 1 1 A 31 31 ALA HA H 31 3.656 3.966 -0.310 1
1 184 . 12 1 1 A 32 32 GLY H H 32 7.670 7.621 0.049 1
1 185 . 12 1 1 A 32 32 GLY HA2 H 32 3.380 3.853 -0.473 1
1 186 . 12 1 1 A 32 32 GLY HA3 H 32 3.844 3.870 -0.026 1
1 187 . 12 1 1 A 33 33 LEU H H 33 8.057 8.149 -0.092 1
1 188 . 12 1 1 A 33 33 LEU HA H 33 3.259 3.105 0.154 1
1 197 . 12 1 1 A 34 34 THR H H 34 6.862 6.928 -0.066 1
1 198 . 12 1 1 A 34 34 THR HA H 34 4.738 4.755 -0.017 1
1 203 . 12 1 1 A 35 35 THR H H 35 9.161 8.982 0.179 1
1 204 . 12 1 1 A 35 35 THR HA H 35 4.247 5.254 -1.007 1
1 209 . 12 1 1 A 36 36 GLY H H 36 8.407 8.607 -0.200 1
1 210 . 12 1 1 A 36 36 GLY HA2 H 36 4.349 4.138 0.211 1
1 211 . 12 1 1 A 36 36 GLY HA3 H 36 4.967 4.142 0.825 1
1 212 . 12 1 1 A 37 37 LYS H H 37 10.152 7.793 2.359 1
1 213 . 12 1 1 A 37 37 LYS HA H 37 4.383 4.579 -0.196 1
1 221 . 12 1 1 A 38 38 SER H H 38 9.085 8.285 0.800 1
1 222 . 12 1 1 A 38 38 SER HA H 38 4.338 4.737 -0.399 1
1 226 . 12 1 1 A 39 39 GLY H H 39 8.474 7.630 0.844 1
1 227 . 12 1 1 A 39 39 GLY HA2 H 39 3.840 4.198 -0.358 1
1 228 . 12 1 1 A 40 40 ASP H H 40 9.424 7.742 1.682 1
1 229 . 12 1 1 A 40 40 ASP HA H 40 5.374 4.717 0.657 1
1 231 . 12 1 1 A 41 41 PRO HA H 41 5.624 4.534 1.090 1
1 238 . 12 1 1 A 42 42 HIS H H 42 8.343 8.632 -0.289 1
1 239 . 12 1 1 A 42 42 HIS HA H 42 5.189 5.144 0.045 1
1 244 . 12 1 1 A 43 43 ARG H H 43 8.634 8.219 0.415 1
1 245 . 12 1 1 A 43 43 ARG HA H 43 3.654 3.243 0.411 1
1 252 . 12 1 1 A 44 44 TYR H H 44 8.188 8.612 -0.424 1
1 253 . 12 1 1 A 44 44 TYR HA H 44 5.021 4.284 0.737 1
1 260 . 12 1 1 A 45 45 PHE H H 45 8.728 7.920 0.808 1
1 261 . 12 1 1 A 45 45 PHE HA H 45 4.480 4.853 -0.373 1
1 268 . 12 1 1 A 46 46 ALA H H 46 5.979 8.063 -2.084 1
1 269 . 12 1 1 A 46 46 ALA HA H 46 3.797 4.131 -0.334 1
1 273 . 12 1 1 A 47 47 GLY H H 47 8.510 7.563 0.947 1
1 274 . 12 1 1 A 47 47 GLY HA2 H 47 3.953 3.767 0.186 1
1 275 . 12 1 1 A 47 47 GLY HA3 H 47 4.075 3.821 0.254 1
1 276 . 12 1 1 A 48 48 ASP H H 48 7.504 7.448 0.056 1
1 277 . 12 1 1 A 48 48 ASP HA H 48 5.020 4.738 0.282 1
1 280 . 12 1 1 A 49 49 HIS H H 49 8.240 8.047 0.193 1
1 281 . 12 1 1 A 49 49 HIS HA H 49 4.373 4.160 0.213 1
1 285 . 12 1 1 A 50 50 ILE H H 50 8.468 7.978 0.490 1
1 286 . 12 1 1 A 50 50 ILE HA H 50 3.651 4.204 -0.553 1
1 296 . 12 1 1 A 51 51 ARG H H 51 8.404 8.635 -0.231 1
1 297 . 12 1 1 A 51 51 ARG HA H 51 4.450 4.883 -0.433 1
1 303 . 12 1 1 A 52 52 TRP H H 52 11.176 8.702 2.474 1
1 304 . 12 1 1 A 52 52 TRP HA H 52 4.423 4.671 -0.248 1
1 312 . 12 1 1 A 53 53 GLY H H 53 10.422 8.070 2.352 1
1 313 . 12 1 1 A 53 53 GLY HA2 H 53 3.832 4.003 -0.171 1
1 314 . 12 1 1 A 53 53 GLY HA3 H 53 4.411 4.034 0.377 1
1 315 . 12 1 1 A 54 54 VAL H H 54 7.040 7.661 -0.621 1
1 316 . 12 1 1 A 54 54 VAL HA H 54 4.489 3.992 0.497 1
1 324 . 12 1 1 A 55 55 ASN H H 55 9.530 8.867 0.663 1
1 325 . 12 1 1 A 55 55 ASN HA H 55 4.569 4.473 0.096 1
1 330 . 12 1 1 A 56 56 ASN H H 56 9.175 8.187 0.988 1
1 331 . 12 1 1 A 56 56 ASN HA H 56 4.649 4.370 0.279 1
1 336 . 12 1 1 A 57 57 CYS H H 57 7.613 8.359 -0.746 1
1 337 . 12 1 1 A 57 57 CYS HA H 57 4.645 4.247 0.398 1
1 340 . 12 1 1 A 58 58 ASP H H 58 7.626 8.901 -1.275 1
1 341 . 12 1 1 A 58 58 ASP HA H 58 5.206 4.382 0.824 1
1 344 . 12 1 1 A 59 59 LYS H H 59 7.349 7.715 -0.366 1
1 345 . 12 1 1 A 59 59 LYS HA H 59 4.548 4.342 0.206 1
1 350 . 12 1 1 A 60 60 ALA H H 60 9.155 8.820 0.335 1
1 351 . 12 1 1 A 60 60 ALA HA H 60 4.330 4.206 0.124 1
1 355 . 12 1 1 A 61 61 ASP H H 61 8.548 8.317 0.231 1
1 356 . 12 1 1 A 61 61 ASP HA H 61 4.827 4.356 0.471 1
1 359 . 12 1 1 A 62 62 ALA H H 62 7.463 7.456 0.007 1
1 360 . 12 1 1 A 62 62 ALA HA H 62 4.217 4.278 -0.061 1
1 364 . 12 1 1 A 63 63 ILE H H 63 9.302 8.591 0.711 1
1 365 . 12 1 1 A 63 63 ILE HA H 63 4.332 4.578 -0.246 1
1 374 . 12 1 1 A 64 64 LEU H H 64 8.724 9.092 -0.368 1
1 375 . 12 1 1 A 64 64 LEU HA H 64 5.463 5.092 0.371 1
1 385 . 12 1 1 A 65 65 TRP H H 65 9.621 8.483 1.138 1
1 386 . 12 1 1 A 65 65 TRP HA H 65 4.605 5.330 -0.725 1
1 395 . 12 1 1 A 66 66 GLU H H 66 8.388 9.047 -0.659 1
1 396 . 12 1 1 A 66 66 GLU HA H 66 6.014 5.618 0.396 1
1 401 . 12 1 1 A 67 67 TYR H H 67 8.766 9.155 -0.389 1
1 402 . 12 1 1 A 67 67 TYR HA H 67 5.204 5.149 0.055 1
1 405 . 12 1 1 A 68 68 PRO HA H 68 4.523 4.408 0.115 1
1 412 . 12 1 1 A 69 69 ILE H H 69 7.308 7.945 -0.637 1
1 413 . 12 1 1 A 69 69 ILE HA H 69 4.870 5.122 -0.252 1
1 414 . 12 1 1 A 70 70 TYR H H 70 9.219 9.009 0.210 1
1 415 . 12 1 1 A 70 70 TYR HA H 70 4.854 4.744 0.110 1
1 423 . 12 1 1 A 71 71 TRP H H 71 6.662 8.250 -1.588 1
1 424 . 12 1 1 A 71 71 TRP HA H 71 5.496 4.906 0.590 1
1 432 . 12 1 1 A 72 72 VAL H H 72 9.510 9.092 0.418 1
1 433 . 12 1 1 A 72 72 VAL HA H 72 3.999 3.971 0.028 1
1 441 . 12 1 1 A 73 73 GLY H H 73 9.221 8.660 0.561 1
1 442 . 12 1 1 A 73 73 GLY HA2 H 73 3.877 3.941 -0.064 1
1 443 . 12 1 1 A 73 73 GLY HA3 H 73 4.682 3.993 0.689 1
1 444 . 12 1 1 A 74 74 LYS H H 74 7.962 7.637 0.325 1
1 445 . 12 1 1 A 74 74 LYS HA H 74 4.469 4.619 -0.150 1
1 457 . 12 1 1 A 75 75 ASN H H 75 8.928 8.803 0.125 1
1 458 . 12 1 1 A 75 75 ASN HA H 75 4.837 5.085 -0.248 1
1 463 . 12 1 1 A 76 76 ALA H H 76 7.544 7.744 -0.200 1
1 464 . 12 1 1 A 76 76 ALA HA H 76 4.555 4.852 -0.297 1
1 468 . 12 1 1 A 77 77 GLU H H 77 8.290 8.271 0.019 1
1 469 . 12 1 1 A 77 77 GLU HA H 77 4.900 3.764 1.136 1
1 474 . 12 1 1 A 78 78 TRP H H 78 10.065 8.892 1.173 1
1 475 . 12 1 1 A 78 78 TRP HA H 78 4.600 5.047 -0.447 1
1 484 . 12 1 1 A 79 79 ALA H H 79 9.850 8.116 1.734 1
1 485 . 12 1 1 A 79 79 ALA HA H 79 5.022 4.745 0.277 1
1 489 . 12 1 1 A 80 80 LYS H H 80 9.255 8.910 0.345 1
1 490 . 12 1 1 A 80 80 LYS HA H 80 4.511 4.594 -0.083 1
1 494 . 12 1 1 A 81 81 ASP H H 81 9.332 8.227 1.105 1
1 495 . 12 1 1 A 81 81 ASP HA H 81 5.429 4.761 0.668 1
1 498 . 12 1 1 A 82 82 VAL H H 82 7.226 7.215 0.011 1
1 499 . 12 1 1 A 82 82 VAL HA H 82 4.248 4.733 -0.485 1
1 507 . 12 1 1 A 83 83 LYS H H 83 8.407 8.646 -0.239 1
1 508 . 12 1 1 A 83 83 LYS HA H 83 4.356 4.518 -0.162 1
1 510 . 12 1 1 A 84 84 THR H H 84 9.088 9.074 0.014 1
1 511 . 12 1 1 A 84 84 THR HA H 84 3.989 4.089 -0.100 1
1 516 . 12 1 1 A 85 85 SER H H 85 8.391 8.077 0.314 1
1 517 . 12 1 1 A 85 85 SER HA H 85 4.442 4.088 0.354 1
1 520 . 12 1 1 A 86 86 GLN H H 86 7.974 7.913 0.061 1
1 521 . 12 1 1 A 86 86 GLN HA H 86 4.585 4.024 0.561 1
1 527 . 12 1 1 A 87 87 GLN H H 87 7.083 7.681 -0.598 1
1 528 . 12 1 1 A 87 87 GLN HA H 87 3.903 3.826 0.077 1
1 534 . 12 1 1 A 88 88 LYS H H 88 9.453 8.385 1.068 1
1 535 . 12 1 1 A 88 88 LYS HA H 88 4.114 4.497 -0.383 1
1 539 . 12 1 1 A 89 89 GLY H H 89 9.466 7.833 1.633 1
1 540 . 12 1 1 A 89 89 GLY HA2 H 89 3.965 4.178 -0.213 1
1 541 . 12 1 1 A 89 89 GLY HA3 H 89 3.148 4.228 -1.080 1
1 542 . 12 1 1 A 90 90 GLY H H 90 7.228 7.358 -0.130 1
1 543 . 12 1 1 A 90 90 GLY HA2 H 90 4.290 4.073 0.217 1
1 544 . 12 1 1 A 90 90 GLY HA3 H 90 4.682 4.094 0.588 1
1 545 . 12 1 1 A 91 91 PRO HA H 91 4.902 4.790 0.112 1
1 552 . 12 1 1 A 92 92 THR H H 92 8.585 7.745 0.840 1
1 553 . 12 1 1 A 92 92 THR HA H 92 5.701 4.333 1.368 1
1 559 . 12 1 1 A 93 93 PRO HA H 93 5.551 3.900 1.651 1
1 563 . 12 1 1 A 94 94 ILE H H 94 8.155 7.350 0.805 1
1 564 . 12 1 1 A 94 94 ILE HA H 94 4.794 4.284 0.510 1
1 571 . 12 1 1 A 95 95 ARG H H 95 9.538 9.054 0.484 1
1 572 . 12 1 1 A 95 95 ARG HA H 95 5.278 5.343 -0.065 1
1 576 . 12 1 1 A 96 96 VAL H H 96 9.276 8.916 0.360 1
1 577 . 12 1 1 A 96 96 VAL HA H 96 5.222 4.314 0.908 1
1 585 . 12 1 1 A 97 97 VAL H H 97 8.739 8.788 -0.049 1
1 586 . 12 1 1 A 97 97 VAL HA H 97 5.160 5.154 0.006 1
1 594 . 12 1 1 A 98 98 TYR H H 98 8.596 8.626 -0.030 1
1 595 . 12 1 1 A 98 98 TYR HA H 98 5.266 5.024 0.242 1
1 603 . 12 1 1 A 99 99 ALA H H 99 9.685 8.571 1.114 1
1 604 . 12 1 1 A 99 99 ALA HA H 99 5.680 4.379 1.301 1
1 608 . 12 1 1 A 100 100 ASN H H 100 8.468 9.650 -1.182 1
1 609 . 12 1 1 A 100 100 ASN HA H 100 4.885 4.504 0.381 1
1 614 . 12 1 1 A 101 101 SER H H 101 9.342 8.133 1.209 1
1 615 . 12 1 1 A 101 101 SER HA H 101 4.993 4.137 0.856 1
1 618 . 12 1 1 A 102 102 ARG H H 102 9.349 8.545 0.804 1
1 619 . 12 1 1 A 102 102 ARG HA H 102 4.068 4.021 0.047 1
1 620 . 12 1 1 A 103 103 GLY H H 103 8.632 8.822 -0.190 1
1 621 . 12 1 1 A 103 103 GLY HA2 H 103 3.691 3.924 -0.233 1
1 622 . 12 1 1 A 103 103 GLY HA3 H 103 4.341 3.941 0.400 1
1 623 . 12 1 1 A 104 104 ALA H H 104 7.820 7.365 0.455 1
1 624 . 12 1 1 A 104 104 ALA HA H 104 4.775 4.676 0.099 1
1 628 . 12 1 1 A 105 105 VAL H H 105 8.402 8.438 -0.036 1
1 629 . 12 1 1 A 105 105 VAL HA H 105 4.218 5.081 -0.863 1
1 637 . 12 1 1 A 106 106 GLN H H 106 9.352 7.882 1.470 1
1 638 . 12 1 1 A 106 106 GLN HA H 106 4.900 4.648 0.252 1
1 645 . 12 1 1 A 107 107 TYR H H 107 9.075 8.100 0.975 1
1 646 . 12 1 1 A 107 107 TYR HA H 107 4.007 4.133 -0.126 1
1 653 . 12 1 1 A 108 108 CYS H H 108 8.197 7.715 0.482 1
1 654 . 12 1 1 A 108 108 CYS HA H 108 4.823 4.060 0.763 1
1 657 . 12 1 1 A 109 109 GLY H H 109 6.856 6.648 0.208 1
1 658 . 12 1 1 A 109 109 GLY HA2 H 109 3.983 3.175 0.808 1
1 659 . 12 1 1 A 109 109 GLY HA3 H 109 4.422 3.206 1.216 1
1 660 . 12 1 1 A 110 110 VAL H H 110 9.418 8.447 0.971 1
1 661 . 12 1 1 A 110 110 VAL HA H 110 5.073 4.667 0.406 1
1 669 . 12 1 1 A 111 111 MET H H 111 9.327 9.390 -0.063 1
1 670 . 12 1 1 A 111 111 MET HA H 111 5.678 5.439 0.239 1
1 678 . 12 1 1 A 112 112 THR H H 112 9.310 9.500 -0.190 1
1 679 . 12 1 1 A 112 112 THR HA H 112 5.726 4.677 1.049 1
1 685 . 12 1 1 A 113 113 HIS H H 113 8.960 8.034 0.926 1
1 686 . 12 1 1 A 113 113 HIS HA H 113 3.876 4.243 -0.367 1
1 691 . 12 1 1 A 114 114 SER H H 114 8.367 8.464 -0.097 1
1 692 . 12 1 1 A 114 114 SER HA H 114 4.024 4.019 0.005 1
1 695 . 12 1 1 A 115 115 LYS H H 115 8.140 7.547 0.593 1
1 696 . 12 1 1 A 115 115 LYS HA H 115 5.403 4.244 1.159 1
1 699 . 12 1 1 A 116 116 VAL H H 116 8.525 8.195 0.330 1
1 700 . 12 1 1 A 116 116 VAL HA H 116 5.378 4.803 0.575 1
1 708 . 12 1 1 A 117 117 ASP H H 117 8.025 8.856 -0.831 1
1 709 . 12 1 1 A 117 117 ASP HA H 117 5.243 4.733 0.510 1
1 712 . 12 1 1 A 118 118 LYS H H 118 8.930 8.050 0.880 1
1 713 . 12 1 1 A 118 118 LYS HA H 118 4.216 4.533 -0.317 1
1 716 . 12 1 1 A 119 119 ASN H H 119 8.425 8.122 0.303 1
1 717 . 12 1 1 A 119 119 ASN HA H 119 5.061 4.731 0.330 1
1 722 . 12 1 1 A 120 120 ASN H H 120 8.061 8.081 -0.020 1
1 723 . 12 1 1 A 120 120 ASN HA H 120 4.212 4.284 -0.072 1
1 728 . 12 1 1 A 121 121 GLN H H 121 8.359 7.896 0.463 1
1 729 . 12 1 1 A 121 121 GLN HA H 121 4.373 4.840 -0.467 1
1 735 . 12 1 1 A 122 122 GLY H H 122 8.770 8.691 0.079 1
1 736 . 12 1 1 A 122 122 GLY HA2 H 122 3.182 3.837 -0.655 1
1 737 . 12 1 1 A 122 122 GLY HA3 H 122 5.268 4.082 1.186 1
1 738 . 12 1 1 A 123 123 LYS H H 123 8.587 8.664 -0.077 1
1 739 . 12 1 1 A 123 123 LYS HA H 123 4.016 4.425 -0.409 1
1 745 . 12 1 1 A 124 124 GLU H H 124 8.527 8.351 0.176 1
1 746 . 12 1 1 A 124 124 GLU HA H 124 4.152 4.270 -0.118 1
1 750 . 12 1 1 A 125 125 PHE H H 125 7.936 7.186 0.750 1
1 751 . 12 1 1 A 125 125 PHE HA H 125 4.670 5.129 -0.459 1
1 758 . 12 1 1 A 126 126 PHE H H 126 8.214 9.237 -1.023 1
1 759 . 12 1 1 A 126 126 PHE HA H 126 5.177 5.324 -0.147 1
1 767 . 12 1 1 A 127 127 GLU H H 127 9.169 9.347 -0.178 1
1 768 . 12 1 1 A 127 127 GLU HA H 127 4.852 4.787 0.065 1
1 773 . 12 1 1 A 128 128 LYS H H 128 9.000 8.300 0.700 1
1 774 . 12 1 1 A 128 128 LYS HA H 128 4.191 4.163 0.028 1
1 777 . 12 1 1 A 129 129 CYS H H 129 8.938 8.604 0.334 1
1 778 . 12 1 1 A 129 129 CYS HA H 129 5.268 5.015 0.253 1
1 5 . 13 1 1 A 2 2 PRO HA H 2 4.900 4.423 0.477 1
1 10 . 13 1 1 A 3 3 ILE H H 3 8.774 7.415 1.359 1
1 11 . 13 1 1 A 3 3 ILE HA H 3 5.499 4.259 1.240 1
1 20 . 13 1 1 A 4 4 VAL H H 4 9.501 9.124 0.377 1
1 21 . 13 1 1 A 4 4 VAL HA H 4 4.944 5.160 -0.216 1
1 29 . 13 1 1 A 5 5 THR H H 5 9.243 9.140 0.103 1
1 30 . 13 1 1 A 5 5 THR HA H 5 5.278 5.309 -0.031 1
1 35 . 13 1 1 A 6 6 CYS H H 6 9.815 8.959 0.856 1
1 36 . 13 1 1 A 6 6 CYS HA H 6 5.310 4.664 0.646 1
1 38 . 13 1 1 A 7 7 ARG H H 7 9.154 8.510 0.644 1
1 41 . 13 1 1 A 8 8 PRO HA H 8 4.594 4.784 -0.190 1
1 47 . 13 1 1 A 9 9 LYS H H 9 8.179 8.497 -0.318 1
1 48 . 13 1 1 A 9 9 LYS HA H 9 4.857 4.968 -0.111 1
1 52 . 13 1 1 A 10 10 LEU H H 10 9.108 8.600 0.508 1
1 53 . 13 1 1 A 10 10 LEU HA H 10 5.147 4.721 0.426 1
1 63 . 13 1 1 A 11 11 ASP H H 11 9.835 8.035 1.800 1
1 64 . 13 1 1 A 11 11 ASP HA H 11 4.471 4.661 -0.190 1
1 67 . 13 1 1 A 12 12 GLY H H 12 8.847 8.025 0.822 1
1 68 . 13 1 1 A 12 12 GLY HA2 H 12 3.782 3.893 -0.111 1
1 69 . 13 1 1 A 12 12 GLY HA3 H 12 4.427 3.898 0.529 1
1 70 . 13 1 1 A 13 13 ARG H H 13 7.933 7.795 0.138 1
1 71 . 13 1 1 A 13 13 ARG HA H 13 4.886 4.677 0.209 1
1 77 . 13 1 1 A 14 14 GLU H H 14 9.179 8.692 0.487 1
1 78 . 13 1 1 A 14 14 GLU HA H 14 4.178 4.975 -0.797 1
1 82 . 13 1 1 A 15 15 LYS H H 15 9.078 8.852 0.226 1
1 83 . 13 1 1 A 15 15 LYS HA H 15 4.890 4.710 0.180 1
1 84 . 13 1 1 A 16 16 PRO HA H 16 5.144 4.975 0.169 1
1 91 . 13 1 1 A 17 17 PHE H H 17 9.487 8.727 0.760 1
1 92 . 13 1 1 A 17 17 PHE HA H 17 4.760 4.551 0.209 1
1 100 . 13 1 1 A 18 18 LYS H H 18 9.315 8.593 0.722 1
1 101 . 13 1 1 A 18 18 LYS HA H 18 5.197 4.308 0.889 1
1 108 . 13 1 1 A 19 19 VAL H H 19 9.643 8.702 0.941 1
1 109 . 13 1 1 A 19 19 VAL HA H 19 4.796 4.884 -0.088 1
1 117 . 13 1 1 A 20 20 ASP H H 20 9.555 8.914 0.641 1
1 118 . 13 1 1 A 20 20 ASP HA H 20 5.151 4.999 0.152 1
1 121 . 13 1 1 A 21 21 VAL H H 21 9.607 8.660 0.947 1
1 122 . 13 1 1 A 21 21 VAL HA H 21 3.611 3.773 -0.162 1
1 130 . 13 1 1 A 22 22 ALA H H 22 8.531 8.087 0.444 1
1 131 . 13 1 1 A 22 22 ALA HA H 22 4.299 3.880 0.419 1
1 135 . 13 1 1 A 23 23 THR H H 23 7.294 8.150 -0.856 1
1 136 . 13 1 1 A 23 23 THR HA H 23 4.264 3.845 0.419 1
1 141 . 13 1 1 A 24 24 ALA H H 24 8.346 8.215 0.131 1
1 142 . 13 1 1 A 24 24 ALA HA H 24 4.082 4.106 -0.024 1
1 146 . 13 1 1 A 25 25 GLN H H 25 8.866 8.497 0.369 1
1 147 . 13 1 1 A 25 25 GLN HA H 25 3.804 3.923 -0.119 1
1 153 . 13 1 1 A 26 26 ALA H H 26 7.767 8.162 -0.395 1
1 154 . 13 1 1 A 26 26 ALA HA H 26 4.208 4.008 0.200 1
1 158 . 13 1 1 A 27 27 GLN H H 27 8.881 8.087 0.794 1
1 159 . 13 1 1 A 27 27 GLN HA H 27 4.041 3.954 0.087 1
1 165 . 13 1 1 A 28 28 ALA H H 28 8.142 8.063 0.079 1
1 166 . 13 1 1 A 28 28 ALA HA H 28 3.475 3.511 -0.036 1
1 170 . 13 1 1 A 29 29 ARG H H 29 7.291 7.767 -0.476 1
1 171 . 13 1 1 A 29 29 ARG HA H 29 3.688 3.844 -0.156 1
1 174 . 13 1 1 A 30 30 LYS H H 30 7.768 7.961 -0.193 1
1 175 . 13 1 1 A 30 30 LYS HA H 30 4.038 3.907 0.131 1
1 179 . 13 1 1 A 31 31 ALA H H 31 8.127 7.323 0.804 1
1 180 . 13 1 1 A 31 31 ALA HA H 31 3.656 4.030 -0.374 1
1 184 . 13 1 1 A 32 32 GLY H H 32 7.670 7.978 -0.308 1
1 185 . 13 1 1 A 32 32 GLY HA2 H 32 3.380 3.723 -0.343 1
1 186 . 13 1 1 A 32 32 GLY HA3 H 32 3.844 3.747 0.097 1
1 187 . 13 1 1 A 33 33 LEU H H 33 8.057 8.181 -0.124 1
1 188 . 13 1 1 A 33 33 LEU HA H 33 3.259 3.193 0.066 1
1 197 . 13 1 1 A 34 34 THR H H 34 6.862 7.017 -0.155 1
1 198 . 13 1 1 A 34 34 THR HA H 34 4.738 4.792 -0.054 1
1 203 . 13 1 1 A 35 35 THR H H 35 9.161 9.125 0.036 1
1 204 . 13 1 1 A 35 35 THR HA H 35 4.247 5.237 -0.990 1
1 209 . 13 1 1 A 36 36 GLY H H 36 8.407 8.533 -0.126 1
1 210 . 13 1 1 A 36 36 GLY HA2 H 36 4.349 3.997 0.352 1
1 211 . 13 1 1 A 36 36 GLY HA3 H 36 4.967 4.000 0.967 1
1 212 . 13 1 1 A 37 37 LYS H H 37 10.152 8.245 1.907 1
1 213 . 13 1 1 A 37 37 LYS HA H 37 4.383 4.110 0.273 1
1 221 . 13 1 1 A 38 38 SER H H 38 9.085 8.205 0.880 1
1 222 . 13 1 1 A 38 38 SER HA H 38 4.338 4.741 -0.403 1
1 226 . 13 1 1 A 39 39 GLY H H 39 8.474 7.624 0.850 1
1 227 . 13 1 1 A 39 39 GLY HA2 H 39 3.840 4.191 -0.351 1
1 228 . 13 1 1 A 40 40 ASP H H 40 9.424 7.849 1.575 1
1 229 . 13 1 1 A 40 40 ASP HA H 40 5.374 4.720 0.654 1
1 231 . 13 1 1 A 41 41 PRO HA H 41 5.624 4.577 1.047 1
1 238 . 13 1 1 A 42 42 HIS H H 42 8.343 8.544 -0.201 1
1 239 . 13 1 1 A 42 42 HIS HA H 42 5.189 5.217 -0.028 1
1 244 . 13 1 1 A 43 43 ARG H H 43 8.634 8.175 0.459 1
1 245 . 13 1 1 A 43 43 ARG HA H 43 3.654 3.210 0.444 1
1 252 . 13 1 1 A 44 44 TYR H H 44 8.188 8.594 -0.406 1
1 253 . 13 1 1 A 44 44 TYR HA H 44 5.021 4.286 0.735 1
1 260 . 13 1 1 A 45 45 PHE H H 45 8.728 7.865 0.863 1
1 261 . 13 1 1 A 45 45 PHE HA H 45 4.480 4.827 -0.347 1
1 268 . 13 1 1 A 46 46 ALA H H 46 5.979 7.995 -2.016 1
1 269 . 13 1 1 A 46 46 ALA HA H 46 3.797 4.115 -0.318 1
1 273 . 13 1 1 A 47 47 GLY H H 47 8.510 7.352 1.158 1
1 274 . 13 1 1 A 47 47 GLY HA2 H 47 3.953 3.660 0.293 1
1 275 . 13 1 1 A 47 47 GLY HA3 H 47 4.075 3.763 0.312 1
1 276 . 13 1 1 A 48 48 ASP H H 48 7.504 7.115 0.389 1
1 277 . 13 1 1 A 48 48 ASP HA H 48 5.020 4.265 0.755 1
1 280 . 13 1 1 A 49 49 HIS H H 49 8.240 7.885 0.355 1
1 281 . 13 1 1 A 49 49 HIS HA H 49 4.373 4.196 0.177 1
1 285 . 13 1 1 A 50 50 ILE H H 50 8.468 7.399 1.069 1
1 286 . 13 1 1 A 50 50 ILE HA H 50 3.651 4.363 -0.712 1
1 296 . 13 1 1 A 51 51 ARG H H 51 8.404 8.221 0.183 1
1 297 . 13 1 1 A 51 51 ARG HA H 51 4.450 4.690 -0.240 1
1 303 . 13 1 1 A 52 52 TRP H H 52 11.176 7.754 3.422 1
1 304 . 13 1 1 A 52 52 TRP HA H 52 4.423 4.238 0.185 1
1 312 . 13 1 1 A 53 53 GLY H H 53 10.422 8.778 1.644 1
1 313 . 13 1 1 A 53 53 GLY HA2 H 53 3.832 3.933 -0.101 1
1 314 . 13 1 1 A 53 53 GLY HA3 H 53 4.411 3.959 0.452 1
1 315 . 13 1 1 A 54 54 VAL H H 54 7.040 7.443 -0.403 1
1 316 . 13 1 1 A 54 54 VAL HA H 54 4.489 4.399 0.090 1
1 324 . 13 1 1 A 55 55 ASN H H 55 9.530 9.125 0.405 1
1 325 . 13 1 1 A 55 55 ASN HA H 55 4.569 4.357 0.212 1
1 330 . 13 1 1 A 56 56 ASN H H 56 9.175 8.093 1.082 1
1 331 . 13 1 1 A 56 56 ASN HA H 56 4.649 4.427 0.222 1
1 336 . 13 1 1 A 57 57 CYS H H 57 7.613 8.503 -0.890 1
1 337 . 13 1 1 A 57 57 CYS HA H 57 4.645 4.287 0.358 1
1 340 . 13 1 1 A 58 58 ASP H H 58 7.626 8.764 -1.138 1
1 341 . 13 1 1 A 58 58 ASP HA H 58 5.206 4.456 0.750 1
1 344 . 13 1 1 A 59 59 LYS H H 59 7.349 7.391 -0.042 1
1 345 . 13 1 1 A 59 59 LYS HA H 59 4.548 4.311 0.237 1
1 350 . 13 1 1 A 60 60 ALA H H 60 9.155 8.877 0.278 1
1 351 . 13 1 1 A 60 60 ALA HA H 60 4.330 4.212 0.118 1
1 355 . 13 1 1 A 61 61 ASP H H 61 8.548 7.928 0.620 1
1 356 . 13 1 1 A 61 61 ASP HA H 61 4.827 4.698 0.129 1
1 359 . 13 1 1 A 62 62 ALA H H 62 7.463 7.416 0.047 1
1 360 . 13 1 1 A 62 62 ALA HA H 62 4.217 4.343 -0.126 1
1 364 . 13 1 1 A 63 63 ILE H H 63 9.302 8.637 0.665 1
1 365 . 13 1 1 A 63 63 ILE HA H 63 4.332 4.628 -0.296 1
1 374 . 13 1 1 A 64 64 LEU H H 64 8.724 9.015 -0.291 1
1 375 . 13 1 1 A 64 64 LEU HA H 64 5.463 5.267 0.196 1
1 385 . 13 1 1 A 65 65 TRP H H 65 9.621 8.444 1.177 1
1 386 . 13 1 1 A 65 65 TRP HA H 65 4.605 5.232 -0.627 1
1 395 . 13 1 1 A 66 66 GLU H H 66 8.388 9.011 -0.623 1
1 396 . 13 1 1 A 66 66 GLU HA H 66 6.014 5.818 0.196 1
1 401 . 13 1 1 A 67 67 TYR H H 67 8.766 9.031 -0.265 1
1 402 . 13 1 1 A 67 67 TYR HA H 67 5.204 5.016 0.188 1
1 405 . 13 1 1 A 68 68 PRO HA H 68 4.523 4.459 0.064 1
1 412 . 13 1 1 A 69 69 ILE H H 69 7.308 8.097 -0.789 1
1 413 . 13 1 1 A 69 69 ILE HA H 69 4.870 4.818 0.052 1
1 414 . 13 1 1 A 70 70 TYR H H 70 9.219 9.092 0.127 1
1 415 . 13 1 1 A 70 70 TYR HA H 70 4.854 4.436 0.418 1
1 423 . 13 1 1 A 71 71 TRP H H 71 6.662 8.172 -1.510 1
1 424 . 13 1 1 A 71 71 TRP HA H 71 5.496 4.801 0.695 1
1 432 . 13 1 1 A 72 72 VAL H H 72 9.510 8.914 0.596 1
1 433 . 13 1 1 A 72 72 VAL HA H 72 3.999 3.917 0.082 1
1 441 . 13 1 1 A 73 73 GLY H H 73 9.221 8.754 0.467 1
1 442 . 13 1 1 A 73 73 GLY HA2 H 73 3.877 3.943 -0.066 1
1 443 . 13 1 1 A 73 73 GLY HA3 H 73 4.682 3.971 0.711 1
1 444 . 13 1 1 A 74 74 LYS H H 74 7.962 7.297 0.665 1
1 445 . 13 1 1 A 74 74 LYS HA H 74 4.469 4.433 0.036 1
1 457 . 13 1 1 A 75 75 ASN H H 75 8.928 8.744 0.184 1
1 458 . 13 1 1 A 75 75 ASN HA H 75 4.837 4.964 -0.127 1
1 463 . 13 1 1 A 76 76 ALA H H 76 7.544 7.567 -0.023 1
1 464 . 13 1 1 A 76 76 ALA HA H 76 4.555 4.160 0.395 1
1 468 . 13 1 1 A 77 77 GLU H H 77 8.290 8.207 0.083 1
1 469 . 13 1 1 A 77 77 GLU HA H 77 4.900 3.588 1.312 1
1 474 . 13 1 1 A 78 78 TRP H H 78 10.065 8.688 1.377 1
1 475 . 13 1 1 A 78 78 TRP HA H 78 4.600 4.921 -0.321 1
1 484 . 13 1 1 A 79 79 ALA H H 79 9.850 8.361 1.489 1
1 485 . 13 1 1 A 79 79 ALA HA H 79 5.022 5.040 -0.018 1
1 489 . 13 1 1 A 80 80 LYS H H 80 9.255 8.968 0.287 1
1 490 . 13 1 1 A 80 80 LYS HA H 80 4.511 4.220 0.291 1
1 494 . 13 1 1 A 81 81 ASP H H 81 9.332 7.881 1.451 1
1 495 . 13 1 1 A 81 81 ASP HA H 81 5.429 4.795 0.634 1
1 498 . 13 1 1 A 82 82 VAL H H 82 7.226 7.429 -0.203 1
1 499 . 13 1 1 A 82 82 VAL HA H 82 4.248 4.595 -0.347 1
1 507 . 13 1 1 A 83 83 LYS H H 83 8.407 8.645 -0.238 1
1 508 . 13 1 1 A 83 83 LYS HA H 83 4.356 4.695 -0.339 1
1 510 . 13 1 1 A 84 84 THR H H 84 9.088 9.179 -0.091 1
1 511 . 13 1 1 A 84 84 THR HA H 84 3.989 3.975 0.014 1
1 516 . 13 1 1 A 85 85 SER H H 85 8.391 8.281 0.110 1
1 517 . 13 1 1 A 85 85 SER HA H 85 4.442 4.022 0.420 1
1 520 . 13 1 1 A 86 86 GLN H H 86 7.974 8.163 -0.189 1
1 521 . 13 1 1 A 86 86 GLN HA H 86 4.585 3.932 0.653 1
1 527 . 13 1 1 A 87 87 GLN H H 87 7.083 7.799 -0.716 1
1 528 . 13 1 1 A 87 87 GLN HA H 87 3.903 3.796 0.107 1
1 534 . 13 1 1 A 88 88 LYS H H 88 9.453 8.484 0.969 1
1 535 . 13 1 1 A 88 88 LYS HA H 88 4.114 4.527 -0.413 1
1 539 . 13 1 1 A 89 89 GLY H H 89 9.466 8.423 1.043 1
1 540 . 13 1 1 A 89 89 GLY HA2 H 89 3.965 4.080 -0.115 1
1 541 . 13 1 1 A 89 89 GLY HA3 H 89 3.148 4.089 -0.941 1
1 542 . 13 1 1 A 90 90 GLY H H 90 7.228 7.437 -0.209 1
1 543 . 13 1 1 A 90 90 GLY HA2 H 90 4.290 4.080 0.210 1
1 544 . 13 1 1 A 90 90 GLY HA3 H 90 4.682 4.081 0.601 1
1 545 . 13 1 1 A 91 91 PRO HA H 91 4.902 4.802 0.100 1
1 552 . 13 1 1 A 92 92 THR H H 92 8.585 8.426 0.159 1
1 553 . 13 1 1 A 92 92 THR HA H 92 5.701 5.029 0.672 1
1 559 . 13 1 1 A 93 93 PRO HA H 93 5.551 4.099 1.452 1
1 563 . 13 1 1 A 94 94 ILE H H 94 8.155 7.514 0.641 1
1 564 . 13 1 1 A 94 94 ILE HA H 94 4.794 4.358 0.436 1
1 571 . 13 1 1 A 95 95 ARG H H 95 9.538 9.207 0.331 1
1 572 . 13 1 1 A 95 95 ARG HA H 95 5.278 5.316 -0.038 1
1 576 . 13 1 1 A 96 96 VAL H H 96 9.276 9.052 0.224 1
1 577 . 13 1 1 A 96 96 VAL HA H 96 5.222 4.285 0.937 1
1 585 . 13 1 1 A 97 97 VAL H H 97 8.739 8.934 -0.195 1
1 586 . 13 1 1 A 97 97 VAL HA H 97 5.160 5.367 -0.207 1
1 594 . 13 1 1 A 98 98 TYR H H 98 8.596 8.519 0.077 1
1 595 . 13 1 1 A 98 98 TYR HA H 98 5.266 5.137 0.129 1
1 603 . 13 1 1 A 99 99 ALA H H 99 9.685 8.577 1.108 1
1 604 . 13 1 1 A 99 99 ALA HA H 99 5.680 4.594 1.086 1
1 608 . 13 1 1 A 100 100 ASN H H 100 8.468 8.826 -0.358 1
1 609 . 13 1 1 A 100 100 ASN HA H 100 4.885 4.859 0.026 1
1 614 . 13 1 1 A 101 101 SER H H 101 9.342 7.921 1.421 1
1 615 . 13 1 1 A 101 101 SER HA H 101 4.993 4.482 0.511 1
1 618 . 13 1 1 A 102 102 ARG H H 102 9.349 8.844 0.505 1
1 619 . 13 1 1 A 102 102 ARG HA H 102 4.068 3.984 0.084 1
1 620 . 13 1 1 A 103 103 GLY H H 103 8.632 8.516 0.116 1
1 621 . 13 1 1 A 103 103 GLY HA2 H 103 3.691 3.867 -0.176 1
1 622 . 13 1 1 A 103 103 GLY HA3 H 103 4.341 3.884 0.457 1
1 623 . 13 1 1 A 104 104 ALA H H 104 7.820 7.892 -0.072 1
1 624 . 13 1 1 A 104 104 ALA HA H 104 4.775 4.214 0.561 1
1 628 . 13 1 1 A 105 105 VAL H H 105 8.402 8.463 -0.061 1
1 629 . 13 1 1 A 105 105 VAL HA H 105 4.218 4.249 -0.031 1
1 637 . 13 1 1 A 106 106 GLN H H 106 9.352 8.542 0.810 1
1 638 . 13 1 1 A 106 106 GLN HA H 106 4.900 4.573 0.327 1
1 645 . 13 1 1 A 107 107 TYR H H 107 9.075 8.097 0.978 1
1 646 . 13 1 1 A 107 107 TYR HA H 107 4.007 4.100 -0.093 1
1 653 . 13 1 1 A 108 108 CYS H H 108 8.197 7.728 0.469 1
1 654 . 13 1 1 A 108 108 CYS HA H 108 4.823 4.045 0.778 1
1 657 . 13 1 1 A 109 109 GLY H H 109 6.856 6.694 0.162 1
1 658 . 13 1 1 A 109 109 GLY HA2 H 109 3.983 3.220 0.763 1
1 659 . 13 1 1 A 109 109 GLY HA3 H 109 4.422 3.263 1.159 1
1 660 . 13 1 1 A 110 110 VAL H H 110 9.418 8.459 0.959 1
1 661 . 13 1 1 A 110 110 VAL HA H 110 5.073 4.689 0.384 1
1 669 . 13 1 1 A 111 111 MET H H 111 9.327 9.632 -0.305 1
1 670 . 13 1 1 A 111 111 MET HA H 111 5.678 5.572 0.106 1
1 678 . 13 1 1 A 112 112 THR H H 112 9.310 9.219 0.091 1
1 679 . 13 1 1 A 112 112 THR HA H 112 5.726 4.583 1.143 1
1 685 . 13 1 1 A 113 113 HIS H H 113 8.960 8.233 0.727 1
1 686 . 13 1 1 A 113 113 HIS HA H 113 3.876 4.388 -0.512 1
1 691 . 13 1 1 A 114 114 SER H H 114 8.367 8.262 0.105 1
1 692 . 13 1 1 A 114 114 SER HA H 114 4.024 4.299 -0.275 1
1 695 . 13 1 1 A 115 115 LYS H H 115 8.140 7.600 0.540 1
1 696 . 13 1 1 A 115 115 LYS HA H 115 5.403 4.367 1.036 1
1 699 . 13 1 1 A 116 116 VAL H H 116 8.525 8.339 0.186 1
1 700 . 13 1 1 A 116 116 VAL HA H 116 5.378 4.837 0.541 1
1 708 . 13 1 1 A 117 117 ASP H H 117 8.025 8.946 -0.921 1
1 709 . 13 1 1 A 117 117 ASP HA H 117 5.243 4.744 0.499 1
1 712 . 13 1 1 A 118 118 LYS H H 118 8.930 8.143 0.787 1
1 713 . 13 1 1 A 118 118 LYS HA H 118 4.216 4.418 -0.202 1
1 716 . 13 1 1 A 119 119 ASN H H 119 8.425 7.973 0.452 1
1 717 . 13 1 1 A 119 119 ASN HA H 119 5.061 4.827 0.234 1
1 722 . 13 1 1 A 120 120 ASN H H 120 8.061 8.051 0.010 1
1 723 . 13 1 1 A 120 120 ASN HA H 120 4.212 4.316 -0.104 1
1 728 . 13 1 1 A 121 121 GLN H H 121 8.359 7.844 0.515 1
1 729 . 13 1 1 A 121 121 GLN HA H 121 4.373 4.344 0.029 1
1 735 . 13 1 1 A 122 122 GLY H H 122 8.770 8.621 0.149 1
1 736 . 13 1 1 A 122 122 GLY HA2 H 122 3.182 3.941 -0.759 1
1 737 . 13 1 1 A 122 122 GLY HA3 H 122 5.268 4.110 1.158 1
1 738 . 13 1 1 A 123 123 LYS H H 123 8.587 8.243 0.344 1
1 739 . 13 1 1 A 123 123 LYS HA H 123 4.016 4.266 -0.250 1
1 745 . 13 1 1 A 124 124 GLU H H 124 8.527 7.779 0.748 1
1 746 . 13 1 1 A 124 124 GLU HA H 124 4.152 4.540 -0.388 1
1 750 . 13 1 1 A 125 125 PHE H H 125 7.936 8.850 -0.914 1
1 751 . 13 1 1 A 125 125 PHE HA H 125 4.670 4.724 -0.054 1
1 758 . 13 1 1 A 126 126 PHE H H 126 8.214 8.888 -0.674 1
1 759 . 13 1 1 A 126 126 PHE HA H 126 5.177 4.861 0.316 1
1 767 . 13 1 1 A 127 127 GLU H H 127 9.169 8.037 1.132 1
1 768 . 13 1 1 A 127 127 GLU HA H 127 4.852 3.900 0.952 1
1 773 . 13 1 1 A 128 128 LYS H H 128 9.000 8.293 0.707 1
1 774 . 13 1 1 A 128 128 LYS HA H 128 4.191 4.025 0.166 1
1 777 . 13 1 1 A 129 129 CYS H H 129 8.938 9.201 -0.263 1
1 778 . 13 1 1 A 129 129 CYS HA H 129 5.268 4.514 0.754 1
1 5 . 14 1 1 A 2 2 PRO HA H 2 4.900 4.463 0.437 1
1 10 . 14 1 1 A 3 3 ILE H H 3 8.774 7.473 1.301 1
1 11 . 14 1 1 A 3 3 ILE HA H 3 5.499 4.733 0.766 1
1 20 . 14 1 1 A 4 4 VAL H H 4 9.501 9.191 0.310 1
1 21 . 14 1 1 A 4 4 VAL HA H 4 4.944 5.125 -0.181 1
1 29 . 14 1 1 A 5 5 THR H H 5 9.243 8.862 0.381 1
1 30 . 14 1 1 A 5 5 THR HA H 5 5.278 5.340 -0.062 1
1 35 . 14 1 1 A 6 6 CYS H H 6 9.815 8.873 0.942 1
1 36 . 14 1 1 A 6 6 CYS HA H 6 5.310 4.631 0.679 1
1 38 . 14 1 1 A 7 7 ARG H H 7 9.154 8.049 1.105 1
1 41 . 14 1 1 A 8 8 PRO HA H 8 4.594 4.525 0.069 1
1 47 . 14 1 1 A 9 9 LYS H H 9 8.179 8.484 -0.305 1
1 48 . 14 1 1 A 9 9 LYS HA H 9 4.857 4.847 0.010 1
1 52 . 14 1 1 A 10 10 LEU H H 10 9.108 7.956 1.152 1
1 53 . 14 1 1 A 10 10 LEU HA H 10 5.147 3.926 1.221 1
1 63 . 14 1 1 A 11 11 ASP H H 11 9.835 8.204 1.631 1
1 64 . 14 1 1 A 11 11 ASP HA H 11 4.471 4.870 -0.399 1
1 67 . 14 1 1 A 12 12 GLY H H 12 8.847 7.907 0.940 1
1 68 . 14 1 1 A 12 12 GLY HA2 H 12 3.782 4.035 -0.253 1
1 69 . 14 1 1 A 12 12 GLY HA3 H 12 4.427 4.043 0.384 1
1 70 . 14 1 1 A 13 13 ARG H H 13 7.933 7.674 0.259 1
1 71 . 14 1 1 A 13 13 ARG HA H 13 4.886 4.666 0.220 1
1 77 . 14 1 1 A 14 14 GLU H H 14 9.179 8.662 0.517 1
1 78 . 14 1 1 A 14 14 GLU HA H 14 4.178 4.708 -0.530 1
1 82 . 14 1 1 A 15 15 LYS H H 15 9.078 8.854 0.224 1
1 83 . 14 1 1 A 15 15 LYS HA H 15 4.890 4.771 0.119 1
1 84 . 14 1 1 A 16 16 PRO HA H 16 5.144 5.054 0.090 1
1 91 . 14 1 1 A 17 17 PHE H H 17 9.487 8.567 0.920 1
1 92 . 14 1 1 A 17 17 PHE HA H 17 4.760 4.496 0.264 1
1 100 . 14 1 1 A 18 18 LYS H H 18 9.315 8.554 0.761 1
1 101 . 14 1 1 A 18 18 LYS HA H 18 5.197 4.204 0.993 1
1 108 . 14 1 1 A 19 19 VAL H H 19 9.643 8.800 0.843 1
1 109 . 14 1 1 A 19 19 VAL HA H 19 4.796 4.873 -0.077 1
1 117 . 14 1 1 A 20 20 ASP H H 20 9.555 8.807 0.748 1
1 118 . 14 1 1 A 20 20 ASP HA H 20 5.151 5.397 -0.246 1
1 121 . 14 1 1 A 21 21 VAL H H 21 9.607 8.875 0.732 1
1 122 . 14 1 1 A 21 21 VAL HA H 21 3.611 3.915 -0.304 1
1 130 . 14 1 1 A 22 22 ALA H H 22 8.531 8.259 0.272 1
1 131 . 14 1 1 A 22 22 ALA HA H 22 4.299 3.889 0.410 1
1 135 . 14 1 1 A 23 23 THR H H 23 7.294 8.100 -0.806 1
1 136 . 14 1 1 A 23 23 THR HA H 23 4.264 3.893 0.371 1
1 141 . 14 1 1 A 24 24 ALA H H 24 8.346 8.253 0.093 1
1 142 . 14 1 1 A 24 24 ALA HA H 24 4.082 4.112 -0.030 1
1 146 . 14 1 1 A 25 25 GLN H H 25 8.866 8.586 0.280 1
1 147 . 14 1 1 A 25 25 GLN HA H 25 3.804 3.876 -0.072 1
1 153 . 14 1 1 A 26 26 ALA H H 26 7.767 8.240 -0.473 1
1 154 . 14 1 1 A 26 26 ALA HA H 26 4.208 4.005 0.203 1
1 158 . 14 1 1 A 27 27 GLN H H 27 8.881 8.051 0.830 1
1 159 . 14 1 1 A 27 27 GLN HA H 27 4.041 3.895 0.146 1
1 165 . 14 1 1 A 28 28 ALA H H 28 8.142 8.141 0.001 1
1 166 . 14 1 1 A 28 28 ALA HA H 28 3.475 3.678 -0.203 1
1 170 . 14 1 1 A 29 29 ARG H H 29 7.291 8.104 -0.813 1
1 171 . 14 1 1 A 29 29 ARG HA H 29 3.688 3.702 -0.014 1
1 174 . 14 1 1 A 30 30 LYS H H 30 7.768 7.859 -0.091 1
1 175 . 14 1 1 A 30 30 LYS HA H 30 4.038 3.857 0.181 1
1 179 . 14 1 1 A 31 31 ALA H H 31 8.127 7.420 0.707 1
1 180 . 14 1 1 A 31 31 ALA HA H 31 3.656 3.941 -0.285 1
1 184 . 14 1 1 A 32 32 GLY H H 32 7.670 7.529 0.141 1
1 185 . 14 1 1 A 32 32 GLY HA2 H 32 3.380 3.723 -0.343 1
1 186 . 14 1 1 A 32 32 GLY HA3 H 32 3.844 3.782 0.062 1
1 187 . 14 1 1 A 33 33 LEU H H 33 8.057 8.178 -0.121 1
1 188 . 14 1 1 A 33 33 LEU HA H 33 3.259 3.005 0.254 1
1 197 . 14 1 1 A 34 34 THR H H 34 6.862 7.124 -0.262 1
1 198 . 14 1 1 A 34 34 THR HA H 34 4.738 5.225 -0.487 1
1 203 . 14 1 1 A 35 35 THR H H 35 9.161 8.799 0.362 1
1 204 . 14 1 1 A 35 35 THR HA H 35 4.247 4.905 -0.658 1
1 209 . 14 1 1 A 36 36 GLY H H 36 8.407 8.686 -0.279 1
1 210 . 14 1 1 A 36 36 GLY HA2 H 36 4.349 4.064 0.285 1
1 211 . 14 1 1 A 36 36 GLY HA3 H 36 4.967 4.068 0.899 1
1 212 . 14 1 1 A 37 37 LYS H H 37 10.152 7.923 2.229 1
1 213 . 14 1 1 A 37 37 LYS HA H 37 4.383 4.616 -0.233 1
1 221 . 14 1 1 A 38 38 SER H H 38 9.085 8.117 0.968 1
1 222 . 14 1 1 A 38 38 SER HA H 38 4.338 4.774 -0.436 1
1 226 . 14 1 1 A 39 39 GLY H H 39 8.474 7.770 0.704 1
1 227 . 14 1 1 A 39 39 GLY HA2 H 39 3.840 4.132 -0.292 1
1 228 . 14 1 1 A 40 40 ASP H H 40 9.424 7.509 1.915 1
1 229 . 14 1 1 A 40 40 ASP HA H 40 5.374 4.153 1.221 1
1 231 . 14 1 1 A 41 41 PRO HA H 41 5.624 4.633 0.991 1
1 238 . 14 1 1 A 42 42 HIS H H 42 8.343 8.581 -0.238 1
1 239 . 14 1 1 A 42 42 HIS HA H 42 5.189 5.228 -0.039 1
1 244 . 14 1 1 A 43 43 ARG H H 43 8.634 8.351 0.283 1
1 245 . 14 1 1 A 43 43 ARG HA H 43 3.654 3.253 0.401 1
1 252 . 14 1 1 A 44 44 TYR H H 44 8.188 8.329 -0.141 1
1 253 . 14 1 1 A 44 44 TYR HA H 44 5.021 5.010 0.011 1
1 260 . 14 1 1 A 45 45 PHE H H 45 8.728 8.462 0.266 1
1 261 . 14 1 1 A 45 45 PHE HA H 45 4.480 5.012 -0.532 1
1 268 . 14 1 1 A 46 46 ALA H H 46 5.979 8.893 -2.914 1
1 269 . 14 1 1 A 46 46 ALA HA H 46 3.797 4.393 -0.596 1
1 273 . 14 1 1 A 47 47 GLY H H 47 8.510 8.272 0.238 1
1 274 . 14 1 1 A 47 47 GLY HA2 H 47 3.953 4.127 -0.174 1
1 275 . 14 1 1 A 47 47 GLY HA3 H 47 4.075 4.144 -0.069 1
1 276 . 14 1 1 A 48 48 ASP H H 48 7.504 7.974 -0.470 1
1 277 . 14 1 1 A 48 48 ASP HA H 48 5.020 4.788 0.232 1
1 280 . 14 1 1 A 49 49 HIS H H 49 8.240 8.228 0.012 1
1 281 . 14 1 1 A 49 49 HIS HA H 49 4.373 4.174 0.199 1
1 285 . 14 1 1 A 50 50 ILE H H 50 8.468 7.736 0.732 1
1 286 . 14 1 1 A 50 50 ILE HA H 50 3.651 4.345 -0.694 1
1 296 . 14 1 1 A 51 51 ARG H H 51 8.404 8.348 0.056 1
1 297 . 14 1 1 A 51 51 ARG HA H 51 4.450 4.759 -0.309 1
1 303 . 14 1 1 A 52 52 TRP H H 52 11.176 7.904 3.272 1
1 304 . 14 1 1 A 52 52 TRP HA H 52 4.423 4.207 0.216 1
1 312 . 14 1 1 A 53 53 GLY H H 53 10.422 8.748 1.674 1
1 313 . 14 1 1 A 53 53 GLY HA2 H 53 3.832 3.907 -0.075 1
1 314 . 14 1 1 A 53 53 GLY HA3 H 53 4.411 3.933 0.478 1
1 315 . 14 1 1 A 54 54 VAL H H 54 7.040 7.542 -0.502 1
1 316 . 14 1 1 A 54 54 VAL HA H 54 4.489 4.680 -0.191 1
1 324 . 14 1 1 A 55 55 ASN H H 55 9.530 8.979 0.551 1
1 325 . 14 1 1 A 55 55 ASN HA H 55 4.569 4.482 0.087 1
1 330 . 14 1 1 A 56 56 ASN H H 56 9.175 8.262 0.913 1
1 331 . 14 1 1 A 56 56 ASN HA H 56 4.649 4.356 0.293 1
1 336 . 14 1 1 A 57 57 CYS H H 57 7.613 8.134 -0.521 1
1 337 . 14 1 1 A 57 57 CYS HA H 57 4.645 4.478 0.167 1
1 340 . 14 1 1 A 58 58 ASP H H 58 7.626 7.553 0.073 1
1 341 . 14 1 1 A 58 58 ASP HA H 58 5.206 4.797 0.409 1
1 344 . 14 1 1 A 59 59 LYS H H 59 7.349 7.437 -0.088 1
1 345 . 14 1 1 A 59 59 LYS HA H 59 4.548 4.599 -0.051 1
1 350 . 14 1 1 A 60 60 ALA H H 60 9.155 8.505 0.650 1
1 351 . 14 1 1 A 60 60 ALA HA H 60 4.330 4.268 0.062 1
1 355 . 14 1 1 A 61 61 ASP H H 61 8.548 7.908 0.640 1
1 356 . 14 1 1 A 61 61 ASP HA H 61 4.827 4.864 -0.037 1
1 359 . 14 1 1 A 62 62 ALA H H 62 7.463 7.468 -0.005 1
1 360 . 14 1 1 A 62 62 ALA HA H 62 4.217 4.317 -0.100 1
1 364 . 14 1 1 A 63 63 ILE H H 63 9.302 8.698 0.604 1
1 365 . 14 1 1 A 63 63 ILE HA H 63 4.332 4.437 -0.105 1
1 374 . 14 1 1 A 64 64 LEU H H 64 8.724 8.729 -0.005 1
1 375 . 14 1 1 A 64 64 LEU HA H 64 5.463 5.113 0.350 1
1 385 . 14 1 1 A 65 65 TRP H H 65 9.621 8.339 1.282 1
1 386 . 14 1 1 A 65 65 TRP HA H 65 4.605 5.213 -0.608 1
1 395 . 14 1 1 A 66 66 GLU H H 66 8.388 9.245 -0.857 1
1 396 . 14 1 1 A 66 66 GLU HA H 66 6.014 5.756 0.258 1
1 401 . 14 1 1 A 67 67 TYR H H 67 8.766 9.031 -0.265 1
1 402 . 14 1 1 A 67 67 TYR HA H 67 5.204 5.193 0.011 1
1 405 . 14 1 1 A 68 68 PRO HA H 68 4.523 4.407 0.116 1
1 412 . 14 1 1 A 69 69 ILE H H 69 7.308 7.752 -0.444 1
1 413 . 14 1 1 A 69 69 ILE HA H 69 4.870 5.185 -0.315 1
1 414 . 14 1 1 A 70 70 TYR H H 70 9.219 9.113 0.106 1
1 415 . 14 1 1 A 70 70 TYR HA H 70 4.854 4.833 0.021 1
1 423 . 14 1 1 A 71 71 TRP H H 71 6.662 7.962 -1.300 1
1 424 . 14 1 1 A 71 71 TRP HA H 71 5.496 5.062 0.434 1
1 432 . 14 1 1 A 72 72 VAL H H 72 9.510 9.000 0.510 1
1 433 . 14 1 1 A 72 72 VAL HA H 72 3.999 3.685 0.314 1
1 441 . 14 1 1 A 73 73 GLY H H 73 9.221 8.367 0.854 1
1 442 . 14 1 1 A 73 73 GLY HA2 H 73 3.877 3.999 -0.122 1
1 443 . 14 1 1 A 73 73 GLY HA3 H 73 4.682 4.040 0.642 1
1 444 . 14 1 1 A 74 74 LYS H H 74 7.962 7.735 0.227 1
1 445 . 14 1 1 A 74 74 LYS HA H 74 4.469 4.593 -0.124 1
1 457 . 14 1 1 A 75 75 ASN H H 75 8.928 8.867 0.061 1
1 458 . 14 1 1 A 75 75 ASN HA H 75 4.837 5.134 -0.297 1
1 463 . 14 1 1 A 76 76 ALA H H 76 7.544 7.346 0.198 1
1 464 . 14 1 1 A 76 76 ALA HA H 76 4.555 4.635 -0.080 1
1 468 . 14 1 1 A 77 77 GLU H H 77 8.290 8.288 0.002 1
1 469 . 14 1 1 A 77 77 GLU HA H 77 4.900 4.519 0.381 1
1 474 . 14 1 1 A 78 78 TRP H H 78 10.065 9.019 1.046 1
1 475 . 14 1 1 A 78 78 TRP HA H 78 4.600 5.258 -0.658 1
1 484 . 14 1 1 A 79 79 ALA H H 79 9.850 8.453 1.397 1
1 485 . 14 1 1 A 79 79 ALA HA H 79 5.022 4.734 0.288 1
1 489 . 14 1 1 A 80 80 LYS H H 80 9.255 8.839 0.416 1
1 490 . 14 1 1 A 80 80 LYS HA H 80 4.511 4.595 -0.084 1
1 494 . 14 1 1 A 81 81 ASP H H 81 9.332 7.781 1.551 1
1 495 . 14 1 1 A 81 81 ASP HA H 81 5.429 4.862 0.567 1
1 498 . 14 1 1 A 82 82 VAL H H 82 7.226 7.190 0.036 1
1 499 . 14 1 1 A 82 82 VAL HA H 82 4.248 4.688 -0.440 1
1 507 . 14 1 1 A 83 83 LYS H H 83 8.407 8.680 -0.273 1
1 508 . 14 1 1 A 83 83 LYS HA H 83 4.356 4.430 -0.074 1
1 510 . 14 1 1 A 84 84 THR H H 84 9.088 8.989 0.099 1
1 511 . 14 1 1 A 84 84 THR HA H 84 3.989 4.146 -0.157 1
1 516 . 14 1 1 A 85 85 SER H H 85 8.391 8.088 0.303 1
1 517 . 14 1 1 A 85 85 SER HA H 85 4.442 4.133 0.309 1
1 520 . 14 1 1 A 86 86 GLN H H 86 7.974 8.023 -0.049 1
1 521 . 14 1 1 A 86 86 GLN HA H 86 4.585 4.014 0.571 1
1 527 . 14 1 1 A 87 87 GLN H H 87 7.083 7.850 -0.767 1
1 528 . 14 1 1 A 87 87 GLN HA H 87 3.903 3.838 0.065 1
1 534 . 14 1 1 A 88 88 LYS H H 88 9.453 8.625 0.828 1
1 535 . 14 1 1 A 88 88 LYS HA H 88 4.114 4.495 -0.381 1
1 539 . 14 1 1 A 89 89 GLY H H 89 9.466 7.933 1.533 1
1 540 . 14 1 1 A 89 89 GLY HA2 H 89 3.965 4.154 -0.189 1
1 541 . 14 1 1 A 89 89 GLY HA3 H 89 3.148 4.182 -1.034 1
1 542 . 14 1 1 A 90 90 GLY H H 90 7.228 7.420 -0.192 1
1 543 . 14 1 1 A 90 90 GLY HA2 H 90 4.290 4.074 0.216 1
1 544 . 14 1 1 A 90 90 GLY HA3 H 90 4.682 4.096 0.586 1
1 545 . 14 1 1 A 91 91 PRO HA H 91 4.902 4.737 0.165 1
1 552 . 14 1 1 A 92 92 THR H H 92 8.585 7.512 1.073 1
1 553 . 14 1 1 A 92 92 THR HA H 92 5.701 4.297 1.404 1
1 559 . 14 1 1 A 93 93 PRO HA H 93 5.551 4.313 1.238 1
1 563 . 14 1 1 A 94 94 ILE H H 94 8.155 7.488 0.667 1
1 564 . 14 1 1 A 94 94 ILE HA H 94 4.794 4.326 0.468 1
1 571 . 14 1 1 A 95 95 ARG H H 95 9.538 9.014 0.524 1
1 572 . 14 1 1 A 95 95 ARG HA H 95 5.278 5.338 -0.060 1
1 576 . 14 1 1 A 96 96 VAL H H 96 9.276 9.013 0.263 1
1 577 . 14 1 1 A 96 96 VAL HA H 96 5.222 4.374 0.848 1
1 585 . 14 1 1 A 97 97 VAL H H 97 8.739 9.269 -0.530 1
1 586 . 14 1 1 A 97 97 VAL HA H 97 5.160 5.092 0.068 1
1 594 . 14 1 1 A 98 98 TYR H H 98 8.596 8.541 0.055 1
1 595 . 14 1 1 A 98 98 TYR HA H 98 5.266 5.405 -0.139 1
1 603 . 14 1 1 A 99 99 ALA H H 99 9.685 8.766 0.919 1
1 604 . 14 1 1 A 99 99 ALA HA H 99 5.680 4.946 0.734 1
1 608 . 14 1 1 A 100 100 ASN H H 100 8.468 8.789 -0.321 1
1 609 . 14 1 1 A 100 100 ASN HA H 100 4.885 5.151 -0.266 1
1 614 . 14 1 1 A 101 101 SER H H 101 9.342 7.637 1.705 1
1 615 . 14 1 1 A 101 101 SER HA H 101 4.993 4.320 0.673 1
1 618 . 14 1 1 A 102 102 ARG H H 102 9.349 8.861 0.488 1
1 619 . 14 1 1 A 102 102 ARG HA H 102 4.068 3.981 0.087 1
1 620 . 14 1 1 A 103 103 GLY H H 103 8.632 8.555 0.077 1
1 621 . 14 1 1 A 103 103 GLY HA2 H 103 3.691 3.940 -0.249 1
1 622 . 14 1 1 A 103 103 GLY HA3 H 103 4.341 3.947 0.394 1
1 623 . 14 1 1 A 104 104 ALA H H 104 7.820 7.795 0.025 1
1 624 . 14 1 1 A 104 104 ALA HA H 104 4.775 4.689 0.086 1
1 628 . 14 1 1 A 105 105 VAL H H 105 8.402 8.872 -0.470 1
1 629 . 14 1 1 A 105 105 VAL HA H 105 4.218 4.236 -0.018 1
1 637 . 14 1 1 A 106 106 GLN H H 106 9.352 8.670 0.682 1
1 638 . 14 1 1 A 106 106 GLN HA H 106 4.900 4.628 0.272 1
1 645 . 14 1 1 A 107 107 TYR H H 107 9.075 8.093 0.982 1
1 646 . 14 1 1 A 107 107 TYR HA H 107 4.007 4.136 -0.129 1
1 653 . 14 1 1 A 108 108 CYS H H 108 8.197 7.786 0.411 1
1 654 . 14 1 1 A 108 108 CYS HA H 108 4.823 4.085 0.738 1
1 657 . 14 1 1 A 109 109 GLY H H 109 6.856 6.812 0.044 1
1 658 . 14 1 1 A 109 109 GLY HA2 H 109 3.983 3.303 0.680 1
1 659 . 14 1 1 A 109 109 GLY HA3 H 109 4.422 3.351 1.071 1
1 660 . 14 1 1 A 110 110 VAL H H 110 9.418 8.450 0.968 1
1 661 . 14 1 1 A 110 110 VAL HA H 110 5.073 4.912 0.161 1
1 669 . 14 1 1 A 111 111 MET H H 111 9.327 9.664 -0.337 1
1 670 . 14 1 1 A 111 111 MET HA H 111 5.678 5.559 0.119 1
1 678 . 14 1 1 A 112 112 THR H H 112 9.310 8.952 0.358 1
1 679 . 14 1 1 A 112 112 THR HA H 112 5.726 4.468 1.258 1
1 685 . 14 1 1 A 113 113 HIS H H 113 8.960 8.162 0.798 1
1 686 . 14 1 1 A 113 113 HIS HA H 113 3.876 4.854 -0.978 1
1 691 . 14 1 1 A 114 114 SER H H 114 8.367 8.220 0.147 1
1 692 . 14 1 1 A 114 114 SER HA H 114 4.024 4.414 -0.390 1
1 695 . 14 1 1 A 115 115 LYS H H 115 8.140 7.534 0.606 1
1 696 . 14 1 1 A 115 115 LYS HA H 115 5.403 4.241 1.162 1
1 699 . 14 1 1 A 116 116 VAL H H 116 8.525 7.937 0.588 1
1 700 . 14 1 1 A 116 116 VAL HA H 116 5.378 4.047 1.331 1
1 708 . 14 1 1 A 117 117 ASP H H 117 8.025 9.115 -1.090 1
1 709 . 14 1 1 A 117 117 ASP HA H 117 5.243 4.616 0.627 1
1 712 . 14 1 1 A 118 118 LYS H H 118 8.930 8.078 0.852 1
1 713 . 14 1 1 A 118 118 LYS HA H 118 4.216 4.592 -0.376 1
1 716 . 14 1 1 A 119 119 ASN H H 119 8.425 8.162 0.263 1
1 717 . 14 1 1 A 119 119 ASN HA H 119 5.061 4.930 0.131 1
1 722 . 14 1 1 A 120 120 ASN H H 120 8.061 8.172 -0.111 1
1 723 . 14 1 1 A 120 120 ASN HA H 120 4.212 4.441 -0.229 1
1 728 . 14 1 1 A 121 121 GLN H H 121 8.359 8.381 -0.022 1
1 729 . 14 1 1 A 121 121 GLN HA H 121 4.373 4.162 0.211 1
1 735 . 14 1 1 A 122 122 GLY H H 122 8.770 7.476 1.294 1
1 736 . 14 1 1 A 122 122 GLY HA2 H 122 3.182 3.923 -0.741 1
1 737 . 14 1 1 A 122 122 GLY HA3 H 122 5.268 3.947 1.321 1
1 738 . 14 1 1 A 123 123 LYS H H 123 8.587 8.302 0.285 1
1 739 . 14 1 1 A 123 123 LYS HA H 123 4.016 4.437 -0.421 1
1 745 . 14 1 1 A 124 124 GLU H H 124 8.527 8.100 0.427 1
1 746 . 14 1 1 A 124 124 GLU HA H 124 4.152 4.087 0.065 1
1 750 . 14 1 1 A 125 125 PHE H H 125 7.936 7.121 0.815 1
1 751 . 14 1 1 A 125 125 PHE HA H 125 4.670 4.968 -0.298 1
1 758 . 14 1 1 A 126 126 PHE H H 126 8.214 9.350 -1.136 1
1 759 . 14 1 1 A 126 126 PHE HA H 126 5.177 5.145 0.032 1
1 767 . 14 1 1 A 127 127 GLU H H 127 9.169 8.550 0.619 1
1 768 . 14 1 1 A 127 127 GLU HA H 127 4.852 4.394 0.458 1
1 773 . 14 1 1 A 128 128 LYS H H 128 9.000 8.185 0.815 1
1 774 . 14 1 1 A 128 128 LYS HA H 128 4.191 3.711 0.480 1
1 777 . 14 1 1 A 129 129 CYS H H 129 8.938 8.888 0.050 1
1 778 . 14 1 1 A 129 129 CYS HA H 129 5.268 4.483 0.785 1
1 5 . 15 1 1 A 2 2 PRO HA H 2 4.900 4.534 0.366 1
1 10 . 15 1 1 A 3 3 ILE H H 3 8.774 7.504 1.270 1
1 11 . 15 1 1 A 3 3 ILE HA H 3 5.499 4.636 0.863 1
1 20 . 15 1 1 A 4 4 VAL H H 4 9.501 9.362 0.139 1
1 21 . 15 1 1 A 4 4 VAL HA H 4 4.944 5.162 -0.218 1
1 29 . 15 1 1 A 5 5 THR H H 5 9.243 9.199 0.044 1
1 30 . 15 1 1 A 5 5 THR HA H 5 5.278 5.376 -0.098 1
1 35 . 15 1 1 A 6 6 CYS H H 6 9.815 8.806 1.009 1
1 36 . 15 1 1 A 6 6 CYS HA H 6 5.310 4.635 0.675 1
1 38 . 15 1 1 A 7 7 ARG H H 7 9.154 8.472 0.682 1
1 41 . 15 1 1 A 8 8 PRO HA H 8 4.594 4.595 -0.001 1
1 47 . 15 1 1 A 9 9 LYS H H 9 8.179 8.392 -0.213 1
1 48 . 15 1 1 A 9 9 LYS HA H 9 4.857 4.860 -0.003 1
1 52 . 15 1 1 A 10 10 LEU H H 10 9.108 7.912 1.196 1
1 53 . 15 1 1 A 10 10 LEU HA H 10 5.147 4.567 0.580 1
1 63 . 15 1 1 A 11 11 ASP H H 11 9.835 7.765 2.070 1
1 64 . 15 1 1 A 11 11 ASP HA H 11 4.471 4.606 -0.135 1
1 67 . 15 1 1 A 12 12 GLY H H 12 8.847 8.461 0.386 1
1 68 . 15 1 1 A 12 12 GLY HA2 H 12 3.782 3.839 -0.057 1
1 69 . 15 1 1 A 12 12 GLY HA3 H 12 4.427 3.846 0.581 1
1 70 . 15 1 1 A 13 13 ARG H H 13 7.933 7.651 0.282 1
1 71 . 15 1 1 A 13 13 ARG HA H 13 4.886 4.851 0.035 1
1 77 . 15 1 1 A 14 14 GLU H H 14 9.179 8.432 0.747 1
1 78 . 15 1 1 A 14 14 GLU HA H 14 4.178 4.586 -0.408 1
1 82 . 15 1 1 A 15 15 LYS H H 15 9.078 8.898 0.180 1
1 83 . 15 1 1 A 15 15 LYS HA H 15 4.890 4.759 0.131 1
1 84 . 15 1 1 A 16 16 PRO HA H 16 5.144 4.932 0.212 1
1 91 . 15 1 1 A 17 17 PHE H H 17 9.487 8.581 0.906 1
1 92 . 15 1 1 A 17 17 PHE HA H 17 4.760 4.551 0.209 1
1 100 . 15 1 1 A 18 18 LYS H H 18 9.315 8.588 0.727 1
1 101 . 15 1 1 A 18 18 LYS HA H 18 5.197 4.193 1.004 1
1 108 . 15 1 1 A 19 19 VAL H H 19 9.643 8.765 0.878 1
1 109 . 15 1 1 A 19 19 VAL HA H 19 4.796 5.082 -0.286 1
1 117 . 15 1 1 A 20 20 ASP H H 20 9.555 8.763 0.792 1
1 118 . 15 1 1 A 20 20 ASP HA H 20 5.151 5.483 -0.332 1
1 121 . 15 1 1 A 21 21 VAL H H 21 9.607 8.678 0.929 1
1 122 . 15 1 1 A 21 21 VAL HA H 21 3.611 3.909 -0.298 1
1 130 . 15 1 1 A 22 22 ALA H H 22 8.531 8.201 0.330 1
1 131 . 15 1 1 A 22 22 ALA HA H 22 4.299 3.890 0.409 1
1 135 . 15 1 1 A 23 23 THR H H 23 7.294 8.251 -0.957 1
1 136 . 15 1 1 A 23 23 THR HA H 23 4.264 3.810 0.454 1
1 141 . 15 1 1 A 24 24 ALA H H 24 8.346 8.191 0.155 1
1 142 . 15 1 1 A 24 24 ALA HA H 24 4.082 4.146 -0.064 1
1 146 . 15 1 1 A 25 25 GLN H H 25 8.866 8.265 0.601 1
1 147 . 15 1 1 A 25 25 GLN HA H 25 3.804 3.843 -0.039 1
1 153 . 15 1 1 A 26 26 ALA H H 26 7.767 8.033 -0.266 1
1 154 . 15 1 1 A 26 26 ALA HA H 26 4.208 3.984 0.224 1
1 158 . 15 1 1 A 27 27 GLN H H 27 8.881 8.198 0.683 1
1 159 . 15 1 1 A 27 27 GLN HA H 27 4.041 3.754 0.287 1
1 165 . 15 1 1 A 28 28 ALA H H 28 8.142 7.907 0.235 1
1 166 . 15 1 1 A 28 28 ALA HA H 28 3.475 3.246 0.229 1
1 170 . 15 1 1 A 29 29 ARG H H 29 7.291 7.797 -0.506 1
1 171 . 15 1 1 A 29 29 ARG HA H 29 3.688 3.778 -0.090 1
1 174 . 15 1 1 A 30 30 LYS H H 30 7.768 7.979 -0.211 1
1 175 . 15 1 1 A 30 30 LYS HA H 30 4.038 3.914 0.124 1
1 179 . 15 1 1 A 31 31 ALA H H 31 8.127 7.740 0.387 1
1 180 . 15 1 1 A 31 31 ALA HA H 31 3.656 3.939 -0.283 1
1 184 . 15 1 1 A 32 32 GLY H H 32 7.670 7.588 0.082 1
1 185 . 15 1 1 A 32 32 GLY HA2 H 32 3.380 3.787 -0.407 1
1 186 . 15 1 1 A 32 32 GLY HA3 H 32 3.844 3.807 0.037 1
1 187 . 15 1 1 A 33 33 LEU H H 33 8.057 8.173 -0.116 1
1 188 . 15 1 1 A 33 33 LEU HA H 33 3.259 3.059 0.200 1
1 197 . 15 1 1 A 34 34 THR H H 34 6.862 7.067 -0.205 1
1 198 . 15 1 1 A 34 34 THR HA H 34 4.738 4.990 -0.252 1
1 203 . 15 1 1 A 35 35 THR H H 35 9.161 9.053 0.108 1
1 204 . 15 1 1 A 35 35 THR HA H 35 4.247 5.222 -0.975 1
1 209 . 15 1 1 A 36 36 GLY H H 36 8.407 8.308 0.099 1
1 210 . 15 1 1 A 36 36 GLY HA2 H 36 4.349 4.035 0.314 1
1 211 . 15 1 1 A 36 36 GLY HA3 H 36 4.967 4.044 0.923 1
1 212 . 15 1 1 A 37 37 LYS H H 37 10.152 8.377 1.775 1
1 213 . 15 1 1 A 37 37 LYS HA H 37 4.383 4.126 0.257 1
1 221 . 15 1 1 A 38 38 SER H H 38 9.085 8.126 0.959 1
1 222 . 15 1 1 A 38 38 SER HA H 38 4.338 4.770 -0.432 1
1 226 . 15 1 1 A 39 39 GLY H H 39 8.474 7.718 0.756 1
1 227 . 15 1 1 A 39 39 GLY HA2 H 39 3.840 4.137 -0.297 1
1 228 . 15 1 1 A 40 40 ASP H H 40 9.424 7.595 1.829 1
1 229 . 15 1 1 A 40 40 ASP HA H 40 5.374 4.534 0.840 1
1 231 . 15 1 1 A 41 41 PRO HA H 41 5.624 4.513 1.111 1
1 238 . 15 1 1 A 42 42 HIS H H 42 8.343 8.658 -0.315 1
1 239 . 15 1 1 A 42 42 HIS HA H 42 5.189 5.247 -0.058 1
1 244 . 15 1 1 A 43 43 ARG H H 43 8.634 8.374 0.260 1
1 245 . 15 1 1 A 43 43 ARG HA H 43 3.654 3.382 0.272 1
1 252 . 15 1 1 A 44 44 TYR H H 44 8.188 8.723 -0.535 1
1 253 . 15 1 1 A 44 44 TYR HA H 44 5.021 4.444 0.577 1
1 260 . 15 1 1 A 45 45 PHE H H 45 8.728 7.728 1.000 1
1 261 . 15 1 1 A 45 45 PHE HA H 45 4.480 5.559 -1.079 1
1 268 . 15 1 1 A 46 46 ALA H H 46 5.979 8.781 -2.802 1
1 269 . 15 1 1 A 46 46 ALA HA H 46 3.797 4.458 -0.661 1
1 273 . 15 1 1 A 47 47 GLY H H 47 8.510 8.506 0.004 1
1 274 . 15 1 1 A 47 47 GLY HA2 H 47 3.953 3.988 -0.035 1
1 275 . 15 1 1 A 47 47 GLY HA3 H 47 4.075 3.995 0.080 1
1 276 . 15 1 1 A 48 48 ASP H H 48 7.504 7.705 -0.201 1
1 277 . 15 1 1 A 48 48 ASP HA H 48 5.020 4.696 0.324 1
1 280 . 15 1 1 A 49 49 HIS H H 49 8.240 8.862 -0.622 1
1 281 . 15 1 1 A 49 49 HIS HA H 49 4.373 4.310 0.063 1
1 285 . 15 1 1 A 50 50 ILE H H 50 8.468 7.601 0.867 1
1 286 . 15 1 1 A 50 50 ILE HA H 50 3.651 3.799 -0.148 1
1 296 . 15 1 1 A 51 51 ARG H H 51 8.404 8.612 -0.208 1
1 297 . 15 1 1 A 51 51 ARG HA H 51 4.450 4.627 -0.177 1
1 303 . 15 1 1 A 52 52 TRP H H 52 11.176 7.739 3.437 1
1 304 . 15 1 1 A 52 52 TRP HA H 52 4.423 4.213 0.210 1
1 312 . 15 1 1 A 53 53 GLY H H 53 10.422 8.737 1.685 1
1 313 . 15 1 1 A 53 53 GLY HA2 H 53 3.832 3.910 -0.078 1
1 314 . 15 1 1 A 53 53 GLY HA3 H 53 4.411 3.936 0.475 1
1 315 . 15 1 1 A 54 54 VAL H H 54 7.040 7.464 -0.424 1
1 316 . 15 1 1 A 54 54 VAL HA H 54 4.489 4.698 -0.209 1
1 324 . 15 1 1 A 55 55 ASN H H 55 9.530 8.917 0.613 1
1 325 . 15 1 1 A 55 55 ASN HA H 55 4.569 4.394 0.175 1
1 330 . 15 1 1 A 56 56 ASN H H 56 9.175 8.240 0.935 1
1 331 . 15 1 1 A 56 56 ASN HA H 56 4.649 4.341 0.308 1
1 336 . 15 1 1 A 57 57 CYS H H 57 7.613 8.469 -0.856 1
1 337 . 15 1 1 A 57 57 CYS HA H 57 4.645 4.162 0.483 1
1 340 . 15 1 1 A 58 58 ASP H H 58 7.626 8.122 -0.496 1
1 341 . 15 1 1 A 58 58 ASP HA H 58 5.206 4.384 0.822 1
1 344 . 15 1 1 A 59 59 LYS H H 59 7.349 7.413 -0.064 1
1 345 . 15 1 1 A 59 59 LYS HA H 59 4.548 4.284 0.264 1
1 350 . 15 1 1 A 60 60 ALA H H 60 9.155 8.759 0.396 1
1 351 . 15 1 1 A 60 60 ALA HA H 60 4.330 4.205 0.125 1
1 355 . 15 1 1 A 61 61 ASP H H 61 8.548 7.824 0.724 1
1 356 . 15 1 1 A 61 61 ASP HA H 61 4.827 4.803 0.024 1
1 359 . 15 1 1 A 62 62 ALA H H 62 7.463 7.381 0.082 1
1 360 . 15 1 1 A 62 62 ALA HA H 62 4.217 4.503 -0.286 1
1 364 . 15 1 1 A 63 63 ILE H H 63 9.302 8.615 0.687 1
1 365 . 15 1 1 A 63 63 ILE HA H 63 4.332 4.604 -0.272 1
1 374 . 15 1 1 A 64 64 LEU H H 64 8.724 9.141 -0.417 1
1 375 . 15 1 1 A 64 64 LEU HA H 64 5.463 5.108 0.355 1
1 385 . 15 1 1 A 65 65 TRP H H 65 9.621 8.320 1.301 1
1 386 . 15 1 1 A 65 65 TRP HA H 65 4.605 5.383 -0.778 1
1 395 . 15 1 1 A 66 66 GLU H H 66 8.388 9.278 -0.890 1
1 396 . 15 1 1 A 66 66 GLU HA H 66 6.014 5.656 0.358 1
1 401 . 15 1 1 A 67 67 TYR H H 67 8.766 9.194 -0.428 1
1 402 . 15 1 1 A 67 67 TYR HA H 67 5.204 5.186 0.018 1
1 405 . 15 1 1 A 68 68 PRO HA H 68 4.523 4.416 0.107 1
1 412 . 15 1 1 A 69 69 ILE H H 69 7.308 8.164 -0.856 1
1 413 . 15 1 1 A 69 69 ILE HA H 69 4.870 5.506 -0.636 1
1 414 . 15 1 1 A 70 70 TYR H H 70 9.219 9.037 0.182 1
1 415 . 15 1 1 A 70 70 TYR HA H 70 4.854 4.630 0.224 1
1 423 . 15 1 1 A 71 71 TRP H H 71 6.662 8.243 -1.581 1
1 424 . 15 1 1 A 71 71 TRP HA H 71 5.496 4.914 0.582 1
1 432 . 15 1 1 A 72 72 VAL H H 72 9.510 9.024 0.486 1
1 433 . 15 1 1 A 72 72 VAL HA H 72 3.999 3.739 0.260 1
1 441 . 15 1 1 A 73 73 GLY H H 73 9.221 8.395 0.826 1
1 442 . 15 1 1 A 73 73 GLY HA2 H 73 3.877 3.843 0.034 1
1 443 . 15 1 1 A 73 73 GLY HA3 H 73 4.682 3.862 0.820 1
1 444 . 15 1 1 A 74 74 LYS H H 74 7.962 7.828 0.134 1
1 445 . 15 1 1 A 74 74 LYS HA H 74 4.469 4.156 0.313 1
1 457 . 15 1 1 A 75 75 ASN H H 75 8.928 8.952 -0.024 1
1 458 . 15 1 1 A 75 75 ASN HA H 75 4.837 5.093 -0.256 1
1 463 . 15 1 1 A 76 76 ALA H H 76 7.544 8.099 -0.555 1
1 464 . 15 1 1 A 76 76 ALA HA H 76 4.555 4.749 -0.194 1
1 468 . 15 1 1 A 77 77 GLU H H 77 8.290 8.529 -0.239 1
1 469 . 15 1 1 A 77 77 GLU HA H 77 4.900 3.716 1.184 1
1 474 . 15 1 1 A 78 78 TRP H H 78 10.065 8.647 1.418 1
1 475 . 15 1 1 A 78 78 TRP HA H 78 4.600 4.957 -0.357 1
1 484 . 15 1 1 A 79 79 ALA H H 79 9.850 8.035 1.815 1
1 485 . 15 1 1 A 79 79 ALA HA H 79 5.022 4.706 0.316 1
1 489 . 15 1 1 A 80 80 LYS H H 80 9.255 9.007 0.248 1
1 490 . 15 1 1 A 80 80 LYS HA H 80 4.511 4.183 0.328 1
1 494 . 15 1 1 A 81 81 ASP H H 81 9.332 8.290 1.042 1
1 495 . 15 1 1 A 81 81 ASP HA H 81 5.429 4.730 0.699 1
1 498 . 15 1 1 A 82 82 VAL H H 82 7.226 7.569 -0.343 1
1 499 . 15 1 1 A 82 82 VAL HA H 82 4.248 4.657 -0.409 1
1 507 . 15 1 1 A 83 83 LYS H H 83 8.407 8.688 -0.281 1
1 508 . 15 1 1 A 83 83 LYS HA H 83 4.356 4.457 -0.101 1
1 510 . 15 1 1 A 84 84 THR H H 84 9.088 9.083 0.005 1
1 511 . 15 1 1 A 84 84 THR HA H 84 3.989 4.005 -0.016 1
1 516 . 15 1 1 A 85 85 SER H H 85 8.391 8.044 0.347 1
1 517 . 15 1 1 A 85 85 SER HA H 85 4.442 4.033 0.409 1
1 520 . 15 1 1 A 86 86 GLN H H 86 7.974 8.084 -0.110 1
1 521 . 15 1 1 A 86 86 GLN HA H 86 4.585 4.008 0.577 1
1 527 . 15 1 1 A 87 87 GLN H H 87 7.083 7.558 -0.475 1
1 528 . 15 1 1 A 87 87 GLN HA H 87 3.903 3.911 -0.008 1
1 534 . 15 1 1 A 88 88 LYS H H 88 9.453 8.489 0.964 1
1 535 . 15 1 1 A 88 88 LYS HA H 88 4.114 3.939 0.175 1
1 539 . 15 1 1 A 89 89 GLY H H 89 9.466 8.125 1.341 1
1 540 . 15 1 1 A 89 89 GLY HA2 H 89 3.965 3.938 0.027 1
1 541 . 15 1 1 A 89 89 GLY HA3 H 89 3.148 4.005 -0.857 1
1 542 . 15 1 1 A 90 90 GLY H H 90 7.228 7.552 -0.324 1
1 543 . 15 1 1 A 90 90 GLY HA2 H 90 4.290 4.049 0.241 1
1 544 . 15 1 1 A 90 90 GLY HA3 H 90 4.682 4.080 0.602 1
1 545 . 15 1 1 A 91 91 PRO HA H 91 4.902 4.947 -0.045 1
1 552 . 15 1 1 A 92 92 THR H H 92 8.585 8.649 -0.064 1
1 553 . 15 1 1 A 92 92 THR HA H 92 5.701 4.639 1.062 1
1 559 . 15 1 1 A 93 93 PRO HA H 93 5.551 3.575 1.976 1
1 563 . 15 1 1 A 94 94 ILE H H 94 8.155 7.445 0.710 1
1 564 . 15 1 1 A 94 94 ILE HA H 94 4.794 4.313 0.481 1
1 571 . 15 1 1 A 95 95 ARG H H 95 9.538 9.301 0.237 1
1 572 . 15 1 1 A 95 95 ARG HA H 95 5.278 5.386 -0.108 1
1 576 . 15 1 1 A 96 96 VAL H H 96 9.276 8.927 0.349 1
1 577 . 15 1 1 A 96 96 VAL HA H 96 5.222 4.346 0.876 1
1 585 . 15 1 1 A 97 97 VAL H H 97 8.739 9.053 -0.314 1
1 586 . 15 1 1 A 97 97 VAL HA H 97 5.160 5.351 -0.191 1
1 594 . 15 1 1 A 98 98 TYR H H 98 8.596 8.361 0.235 1
1 595 . 15 1 1 A 98 98 TYR HA H 98 5.266 5.038 0.228 1
1 603 . 15 1 1 A 99 99 ALA H H 99 9.685 8.557 1.128 1
1 604 . 15 1 1 A 99 99 ALA HA H 99 5.680 4.508 1.172 1
1 608 . 15 1 1 A 100 100 ASN H H 100 8.468 8.978 -0.510 1
1 609 . 15 1 1 A 100 100 ASN HA H 100 4.885 4.871 0.014 1
1 614 . 15 1 1 A 101 101 SER H H 101 9.342 8.016 1.326 1
1 615 . 15 1 1 A 101 101 SER HA H 101 4.993 4.627 0.366 1
1 618 . 15 1 1 A 102 102 ARG H H 102 9.349 9.182 0.167 1
1 619 . 15 1 1 A 102 102 ARG HA H 102 4.068 4.050 0.018 1
1 620 . 15 1 1 A 103 103 GLY H H 103 8.632 8.466 0.166 1
1 621 . 15 1 1 A 103 103 GLY HA2 H 103 3.691 3.862 -0.171 1
1 622 . 15 1 1 A 103 103 GLY HA3 H 103 4.341 3.875 0.466 1
1 623 . 15 1 1 A 104 104 ALA H H 104 7.820 7.672 0.148 1
1 624 . 15 1 1 A 104 104 ALA HA H 104 4.775 4.362 0.413 1
1 628 . 15 1 1 A 105 105 VAL H H 105 8.402 8.528 -0.126 1
1 629 . 15 1 1 A 105 105 VAL HA H 105 4.218 4.424 -0.206 1
1 637 . 15 1 1 A 106 106 GLN H H 106 9.352 8.444 0.908 1
1 638 . 15 1 1 A 106 106 GLN HA H 106 4.900 4.620 0.280 1
1 645 . 15 1 1 A 107 107 TYR H H 107 9.075 8.082 0.993 1
1 646 . 15 1 1 A 107 107 TYR HA H 107 4.007 4.120 -0.113 1
1 653 . 15 1 1 A 108 108 CYS H H 108 8.197 7.760 0.437 1
1 654 . 15 1 1 A 108 108 CYS HA H 108 4.823 4.052 0.771 1
1 657 . 15 1 1 A 109 109 GLY H H 109 6.856 6.698 0.158 1
1 658 . 15 1 1 A 109 109 GLY HA2 H 109 3.983 3.240 0.743 1
1 659 . 15 1 1 A 109 109 GLY HA3 H 109 4.422 3.287 1.135 1
1 660 . 15 1 1 A 110 110 VAL H H 110 9.418 8.465 0.953 1
1 661 . 15 1 1 A 110 110 VAL HA H 110 5.073 4.877 0.196 1
1 669 . 15 1 1 A 111 111 MET H H 111 9.327 9.563 -0.236 1
1 670 . 15 1 1 A 111 111 MET HA H 111 5.678 5.596 0.082 1
1 678 . 15 1 1 A 112 112 THR H H 112 9.310 9.485 -0.175 1
1 679 . 15 1 1 A 112 112 THR HA H 112 5.726 4.767 0.959 1
1 685 . 15 1 1 A 113 113 HIS H H 113 8.960 8.048 0.912 1
1 686 . 15 1 1 A 113 113 HIS HA H 113 3.876 4.715 -0.839 1
1 691 . 15 1 1 A 114 114 SER H H 114 8.367 8.178 0.189 1
1 692 . 15 1 1 A 114 114 SER HA H 114 4.024 4.220 -0.196 1
1 695 . 15 1 1 A 115 115 LYS H H 115 8.140 7.358 0.782 1
1 696 . 15 1 1 A 115 115 LYS HA H 115 5.403 4.307 1.096 1
1 699 . 15 1 1 A 116 116 VAL H H 116 8.525 8.014 0.511 1
1 700 . 15 1 1 A 116 116 VAL HA H 116 5.378 4.799 0.579 1
1 708 . 15 1 1 A 117 117 ASP H H 117 8.025 8.795 -0.770 1
1 709 . 15 1 1 A 117 117 ASP HA H 117 5.243 4.866 0.377 1
1 712 . 15 1 1 A 118 118 LYS H H 118 8.930 8.257 0.673 1
1 713 . 15 1 1 A 118 118 LYS HA H 118 4.216 4.171 0.045 1
1 716 . 15 1 1 A 119 119 ASN H H 119 8.425 7.743 0.682 1
1 717 . 15 1 1 A 119 119 ASN HA H 119 5.061 5.096 -0.035 1
1 722 . 15 1 1 A 120 120 ASN H H 120 8.061 9.130 -1.069 1
1 723 . 15 1 1 A 120 120 ASN HA H 120 4.212 4.855 -0.643 1
1 728 . 15 1 1 A 121 121 GLN H H 121 8.359 8.166 0.193 1
1 729 . 15 1 1 A 121 121 GLN HA H 121 4.373 4.465 -0.092 1
1 735 . 15 1 1 A 122 122 GLY H H 122 8.770 7.895 0.875 1
1 736 . 15 1 1 A 122 122 GLY HA2 H 122 3.182 3.955 -0.773 1
1 737 . 15 1 1 A 122 122 GLY HA3 H 122 5.268 4.009 1.259 1
1 738 . 15 1 1 A 123 123 LYS H H 123 8.587 8.397 0.190 1
1 739 . 15 1 1 A 123 123 LYS HA H 123 4.016 4.467 -0.451 1
1 745 . 15 1 1 A 124 124 GLU H H 124 8.527 7.941 0.586 1
1 746 . 15 1 1 A 124 124 GLU HA H 124 4.152 4.205 -0.053 1
1 750 . 15 1 1 A 125 125 PHE H H 125 7.936 7.222 0.714 1
1 751 . 15 1 1 A 125 125 PHE HA H 125 4.670 4.979 -0.309 1
1 758 . 15 1 1 A 126 126 PHE H H 126 8.214 8.827 -0.613 1
1 759 . 15 1 1 A 126 126 PHE HA H 126 5.177 5.042 0.135 1
1 767 . 15 1 1 A 127 127 GLU H H 127 9.169 8.809 0.360 1
1 768 . 15 1 1 A 127 127 GLU HA H 127 4.852 4.532 0.320 1
1 773 . 15 1 1 A 128 128 LYS H H 128 9.000 8.332 0.668 1
1 774 . 15 1 1 A 128 128 LYS HA H 128 4.191 4.064 0.127 1
1 777 . 15 1 1 A 129 129 CYS H H 129 8.938 8.617 0.321 1
1 778 . 15 1 1 A 129 129 CYS HA H 129 5.268 4.894 0.374 1
1 5 . 16 1 1 A 2 2 PRO HA H 2 4.900 4.498 0.402 1
1 10 . 16 1 1 A 3 3 ILE H H 3 8.774 7.440 1.334 1
1 11 . 16 1 1 A 3 3 ILE HA H 3 5.499 4.754 0.745 1
1 20 . 16 1 1 A 4 4 VAL H H 4 9.501 9.388 0.113 1
1 21 . 16 1 1 A 4 4 VAL HA H 4 4.944 5.247 -0.303 1
1 29 . 16 1 1 A 5 5 THR H H 5 9.243 9.126 0.117 1
1 30 . 16 1 1 A 5 5 THR HA H 5 5.278 5.324 -0.046 1
1 35 . 16 1 1 A 6 6 CYS H H 6 9.815 8.988 0.827 1
1 36 . 16 1 1 A 6 6 CYS HA H 6 5.310 4.671 0.639 1
1 38 . 16 1 1 A 7 7 ARG H H 7 9.154 8.256 0.898 1
1 41 . 16 1 1 A 8 8 PRO HA H 8 4.594 4.810 -0.216 1
1 47 . 16 1 1 A 9 9 LYS H H 9 8.179 8.475 -0.296 1
1 48 . 16 1 1 A 9 9 LYS HA H 9 4.857 4.905 -0.048 1
1 52 . 16 1 1 A 10 10 LEU H H 10 9.108 8.339 0.769 1
1 53 . 16 1 1 A 10 10 LEU HA H 10 5.147 4.727 0.420 1
1 63 . 16 1 1 A 11 11 ASP H H 11 9.835 8.129 1.706 1
1 64 . 16 1 1 A 11 11 ASP HA H 11 4.471 4.851 -0.380 1
1 67 . 16 1 1 A 12 12 GLY H H 12 8.847 8.030 0.817 1
1 68 . 16 1 1 A 12 12 GLY HA2 H 12 3.782 3.959 -0.177 1
1 69 . 16 1 1 A 12 12 GLY HA3 H 12 4.427 3.966 0.461 1
1 70 . 16 1 1 A 13 13 ARG H H 13 7.933 7.756 0.177 1
1 71 . 16 1 1 A 13 13 ARG HA H 13 4.886 4.461 0.425 1
1 77 . 16 1 1 A 14 14 GLU H H 14 9.179 8.614 0.565 1
1 78 . 16 1 1 A 14 14 GLU HA H 14 4.178 4.602 -0.424 1
1 82 . 16 1 1 A 15 15 LYS H H 15 9.078 9.182 -0.104 1
1 83 . 16 1 1 A 15 15 LYS HA H 15 4.890 4.780 0.110 1
1 84 . 16 1 1 A 16 16 PRO HA H 16 5.144 4.922 0.222 1
1 91 . 16 1 1 A 17 17 PHE H H 17 9.487 8.507 0.980 1
1 92 . 16 1 1 A 17 17 PHE HA H 17 4.760 4.913 -0.153 1
1 100 . 16 1 1 A 18 18 LYS H H 18 9.315 8.853 0.462 1
1 101 . 16 1 1 A 18 18 LYS HA H 18 5.197 4.427 0.770 1
1 108 . 16 1 1 A 19 19 VAL H H 19 9.643 8.698 0.945 1
1 109 . 16 1 1 A 19 19 VAL HA H 19 4.796 4.763 0.033 1
1 117 . 16 1 1 A 20 20 ASP H H 20 9.555 8.921 0.634 1
1 118 . 16 1 1 A 20 20 ASP HA H 20 5.151 4.992 0.159 1
1 121 . 16 1 1 A 21 21 VAL H H 21 9.607 8.604 1.003 1
1 122 . 16 1 1 A 21 21 VAL HA H 21 3.611 3.731 -0.120 1
1 130 . 16 1 1 A 22 22 ALA H H 22 8.531 8.042 0.489 1
1 131 . 16 1 1 A 22 22 ALA HA H 22 4.299 3.927 0.372 1
1 135 . 16 1 1 A 23 23 THR H H 23 7.294 8.534 -1.240 1
1 136 . 16 1 1 A 23 23 THR HA H 23 4.264 3.847 0.417 1
1 141 . 16 1 1 A 24 24 ALA H H 24 8.346 8.273 0.073 1
1 142 . 16 1 1 A 24 24 ALA HA H 24 4.082 4.125 -0.043 1
1 146 . 16 1 1 A 25 25 GLN H H 25 8.866 8.468 0.398 1
1 147 . 16 1 1 A 25 25 GLN HA H 25 3.804 3.926 -0.122 1
1 153 . 16 1 1 A 26 26 ALA H H 26 7.767 8.219 -0.452 1
1 154 . 16 1 1 A 26 26 ALA HA H 26 4.208 4.021 0.187 1
1 158 . 16 1 1 A 27 27 GLN H H 27 8.881 8.285 0.596 1
1 159 . 16 1 1 A 27 27 GLN HA H 27 4.041 3.999 0.042 1
1 165 . 16 1 1 A 28 28 ALA H H 28 8.142 8.106 0.036 1
1 166 . 16 1 1 A 28 28 ALA HA H 28 3.475 3.605 -0.130 1
1 170 . 16 1 1 A 29 29 ARG H H 29 7.291 7.685 -0.394 1
1 171 . 16 1 1 A 29 29 ARG HA H 29 3.688 3.827 -0.139 1
1 174 . 16 1 1 A 30 30 LYS H H 30 7.768 8.062 -0.294 1
1 175 . 16 1 1 A 30 30 LYS HA H 30 4.038 3.863 0.175 1
1 179 . 16 1 1 A 31 31 ALA H H 31 8.127 7.187 0.940 1
1 180 . 16 1 1 A 31 31 ALA HA H 31 3.656 3.903 -0.247 1
1 184 . 16 1 1 A 32 32 GLY H H 32 7.670 7.635 0.035 1
1 185 . 16 1 1 A 32 32 GLY HA2 H 32 3.380 3.733 -0.353 1
1 186 . 16 1 1 A 32 32 GLY HA3 H 32 3.844 3.776 0.068 1
1 187 . 16 1 1 A 33 33 LEU H H 33 8.057 8.191 -0.134 1
1 188 . 16 1 1 A 33 33 LEU HA H 33 3.259 3.196 0.063 1
1 197 . 16 1 1 A 34 34 THR H H 34 6.862 7.098 -0.236 1
1 198 . 16 1 1 A 34 34 THR HA H 34 4.738 4.907 -0.169 1
1 203 . 16 1 1 A 35 35 THR H H 35 9.161 9.182 -0.021 1
1 204 . 16 1 1 A 35 35 THR HA H 35 4.247 5.266 -1.019 1
1 209 . 16 1 1 A 36 36 GLY H H 36 8.407 8.615 -0.208 1
1 210 . 16 1 1 A 36 36 GLY HA2 H 36 4.349 4.167 0.182 1
1 211 . 16 1 1 A 36 36 GLY HA3 H 36 4.967 4.171 0.796 1
1 212 . 16 1 1 A 37 37 LYS H H 37 10.152 7.896 2.256 1
1 213 . 16 1 1 A 37 37 LYS HA H 37 4.383 4.591 -0.208 1
1 221 . 16 1 1 A 38 38 SER H H 38 9.085 8.335 0.750 1
1 222 . 16 1 1 A 38 38 SER HA H 38 4.338 4.725 -0.387 1
1 226 . 16 1 1 A 39 39 GLY H H 39 8.474 7.592 0.882 1
1 227 . 16 1 1 A 39 39 GLY HA2 H 39 3.840 4.204 -0.364 1
1 228 . 16 1 1 A 40 40 ASP H H 40 9.424 7.769 1.655 1
1 229 . 16 1 1 A 40 40 ASP HA H 40 5.374 4.694 0.680 1
1 231 . 16 1 1 A 41 41 PRO HA H 41 5.624 4.594 1.030 1
1 238 . 16 1 1 A 42 42 HIS H H 42 8.343 8.564 -0.221 1
1 239 . 16 1 1 A 42 42 HIS HA H 42 5.189 5.289 -0.100 1
1 244 . 16 1 1 A 43 43 ARG H H 43 8.634 8.280 0.354 1
1 245 . 16 1 1 A 43 43 ARG HA H 43 3.654 3.356 0.298 1
1 252 . 16 1 1 A 44 44 TYR H H 44 8.188 8.606 -0.418 1
1 253 . 16 1 1 A 44 44 TYR HA H 44 5.021 4.528 0.493 1
1 260 . 16 1 1 A 45 45 PHE H H 45 8.728 7.806 0.922 1
1 261 . 16 1 1 A 45 45 PHE HA H 45 4.480 5.493 -1.013 1
1 268 . 16 1 1 A 46 46 ALA H H 46 5.979 8.377 -2.398 1
1 269 . 16 1 1 A 46 46 ALA HA H 46 3.797 4.573 -0.776 1
1 273 . 16 1 1 A 47 47 GLY H H 47 8.510 8.767 -0.257 1
1 274 . 16 1 1 A 47 47 GLY HA2 H 47 3.953 4.003 -0.050 1
1 275 . 16 1 1 A 47 47 GLY HA3 H 47 4.075 4.023 0.052 1
1 276 . 16 1 1 A 48 48 ASP H H 48 7.504 7.827 -0.323 1
1 277 . 16 1 1 A 48 48 ASP HA H 48 5.020 4.664 0.356 1
1 280 . 16 1 1 A 49 49 HIS H H 49 8.240 8.714 -0.474 1
1 281 . 16 1 1 A 49 49 HIS HA H 49 4.373 4.291 0.082 1
1 285 . 16 1 1 A 50 50 ILE H H 50 8.468 7.657 0.811 1
1 286 . 16 1 1 A 50 50 ILE HA H 50 3.651 3.797 -0.146 1
1 296 . 16 1 1 A 51 51 ARG H H 51 8.404 8.547 -0.143 1
1 297 . 16 1 1 A 51 51 ARG HA H 51 4.450 4.722 -0.272 1
1 303 . 16 1 1 A 52 52 TRP H H 52 11.176 7.838 3.338 1
1 304 . 16 1 1 A 52 52 TRP HA H 52 4.423 4.230 0.193 1
1 312 . 16 1 1 A 53 53 GLY H H 53 10.422 8.774 1.648 1
1 313 . 16 1 1 A 53 53 GLY HA2 H 53 3.832 3.931 -0.099 1
1 314 . 16 1 1 A 53 53 GLY HA3 H 53 4.411 3.959 0.452 1
1 315 . 16 1 1 A 54 54 VAL H H 54 7.040 7.533 -0.493 1
1 316 . 16 1 1 A 54 54 VAL HA H 54 4.489 4.494 -0.005 1
1 324 . 16 1 1 A 55 55 ASN H H 55 9.530 8.964 0.566 1
1 325 . 16 1 1 A 55 55 ASN HA H 55 4.569 4.334 0.235 1
1 330 . 16 1 1 A 56 56 ASN H H 56 9.175 8.269 0.906 1
1 331 . 16 1 1 A 56 56 ASN HA H 56 4.649 4.430 0.219 1
1 336 . 16 1 1 A 57 57 CYS H H 57 7.613 8.259 -0.646 1
1 337 . 16 1 1 A 57 57 CYS HA H 57 4.645 4.162 0.483 1
1 340 . 16 1 1 A 58 58 ASP H H 58 7.626 8.180 -0.554 1
1 341 . 16 1 1 A 58 58 ASP HA H 58 5.206 4.777 0.429 1
1 344 . 16 1 1 A 59 59 LYS H H 59 7.349 7.494 -0.145 1
1 345 . 16 1 1 A 59 59 LYS HA H 59 4.548 4.402 0.146 1
1 350 . 16 1 1 A 60 60 ALA H H 60 9.155 8.418 0.737 1
1 351 . 16 1 1 A 60 60 ALA HA H 60 4.330 4.452 -0.122 1
1 355 . 16 1 1 A 61 61 ASP H H 61 8.548 8.502 0.046 1
1 356 . 16 1 1 A 61 61 ASP HA H 61 4.827 4.346 0.481 1
1 359 . 16 1 1 A 62 62 ALA H H 62 7.463 7.606 -0.143 1
1 360 . 16 1 1 A 62 62 ALA HA H 62 4.217 4.296 -0.079 1
1 364 . 16 1 1 A 63 63 ILE H H 63 9.302 8.544 0.758 1
1 365 . 16 1 1 A 63 63 ILE HA H 63 4.332 4.321 0.011 1
1 374 . 16 1 1 A 64 64 LEU H H 64 8.724 8.840 -0.116 1
1 375 . 16 1 1 A 64 64 LEU HA H 64 5.463 5.172 0.291 1
1 385 . 16 1 1 A 65 65 TRP H H 65 9.621 8.537 1.084 1
1 386 . 16 1 1 A 65 65 TRP HA H 65 4.605 5.350 -0.745 1
1 395 . 16 1 1 A 66 66 GLU H H 66 8.388 9.293 -0.905 1
1 396 . 16 1 1 A 66 66 GLU HA H 66 6.014 5.650 0.364 1
1 401 . 16 1 1 A 67 67 TYR H H 67 8.766 9.223 -0.457 1
1 402 . 16 1 1 A 67 67 TYR HA H 67 5.204 5.118 0.086 1
1 405 . 16 1 1 A 68 68 PRO HA H 68 4.523 4.421 0.102 1
1 412 . 16 1 1 A 69 69 ILE H H 69 7.308 8.172 -0.864 1
1 413 . 16 1 1 A 69 69 ILE HA H 69 4.870 5.368 -0.498 1
1 414 . 16 1 1 A 70 70 TYR H H 70 9.219 8.916 0.303 1
1 415 . 16 1 1 A 70 70 TYR HA H 70 4.854 4.570 0.284 1
1 423 . 16 1 1 A 71 71 TRP H H 71 6.662 8.256 -1.594 1
1 424 . 16 1 1 A 71 71 TRP HA H 71 5.496 4.804 0.692 1
1 432 . 16 1 1 A 72 72 VAL H H 72 9.510 8.934 0.576 1
1 433 . 16 1 1 A 72 72 VAL HA H 72 3.999 3.903 0.096 1
1 441 . 16 1 1 A 73 73 GLY H H 73 9.221 8.668 0.553 1
1 442 . 16 1 1 A 73 73 GLY HA2 H 73 3.877 3.898 -0.021 1
1 443 . 16 1 1 A 73 73 GLY HA3 H 73 4.682 3.931 0.751 1
1 444 . 16 1 1 A 74 74 LYS H H 74 7.962 7.452 0.510 1
1 445 . 16 1 1 A 74 74 LYS HA H 74 4.469 4.369 0.100 1
1 457 . 16 1 1 A 75 75 ASN H H 75 8.928 8.693 0.235 1
1 458 . 16 1 1 A 75 75 ASN HA H 75 4.837 5.078 -0.241 1
1 463 . 16 1 1 A 76 76 ALA H H 76 7.544 7.604 -0.060 1
1 464 . 16 1 1 A 76 76 ALA HA H 76 4.555 4.631 -0.076 1
1 468 . 16 1 1 A 77 77 GLU H H 77 8.290 8.474 -0.184 1
1 469 . 16 1 1 A 77 77 GLU HA H 77 4.900 4.468 0.432 1
1 474 . 16 1 1 A 78 78 TRP H H 78 10.065 9.012 1.053 1
1 475 . 16 1 1 A 78 78 TRP HA H 78 4.600 4.912 -0.312 1
1 484 . 16 1 1 A 79 79 ALA H H 79 9.850 8.545 1.305 1
1 485 . 16 1 1 A 79 79 ALA HA H 79 5.022 4.584 0.438 1
1 489 . 16 1 1 A 80 80 LYS H H 80 9.255 8.888 0.367 1
1 490 . 16 1 1 A 80 80 LYS HA H 80 4.511 4.573 -0.062 1
1 494 . 16 1 1 A 81 81 ASP H H 81 9.332 8.206 1.126 1
1 495 . 16 1 1 A 81 81 ASP HA H 81 5.429 4.764 0.665 1
1 498 . 16 1 1 A 82 82 VAL H H 82 7.226 7.125 0.101 1
1 499 . 16 1 1 A 82 82 VAL HA H 82 4.248 4.683 -0.435 1
1 507 . 16 1 1 A 83 83 LYS H H 83 8.407 8.686 -0.279 1
1 508 . 16 1 1 A 83 83 LYS HA H 83 4.356 4.647 -0.291 1
1 510 . 16 1 1 A 84 84 THR H H 84 9.088 9.114 -0.026 1
1 511 . 16 1 1 A 84 84 THR HA H 84 3.989 4.164 -0.175 1
1 516 . 16 1 1 A 85 85 SER H H 85 8.391 8.271 0.120 1
1 517 . 16 1 1 A 85 85 SER HA H 85 4.442 4.052 0.390 1
1 520 . 16 1 1 A 86 86 GLN H H 86 7.974 8.172 -0.198 1
1 521 . 16 1 1 A 86 86 GLN HA H 86 4.585 3.962 0.623 1
1 527 . 16 1 1 A 87 87 GLN H H 87 7.083 7.838 -0.755 1
1 528 . 16 1 1 A 87 87 GLN HA H 87 3.903 3.921 -0.018 1
1 534 . 16 1 1 A 88 88 LYS H H 88 9.453 8.424 1.029 1
1 535 . 16 1 1 A 88 88 LYS HA H 88 4.114 4.040 0.074 1
1 539 . 16 1 1 A 89 89 GLY H H 89 9.466 8.196 1.270 1
1 540 . 16 1 1 A 89 89 GLY HA2 H 89 3.965 3.891 0.074 1
1 541 . 16 1 1 A 89 89 GLY HA3 H 89 3.148 3.899 -0.751 1
1 542 . 16 1 1 A 90 90 GLY H H 90 7.228 7.471 -0.243 1
1 543 . 16 1 1 A 90 90 GLY HA2 H 90 4.290 4.055 0.235 1
1 544 . 16 1 1 A 90 90 GLY HA3 H 90 4.682 4.071 0.611 1
1 545 . 16 1 1 A 91 91 PRO HA H 91 4.902 4.889 0.013 1
1 552 . 16 1 1 A 92 92 THR H H 92 8.585 8.607 -0.022 1
1 553 . 16 1 1 A 92 92 THR HA H 92 5.701 5.040 0.661 1
1 559 . 16 1 1 A 93 93 PRO HA H 93 5.551 4.218 1.333 1
1 563 . 16 1 1 A 94 94 ILE H H 94 8.155 7.456 0.699 1
1 564 . 16 1 1 A 94 94 ILE HA H 94 4.794 4.346 0.448 1
1 571 . 16 1 1 A 95 95 ARG H H 95 9.538 9.278 0.260 1
1 572 . 16 1 1 A 95 95 ARG HA H 95 5.278 5.185 0.093 1
1 576 . 16 1 1 A 96 96 VAL H H 96 9.276 9.017 0.259 1
1 577 . 16 1 1 A 96 96 VAL HA H 96 5.222 4.424 0.798 1
1 585 . 16 1 1 A 97 97 VAL H H 97 8.739 9.129 -0.390 1
1 586 . 16 1 1 A 97 97 VAL HA H 97 5.160 5.245 -0.085 1
1 594 . 16 1 1 A 98 98 TYR H H 98 8.596 8.389 0.207 1
1 595 . 16 1 1 A 98 98 TYR HA H 98 5.266 5.092 0.174 1
1 603 . 16 1 1 A 99 99 ALA H H 99 9.685 8.473 1.212 1
1 604 . 16 1 1 A 99 99 ALA HA H 99 5.680 4.659 1.021 1
1 608 . 16 1 1 A 100 100 ASN H H 100 8.468 8.868 -0.400 1
1 609 . 16 1 1 A 100 100 ASN HA H 100 4.885 5.081 -0.196 1
1 614 . 16 1 1 A 101 101 SER H H 101 9.342 8.678 0.664 1
1 615 . 16 1 1 A 101 101 SER HA H 101 4.993 4.525 0.468 1
1 618 . 16 1 1 A 102 102 ARG H H 102 9.349 7.831 1.518 1
1 619 . 16 1 1 A 102 102 ARG HA H 102 4.068 4.541 -0.473 1
1 620 . 16 1 1 A 103 103 GLY H H 103 8.632 8.063 0.569 1
1 621 . 16 1 1 A 103 103 GLY HA2 H 103 3.691 3.940 -0.249 1
1 622 . 16 1 1 A 103 103 GLY HA3 H 103 4.341 3.952 0.389 1
1 623 . 16 1 1 A 104 104 ALA H H 104 7.820 7.988 -0.168 1
1 624 . 16 1 1 A 104 104 ALA HA H 104 4.775 4.260 0.515 1
1 628 . 16 1 1 A 105 105 VAL H H 105 8.402 8.414 -0.012 1
1 629 . 16 1 1 A 105 105 VAL HA H 105 4.218 4.209 0.009 1
1 637 . 16 1 1 A 106 106 GLN H H 106 9.352 8.491 0.861 1
1 638 . 16 1 1 A 106 106 GLN HA H 106 4.900 4.654 0.246 1
1 645 . 16 1 1 A 107 107 TYR H H 107 9.075 8.090 0.985 1
1 646 . 16 1 1 A 107 107 TYR HA H 107 4.007 4.117 -0.110 1
1 653 . 16 1 1 A 108 108 CYS H H 108 8.197 7.783 0.414 1
1 654 . 16 1 1 A 108 108 CYS HA H 108 4.823 4.075 0.748 1
1 657 . 16 1 1 A 109 109 GLY H H 109 6.856 6.708 0.148 1
1 658 . 16 1 1 A 109 109 GLY HA2 H 109 3.983 3.224 0.759 1
1 659 . 16 1 1 A 109 109 GLY HA3 H 109 4.422 3.281 1.141 1
1 660 . 16 1 1 A 110 110 VAL H H 110 9.418 8.691 0.727 1
1 661 . 16 1 1 A 110 110 VAL HA H 110 5.073 5.316 -0.243 1
1 669 . 16 1 1 A 111 111 MET H H 111 9.327 9.570 -0.243 1
1 670 . 16 1 1 A 111 111 MET HA H 111 5.678 5.525 0.153 1
1 678 . 16 1 1 A 112 112 THR H H 112 9.310 9.132 0.178 1
1 679 . 16 1 1 A 112 112 THR HA H 112 5.726 4.675 1.051 1
1 685 . 16 1 1 A 113 113 HIS H H 113 8.960 8.535 0.425 1
1 686 . 16 1 1 A 113 113 HIS HA H 113 3.876 4.427 -0.551 1
1 691 . 16 1 1 A 114 114 SER H H 114 8.367 8.641 -0.274 1
1 692 . 16 1 1 A 114 114 SER HA H 114 4.024 4.425 -0.401 1
1 695 . 16 1 1 A 115 115 LYS H H 115 8.140 7.779 0.361 1
1 696 . 16 1 1 A 115 115 LYS HA H 115 5.403 4.548 0.855 1
1 699 . 16 1 1 A 116 116 VAL H H 116 8.525 7.935 0.590 1
1 700 . 16 1 1 A 116 116 VAL HA H 116 5.378 4.878 0.500 1
1 708 . 16 1 1 A 117 117 ASP H H 117 8.025 9.092 -1.067 1
1 709 . 16 1 1 A 117 117 ASP HA H 117 5.243 4.744 0.499 1
1 712 . 16 1 1 A 118 118 LYS H H 118 8.930 8.199 0.731 1
1 713 . 16 1 1 A 118 118 LYS HA H 118 4.216 4.426 -0.210 1
1 716 . 16 1 1 A 119 119 ASN H H 119 8.425 8.017 0.408 1
1 717 . 16 1 1 A 119 119 ASN HA H 119 5.061 4.909 0.152 1
1 722 . 16 1 1 A 120 120 ASN H H 120 8.061 8.222 -0.161 1
1 723 . 16 1 1 A 120 120 ASN HA H 120 4.212 4.428 -0.216 1
1 728 . 16 1 1 A 121 121 GLN H H 121 8.359 7.851 0.508 1
1 729 . 16 1 1 A 121 121 GLN HA H 121 4.373 4.448 -0.075 1
1 735 . 16 1 1 A 122 122 GLY H H 122 8.770 8.677 0.093 1
1 736 . 16 1 1 A 122 122 GLY HA2 H 122 3.182 3.987 -0.805 1
1 737 . 16 1 1 A 122 122 GLY HA3 H 122 5.268 4.157 1.111 1
1 738 . 16 1 1 A 123 123 LYS H H 123 8.587 8.495 0.092 1
1 739 . 16 1 1 A 123 123 LYS HA H 123 4.016 4.523 -0.507 1
1 745 . 16 1 1 A 124 124 GLU H H 124 8.527 7.551 0.976 1
1 746 . 16 1 1 A 124 124 GLU HA H 124 4.152 4.542 -0.390 1
1 750 . 16 1 1 A 125 125 PHE H H 125 7.936 8.774 -0.838 1
1 751 . 16 1 1 A 125 125 PHE HA H 125 4.670 4.658 0.012 1
1 758 . 16 1 1 A 126 126 PHE H H 126 8.214 9.491 -1.277 1
1 759 . 16 1 1 A 126 126 PHE HA H 126 5.177 5.358 -0.181 1
1 767 . 16 1 1 A 127 127 GLU H H 127 9.169 9.356 -0.187 1
1 768 . 16 1 1 A 127 127 GLU HA H 127 4.852 5.167 -0.315 1
1 773 . 16 1 1 A 128 128 LYS H H 128 9.000 8.231 0.769 1
1 774 . 16 1 1 A 128 128 LYS HA H 128 4.191 3.769 0.422 1
1 777 . 16 1 1 A 129 129 CYS H H 129 8.938 8.887 0.051 1
1 778 . 16 1 1 A 129 129 CYS HA H 129 5.268 4.613 0.655 1
1 5 . 17 1 1 A 2 2 PRO HA H 2 4.900 4.476 0.424 1
1 10 . 17 1 1 A 3 3 ILE H H 3 8.774 7.525 1.249 1
1 11 . 17 1 1 A 3 3 ILE HA H 3 5.499 4.073 1.426 1
1 20 . 17 1 1 A 4 4 VAL H H 4 9.501 9.157 0.344 1
1 21 . 17 1 1 A 4 4 VAL HA H 4 4.944 5.186 -0.242 1
1 29 . 17 1 1 A 5 5 THR H H 5 9.243 9.227 0.016 1
1 30 . 17 1 1 A 5 5 THR HA H 5 5.278 5.247 0.031 1
1 35 . 17 1 1 A 6 6 CYS H H 6 9.815 8.868 0.947 1
1 36 . 17 1 1 A 6 6 CYS HA H 6 5.310 4.645 0.665 1
1 38 . 17 1 1 A 7 7 ARG H H 7 9.154 8.526 0.628 1
1 41 . 17 1 1 A 8 8 PRO HA H 8 4.594 4.599 -0.005 1
1 47 . 17 1 1 A 9 9 LYS H H 9 8.179 8.488 -0.309 1
1 48 . 17 1 1 A 9 9 LYS HA H 9 4.857 4.674 0.183 1
1 52 . 17 1 1 A 10 10 LEU H H 10 9.108 8.202 0.906 1
1 53 . 17 1 1 A 10 10 LEU HA H 10 5.147 4.065 1.082 1
1 63 . 17 1 1 A 11 11 ASP H H 11 9.835 8.120 1.715 1
1 64 . 17 1 1 A 11 11 ASP HA H 11 4.471 4.829 -0.358 1
1 67 . 17 1 1 A 12 12 GLY H H 12 8.847 8.007 0.840 1
1 68 . 17 1 1 A 12 12 GLY HA2 H 12 3.782 3.948 -0.166 1
1 69 . 17 1 1 A 12 12 GLY HA3 H 12 4.427 3.957 0.470 1
1 70 . 17 1 1 A 13 13 ARG H H 13 7.933 7.751 0.182 1
1 71 . 17 1 1 A 13 13 ARG HA H 13 4.886 4.462 0.424 1
1 77 . 17 1 1 A 14 14 GLU H H 14 9.179 8.594 0.585 1
1 78 . 17 1 1 A 14 14 GLU HA H 14 4.178 4.558 -0.380 1
1 82 . 17 1 1 A 15 15 LYS H H 15 9.078 8.940 0.138 1
1 83 . 17 1 1 A 15 15 LYS HA H 15 4.890 4.742 0.148 1
1 84 . 17 1 1 A 16 16 PRO HA H 16 5.144 4.904 0.240 1
1 91 . 17 1 1 A 17 17 PHE H H 17 9.487 8.778 0.709 1
1 92 . 17 1 1 A 17 17 PHE HA H 17 4.760 4.561 0.199 1
1 100 . 17 1 1 A 18 18 LYS H H 18 9.315 8.528 0.787 1
1 101 . 17 1 1 A 18 18 LYS HA H 18 5.197 4.192 1.005 1
1 108 . 17 1 1 A 19 19 VAL H H 19 9.643 8.767 0.876 1
1 109 . 17 1 1 A 19 19 VAL HA H 19 4.796 5.046 -0.250 1
1 117 . 17 1 1 A 20 20 ASP H H 20 9.555 8.812 0.743 1
1 118 . 17 1 1 A 20 20 ASP HA H 20 5.151 5.144 0.007 1
1 121 . 17 1 1 A 21 21 VAL H H 21 9.607 8.608 0.999 1
1 122 . 17 1 1 A 21 21 VAL HA H 21 3.611 3.875 -0.264 1
1 130 . 17 1 1 A 22 22 ALA H H 22 8.531 8.129 0.402 1
1 131 . 17 1 1 A 22 22 ALA HA H 22 4.299 3.882 0.417 1
1 135 . 17 1 1 A 23 23 THR H H 23 7.294 8.111 -0.817 1
1 136 . 17 1 1 A 23 23 THR HA H 23 4.264 3.841 0.423 1
1 141 . 17 1 1 A 24 24 ALA H H 24 8.346 8.242 0.104 1
1 142 . 17 1 1 A 24 24 ALA HA H 24 4.082 4.008 0.074 1
1 146 . 17 1 1 A 25 25 GLN H H 25 8.866 8.327 0.539 1
1 147 . 17 1 1 A 25 25 GLN HA H 25 3.804 4.033 -0.229 1
1 153 . 17 1 1 A 26 26 ALA H H 26 7.767 8.215 -0.448 1
1 154 . 17 1 1 A 26 26 ALA HA H 26 4.208 4.011 0.197 1
1 158 . 17 1 1 A 27 27 GLN H H 27 8.881 8.422 0.459 1
1 159 . 17 1 1 A 27 27 GLN HA H 27 4.041 3.926 0.115 1
1 165 . 17 1 1 A 28 28 ALA H H 28 8.142 7.881 0.261 1
1 166 . 17 1 1 A 28 28 ALA HA H 28 3.475 3.551 -0.076 1
1 170 . 17 1 1 A 29 29 ARG H H 29 7.291 7.600 -0.309 1
1 171 . 17 1 1 A 29 29 ARG HA H 29 3.688 3.839 -0.151 1
1 174 . 17 1 1 A 30 30 LYS H H 30 7.768 7.859 -0.091 1
1 175 . 17 1 1 A 30 30 LYS HA H 30 4.038 3.943 0.095 1
1 179 . 17 1 1 A 31 31 ALA H H 31 8.127 7.362 0.765 1
1 180 . 17 1 1 A 31 31 ALA HA H 31 3.656 3.906 -0.250 1
1 184 . 17 1 1 A 32 32 GLY H H 32 7.670 7.661 0.009 1
1 185 . 17 1 1 A 32 32 GLY HA2 H 32 3.380 3.815 -0.435 1
1 186 . 17 1 1 A 32 32 GLY HA3 H 32 3.844 3.845 -0.001 1
1 187 . 17 1 1 A 33 33 LEU H H 33 8.057 8.179 -0.122 1
1 188 . 17 1 1 A 33 33 LEU HA H 33 3.259 3.164 0.095 1
1 197 . 17 1 1 A 34 34 THR H H 34 6.862 7.084 -0.222 1
1 198 . 17 1 1 A 34 34 THR HA H 34 4.738 4.917 -0.179 1
1 203 . 17 1 1 A 35 35 THR H H 35 9.161 8.823 0.338 1
1 204 . 17 1 1 A 35 35 THR HA H 35 4.247 4.952 -0.705 1
1 209 . 17 1 1 A 36 36 GLY H H 36 8.407 8.421 -0.014 1
1 210 . 17 1 1 A 36 36 GLY HA2 H 36 4.349 3.997 0.352 1
1 211 . 17 1 1 A 36 36 GLY HA3 H 36 4.967 4.001 0.966 1
1 212 . 17 1 1 A 37 37 LYS H H 37 10.152 8.292 1.860 1
1 213 . 17 1 1 A 37 37 LYS HA H 37 4.383 4.096 0.287 1
1 221 . 17 1 1 A 38 38 SER H H 38 9.085 8.153 0.932 1
1 222 . 17 1 1 A 38 38 SER HA H 38 4.338 4.756 -0.418 1
1 226 . 17 1 1 A 39 39 GLY H H 39 8.474 7.701 0.773 1
1 227 . 17 1 1 A 39 39 GLY HA2 H 39 3.840 4.145 -0.305 1
1 228 . 17 1 1 A 40 40 ASP H H 40 9.424 8.002 1.422 1
1 229 . 17 1 1 A 40 40 ASP HA H 40 5.374 4.577 0.797 1
1 231 . 17 1 1 A 41 41 PRO HA H 41 5.624 4.596 1.028 1
1 238 . 17 1 1 A 42 42 HIS H H 42 8.343 8.589 -0.246 1
1 239 . 17 1 1 A 42 42 HIS HA H 42 5.189 5.253 -0.064 1
1 244 . 17 1 1 A 43 43 ARG H H 43 8.634 8.245 0.389 1
1 245 . 17 1 1 A 43 43 ARG HA H 43 3.654 3.272 0.382 1
1 252 . 17 1 1 A 44 44 TYR H H 44 8.188 8.623 -0.435 1
1 253 . 17 1 1 A 44 44 TYR HA H 44 5.021 4.815 0.206 1
1 260 . 17 1 1 A 45 45 PHE H H 45 8.728 8.119 0.609 1
1 261 . 17 1 1 A 45 45 PHE HA H 45 4.480 4.491 -0.011 1
1 268 . 17 1 1 A 46 46 ALA H H 46 5.979 7.522 -1.543 1
1 269 . 17 1 1 A 46 46 ALA HA H 46 3.797 3.875 -0.078 1
1 273 . 17 1 1 A 47 47 GLY H H 47 8.510 7.843 0.667 1
1 274 . 17 1 1 A 47 47 GLY HA2 H 47 3.953 3.946 0.007 1
1 275 . 17 1 1 A 47 47 GLY HA3 H 47 4.075 3.989 0.086 1
1 276 . 17 1 1 A 48 48 ASP H H 48 7.504 7.717 -0.213 1
1 277 . 17 1 1 A 48 48 ASP HA H 48 5.020 4.837 0.183 1
1 280 . 17 1 1 A 49 49 HIS H H 49 8.240 8.038 0.202 1
1 281 . 17 1 1 A 49 49 HIS HA H 49 4.373 4.151 0.222 1
1 285 . 17 1 1 A 50 50 ILE H H 50 8.468 7.617 0.851 1
1 286 . 17 1 1 A 50 50 ILE HA H 50 3.651 4.828 -1.177 1
1 296 . 17 1 1 A 51 51 ARG H H 51 8.404 8.353 0.051 1
1 297 . 17 1 1 A 51 51 ARG HA H 51 4.450 4.810 -0.360 1
1 303 . 17 1 1 A 52 52 TRP H H 52 11.176 8.720 2.456 1
1 304 . 17 1 1 A 52 52 TRP HA H 52 4.423 4.768 -0.345 1
1 312 . 17 1 1 A 53 53 GLY H H 53 10.422 7.931 2.491 1
1 313 . 17 1 1 A 53 53 GLY HA2 H 53 3.832 3.986 -0.154 1
1 314 . 17 1 1 A 53 53 GLY HA3 H 53 4.411 4.021 0.390 1
1 315 . 17 1 1 A 54 54 VAL H H 54 7.040 7.834 -0.794 1
1 316 . 17 1 1 A 54 54 VAL HA H 54 4.489 4.605 -0.116 1
1 324 . 17 1 1 A 55 55 ASN H H 55 9.530 9.313 0.217 1
1 325 . 17 1 1 A 55 55 ASN HA H 55 4.569 4.382 0.187 1
1 330 . 17 1 1 A 56 56 ASN H H 56 9.175 8.375 0.800 1
1 331 . 17 1 1 A 56 56 ASN HA H 56 4.649 4.414 0.235 1
1 336 . 17 1 1 A 57 57 CYS H H 57 7.613 8.545 -0.932 1
1 337 . 17 1 1 A 57 57 CYS HA H 57 4.645 4.451 0.194 1
1 340 . 17 1 1 A 58 58 ASP H H 58 7.626 8.124 -0.498 1
1 341 . 17 1 1 A 58 58 ASP HA H 58 5.206 4.779 0.427 1
1 344 . 17 1 1 A 59 59 LYS H H 59 7.349 7.563 -0.214 1
1 345 . 17 1 1 A 59 59 LYS HA H 59 4.548 4.603 -0.055 1
1 350 . 17 1 1 A 60 60 ALA H H 60 9.155 8.448 0.707 1
1 351 . 17 1 1 A 60 60 ALA HA H 60 4.330 4.227 0.103 1
1 355 . 17 1 1 A 61 61 ASP H H 61 8.548 8.220 0.328 1
1 356 . 17 1 1 A 61 61 ASP HA H 61 4.827 4.544 0.283 1
1 359 . 17 1 1 A 62 62 ALA H H 62 7.463 7.364 0.099 1
1 360 . 17 1 1 A 62 62 ALA HA H 62 4.217 4.282 -0.065 1
1 364 . 17 1 1 A 63 63 ILE H H 63 9.302 8.740 0.562 1
1 365 . 17 1 1 A 63 63 ILE HA H 63 4.332 4.571 -0.239 1
1 374 . 17 1 1 A 64 64 LEU H H 64 8.724 8.941 -0.217 1
1 375 . 17 1 1 A 64 64 LEU HA H 64 5.463 5.141 0.322 1
1 385 . 17 1 1 A 65 65 TRP H H 65 9.621 8.530 1.091 1
1 386 . 17 1 1 A 65 65 TRP HA H 65 4.605 5.317 -0.712 1
1 395 . 17 1 1 A 66 66 GLU H H 66 8.388 9.246 -0.858 1
1 396 . 17 1 1 A 66 66 GLU HA H 66 6.014 5.575 0.439 1
1 401 . 17 1 1 A 67 67 TYR H H 67 8.766 9.104 -0.338 1
1 402 . 17 1 1 A 67 67 TYR HA H 67 5.204 5.102 0.102 1
1 405 . 17 1 1 A 68 68 PRO HA H 68 4.523 4.563 -0.040 1
1 412 . 17 1 1 A 69 69 ILE H H 69 7.308 8.197 -0.889 1
1 413 . 17 1 1 A 69 69 ILE HA H 69 4.870 5.080 -0.210 1
1 414 . 17 1 1 A 70 70 TYR H H 70 9.219 9.064 0.155 1
1 415 . 17 1 1 A 70 70 TYR HA H 70 4.854 4.523 0.331 1
1 423 . 17 1 1 A 71 71 TRP H H 71 6.662 8.185 -1.523 1
1 424 . 17 1 1 A 71 71 TRP HA H 71 5.496 4.724 0.772 1
1 432 . 17 1 1 A 72 72 VAL H H 72 9.510 8.976 0.534 1
1 433 . 17 1 1 A 72 72 VAL HA H 72 3.999 3.687 0.312 1
1 441 . 17 1 1 A 73 73 GLY H H 73 9.221 8.419 0.802 1
1 442 . 17 1 1 A 73 73 GLY HA2 H 73 3.877 3.932 -0.055 1
1 443 . 17 1 1 A 73 73 GLY HA3 H 73 4.682 3.961 0.721 1
1 444 . 17 1 1 A 74 74 LYS H H 74 7.962 7.676 0.286 1
1 445 . 17 1 1 A 74 74 LYS HA H 74 4.469 4.383 0.086 1
1 457 . 17 1 1 A 75 75 ASN H H 75 8.928 8.724 0.204 1
1 458 . 17 1 1 A 75 75 ASN HA H 75 4.837 4.970 -0.133 1
1 463 . 17 1 1 A 76 76 ALA H H 76 7.544 7.594 -0.050 1
1 464 . 17 1 1 A 76 76 ALA HA H 76 4.555 4.134 0.421 1
1 468 . 17 1 1 A 77 77 GLU H H 77 8.290 8.196 0.094 1
1 469 . 17 1 1 A 77 77 GLU HA H 77 4.900 3.912 0.988 1
1 474 . 17 1 1 A 78 78 TRP H H 78 10.065 8.902 1.163 1
1 475 . 17 1 1 A 78 78 TRP HA H 78 4.600 5.003 -0.403 1
1 484 . 17 1 1 A 79 79 ALA H H 79 9.850 8.106 1.744 1
1 485 . 17 1 1 A 79 79 ALA HA H 79 5.022 4.713 0.309 1
1 489 . 17 1 1 A 80 80 LYS H H 80 9.255 8.701 0.554 1
1 490 . 17 1 1 A 80 80 LYS HA H 80 4.511 4.437 0.074 1
1 494 . 17 1 1 A 81 81 ASP H H 81 9.332 7.873 1.459 1
1 495 . 17 1 1 A 81 81 ASP HA H 81 5.429 4.783 0.646 1
1 498 . 17 1 1 A 82 82 VAL H H 82 7.226 7.560 -0.334 1
1 499 . 17 1 1 A 82 82 VAL HA H 82 4.248 4.603 -0.355 1
1 507 . 17 1 1 A 83 83 LYS H H 83 8.407 8.623 -0.216 1
1 508 . 17 1 1 A 83 83 LYS HA H 83 4.356 4.498 -0.142 1
1 510 . 17 1 1 A 84 84 THR H H 84 9.088 9.060 0.028 1
1 511 . 17 1 1 A 84 84 THR HA H 84 3.989 4.051 -0.062 1
1 516 . 17 1 1 A 85 85 SER H H 85 8.391 8.101 0.290 1
1 517 . 17 1 1 A 85 85 SER HA H 85 4.442 4.100 0.342 1
1 520 . 17 1 1 A 86 86 GLN H H 86 7.974 7.979 -0.005 1
1 521 . 17 1 1 A 86 86 GLN HA H 86 4.585 4.051 0.534 1
1 527 . 17 1 1 A 87 87 GLN H H 87 7.083 7.751 -0.668 1
1 528 . 17 1 1 A 87 87 GLN HA H 87 3.903 3.840 0.063 1
1 534 . 17 1 1 A 88 88 LYS H H 88 9.453 8.698 0.755 1
1 535 . 17 1 1 A 88 88 LYS HA H 88 4.114 4.510 -0.396 1
1 539 . 17 1 1 A 89 89 GLY H H 89 9.466 7.975 1.491 1
1 540 . 17 1 1 A 89 89 GLY HA2 H 89 3.965 4.063 -0.098 1
1 541 . 17 1 1 A 89 89 GLY HA3 H 89 3.148 4.075 -0.927 1
1 542 . 17 1 1 A 90 90 GLY H H 90 7.228 7.512 -0.284 1
1 543 . 17 1 1 A 90 90 GLY HA2 H 90 4.290 4.078 0.212 1
1 544 . 17 1 1 A 90 90 GLY HA3 H 90 4.682 4.093 0.589 1
1 545 . 17 1 1 A 91 91 PRO HA H 91 4.902 4.811 0.091 1
1 552 . 17 1 1 A 92 92 THR H H 92 8.585 8.468 0.117 1
1 553 . 17 1 1 A 92 92 THR HA H 92 5.701 5.066 0.635 1
1 559 . 17 1 1 A 93 93 PRO HA H 93 5.551 3.924 1.627 1
1 563 . 17 1 1 A 94 94 ILE H H 94 8.155 7.514 0.641 1
1 564 . 17 1 1 A 94 94 ILE HA H 94 4.794 4.251 0.543 1
1 571 . 17 1 1 A 95 95 ARG H H 95 9.538 8.966 0.572 1
1 572 . 17 1 1 A 95 95 ARG HA H 95 5.278 5.261 0.017 1
1 576 . 17 1 1 A 96 96 VAL H H 96 9.276 8.959 0.317 1
1 577 . 17 1 1 A 96 96 VAL HA H 96 5.222 4.261 0.961 1
1 585 . 17 1 1 A 97 97 VAL H H 97 8.739 8.927 -0.188 1
1 586 . 17 1 1 A 97 97 VAL HA H 97 5.160 5.109 0.051 1
1 594 . 17 1 1 A 98 98 TYR H H 98 8.596 8.693 -0.097 1
1 595 . 17 1 1 A 98 98 TYR HA H 98 5.266 5.406 -0.140 1
1 603 . 17 1 1 A 99 99 ALA H H 99 9.685 8.679 1.006 1
1 604 . 17 1 1 A 99 99 ALA HA H 99 5.680 4.721 0.959 1
1 608 . 17 1 1 A 100 100 ASN H H 100 8.468 8.754 -0.286 1
1 609 . 17 1 1 A 100 100 ASN HA H 100 4.885 4.799 0.086 1
1 614 . 17 1 1 A 101 101 SER H H 101 9.342 8.350 0.992 1
1 615 . 17 1 1 A 101 101 SER HA H 101 4.993 4.877 0.116 1
1 618 . 17 1 1 A 102 102 ARG H H 102 9.349 9.523 -0.174 1
1 619 . 17 1 1 A 102 102 ARG HA H 102 4.068 4.043 0.025 1
1 620 . 17 1 1 A 103 103 GLY H H 103 8.632 8.442 0.190 1
1 621 . 17 1 1 A 103 103 GLY HA2 H 103 3.691 3.878 -0.187 1
1 622 . 17 1 1 A 103 103 GLY HA3 H 103 4.341 3.893 0.448 1
1 623 . 17 1 1 A 104 104 ALA H H 104 7.820 7.618 0.202 1
1 624 . 17 1 1 A 104 104 ALA HA H 104 4.775 4.339 0.436 1
1 628 . 17 1 1 A 105 105 VAL H H 105 8.402 8.573 -0.171 1
1 629 . 17 1 1 A 105 105 VAL HA H 105 4.218 4.805 -0.587 1
1 637 . 17 1 1 A 106 106 GLN H H 106 9.352 8.340 1.012 1
1 638 . 17 1 1 A 106 106 GLN HA H 106 4.900 4.679 0.221 1
1 645 . 17 1 1 A 107 107 TYR H H 107 9.075 8.113 0.962 1
1 646 . 17 1 1 A 107 107 TYR HA H 107 4.007 4.130 -0.123 1
1 653 . 17 1 1 A 108 108 CYS H H 108 8.197 7.801 0.396 1
1 654 . 17 1 1 A 108 108 CYS HA H 108 4.823 4.125 0.698 1
1 657 . 17 1 1 A 109 109 GLY H H 109 6.856 6.720 0.136 1
1 658 . 17 1 1 A 109 109 GLY HA2 H 109 3.983 3.238 0.745 1
1 659 . 17 1 1 A 109 109 GLY HA3 H 109 4.422 3.242 1.180 1
1 660 . 17 1 1 A 110 110 VAL H H 110 9.418 8.335 1.083 1
1 661 . 17 1 1 A 110 110 VAL HA H 110 5.073 4.583 0.490 1
1 669 . 17 1 1 A 111 111 MET H H 111 9.327 9.500 -0.173 1
1 670 . 17 1 1 A 111 111 MET HA H 111 5.678 5.496 0.182 1
1 678 . 17 1 1 A 112 112 THR H H 112 9.310 9.403 -0.093 1
1 679 . 17 1 1 A 112 112 THR HA H 112 5.726 4.703 1.023 1
1 685 . 17 1 1 A 113 113 HIS H H 113 8.960 8.144 0.816 1
1 686 . 17 1 1 A 113 113 HIS HA H 113 3.876 4.217 -0.341 1
1 691 . 17 1 1 A 114 114 SER H H 114 8.367 8.566 -0.199 1
1 692 . 17 1 1 A 114 114 SER HA H 114 4.024 4.077 -0.053 1
1 695 . 17 1 1 A 115 115 LYS H H 115 8.140 7.617 0.523 1
1 696 . 17 1 1 A 115 115 LYS HA H 115 5.403 4.257 1.146 1
1 699 . 17 1 1 A 116 116 VAL H H 116 8.525 8.187 0.338 1
1 700 . 17 1 1 A 116 116 VAL HA H 116 5.378 4.488 0.890 1
1 708 . 17 1 1 A 117 117 ASP H H 117 8.025 8.240 -0.215 1
1 709 . 17 1 1 A 117 117 ASP HA H 117 5.243 4.328 0.915 1
1 712 . 17 1 1 A 118 118 LYS H H 118 8.930 7.965 0.965 1
1 713 . 17 1 1 A 118 118 LYS HA H 118 4.216 4.568 -0.352 1
1 716 . 17 1 1 A 119 119 ASN H H 119 8.425 8.005 0.420 1
1 717 . 17 1 1 A 119 119 ASN HA H 119 5.061 4.848 0.213 1
1 722 . 17 1 1 A 120 120 ASN H H 120 8.061 8.176 -0.115 1
1 723 . 17 1 1 A 120 120 ASN HA H 120 4.212 4.393 -0.181 1
1 728 . 17 1 1 A 121 121 GLN H H 121 8.359 8.125 0.234 1
1 729 . 17 1 1 A 121 121 GLN HA H 121 4.373 4.490 -0.117 1
1 735 . 17 1 1 A 122 122 GLY H H 122 8.770 8.448 0.322 1
1 736 . 17 1 1 A 122 122 GLY HA2 H 122 3.182 3.950 -0.768 1
1 737 . 17 1 1 A 122 122 GLY HA3 H 122 5.268 4.205 1.063 1
1 738 . 17 1 1 A 123 123 LYS H H 123 8.587 8.555 0.032 1
1 739 . 17 1 1 A 123 123 LYS HA H 123 4.016 4.380 -0.364 1
1 745 . 17 1 1 A 124 124 GLU H H 124 8.527 7.811 0.716 1
1 746 . 17 1 1 A 124 124 GLU HA H 124 4.152 4.481 -0.329 1
1 750 . 17 1 1 A 125 125 PHE H H 125 7.936 8.804 -0.868 1
1 751 . 17 1 1 A 125 125 PHE HA H 125 4.670 4.628 0.042 1
1 758 . 17 1 1 A 126 126 PHE H H 126 8.214 8.659 -0.445 1
1 759 . 17 1 1 A 126 126 PHE HA H 126 5.177 4.961 0.216 1
1 767 . 17 1 1 A 127 127 GLU H H 127 9.169 8.855 0.314 1
1 768 . 17 1 1 A 127 127 GLU HA H 127 4.852 4.500 0.352 1
1 773 . 17 1 1 A 128 128 LYS H H 128 9.000 8.279 0.721 1
1 774 . 17 1 1 A 128 128 LYS HA H 128 4.191 4.081 0.110 1
1 777 . 17 1 1 A 129 129 CYS H H 129 8.938 8.620 0.318 1
1 778 . 17 1 1 A 129 129 CYS HA H 129 5.268 5.234 0.034 1
1 5 . 18 1 1 A 2 2 PRO HA H 2 4.900 4.569 0.331 1
1 10 . 18 1 1 A 3 3 ILE H H 3 8.774 7.548 1.226 1
1 11 . 18 1 1 A 3 3 ILE HA H 3 5.499 4.104 1.395 1
1 20 . 18 1 1 A 4 4 VAL H H 4 9.501 8.997 0.504 1
1 21 . 18 1 1 A 4 4 VAL HA H 4 4.944 5.186 -0.242 1
1 29 . 18 1 1 A 5 5 THR H H 5 9.243 9.132 0.111 1
1 30 . 18 1 1 A 5 5 THR HA H 5 5.278 5.276 0.002 1
1 35 . 18 1 1 A 6 6 CYS H H 6 9.815 8.961 0.854 1
1 36 . 18 1 1 A 6 6 CYS HA H 6 5.310 4.642 0.668 1
1 38 . 18 1 1 A 7 7 ARG H H 7 9.154 8.538 0.616 1
1 41 . 18 1 1 A 8 8 PRO HA H 8 4.594 4.598 -0.004 1
1 47 . 18 1 1 A 9 9 LYS H H 9 8.179 8.447 -0.268 1
1 48 . 18 1 1 A 9 9 LYS HA H 9 4.857 4.912 -0.055 1
1 52 . 18 1 1 A 10 10 LEU H H 10 9.108 8.482 0.626 1
1 53 . 18 1 1 A 10 10 LEU HA H 10 5.147 4.685 0.462 1
1 63 . 18 1 1 A 11 11 ASP H H 11 9.835 7.953 1.882 1
1 64 . 18 1 1 A 11 11 ASP HA H 11 4.471 4.521 -0.050 1
1 67 . 18 1 1 A 12 12 GLY H H 12 8.847 8.093 0.754 1
1 68 . 18 1 1 A 12 12 GLY HA2 H 12 3.782 3.853 -0.071 1
1 69 . 18 1 1 A 12 12 GLY HA3 H 12 4.427 3.858 0.569 1
1 70 . 18 1 1 A 13 13 ARG H H 13 7.933 7.695 0.238 1
1 71 . 18 1 1 A 13 13 ARG HA H 13 4.886 4.673 0.213 1
1 77 . 18 1 1 A 14 14 GLU H H 14 9.179 8.477 0.702 1
1 78 . 18 1 1 A 14 14 GLU HA H 14 4.178 4.730 -0.552 1
1 82 . 18 1 1 A 15 15 LYS H H 15 9.078 9.197 -0.119 1
1 83 . 18 1 1 A 15 15 LYS HA H 15 4.890 4.793 0.097 1
1 84 . 18 1 1 A 16 16 PRO HA H 16 5.144 4.815 0.329 1
1 91 . 18 1 1 A 17 17 PHE H H 17 9.487 8.793 0.694 1
1 92 . 18 1 1 A 17 17 PHE HA H 17 4.760 4.556 0.204 1
1 100 . 18 1 1 A 18 18 LYS H H 18 9.315 8.551 0.764 1
1 101 . 18 1 1 A 18 18 LYS HA H 18 5.197 4.216 0.981 1
1 108 . 18 1 1 A 19 19 VAL H H 19 9.643 8.609 1.034 1
1 109 . 18 1 1 A 19 19 VAL HA H 19 4.796 4.978 -0.182 1
1 117 . 18 1 1 A 20 20 ASP H H 20 9.555 8.992 0.563 1
1 118 . 18 1 1 A 20 20 ASP HA H 20 5.151 5.151 0.000 1
1 121 . 18 1 1 A 21 21 VAL H H 21 9.607 8.609 0.998 1
1 122 . 18 1 1 A 21 21 VAL HA H 21 3.611 3.769 -0.158 1
1 130 . 18 1 1 A 22 22 ALA H H 22 8.531 8.193 0.338 1
1 131 . 18 1 1 A 22 22 ALA HA H 22 4.299 3.890 0.409 1
1 135 . 18 1 1 A 23 23 THR H H 23 7.294 8.171 -0.877 1
1 136 . 18 1 1 A 23 23 THR HA H 23 4.264 3.857 0.407 1
1 141 . 18 1 1 A 24 24 ALA H H 24 8.346 8.342 0.004 1
1 142 . 18 1 1 A 24 24 ALA HA H 24 4.082 4.029 0.053 1
1 146 . 18 1 1 A 25 25 GLN H H 25 8.866 8.337 0.529 1
1 147 . 18 1 1 A 25 25 GLN HA H 25 3.804 3.920 -0.116 1
1 153 . 18 1 1 A 26 26 ALA H H 26 7.767 8.056 -0.289 1
1 154 . 18 1 1 A 26 26 ALA HA H 26 4.208 4.017 0.191 1
1 158 . 18 1 1 A 27 27 GLN H H 27 8.881 8.452 0.429 1
1 159 . 18 1 1 A 27 27 GLN HA H 27 4.041 3.902 0.139 1
1 165 . 18 1 1 A 28 28 ALA H H 28 8.142 8.040 0.102 1
1 166 . 18 1 1 A 28 28 ALA HA H 28 3.475 3.347 0.128 1
1 170 . 18 1 1 A 29 29 ARG H H 29 7.291 7.538 -0.247 1
1 171 . 18 1 1 A 29 29 ARG HA H 29 3.688 3.838 -0.150 1
1 174 . 18 1 1 A 30 30 LYS H H 30 7.768 8.004 -0.236 1
1 175 . 18 1 1 A 30 30 LYS HA H 30 4.038 3.888 0.150 1
1 179 . 18 1 1 A 31 31 ALA H H 31 8.127 7.365 0.762 1
1 180 . 18 1 1 A 31 31 ALA HA H 31 3.656 3.881 -0.225 1
1 184 . 18 1 1 A 32 32 GLY H H 32 7.670 7.491 0.179 1
1 185 . 18 1 1 A 32 32 GLY HA2 H 32 3.380 3.770 -0.390 1
1 186 . 18 1 1 A 32 32 GLY HA3 H 32 3.844 3.801 0.043 1
1 187 . 18 1 1 A 33 33 LEU H H 33 8.057 8.168 -0.111 1
1 188 . 18 1 1 A 33 33 LEU HA H 33 3.259 2.960 0.299 1
1 197 . 18 1 1 A 34 34 THR H H 34 6.862 7.060 -0.198 1
1 198 . 18 1 1 A 34 34 THR HA H 34 4.738 4.908 -0.170 1
1 203 . 18 1 1 A 35 35 THR H H 35 9.161 8.895 0.266 1
1 204 . 18 1 1 A 35 35 THR HA H 35 4.247 5.171 -0.924 1
1 209 . 18 1 1 A 36 36 GLY H H 36 8.407 8.381 0.026 1
1 210 . 18 1 1 A 36 36 GLY HA2 H 36 4.349 4.033 0.316 1
1 211 . 18 1 1 A 36 36 GLY HA3 H 36 4.967 4.040 0.927 1
1 212 . 18 1 1 A 37 37 LYS H H 37 10.152 8.298 1.854 1
1 213 . 18 1 1 A 37 37 LYS HA H 37 4.383 4.094 0.289 1
1 221 . 18 1 1 A 38 38 SER H H 38 9.085 8.133 0.952 1
1 222 . 18 1 1 A 38 38 SER HA H 38 4.338 4.756 -0.418 1
1 226 . 18 1 1 A 39 39 GLY H H 39 8.474 7.703 0.771 1
1 227 . 18 1 1 A 39 39 GLY HA2 H 39 3.840 4.118 -0.278 1
1 228 . 18 1 1 A 40 40 ASP H H 40 9.424 8.360 1.064 1
1 229 . 18 1 1 A 40 40 ASP HA H 40 5.374 4.484 0.890 1
1 231 . 18 1 1 A 41 41 PRO HA H 41 5.624 4.553 1.071 1
1 238 . 18 1 1 A 42 42 HIS H H 42 8.343 8.765 -0.422 1
1 239 . 18 1 1 A 42 42 HIS HA H 42 5.189 5.189 0.000 1
1 244 . 18 1 1 A 43 43 ARG H H 43 8.634 8.297 0.337 1
1 245 . 18 1 1 A 43 43 ARG HA H 43 3.654 3.326 0.328 1
1 252 . 18 1 1 A 44 44 TYR H H 44 8.188 8.555 -0.367 1
1 253 . 18 1 1 A 44 44 TYR HA H 44 5.021 5.146 -0.125 1
1 260 . 18 1 1 A 45 45 PHE H H 45 8.728 8.770 -0.042 1
1 261 . 18 1 1 A 45 45 PHE HA H 45 4.480 4.837 -0.357 1
1 268 . 18 1 1 A 46 46 ALA H H 46 5.979 8.706 -2.727 1
1 269 . 18 1 1 A 46 46 ALA HA H 46 3.797 4.019 -0.222 1
1 273 . 18 1 1 A 47 47 GLY H H 47 8.510 7.387 1.123 1
1 274 . 18 1 1 A 47 47 GLY HA2 H 47 3.953 3.387 0.566 1
1 275 . 18 1 1 A 47 47 GLY HA3 H 47 4.075 3.469 0.606 1
1 276 . 18 1 1 A 48 48 ASP H H 48 7.504 7.343 0.161 1
1 277 . 18 1 1 A 48 48 ASP HA H 48 5.020 4.494 0.526 1
1 280 . 18 1 1 A 49 49 HIS H H 49 8.240 8.336 -0.096 1
1 281 . 18 1 1 A 49 49 HIS HA H 49 4.373 4.692 -0.319 1
1 285 . 18 1 1 A 50 50 ILE H H 50 8.468 8.541 -0.073 1
1 286 . 18 1 1 A 50 50 ILE HA H 50 3.651 4.819 -1.168 1
1 296 . 18 1 1 A 51 51 ARG H H 51 8.404 8.326 0.078 1
1 297 . 18 1 1 A 51 51 ARG HA H 51 4.450 4.627 -0.177 1
1 303 . 18 1 1 A 52 52 TRP H H 52 11.176 8.386 2.790 1
1 304 . 18 1 1 A 52 52 TRP HA H 52 4.423 4.510 -0.087 1
1 312 . 18 1 1 A 53 53 GLY H H 53 10.422 8.479 1.943 1
1 313 . 18 1 1 A 53 53 GLY HA2 H 53 3.832 3.972 -0.140 1
1 314 . 18 1 1 A 53 53 GLY HA3 H 53 4.411 4.002 0.409 1
1 315 . 18 1 1 A 54 54 VAL H H 54 7.040 7.600 -0.560 1
1 316 . 18 1 1 A 54 54 VAL HA H 54 4.489 4.198 0.291 1
1 324 . 18 1 1 A 55 55 ASN H H 55 9.530 8.849 0.681 1
1 325 . 18 1 1 A 55 55 ASN HA H 55 4.569 4.399 0.170 1
1 330 . 18 1 1 A 56 56 ASN H H 56 9.175 8.341 0.834 1
1 331 . 18 1 1 A 56 56 ASN HA H 56 4.649 4.394 0.255 1
1 336 . 18 1 1 A 57 57 CYS H H 57 7.613 7.986 -0.373 1
1 337 . 18 1 1 A 57 57 CYS HA H 57 4.645 4.506 0.139 1
1 340 . 18 1 1 A 58 58 ASP H H 58 7.626 8.080 -0.454 1
1 341 . 18 1 1 A 58 58 ASP HA H 58 5.206 4.861 0.345 1
1 344 . 18 1 1 A 59 59 LYS H H 59 7.349 7.449 -0.100 1
1 345 . 18 1 1 A 59 59 LYS HA H 59 4.548 4.438 0.110 1
1 350 . 18 1 1 A 60 60 ALA H H 60 9.155 8.642 0.513 1
1 351 . 18 1 1 A 60 60 ALA HA H 60 4.330 4.284 0.046 1
1 355 . 18 1 1 A 61 61 ASP H H 61 8.548 7.917 0.631 1
1 356 . 18 1 1 A 61 61 ASP HA H 61 4.827 5.191 -0.364 1
1 359 . 18 1 1 A 62 62 ALA H H 62 7.463 7.471 -0.008 1
1 360 . 18 1 1 A 62 62 ALA HA H 62 4.217 4.343 -0.126 1
1 364 . 18 1 1 A 63 63 ILE H H 63 9.302 8.725 0.577 1
1 365 . 18 1 1 A 63 63 ILE HA H 63 4.332 4.617 -0.285 1
1 374 . 18 1 1 A 64 64 LEU H H 64 8.724 9.007 -0.283 1
1 375 . 18 1 1 A 64 64 LEU HA H 64 5.463 5.164 0.299 1
1 385 . 18 1 1 A 65 65 TRP H H 65 9.621 8.573 1.048 1
1 386 . 18 1 1 A 65 65 TRP HA H 65 4.605 5.406 -0.801 1
1 395 . 18 1 1 A 66 66 GLU H H 66 8.388 9.321 -0.933 1
1 396 . 18 1 1 A 66 66 GLU HA H 66 6.014 5.658 0.356 1
1 401 . 18 1 1 A 67 67 TYR H H 67 8.766 9.187 -0.421 1
1 402 . 18 1 1 A 67 67 TYR HA H 67 5.204 5.117 0.087 1
1 405 . 18 1 1 A 68 68 PRO HA H 68 4.523 4.437 0.086 1
1 412 . 18 1 1 A 69 69 ILE H H 69 7.308 8.084 -0.776 1
1 413 . 18 1 1 A 69 69 ILE HA H 69 4.870 5.107 -0.237 1
1 414 . 18 1 1 A 70 70 TYR H H 70 9.219 9.160 0.059 1
1 415 . 18 1 1 A 70 70 TYR HA H 70 4.854 4.734 0.120 1
1 423 . 18 1 1 A 71 71 TRP H H 71 6.662 8.441 -1.779 1
1 424 . 18 1 1 A 71 71 TRP HA H 71 5.496 4.855 0.641 1
1 432 . 18 1 1 A 72 72 VAL H H 72 9.510 8.683 0.827 1
1 433 . 18 1 1 A 72 72 VAL HA H 72 3.999 3.601 0.398 1
1 441 . 18 1 1 A 73 73 GLY H H 73 9.221 9.047 0.174 1
1 442 . 18 1 1 A 73 73 GLY HA2 H 73 3.877 4.080 -0.203 1
1 443 . 18 1 1 A 73 73 GLY HA3 H 73 4.682 4.095 0.587 1
1 444 . 18 1 1 A 74 74 LYS H H 74 7.962 7.669 0.293 1
1 445 . 18 1 1 A 74 74 LYS HA H 74 4.469 4.305 0.164 1
1 457 . 18 1 1 A 75 75 ASN H H 75 8.928 8.710 0.218 1
1 458 . 18 1 1 A 75 75 ASN HA H 75 4.837 4.862 -0.025 1
1 463 . 18 1 1 A 76 76 ALA H H 76 7.544 7.880 -0.336 1
1 464 . 18 1 1 A 76 76 ALA HA H 76 4.555 4.729 -0.174 1
1 468 . 18 1 1 A 77 77 GLU H H 77 8.290 8.599 -0.309 1
1 469 . 18 1 1 A 77 77 GLU HA H 77 4.900 3.756 1.144 1
1 474 . 18 1 1 A 78 78 TRP H H 78 10.065 8.420 1.645 1
1 475 . 18 1 1 A 78 78 TRP HA H 78 4.600 4.924 -0.324 1
1 484 . 18 1 1 A 79 79 ALA H H 79 9.850 8.417 1.433 1
1 485 . 18 1 1 A 79 79 ALA HA H 79 5.022 4.469 0.553 1
1 489 . 18 1 1 A 80 80 LYS H H 80 9.255 8.737 0.518 1
1 490 . 18 1 1 A 80 80 LYS HA H 80 4.511 4.317 0.194 1
1 494 . 18 1 1 A 81 81 ASP H H 81 9.332 7.894 1.438 1
1 495 . 18 1 1 A 81 81 ASP HA H 81 5.429 4.781 0.648 1
1 498 . 18 1 1 A 82 82 VAL H H 82 7.226 8.184 -0.958 1
1 499 . 18 1 1 A 82 82 VAL HA H 82 4.248 4.792 -0.544 1
1 507 . 18 1 1 A 83 83 LYS H H 83 8.407 8.734 -0.327 1
1 508 . 18 1 1 A 83 83 LYS HA H 83 4.356 4.668 -0.312 1
1 510 . 18 1 1 A 84 84 THR H H 84 9.088 9.117 -0.029 1
1 511 . 18 1 1 A 84 84 THR HA H 84 3.989 4.050 -0.061 1
1 516 . 18 1 1 A 85 85 SER H H 85 8.391 8.281 0.110 1
1 517 . 18 1 1 A 85 85 SER HA H 85 4.442 4.054 0.388 1
1 520 . 18 1 1 A 86 86 GLN H H 86 7.974 7.754 0.220 1
1 521 . 18 1 1 A 86 86 GLN HA H 86 4.585 4.013 0.572 1
1 527 . 18 1 1 A 87 87 GLN H H 87 7.083 7.568 -0.485 1
1 528 . 18 1 1 A 87 87 GLN HA H 87 3.903 3.917 -0.014 1
1 534 . 18 1 1 A 88 88 LYS H H 88 9.453 8.280 1.173 1
1 535 . 18 1 1 A 88 88 LYS HA H 88 4.114 4.254 -0.140 1
1 539 . 18 1 1 A 89 89 GLY H H 89 9.466 7.843 1.623 1
1 540 . 18 1 1 A 89 89 GLY HA2 H 89 3.965 3.948 0.017 1
1 541 . 18 1 1 A 89 89 GLY HA3 H 89 3.148 3.993 -0.845 1
1 542 . 18 1 1 A 90 90 GLY H H 90 7.228 7.372 -0.144 1
1 543 . 18 1 1 A 90 90 GLY HA2 H 90 4.290 4.051 0.239 1
1 544 . 18 1 1 A 90 90 GLY HA3 H 90 4.682 4.074 0.608 1
1 545 . 18 1 1 A 91 91 PRO HA H 91 4.902 4.580 0.322 1
1 552 . 18 1 1 A 92 92 THR H H 92 8.585 7.642 0.943 1
1 553 . 18 1 1 A 92 92 THR HA H 92 5.701 4.372 1.329 1
1 559 . 18 1 1 A 93 93 PRO HA H 93 5.551 4.127 1.424 1
1 563 . 18 1 1 A 94 94 ILE H H 94 8.155 7.477 0.678 1
1 564 . 18 1 1 A 94 94 ILE HA H 94 4.794 4.354 0.440 1
1 571 . 18 1 1 A 95 95 ARG H H 95 9.538 8.984 0.554 1
1 572 . 18 1 1 A 95 95 ARG HA H 95 5.278 5.297 -0.019 1
1 576 . 18 1 1 A 96 96 VAL H H 96 9.276 9.066 0.210 1
1 577 . 18 1 1 A 96 96 VAL HA H 96 5.222 4.279 0.943 1
1 585 . 18 1 1 A 97 97 VAL H H 97 8.739 8.845 -0.106 1
1 586 . 18 1 1 A 97 97 VAL HA H 97 5.160 5.307 -0.147 1
1 594 . 18 1 1 A 98 98 TYR H H 98 8.596 8.439 0.157 1
1 595 . 18 1 1 A 98 98 TYR HA H 98 5.266 4.999 0.267 1
1 603 . 18 1 1 A 99 99 ALA H H 99 9.685 8.590 1.095 1
1 604 . 18 1 1 A 99 99 ALA HA H 99 5.680 4.521 1.159 1
1 608 . 18 1 1 A 100 100 ASN H H 100 8.468 8.727 -0.259 1
1 609 . 18 1 1 A 100 100 ASN HA H 100 4.885 4.873 0.012 1
1 614 . 18 1 1 A 101 101 SER H H 101 9.342 8.589 0.753 1
1 615 . 18 1 1 A 101 101 SER HA H 101 4.993 4.931 0.062 1
1 618 . 18 1 1 A 102 102 ARG H H 102 9.349 9.141 0.208 1
1 619 . 18 1 1 A 102 102 ARG HA H 102 4.068 3.975 0.093 1
1 620 . 18 1 1 A 103 103 GLY H H 103 8.632 8.694 -0.062 1
1 621 . 18 1 1 A 103 103 GLY HA2 H 103 3.691 3.835 -0.144 1
1 622 . 18 1 1 A 103 103 GLY HA3 H 103 4.341 3.849 0.492 1
1 623 . 18 1 1 A 104 104 ALA H H 104 7.820 7.363 0.457 1
1 624 . 18 1 1 A 104 104 ALA HA H 104 4.775 4.732 0.043 1
1 628 . 18 1 1 A 105 105 VAL H H 105 8.402 8.539 -0.137 1
1 629 . 18 1 1 A 105 105 VAL HA H 105 4.218 4.890 -0.672 1
1 637 . 18 1 1 A 106 106 GLN H H 106 9.352 8.404 0.948 1
1 638 . 18 1 1 A 106 106 GLN HA H 106 4.900 4.609 0.291 1
1 645 . 18 1 1 A 107 107 TYR H H 107 9.075 8.067 1.008 1
1 646 . 18 1 1 A 107 107 TYR HA H 107 4.007 4.109 -0.102 1
1 653 . 18 1 1 A 108 108 CYS H H 108 8.197 7.789 0.408 1
1 654 . 18 1 1 A 108 108 CYS HA H 108 4.823 4.091 0.732 1
1 657 . 18 1 1 A 109 109 GLY H H 109 6.856 6.688 0.168 1
1 658 . 18 1 1 A 109 109 GLY HA2 H 109 3.983 3.465 0.518 1
1 659 . 18 1 1 A 109 109 GLY HA3 H 109 4.422 3.476 0.946 1
1 660 . 18 1 1 A 110 110 VAL H H 110 9.418 8.368 1.050 1
1 661 . 18 1 1 A 110 110 VAL HA H 110 5.073 4.787 0.286 1
1 669 . 18 1 1 A 111 111 MET H H 111 9.327 9.622 -0.295 1
1 670 . 18 1 1 A 111 111 MET HA H 111 5.678 5.550 0.128 1
1 678 . 18 1 1 A 112 112 THR H H 112 9.310 9.288 0.022 1
1 679 . 18 1 1 A 112 112 THR HA H 112 5.726 4.700 1.026 1
1 685 . 18 1 1 A 113 113 HIS H H 113 8.960 8.298 0.662 1
1 686 . 18 1 1 A 113 113 HIS HA H 113 3.876 4.253 -0.377 1
1 691 . 18 1 1 A 114 114 SER H H 114 8.367 8.141 0.226 1
1 692 . 18 1 1 A 114 114 SER HA H 114 4.024 4.033 -0.009 1
1 695 . 18 1 1 A 115 115 LYS H H 115 8.140 7.518 0.622 1
1 696 . 18 1 1 A 115 115 LYS HA H 115 5.403 4.454 0.949 1
1 699 . 18 1 1 A 116 116 VAL H H 116 8.525 8.332 0.193 1
1 700 . 18 1 1 A 116 116 VAL HA H 116 5.378 4.893 0.485 1
1 708 . 18 1 1 A 117 117 ASP H H 117 8.025 8.770 -0.745 1
1 709 . 18 1 1 A 117 117 ASP HA H 117 5.243 4.699 0.544 1
1 712 . 18 1 1 A 118 118 LYS H H 118 8.930 8.204 0.726 1
1 713 . 18 1 1 A 118 118 LYS HA H 118 4.216 4.438 -0.222 1
1 716 . 18 1 1 A 119 119 ASN H H 119 8.425 8.223 0.202 1
1 717 . 18 1 1 A 119 119 ASN HA H 119 5.061 4.675 0.386 1
1 722 . 18 1 1 A 120 120 ASN H H 120 8.061 8.135 -0.074 1
1 723 . 18 1 1 A 120 120 ASN HA H 120 4.212 4.571 -0.359 1
1 728 . 18 1 1 A 121 121 GLN H H 121 8.359 8.075 0.284 1
1 729 . 18 1 1 A 121 121 GLN HA H 121 4.373 4.123 0.250 1
1 735 . 18 1 1 A 122 122 GLY H H 122 8.770 7.435 1.335 1
1 736 . 18 1 1 A 122 122 GLY HA2 H 122 3.182 3.960 -0.778 1
1 737 . 18 1 1 A 122 122 GLY HA3 H 122 5.268 3.982 1.286 1
1 738 . 18 1 1 A 123 123 LYS H H 123 8.587 8.354 0.233 1
1 739 . 18 1 1 A 123 123 LYS HA H 123 4.016 4.404 -0.388 1
1 745 . 18 1 1 A 124 124 GLU H H 124 8.527 7.829 0.698 1
1 746 . 18 1 1 A 124 124 GLU HA H 124 4.152 4.475 -0.323 1
1 750 . 18 1 1 A 125 125 PHE H H 125 7.936 8.823 -0.887 1
1 751 . 18 1 1 A 125 125 PHE HA H 125 4.670 4.710 -0.040 1
1 758 . 18 1 1 A 126 126 PHE H H 126 8.214 9.148 -0.934 1
1 759 . 18 1 1 A 126 126 PHE HA H 126 5.177 5.128 0.049 1
1 767 . 18 1 1 A 127 127 GLU H H 127 9.169 8.711 0.458 1
1 768 . 18 1 1 A 127 127 GLU HA H 127 4.852 4.484 0.368 1
1 773 . 18 1 1 A 128 128 LYS H H 128 9.000 8.270 0.730 1
1 774 . 18 1 1 A 128 128 LYS HA H 128 4.191 4.088 0.103 1
1 777 . 18 1 1 A 129 129 CYS H H 129 8.938 9.168 -0.230 1
1 778 . 18 1 1 A 129 129 CYS HA H 129 5.268 4.955 0.313 1
1 5 . 19 1 1 A 2 2 PRO HA H 2 4.900 4.508 0.392 1
1 10 . 19 1 1 A 3 3 ILE H H 3 8.774 7.468 1.306 1
1 11 . 19 1 1 A 3 3 ILE HA H 3 5.499 4.754 0.745 1
1 20 . 19 1 1 A 4 4 VAL H H 4 9.501 8.904 0.597 1
1 21 . 19 1 1 A 4 4 VAL HA H 4 4.944 4.727 0.217 1
1 29 . 19 1 1 A 5 5 THR H H 5 9.243 9.005 0.238 1
1 30 . 19 1 1 A 5 5 THR HA H 5 5.278 5.261 0.017 1
1 35 . 19 1 1 A 6 6 CYS H H 6 9.815 8.836 0.979 1
1 36 . 19 1 1 A 6 6 CYS HA H 6 5.310 4.739 0.571 1
1 38 . 19 1 1 A 7 7 ARG H H 7 9.154 8.349 0.805 1
1 41 . 19 1 1 A 8 8 PRO HA H 8 4.594 4.533 0.061 1
1 47 . 19 1 1 A 9 9 LYS H H 9 8.179 8.347 -0.168 1
1 48 . 19 1 1 A 9 9 LYS HA H 9 4.857 4.827 0.030 1
1 52 . 19 1 1 A 10 10 LEU H H 10 9.108 8.361 0.747 1
1 53 . 19 1 1 A 10 10 LEU HA H 10 5.147 4.782 0.365 1
1 63 . 19 1 1 A 11 11 ASP H H 11 9.835 8.230 1.605 1
1 64 . 19 1 1 A 11 11 ASP HA H 11 4.471 4.755 -0.284 1
1 67 . 19 1 1 A 12 12 GLY H H 12 8.847 8.032 0.815 1
1 68 . 19 1 1 A 12 12 GLY HA2 H 12 3.782 3.898 -0.116 1
1 69 . 19 1 1 A 12 12 GLY HA3 H 12 4.427 3.904 0.523 1
1 70 . 19 1 1 A 13 13 ARG H H 13 7.933 7.727 0.206 1
1 71 . 19 1 1 A 13 13 ARG HA H 13 4.886 4.573 0.313 1
1 77 . 19 1 1 A 14 14 GLU H H 14 9.179 8.506 0.673 1
1 78 . 19 1 1 A 14 14 GLU HA H 14 4.178 4.538 -0.360 1
1 82 . 19 1 1 A 15 15 LYS H H 15 9.078 8.963 0.115 1
1 83 . 19 1 1 A 15 15 LYS HA H 15 4.890 4.727 0.163 1
1 84 . 19 1 1 A 16 16 PRO HA H 16 5.144 4.904 0.240 1
1 91 . 19 1 1 A 17 17 PHE H H 17 9.487 8.548 0.939 1
1 92 . 19 1 1 A 17 17 PHE HA H 17 4.760 4.758 0.002 1
1 100 . 19 1 1 A 18 18 LYS H H 18 9.315 8.789 0.526 1
1 101 . 19 1 1 A 18 18 LYS HA H 18 5.197 4.438 0.759 1
1 108 . 19 1 1 A 19 19 VAL H H 19 9.643 8.697 0.946 1
1 109 . 19 1 1 A 19 19 VAL HA H 19 4.796 4.706 0.090 1
1 117 . 19 1 1 A 20 20 ASP H H 20 9.555 8.705 0.850 1
1 118 . 19 1 1 A 20 20 ASP HA H 20 5.151 4.957 0.194 1
1 121 . 19 1 1 A 21 21 VAL H H 21 9.607 8.819 0.788 1
1 122 . 19 1 1 A 21 21 VAL HA H 21 3.611 3.809 -0.198 1
1 130 . 19 1 1 A 22 22 ALA H H 22 8.531 8.247 0.284 1
1 131 . 19 1 1 A 22 22 ALA HA H 22 4.299 3.879 0.420 1
1 135 . 19 1 1 A 23 23 THR H H 23 7.294 8.304 -1.010 1
1 136 . 19 1 1 A 23 23 THR HA H 23 4.264 3.837 0.427 1
1 141 . 19 1 1 A 24 24 ALA H H 24 8.346 8.234 0.112 1
1 142 . 19 1 1 A 24 24 ALA HA H 24 4.082 4.070 0.012 1
1 146 . 19 1 1 A 25 25 GLN H H 25 8.866 8.308 0.558 1
1 147 . 19 1 1 A 25 25 GLN HA H 25 3.804 3.906 -0.102 1
1 153 . 19 1 1 A 26 26 ALA H H 26 7.767 8.078 -0.311 1
1 154 . 19 1 1 A 26 26 ALA HA H 26 4.208 4.021 0.187 1
1 158 . 19 1 1 A 27 27 GLN H H 27 8.881 8.262 0.619 1
1 159 . 19 1 1 A 27 27 GLN HA H 27 4.041 3.962 0.079 1
1 165 . 19 1 1 A 28 28 ALA H H 28 8.142 8.048 0.094 1
1 166 . 19 1 1 A 28 28 ALA HA H 28 3.475 3.592 -0.117 1
1 170 . 19 1 1 A 29 29 ARG H H 29 7.291 7.533 -0.242 1
1 171 . 19 1 1 A 29 29 ARG HA H 29 3.688 3.792 -0.104 1
1 174 . 19 1 1 A 30 30 LYS H H 30 7.768 7.972 -0.204 1
1 175 . 19 1 1 A 30 30 LYS HA H 30 4.038 3.988 0.050 1
1 179 . 19 1 1 A 31 31 ALA H H 31 8.127 7.429 0.698 1
1 180 . 19 1 1 A 31 31 ALA HA H 31 3.656 3.911 -0.255 1
1 184 . 19 1 1 A 32 32 GLY H H 32 7.670 7.633 0.037 1
1 185 . 19 1 1 A 32 32 GLY HA2 H 32 3.380 3.682 -0.302 1
1 186 . 19 1 1 A 32 32 GLY HA3 H 32 3.844 3.748 0.096 1
1 187 . 19 1 1 A 33 33 LEU H H 33 8.057 8.188 -0.131 1
1 188 . 19 1 1 A 33 33 LEU HA H 33 3.259 3.181 0.078 1
1 197 . 19 1 1 A 34 34 THR H H 34 6.862 7.194 -0.332 1
1 198 . 19 1 1 A 34 34 THR HA H 34 4.738 5.044 -0.306 1
1 203 . 19 1 1 A 35 35 THR H H 35 9.161 8.968 0.193 1
1 204 . 19 1 1 A 35 35 THR HA H 35 4.247 5.241 -0.994 1
1 209 . 19 1 1 A 36 36 GLY H H 36 8.407 8.356 0.051 1
1 210 . 19 1 1 A 36 36 GLY HA2 H 36 4.349 4.014 0.335 1
1 211 . 19 1 1 A 36 36 GLY HA3 H 36 4.967 4.015 0.952 1
1 212 . 19 1 1 A 37 37 LYS H H 37 10.152 8.322 1.830 1
1 213 . 19 1 1 A 37 37 LYS HA H 37 4.383 4.125 0.258 1
1 221 . 19 1 1 A 38 38 SER H H 38 9.085 8.058 1.027 1
1 222 . 19 1 1 A 38 38 SER HA H 38 4.338 4.767 -0.429 1
1 226 . 19 1 1 A 39 39 GLY H H 39 8.474 7.704 0.770 1
1 227 . 19 1 1 A 39 39 GLY HA2 H 39 3.840 4.139 -0.299 1
1 228 . 19 1 1 A 40 40 ASP H H 40 9.424 7.593 1.831 1
1 229 . 19 1 1 A 40 40 ASP HA H 40 5.374 4.552 0.822 1
1 231 . 19 1 1 A 41 41 PRO HA H 41 5.624 4.578 1.046 1
1 238 . 19 1 1 A 42 42 HIS H H 42 8.343 8.704 -0.361 1
1 239 . 19 1 1 A 42 42 HIS HA H 42 5.189 5.215 -0.026 1
1 244 . 19 1 1 A 43 43 ARG H H 43 8.634 8.335 0.299 1
1 245 . 19 1 1 A 43 43 ARG HA H 43 3.654 3.026 0.628 1
1 252 . 19 1 1 A 44 44 TYR H H 44 8.188 8.423 -0.235 1
1 253 . 19 1 1 A 44 44 TYR HA H 44 5.021 4.710 0.311 1
1 260 . 19 1 1 A 45 45 PHE H H 45 8.728 7.554 1.174 1
1 261 . 19 1 1 A 45 45 PHE HA H 45 4.480 4.727 -0.247 1
1 268 . 19 1 1 A 46 46 ALA H H 46 5.979 7.697 -1.718 1
1 269 . 19 1 1 A 46 46 ALA HA H 46 3.797 4.116 -0.319 1
1 273 . 19 1 1 A 47 47 GLY H H 47 8.510 6.994 1.516 1
1 274 . 19 1 1 A 47 47 GLY HA2 H 47 3.953 3.741 0.212 1
1 275 . 19 1 1 A 47 47 GLY HA3 H 47 4.075 3.832 0.243 1
1 276 . 19 1 1 A 48 48 ASP H H 48 7.504 7.610 -0.106 1
1 277 . 19 1 1 A 48 48 ASP HA H 48 5.020 4.854 0.166 1
1 280 . 19 1 1 A 49 49 HIS H H 49 8.240 8.235 0.005 1
1 281 . 19 1 1 A 49 49 HIS HA H 49 4.373 4.196 0.177 1
1 285 . 19 1 1 A 50 50 ILE H H 50 8.468 7.992 0.476 1
1 286 . 19 1 1 A 50 50 ILE HA H 50 3.651 3.979 -0.328 1
1 296 . 19 1 1 A 51 51 ARG H H 51 8.404 8.300 0.104 1
1 297 . 19 1 1 A 51 51 ARG HA H 51 4.450 4.415 0.035 1
1 303 . 19 1 1 A 52 52 TRP H H 52 11.176 7.748 3.428 1
1 304 . 19 1 1 A 52 52 TRP HA H 52 4.423 4.239 0.184 1
1 312 . 19 1 1 A 53 53 GLY H H 53 10.422 8.775 1.647 1
1 313 . 19 1 1 A 53 53 GLY HA2 H 53 3.832 3.907 -0.075 1
1 314 . 19 1 1 A 53 53 GLY HA3 H 53 4.411 3.929 0.482 1
1 315 . 19 1 1 A 54 54 VAL H H 54 7.040 7.656 -0.616 1
1 316 . 19 1 1 A 54 54 VAL HA H 54 4.489 4.441 0.048 1
1 324 . 19 1 1 A 55 55 ASN H H 55 9.530 9.338 0.192 1
1 325 . 19 1 1 A 55 55 ASN HA H 55 4.569 4.377 0.192 1
1 330 . 19 1 1 A 56 56 ASN H H 56 9.175 8.277 0.898 1
1 331 . 19 1 1 A 56 56 ASN HA H 56 4.649 4.381 0.268 1
1 336 . 19 1 1 A 57 57 CYS H H 57 7.613 8.422 -0.809 1
1 337 . 19 1 1 A 57 57 CYS HA H 57 4.645 4.220 0.425 1
1 340 . 19 1 1 A 58 58 ASP H H 58 7.626 8.774 -1.148 1
1 341 . 19 1 1 A 58 58 ASP HA H 58 5.206 4.379 0.827 1
1 344 . 19 1 1 A 59 59 LYS H H 59 7.349 7.204 0.145 1
1 345 . 19 1 1 A 59 59 LYS HA H 59 4.548 4.297 0.251 1
1 350 . 19 1 1 A 60 60 ALA H H 60 9.155 8.835 0.320 1
1 351 . 19 1 1 A 60 60 ALA HA H 60 4.330 4.305 0.025 1
1 355 . 19 1 1 A 61 61 ASP H H 61 8.548 7.886 0.662 1
1 356 . 19 1 1 A 61 61 ASP HA H 61 4.827 4.672 0.155 1
1 359 . 19 1 1 A 62 62 ALA H H 62 7.463 7.413 0.050 1
1 360 . 19 1 1 A 62 62 ALA HA H 62 4.217 4.435 -0.218 1
1 364 . 19 1 1 A 63 63 ILE H H 63 9.302 8.667 0.635 1
1 365 . 19 1 1 A 63 63 ILE HA H 63 4.332 4.631 -0.299 1
1 374 . 19 1 1 A 64 64 LEU H H 64 8.724 8.921 -0.197 1
1 375 . 19 1 1 A 64 64 LEU HA H 64 5.463 5.399 0.064 1
1 385 . 19 1 1 A 65 65 TRP H H 65 9.621 8.490 1.131 1
1 386 . 19 1 1 A 65 65 TRP HA H 65 4.605 5.267 -0.662 1
1 395 . 19 1 1 A 66 66 GLU H H 66 8.388 9.182 -0.794 1
1 396 . 19 1 1 A 66 66 GLU HA H 66 6.014 5.593 0.421 1
1 401 . 19 1 1 A 67 67 TYR H H 67 8.766 9.142 -0.376 1
1 402 . 19 1 1 A 67 67 TYR HA H 67 5.204 5.087 0.117 1
1 405 . 19 1 1 A 68 68 PRO HA H 68 4.523 4.269 0.254 1
1 412 . 19 1 1 A 69 69 ILE H H 69 7.308 8.153 -0.845 1
1 413 . 19 1 1 A 69 69 ILE HA H 69 4.870 4.954 -0.084 1
1 414 . 19 1 1 A 70 70 TYR H H 70 9.219 9.061 0.158 1
1 415 . 19 1 1 A 70 70 TYR HA H 70 4.854 4.646 0.208 1
1 423 . 19 1 1 A 71 71 TRP H H 71 6.662 8.484 -1.822 1
1 424 . 19 1 1 A 71 71 TRP HA H 71 5.496 4.801 0.695 1
1 432 . 19 1 1 A 72 72 VAL H H 72 9.510 9.048 0.462 1
1 433 . 19 1 1 A 72 72 VAL HA H 72 3.999 3.716 0.283 1
1 441 . 19 1 1 A 73 73 GLY H H 73 9.221 8.439 0.782 1
1 442 . 19 1 1 A 73 73 GLY HA2 H 73 3.877 3.863 0.014 1
1 443 . 19 1 1 A 73 73 GLY HA3 H 73 4.682 3.892 0.790 1
1 444 . 19 1 1 A 74 74 LYS H H 74 7.962 7.625 0.337 1
1 445 . 19 1 1 A 74 74 LYS HA H 74 4.469 4.386 0.083 1
1 457 . 19 1 1 A 75 75 ASN H H 75 8.928 8.642 0.286 1
1 458 . 19 1 1 A 75 75 ASN HA H 75 4.837 4.971 -0.134 1
1 463 . 19 1 1 A 76 76 ALA H H 76 7.544 7.406 0.138 1
1 464 . 19 1 1 A 76 76 ALA HA H 76 4.555 4.029 0.526 1
1 468 . 19 1 1 A 77 77 GLU H H 77 8.290 8.145 0.145 1
1 469 . 19 1 1 A 77 77 GLU HA H 77 4.900 4.468 0.432 1
1 474 . 19 1 1 A 78 78 TRP H H 78 10.065 9.057 1.008 1
1 475 . 19 1 1 A 78 78 TRP HA H 78 4.600 5.079 -0.479 1
1 484 . 19 1 1 A 79 79 ALA H H 79 9.850 8.227 1.623 1
1 485 . 19 1 1 A 79 79 ALA HA H 79 5.022 4.820 0.202 1
1 489 . 19 1 1 A 80 80 LYS H H 80 9.255 8.789 0.466 1
1 490 . 19 1 1 A 80 80 LYS HA H 80 4.511 4.513 -0.002 1
1 494 . 19 1 1 A 81 81 ASP H H 81 9.332 8.292 1.040 1
1 495 . 19 1 1 A 81 81 ASP HA H 81 5.429 4.711 0.718 1
1 498 . 19 1 1 A 82 82 VAL H H 82 7.226 7.342 -0.116 1
1 499 . 19 1 1 A 82 82 VAL HA H 82 4.248 4.903 -0.655 1
1 507 . 19 1 1 A 83 83 LYS H H 83 8.407 8.507 -0.100 1
1 508 . 19 1 1 A 83 83 LYS HA H 83 4.356 4.755 -0.399 1
1 510 . 19 1 1 A 84 84 THR H H 84 9.088 9.079 0.009 1
1 511 . 19 1 1 A 84 84 THR HA H 84 3.989 3.938 0.051 1
1 516 . 19 1 1 A 85 85 SER H H 85 8.391 8.373 0.018 1
1 517 . 19 1 1 A 85 85 SER HA H 85 4.442 4.130 0.312 1
1 520 . 19 1 1 A 86 86 GLN H H 86 7.974 7.614 0.360 1
1 521 . 19 1 1 A 86 86 GLN HA H 86 4.585 4.216 0.369 1
1 527 . 19 1 1 A 87 87 GLN H H 87 7.083 7.224 -0.141 1
1 528 . 19 1 1 A 87 87 GLN HA H 87 3.903 4.208 -0.305 1
1 534 . 19 1 1 A 88 88 LYS H H 88 9.453 8.533 0.920 1
1 535 . 19 1 1 A 88 88 LYS HA H 88 4.114 3.752 0.362 1
1 539 . 19 1 1 A 89 89 GLY H H 89 9.466 8.580 0.886 1
1 540 . 19 1 1 A 89 89 GLY HA2 H 89 3.965 3.983 -0.018 1
1 541 . 19 1 1 A 89 89 GLY HA3 H 89 3.148 3.998 -0.850 1
1 542 . 19 1 1 A 90 90 GLY H H 90 7.228 7.803 -0.575 1
1 543 . 19 1 1 A 90 90 GLY HA2 H 90 4.290 4.068 0.222 1
1 544 . 19 1 1 A 90 90 GLY HA3 H 90 4.682 4.079 0.603 1
1 545 . 19 1 1 A 91 91 PRO HA H 91 4.902 4.879 0.023 1
1 552 . 19 1 1 A 92 92 THR H H 92 8.585 8.646 -0.061 1
1 553 . 19 1 1 A 92 92 THR HA H 92 5.701 5.174 0.527 1
1 559 . 19 1 1 A 93 93 PRO HA H 93 5.551 3.925 1.626 1
1 563 . 19 1 1 A 94 94 ILE H H 94 8.155 7.118 1.037 1
1 564 . 19 1 1 A 94 94 ILE HA H 94 4.794 4.190 0.604 1
1 571 . 19 1 1 A 95 95 ARG H H 95 9.538 9.012 0.526 1
1 572 . 19 1 1 A 95 95 ARG HA H 95 5.278 5.195 0.083 1
1 576 . 19 1 1 A 96 96 VAL H H 96 9.276 8.997 0.279 1
1 577 . 19 1 1 A 96 96 VAL HA H 96 5.222 4.445 0.777 1
1 585 . 19 1 1 A 97 97 VAL H H 97 8.739 8.862 -0.123 1
1 586 . 19 1 1 A 97 97 VAL HA H 97 5.160 5.130 0.030 1
1 594 . 19 1 1 A 98 98 TYR H H 98 8.596 8.533 0.063 1
1 595 . 19 1 1 A 98 98 TYR HA H 98 5.266 5.325 -0.059 1
1 603 . 19 1 1 A 99 99 ALA H H 99 9.685 8.843 0.842 1
1 604 . 19 1 1 A 99 99 ALA HA H 99 5.680 5.526 0.154 1
1 608 . 19 1 1 A 100 100 ASN H H 100 8.468 8.845 -0.377 1
1 609 . 19 1 1 A 100 100 ASN HA H 100 4.885 5.173 -0.288 1
1 614 . 19 1 1 A 101 101 SER H H 101 9.342 8.354 0.988 1
1 615 . 19 1 1 A 101 101 SER HA H 101 4.993 4.227 0.766 1
1 618 . 19 1 1 A 102 102 ARG H H 102 9.349 7.958 1.391 1
1 619 . 19 1 1 A 102 102 ARG HA H 102 4.068 4.533 -0.465 1
1 620 . 19 1 1 A 103 103 GLY H H 103 8.632 7.966 0.666 1
1 621 . 19 1 1 A 103 103 GLY HA2 H 103 3.691 3.943 -0.252 1
1 622 . 19 1 1 A 103 103 GLY HA3 H 103 4.341 3.948 0.393 1
1 623 . 19 1 1 A 104 104 ALA H H 104 7.820 7.831 -0.011 1
1 624 . 19 1 1 A 104 104 ALA HA H 104 4.775 4.570 0.205 1
1 628 . 19 1 1 A 105 105 VAL H H 105 8.402 8.769 -0.367 1
1 629 . 19 1 1 A 105 105 VAL HA H 105 4.218 4.033 0.185 1
1 637 . 19 1 1 A 106 106 GLN H H 106 9.352 8.662 0.690 1
1 638 . 19 1 1 A 106 106 GLN HA H 106 4.900 4.562 0.338 1
1 645 . 19 1 1 A 107 107 TYR H H 107 9.075 8.065 1.010 1
1 646 . 19 1 1 A 107 107 TYR HA H 107 4.007 4.125 -0.118 1
1 653 . 19 1 1 A 108 108 CYS H H 108 8.197 7.762 0.435 1
1 654 . 19 1 1 A 108 108 CYS HA H 108 4.823 4.077 0.746 1
1 657 . 19 1 1 A 109 109 GLY H H 109 6.856 6.664 0.192 1
1 658 . 19 1 1 A 109 109 GLY HA2 H 109 3.983 3.147 0.836 1
1 659 . 19 1 1 A 109 109 GLY HA3 H 109 4.422 3.175 1.247 1
1 660 . 19 1 1 A 110 110 VAL H H 110 9.418 8.593 0.825 1
1 661 . 19 1 1 A 110 110 VAL HA H 110 5.073 5.258 -0.185 1
1 669 . 19 1 1 A 111 111 MET H H 111 9.327 9.666 -0.339 1
1 670 . 19 1 1 A 111 111 MET HA H 111 5.678 5.587 0.091 1
1 678 . 19 1 1 A 112 112 THR H H 112 9.310 8.993 0.317 1
1 679 . 19 1 1 A 112 112 THR HA H 112 5.726 4.734 0.992 1
1 685 . 19 1 1 A 113 113 HIS H H 113 8.960 7.914 1.046 1
1 686 . 19 1 1 A 113 113 HIS HA H 113 3.876 4.195 -0.319 1
1 691 . 19 1 1 A 114 114 SER H H 114 8.367 8.599 -0.232 1
1 692 . 19 1 1 A 114 114 SER HA H 114 4.024 4.329 -0.305 1
1 695 . 19 1 1 A 115 115 LYS H H 115 8.140 7.438 0.702 1
1 696 . 19 1 1 A 115 115 LYS HA H 115 5.403 4.521 0.882 1
1 699 . 19 1 1 A 116 116 VAL H H 116 8.525 8.243 0.282 1
1 700 . 19 1 1 A 116 116 VAL HA H 116 5.378 4.763 0.615 1
1 708 . 19 1 1 A 117 117 ASP H H 117 8.025 8.955 -0.930 1
1 709 . 19 1 1 A 117 117 ASP HA H 117 5.243 4.752 0.491 1
1 712 . 19 1 1 A 118 118 LYS H H 118 8.930 8.139 0.791 1
1 713 . 19 1 1 A 118 118 LYS HA H 118 4.216 4.576 -0.360 1
1 716 . 19 1 1 A 119 119 ASN H H 119 8.425 8.051 0.374 1
1 717 . 19 1 1 A 119 119 ASN HA H 119 5.061 4.906 0.155 1
1 722 . 19 1 1 A 120 120 ASN H H 120 8.061 8.121 -0.060 1
1 723 . 19 1 1 A 120 120 ASN HA H 120 4.212 4.345 -0.133 1
1 728 . 19 1 1 A 121 121 GLN H H 121 8.359 7.945 0.414 1
1 729 . 19 1 1 A 121 121 GLN HA H 121 4.373 4.420 -0.047 1
1 735 . 19 1 1 A 122 122 GLY H H 122 8.770 8.231 0.539 1
1 736 . 19 1 1 A 122 122 GLY HA2 H 122 3.182 4.061 -0.879 1
1 737 . 19 1 1 A 122 122 GLY HA3 H 122 5.268 4.152 1.116 1
1 738 . 19 1 1 A 123 123 LYS H H 123 8.587 8.538 0.049 1
1 739 . 19 1 1 A 123 123 LYS HA H 123 4.016 4.500 -0.484 1
1 745 . 19 1 1 A 124 124 GLU H H 124 8.527 7.800 0.727 1
1 746 . 19 1 1 A 124 124 GLU HA H 124 4.152 4.552 -0.400 1
1 750 . 19 1 1 A 125 125 PHE H H 125 7.936 8.828 -0.892 1
1 751 . 19 1 1 A 125 125 PHE HA H 125 4.670 4.748 -0.078 1
1 758 . 19 1 1 A 126 126 PHE H H 126 8.214 9.123 -0.909 1
1 759 . 19 1 1 A 126 126 PHE HA H 126 5.177 4.883 0.294 1
1 767 . 19 1 1 A 127 127 GLU H H 127 9.169 8.923 0.246 1
1 768 . 19 1 1 A 127 127 GLU HA H 127 4.852 4.504 0.348 1
1 773 . 19 1 1 A 128 128 LYS H H 128 9.000 8.255 0.745 1
1 774 . 19 1 1 A 128 128 LYS HA H 128 4.191 3.870 0.321 1
1 777 . 19 1 1 A 129 129 CYS H H 129 8.938 8.885 0.053 1
1 778 . 19 1 1 A 129 129 CYS HA H 129 5.268 4.541 0.727 1
1 5 . 20 1 1 A 2 2 PRO HA H 2 4.900 4.504 0.396 1
1 10 . 20 1 1 A 3 3 ILE H H 3 8.774 7.451 1.323 1
1 11 . 20 1 1 A 3 3 ILE HA H 3 5.499 4.779 0.720 1
1 20 . 20 1 1 A 4 4 VAL H H 4 9.501 8.936 0.565 1
1 21 . 20 1 1 A 4 4 VAL HA H 4 4.944 4.726 0.218 1
1 29 . 20 1 1 A 5 5 THR H H 5 9.243 9.013 0.230 1
1 30 . 20 1 1 A 5 5 THR HA H 5 5.278 5.245 0.033 1
1 35 . 20 1 1 A 6 6 CYS H H 6 9.815 8.959 0.856 1
1 36 . 20 1 1 A 6 6 CYS HA H 6 5.310 4.640 0.670 1
1 38 . 20 1 1 A 7 7 ARG H H 7 9.154 8.510 0.644 1
1 41 . 20 1 1 A 8 8 PRO HA H 8 4.594 4.657 -0.063 1
1 47 . 20 1 1 A 9 9 LYS H H 9 8.179 8.284 -0.105 1
1 48 . 20 1 1 A 9 9 LYS HA H 9 4.857 4.958 -0.101 1
1 52 . 20 1 1 A 10 10 LEU H H 10 9.108 8.406 0.702 1
1 53 . 20 1 1 A 10 10 LEU HA H 10 5.147 4.717 0.430 1
1 63 . 20 1 1 A 11 11 ASP H H 11 9.835 8.108 1.727 1
1 64 . 20 1 1 A 11 11 ASP HA H 11 4.471 4.786 -0.315 1
1 67 . 20 1 1 A 12 12 GLY H H 12 8.847 8.100 0.747 1
1 68 . 20 1 1 A 12 12 GLY HA2 H 12 3.782 3.943 -0.161 1
1 69 . 20 1 1 A 12 12 GLY HA3 H 12 4.427 3.950 0.477 1
1 70 . 20 1 1 A 13 13 ARG H H 13 7.933 7.780 0.153 1
1 71 . 20 1 1 A 13 13 ARG HA H 13 4.886 4.443 0.443 1
1 77 . 20 1 1 A 14 14 GLU H H 14 9.179 8.614 0.565 1
1 78 . 20 1 1 A 14 14 GLU HA H 14 4.178 4.648 -0.470 1
1 82 . 20 1 1 A 15 15 LYS H H 15 9.078 9.065 0.013 1
1 83 . 20 1 1 A 15 15 LYS HA H 15 4.890 4.818 0.072 1
1 84 . 20 1 1 A 16 16 PRO HA H 16 5.144 4.803 0.341 1
1 91 . 20 1 1 A 17 17 PHE H H 17 9.487 8.485 1.002 1
1 92 . 20 1 1 A 17 17 PHE HA H 17 4.760 4.874 -0.114 1
1 100 . 20 1 1 A 18 18 LYS H H 18 9.315 8.818 0.497 1
1 101 . 20 1 1 A 18 18 LYS HA H 18 5.197 4.384 0.813 1
1 108 . 20 1 1 A 19 19 VAL H H 19 9.643 8.459 1.184 1
1 109 . 20 1 1 A 19 19 VAL HA H 19 4.796 4.658 0.138 1
1 117 . 20 1 1 A 20 20 ASP H H 20 9.555 8.681 0.874 1
1 118 . 20 1 1 A 20 20 ASP HA H 20 5.151 4.972 0.179 1
1 121 . 20 1 1 A 21 21 VAL H H 21 9.607 8.748 0.859 1
1 122 . 20 1 1 A 21 21 VAL HA H 21 3.611 3.833 -0.222 1
1 130 . 20 1 1 A 22 22 ALA H H 22 8.531 8.232 0.299 1
1 131 . 20 1 1 A 22 22 ALA HA H 22 4.299 3.863 0.436 1
1 135 . 20 1 1 A 23 23 THR H H 23 7.294 8.251 -0.957 1
1 136 . 20 1 1 A 23 23 THR HA H 23 4.264 3.807 0.457 1
1 141 . 20 1 1 A 24 24 ALA H H 24 8.346 8.161 0.185 1
1 142 . 20 1 1 A 24 24 ALA HA H 24 4.082 4.039 0.043 1
1 146 . 20 1 1 A 25 25 GLN H H 25 8.866 8.131 0.735 1
1 147 . 20 1 1 A 25 25 GLN HA H 25 3.804 3.600 0.204 1
1 153 . 20 1 1 A 26 26 ALA H H 26 7.767 8.267 -0.500 1
1 154 . 20 1 1 A 26 26 ALA HA H 26 4.208 3.984 0.224 1
1 158 . 20 1 1 A 27 27 GLN H H 27 8.881 8.336 0.545 1
1 159 . 20 1 1 A 27 27 GLN HA H 27 4.041 3.868 0.173 1
1 165 . 20 1 1 A 28 28 ALA H H 28 8.142 7.918 0.224 1
1 166 . 20 1 1 A 28 28 ALA HA H 28 3.475 3.571 -0.096 1
1 170 . 20 1 1 A 29 29 ARG H H 29 7.291 7.898 -0.607 1
1 171 . 20 1 1 A 29 29 ARG HA H 29 3.688 3.911 -0.223 1
1 174 . 20 1 1 A 30 30 LYS H H 30 7.768 7.829 -0.061 1
1 175 . 20 1 1 A 30 30 LYS HA H 30 4.038 4.007 0.031 1
1 179 . 20 1 1 A 31 31 ALA H H 31 8.127 7.540 0.587 1
1 180 . 20 1 1 A 31 31 ALA HA H 31 3.656 4.006 -0.350 1
1 184 . 20 1 1 A 32 32 GLY H H 32 7.670 7.745 -0.075 1
1 185 . 20 1 1 A 32 32 GLY HA2 H 32 3.380 3.810 -0.430 1
1 186 . 20 1 1 A 32 32 GLY HA3 H 32 3.844 3.834 0.010 1
1 187 . 20 1 1 A 33 33 LEU H H 33 8.057 8.156 -0.099 1
1 188 . 20 1 1 A 33 33 LEU HA H 33 3.259 3.012 0.247 1
1 197 . 20 1 1 A 34 34 THR H H 34 6.862 7.084 -0.222 1
1 198 . 20 1 1 A 34 34 THR HA H 34 4.738 4.907 -0.169 1
1 203 . 20 1 1 A 35 35 THR H H 35 9.161 9.354 -0.193 1
1 204 . 20 1 1 A 35 35 THR HA H 35 4.247 5.239 -0.992 1
1 209 . 20 1 1 A 36 36 GLY H H 36 8.407 8.655 -0.248 1
1 210 . 20 1 1 A 36 36 GLY HA2 H 36 4.349 4.202 0.147 1
1 211 . 20 1 1 A 36 36 GLY HA3 H 36 4.967 4.206 0.761 1
1 212 . 20 1 1 A 37 37 LYS H H 37 10.152 7.873 2.279 1
1 213 . 20 1 1 A 37 37 LYS HA H 37 4.383 4.564 -0.181 1
1 221 . 20 1 1 A 38 38 SER H H 38 9.085 8.165 0.920 1
1 222 . 20 1 1 A 38 38 SER HA H 38 4.338 4.713 -0.375 1
1 226 . 20 1 1 A 39 39 GLY H H 39 8.474 7.687 0.787 1
1 227 . 20 1 1 A 39 39 GLY HA2 H 39 3.840 4.169 -0.329 1
1 228 . 20 1 1 A 40 40 ASP H H 40 9.424 7.772 1.652 1
1 229 . 20 1 1 A 40 40 ASP HA H 40 5.374 4.828 0.546 1
1 231 . 20 1 1 A 41 41 PRO HA H 41 5.624 4.541 1.083 1
1 238 . 20 1 1 A 42 42 HIS H H 42 8.343 8.584 -0.241 1
1 239 . 20 1 1 A 42 42 HIS HA H 42 5.189 5.183 0.006 1
1 244 . 20 1 1 A 43 43 ARG H H 43 8.634 8.142 0.492 1
1 245 . 20 1 1 A 43 43 ARG HA H 43 3.654 3.168 0.486 1
1 252 . 20 1 1 A 44 44 TYR H H 44 8.188 8.578 -0.390 1
1 253 . 20 1 1 A 44 44 TYR HA H 44 5.021 5.000 0.021 1
1 260 . 20 1 1 A 45 45 PHE H H 45 8.728 8.582 0.146 1
1 261 . 20 1 1 A 45 45 PHE HA H 45 4.480 5.146 -0.666 1
1 268 . 20 1 1 A 46 46 ALA H H 46 5.979 7.539 -1.560 1
1 269 . 20 1 1 A 46 46 ALA HA H 46 3.797 4.284 -0.487 1
1 273 . 20 1 1 A 47 47 GLY H H 47 8.510 8.390 0.120 1
1 274 . 20 1 1 A 47 47 GLY HA2 H 47 3.953 3.905 0.048 1
1 275 . 20 1 1 A 47 47 GLY HA3 H 47 4.075 4.057 0.018 1
1 276 . 20 1 1 A 48 48 ASP H H 48 7.504 7.601 -0.097 1
1 277 . 20 1 1 A 48 48 ASP HA H 48 5.020 4.641 0.379 1
1 280 . 20 1 1 A 49 49 HIS H H 49 8.240 8.561 -0.321 1
1 281 . 20 1 1 A 49 49 HIS HA H 49 4.373 4.356 0.017 1
1 285 . 20 1 1 A 50 50 ILE H H 50 8.468 7.696 0.772 1
1 286 . 20 1 1 A 50 50 ILE HA H 50 3.651 3.820 -0.169 1
1 296 . 20 1 1 A 51 51 ARG H H 51 8.404 8.345 0.059 1
1 297 . 20 1 1 A 51 51 ARG HA H 51 4.450 4.664 -0.214 1
1 303 . 20 1 1 A 52 52 TRP H H 52 11.176 7.909 3.267 1
1 304 . 20 1 1 A 52 52 TRP HA H 52 4.423 4.272 0.151 1
1 312 . 20 1 1 A 53 53 GLY H H 53 10.422 8.809 1.613 1
1 313 . 20 1 1 A 53 53 GLY HA2 H 53 3.832 3.914 -0.082 1
1 314 . 20 1 1 A 53 53 GLY HA3 H 53 4.411 3.944 0.467 1
1 315 . 20 1 1 A 54 54 VAL H H 54 7.040 8.032 -0.992 1
1 316 . 20 1 1 A 54 54 VAL HA H 54 4.489 4.353 0.136 1
1 324 . 20 1 1 A 55 55 ASN H H 55 9.530 9.024 0.506 1
1 325 . 20 1 1 A 55 55 ASN HA H 55 4.569 4.313 0.256 1
1 330 . 20 1 1 A 56 56 ASN H H 56 9.175 8.153 1.022 1
1 331 . 20 1 1 A 56 56 ASN HA H 56 4.649 4.454 0.195 1
1 336 . 20 1 1 A 57 57 CYS H H 57 7.613 8.095 -0.482 1
1 337 . 20 1 1 A 57 57 CYS HA H 57 4.645 4.396 0.249 1
1 340 . 20 1 1 A 58 58 ASP H H 58 7.626 7.945 -0.319 1
1 341 . 20 1 1 A 58 58 ASP HA H 58 5.206 4.758 0.448 1
1 344 . 20 1 1 A 59 59 LYS H H 59 7.349 7.362 -0.013 1
1 345 . 20 1 1 A 59 59 LYS HA H 59 4.548 4.348 0.200 1
1 350 . 20 1 1 A 60 60 ALA H H 60 9.155 8.666 0.489 1
1 351 . 20 1 1 A 60 60 ALA HA H 60 4.330 4.198 0.132 1
1 355 . 20 1 1 A 61 61 ASP H H 61 8.548 7.824 0.724 1
1 356 . 20 1 1 A 61 61 ASP HA H 61 4.827 4.899 -0.072 1
1 359 . 20 1 1 A 62 62 ALA H H 62 7.463 7.301 0.162 1
1 360 . 20 1 1 A 62 62 ALA HA H 62 4.217 4.276 -0.059 1
1 364 . 20 1 1 A 63 63 ILE H H 63 9.302 8.661 0.641 1
1 365 . 20 1 1 A 63 63 ILE HA H 63 4.332 4.636 -0.304 1
1 374 . 20 1 1 A 64 64 LEU H H 64 8.724 8.980 -0.256 1
1 375 . 20 1 1 A 64 64 LEU HA H 64 5.463 5.250 0.213 1
1 385 . 20 1 1 A 65 65 TRP H H 65 9.621 8.422 1.199 1
1 386 . 20 1 1 A 65 65 TRP HA H 65 4.605 5.437 -0.832 1
1 395 . 20 1 1 A 66 66 GLU H H 66 8.388 9.430 -1.042 1
1 396 . 20 1 1 A 66 66 GLU HA H 66 6.014 5.596 0.418 1
1 401 . 20 1 1 A 67 67 TYR H H 67 8.766 9.214 -0.448 1
1 402 . 20 1 1 A 67 67 TYR HA H 67 5.204 5.071 0.133 1
1 405 . 20 1 1 A 68 68 PRO HA H 68 4.523 4.698 -0.175 1
1 412 . 20 1 1 A 69 69 ILE H H 69 7.308 8.199 -0.891 1
1 413 . 20 1 1 A 69 69 ILE HA H 69 4.870 5.398 -0.528 1
1 414 . 20 1 1 A 70 70 TYR H H 70 9.219 9.028 0.191 1
1 415 . 20 1 1 A 70 70 TYR HA H 70 4.854 4.946 -0.092 1
1 423 . 20 1 1 A 71 71 TRP H H 71 6.662 8.313 -1.651 1
1 424 . 20 1 1 A 71 71 TRP HA H 71 5.496 4.811 0.685 1
1 432 . 20 1 1 A 72 72 VAL H H 72 9.510 8.662 0.848 1
1 433 . 20 1 1 A 72 72 VAL HA H 72 3.999 3.583 0.416 1
1 441 . 20 1 1 A 73 73 GLY H H 73 9.221 9.042 0.179 1
1 442 . 20 1 1 A 73 73 GLY HA2 H 73 3.877 4.075 -0.198 1
1 443 . 20 1 1 A 73 73 GLY HA3 H 73 4.682 4.084 0.598 1
1 444 . 20 1 1 A 74 74 LYS H H 74 7.962 7.941 0.021 1
1 445 . 20 1 1 A 74 74 LYS HA H 74 4.469 4.279 0.190 1
1 457 . 20 1 1 A 75 75 ASN H H 75 8.928 8.889 0.039 1
1 458 . 20 1 1 A 75 75 ASN HA H 75 4.837 4.812 0.025 1
1 463 . 20 1 1 A 76 76 ALA H H 76 7.544 8.586 -1.042 1
1 464 . 20 1 1 A 76 76 ALA HA H 76 4.555 3.702 0.853 1
1 468 . 20 1 1 A 77 77 GLU H H 77 8.290 7.588 0.702 1
1 469 . 20 1 1 A 77 77 GLU HA H 77 4.900 3.305 1.595 1
1 474 . 20 1 1 A 78 78 TRP H H 78 10.065 8.378 1.687 1
1 475 . 20 1 1 A 78 78 TRP HA H 78 4.600 4.617 -0.017 1
1 484 . 20 1 1 A 79 79 ALA H H 79 9.850 8.629 1.221 1
1 485 . 20 1 1 A 79 79 ALA HA H 79 5.022 4.617 0.405 1
1 489 . 20 1 1 A 80 80 LYS H H 80 9.255 8.796 0.459 1
1 490 . 20 1 1 A 80 80 LYS HA H 80 4.511 4.558 -0.047 1
1 494 . 20 1 1 A 81 81 ASP H H 81 9.332 8.290 1.042 1
1 495 . 20 1 1 A 81 81 ASP HA H 81 5.429 4.716 0.713 1
1 498 . 20 1 1 A 82 82 VAL H H 82 7.226 7.555 -0.329 1
1 499 . 20 1 1 A 82 82 VAL HA H 82 4.248 4.557 -0.309 1
1 507 . 20 1 1 A 83 83 LYS H H 83 8.407 8.550 -0.143 1
1 508 . 20 1 1 A 83 83 LYS HA H 83 4.356 4.305 0.051 1
1 510 . 20 1 1 A 84 84 THR H H 84 9.088 9.115 -0.027 1
1 511 . 20 1 1 A 84 84 THR HA H 84 3.989 4.132 -0.143 1
1 516 . 20 1 1 A 85 85 SER H H 85 8.391 8.071 0.320 1
1 517 . 20 1 1 A 85 85 SER HA H 85 4.442 4.080 0.362 1
1 520 . 20 1 1 A 86 86 GLN H H 86 7.974 8.141 -0.167 1
1 521 . 20 1 1 A 86 86 GLN HA H 86 4.585 3.989 0.596 1
1 527 . 20 1 1 A 87 87 GLN H H 87 7.083 7.696 -0.613 1
1 528 . 20 1 1 A 87 87 GLN HA H 87 3.903 3.903 0.000 1
1 534 . 20 1 1 A 88 88 LYS H H 88 9.453 8.499 0.954 1
1 535 . 20 1 1 A 88 88 LYS HA H 88 4.114 4.413 -0.299 1
1 539 . 20 1 1 A 89 89 GLY H H 89 9.466 8.093 1.373 1
1 540 . 20 1 1 A 89 89 GLY HA2 H 89 3.965 4.147 -0.182 1
1 541 . 20 1 1 A 89 89 GLY HA3 H 89 3.148 4.167 -1.019 1
1 542 . 20 1 1 A 90 90 GLY H H 90 7.228 7.139 0.089 1
1 543 . 20 1 1 A 90 90 GLY HA2 H 90 4.290 4.084 0.206 1
1 544 . 20 1 1 A 90 90 GLY HA3 H 90 4.682 4.085 0.597 1
1 545 . 20 1 1 A 91 91 PRO HA H 91 4.902 4.651 0.251 1
1 552 . 20 1 1 A 92 92 THR H H 92 8.585 7.657 0.928 1
1 553 . 20 1 1 A 92 92 THR HA H 92 5.701 4.220 1.481 1
1 559 . 20 1 1 A 93 93 PRO HA H 93 5.551 4.150 1.401 1
1 563 . 20 1 1 A 94 94 ILE H H 94 8.155 7.041 1.114 1
1 564 . 20 1 1 A 94 94 ILE HA H 94 4.794 4.310 0.484 1
1 571 . 20 1 1 A 95 95 ARG H H 95 9.538 8.848 0.690 1
1 572 . 20 1 1 A 95 95 ARG HA H 95 5.278 5.273 0.005 1
1 576 . 20 1 1 A 96 96 VAL H H 96 9.276 8.813 0.463 1
1 577 . 20 1 1 A 96 96 VAL HA H 96 5.222 4.248 0.974 1
1 585 . 20 1 1 A 97 97 VAL H H 97 8.739 8.897 -0.158 1
1 586 . 20 1 1 A 97 97 VAL HA H 97 5.160 5.203 -0.043 1
1 594 . 20 1 1 A 98 98 TYR H H 98 8.596 8.465 0.131 1
1 595 . 20 1 1 A 98 98 TYR HA H 98 5.266 5.291 -0.025 1
1 603 . 20 1 1 A 99 99 ALA H H 99 9.685 8.552 1.133 1
1 604 . 20 1 1 A 99 99 ALA HA H 99 5.680 4.735 0.945 1
1 608 . 20 1 1 A 100 100 ASN H H 100 8.468 9.541 -1.073 1
1 609 . 20 1 1 A 100 100 ASN HA H 100 4.885 4.556 0.329 1
1 614 . 20 1 1 A 101 101 SER H H 101 9.342 8.258 1.084 1
1 615 . 20 1 1 A 101 101 SER HA H 101 4.993 4.212 0.781 1
1 618 . 20 1 1 A 102 102 ARG H H 102 9.349 7.910 1.439 1
1 619 . 20 1 1 A 102 102 ARG HA H 102 4.068 3.970 0.098 1
1 620 . 20 1 1 A 103 103 GLY H H 103 8.632 8.523 0.109 1
1 621 . 20 1 1 A 103 103 GLY HA2 H 103 3.691 3.941 -0.250 1
1 622 . 20 1 1 A 103 103 GLY HA3 H 103 4.341 3.955 0.386 1
1 623 . 20 1 1 A 104 104 ALA H H 104 7.820 8.143 -0.323 1
1 624 . 20 1 1 A 104 104 ALA HA H 104 4.775 4.698 0.077 1
1 628 . 20 1 1 A 105 105 VAL H H 105 8.402 8.956 -0.554 1
1 629 . 20 1 1 A 105 105 VAL HA H 105 4.218 4.278 -0.060 1
1 637 . 20 1 1 A 106 106 GLN H H 106 9.352 8.632 0.720 1
1 638 . 20 1 1 A 106 106 GLN HA H 106 4.900 4.564 0.336 1
1 645 . 20 1 1 A 107 107 TYR H H 107 9.075 8.042 1.033 1
1 646 . 20 1 1 A 107 107 TYR HA H 107 4.007 4.119 -0.112 1
1 653 . 20 1 1 A 108 108 CYS H H 108 8.197 7.756 0.441 1
1 654 . 20 1 1 A 108 108 CYS HA H 108 4.823 4.074 0.749 1
1 657 . 20 1 1 A 109 109 GLY H H 109 6.856 6.787 0.069 1
1 658 . 20 1 1 A 109 109 GLY HA2 H 109 3.983 3.296 0.687 1
1 659 . 20 1 1 A 109 109 GLY HA3 H 109 4.422 3.312 1.110 1
1 660 . 20 1 1 A 110 110 VAL H H 110 9.418 8.489 0.929 1
1 661 . 20 1 1 A 110 110 VAL HA H 110 5.073 4.925 0.148 1
1 669 . 20 1 1 A 111 111 MET H H 111 9.327 9.775 -0.448 1
1 670 . 20 1 1 A 111 111 MET HA H 111 5.678 5.779 -0.101 1
1 678 . 20 1 1 A 112 112 THR H H 112 9.310 9.100 0.210 1
1 679 . 20 1 1 A 112 112 THR HA H 112 5.726 4.572 1.154 1
1 685 . 20 1 1 A 113 113 HIS H H 113 8.960 8.372 0.588 1
1 686 . 20 1 1 A 113 113 HIS HA H 113 3.876 4.564 -0.688 1
1 691 . 20 1 1 A 114 114 SER H H 114 8.367 8.726 -0.359 1
1 692 . 20 1 1 A 114 114 SER HA H 114 4.024 4.412 -0.388 1
1 695 . 20 1 1 A 115 115 LYS H H 115 8.140 7.545 0.595 1
1 696 . 20 1 1 A 115 115 LYS HA H 115 5.403 4.425 0.978 1
1 699 . 20 1 1 A 116 116 VAL H H 116 8.525 8.673 -0.148 1
1 700 . 20 1 1 A 116 116 VAL HA H 116 5.378 4.907 0.471 1
1 708 . 20 1 1 A 117 117 ASP H H 117 8.025 8.587 -0.562 1
1 709 . 20 1 1 A 117 117 ASP HA H 117 5.243 4.690 0.553 1
1 712 . 20 1 1 A 118 118 LYS H H 118 8.930 8.064 0.866 1
1 713 . 20 1 1 A 118 118 LYS HA H 118 4.216 4.248 -0.032 1
1 716 . 20 1 1 A 119 119 ASN H H 119 8.425 8.089 0.336 1
1 717 . 20 1 1 A 119 119 ASN HA H 119 5.061 4.915 0.146 1
1 722 . 20 1 1 A 120 120 ASN H H 120 8.061 8.265 -0.204 1
1 723 . 20 1 1 A 120 120 ASN HA H 120 4.212 4.479 -0.267 1
1 728 . 20 1 1 A 121 121 GLN H H 121 8.359 8.043 0.316 1
1 729 . 20 1 1 A 121 121 GLN HA H 121 4.373 4.149 0.224 1
1 735 . 20 1 1 A 122 122 GLY H H 122 8.770 7.963 0.807 1
1 736 . 20 1 1 A 122 122 GLY HA2 H 122 3.182 4.067 -0.885 1
1 737 . 20 1 1 A 122 122 GLY HA3 H 122 5.268 4.079 1.189 1
1 738 . 20 1 1 A 123 123 LYS H H 123 8.587 8.390 0.197 1
1 739 . 20 1 1 A 123 123 LYS HA H 123 4.016 4.588 -0.572 1
1 745 . 20 1 1 A 124 124 GLU H H 124 8.527 7.808 0.719 1
1 746 . 20 1 1 A 124 124 GLU HA H 124 4.152 4.501 -0.349 1
1 750 . 20 1 1 A 125 125 PHE H H 125 7.936 8.744 -0.808 1
1 751 . 20 1 1 A 125 125 PHE HA H 125 4.670 4.497 0.173 1
1 758 . 20 1 1 A 126 126 PHE H H 126 8.214 8.845 -0.631 1
1 759 . 20 1 1 A 126 126 PHE HA H 126 5.177 4.594 0.583 1
1 767 . 20 1 1 A 127 127 GLU H H 127 9.169 8.879 0.290 1
1 768 . 20 1 1 A 127 127 GLU HA H 127 4.852 4.426 0.426 1
1 773 . 20 1 1 A 128 128 LYS H H 128 9.000 8.201 0.799 1
1 774 . 20 1 1 A 128 128 LYS HA H 128 4.191 3.656 0.535 1
1 777 . 20 1 1 A 129 129 CYS H H 129 8.938 8.888 0.050 1
1 778 . 20 1 1 A 129 129 CYS HA H 129 5.268 4.464 0.804 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 0 0.000 1
2 1 1 1 "RMS(OBS, PRED)" CA 0 0.000 1
3 1 1 1 "RMS(OBS, PRED)" CB 0 0.000 1
4 1 1 1 "RMS(OBS, PRED)" H 121 0.810 1
5 1 1 1 "RMS(OBS, PRED)" HA 138 0.511 1
6 1 1 1 "RMS(OBS, PRED)" N 0 0.000 1
7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
8 1 2 1 "RMS(OBS, PRED)" CA 0 0.000 1
9 1 2 1 "RMS(OBS, PRED)" CB 0 0.000 1
10 1 2 1 "RMS(OBS, PRED)" H 121 0.784 1
11 1 2 1 "RMS(OBS, PRED)" HA 138 0.494 1
12 1 2 1 "RMS(OBS, PRED)" N 0 0.000 1
13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 3 1 "RMS(OBS, PRED)" CA 0 0.000 1
15 1 3 1 "RMS(OBS, PRED)" CB 0 0.000 1
16 1 3 1 "RMS(OBS, PRED)" H 121 0.776 1
17 1 3 1 "RMS(OBS, PRED)" HA 138 0.473 1
18 1 3 1 "RMS(OBS, PRED)" N 0 0.000 1
19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 0 0.000 1
21 1 4 1 "RMS(OBS, PRED)" CB 0 0.000 1
22 1 4 1 "RMS(OBS, PRED)" H 121 0.858 1
23 1 4 1 "RMS(OBS, PRED)" HA 138 0.487 1
24 1 4 1 "RMS(OBS, PRED)" N 0 0.000 1
25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 0 0.000 1
27 1 5 1 "RMS(OBS, PRED)" CB 0 0.000 1
28 1 5 1 "RMS(OBS, PRED)" H 121 0.827 1
29 1 5 1 "RMS(OBS, PRED)" HA 138 0.463 1
30 1 5 1 "RMS(OBS, PRED)" N 0 0.000 1
31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
32 1 6 1 "RMS(OBS, PRED)" CA 0 0.000 1
33 1 6 1 "RMS(OBS, PRED)" CB 0 0.000 1
34 1 6 1 "RMS(OBS, PRED)" H 121 0.790 1
35 1 6 1 "RMS(OBS, PRED)" HA 138 0.498 1
36 1 6 1 "RMS(OBS, PRED)" N 0 0.000 1
37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 7 1 "RMS(OBS, PRED)" CA 0 0.000 1
39 1 7 1 "RMS(OBS, PRED)" CB 0 0.000 1
40 1 7 1 "RMS(OBS, PRED)" H 121 0.818 1
41 1 7 1 "RMS(OBS, PRED)" HA 138 0.493 1
42 1 7 1 "RMS(OBS, PRED)" N 0 0.000 1
43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
44 1 8 1 "RMS(OBS, PRED)" CA 0 0.000 1
45 1 8 1 "RMS(OBS, PRED)" CB 0 0.000 1
46 1 8 1 "RMS(OBS, PRED)" H 121 0.826 1
47 1 8 1 "RMS(OBS, PRED)" HA 138 0.503 1
48 1 8 1 "RMS(OBS, PRED)" N 0 0.000 1
49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 9 1 "RMS(OBS, PRED)" CA 0 0.000 1
51 1 9 1 "RMS(OBS, PRED)" CB 0 0.000 1
52 1 9 1 "RMS(OBS, PRED)" H 121 0.823 1
53 1 9 1 "RMS(OBS, PRED)" HA 138 0.490 1
54 1 9 1 "RMS(OBS, PRED)" N 0 0.000 1
55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
56 1 10 1 "RMS(OBS, PRED)" CA 0 0.000 1
57 1 10 1 "RMS(OBS, PRED)" CB 0 0.000 1
58 1 10 1 "RMS(OBS, PRED)" H 121 0.817 1
59 1 10 1 "RMS(OBS, PRED)" HA 138 0.480 1
60 1 10 1 "RMS(OBS, PRED)" N 0 0.000 1
61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 11 1 "RMS(OBS, PRED)" CA 0 0.000 1
63 1 11 1 "RMS(OBS, PRED)" CB 0 0.000 1
64 1 11 1 "RMS(OBS, PRED)" H 121 0.782 1
65 1 11 1 "RMS(OBS, PRED)" HA 138 0.482 1
66 1 11 1 "RMS(OBS, PRED)" N 0 0.000 1
67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
68 1 12 1 "RMS(OBS, PRED)" CA 0 0.000 1
69 1 12 1 "RMS(OBS, PRED)" CB 0 0.000 1
70 1 12 1 "RMS(OBS, PRED)" H 121 0.805 1
71 1 12 1 "RMS(OBS, PRED)" HA 138 0.506 1
72 1 12 1 "RMS(OBS, PRED)" N 0 0.000 1
73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 13 1 "RMS(OBS, PRED)" CA 0 0.000 1
75 1 13 1 "RMS(OBS, PRED)" CB 0 0.000 1
76 1 13 1 "RMS(OBS, PRED)" H 121 0.802 1
77 1 13 1 "RMS(OBS, PRED)" HA 138 0.503 1
78 1 13 1 "RMS(OBS, PRED)" N 0 0.000 1
79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
80 1 14 1 "RMS(OBS, PRED)" CA 0 0.000 1
81 1 14 1 "RMS(OBS, PRED)" CB 0 0.000 1
82 1 14 1 "RMS(OBS, PRED)" H 121 0.838 1
83 1 14 1 "RMS(OBS, PRED)" HA 138 0.504 1
84 1 14 1 "RMS(OBS, PRED)" N 0 0.000 1
85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 15 1 "RMS(OBS, PRED)" CA 0 0.000 1
87 1 15 1 "RMS(OBS, PRED)" CB 0 0.000 1
88 1 15 1 "RMS(OBS, PRED)" H 121 0.838 1
89 1 15 1 "RMS(OBS, PRED)" HA 138 0.515 1
90 1 15 1 "RMS(OBS, PRED)" N 0 0.000 1
91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
92 1 16 1 "RMS(OBS, PRED)" CA 0 0.000 1
93 1 16 1 "RMS(OBS, PRED)" CB 0 0.000 1
94 1 16 1 "RMS(OBS, PRED)" H 121 0.809 1
95 1 16 1 "RMS(OBS, PRED)" HA 138 0.460 1
96 1 16 1 "RMS(OBS, PRED)" N 0 0.000 1
97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 17 1 "RMS(OBS, PRED)" CA 0 0.000 1
99 1 17 1 "RMS(OBS, PRED)" CB 0 0.000 1
100 1 17 1 "RMS(OBS, PRED)" H 121 0.756 1
101 1 17 1 "RMS(OBS, PRED)" HA 138 0.499 1
102 1 17 1 "RMS(OBS, PRED)" N 0 0.000 1
103 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
104 1 18 1 "RMS(OBS, PRED)" CA 0 0.000 1
105 1 18 1 "RMS(OBS, PRED)" CB 0 0.000 1
106 1 18 1 "RMS(OBS, PRED)" H 121 0.801 1
107 1 18 1 "RMS(OBS, PRED)" HA 138 0.498 1
108 1 18 1 "RMS(OBS, PRED)" N 0 0.000 1
109 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 0 0.000 1
111 1 19 1 "RMS(OBS, PRED)" CB 0 0.000 1
112 1 19 1 "RMS(OBS, PRED)" H 121 0.804 1
113 1 19 1 "RMS(OBS, PRED)" HA 138 0.462 1
114 1 19 1 "RMS(OBS, PRED)" N 0 0.000 1
115 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
116 1 20 1 "RMS(OBS, PRED)" CA 0 0.000 1
117 1 20 1 "RMS(OBS, PRED)" CB 0 0.000 1
118 1 20 1 "RMS(OBS, PRED)" H 121 0.815 1
119 1 20 1 "RMS(OBS, PRED)" HA 138 0.506 1
120 1 20 1 "RMS(OBS, PRED)" N 0 0.000 1
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.Conformer_type "average"
_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.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_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.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 5 . 1 1 A 2 2 PRO HA H 2 4.900 4.509 0.391 2
1 10 . 1 1 A 3 3 ILE H H 3 8.774 7.480 1.294 2
1 11 . 1 1 A 3 3 ILE HA H 3 5.499 4.561 0.938 2
1 20 . 1 1 A 4 4 VAL H H 4 9.501 9.181 0.320 2
1 21 . 1 1 A 4 4 VAL HA H 4 4.944 5.098 -0.154 2
1 29 . 1 1 A 5 5 THR H H 5 9.243 9.041 0.202 2
1 30 . 1 1 A 5 5 THR HA H 5 5.278 5.302 -0.024 2
1 35 . 1 1 A 6 6 CYS H H 6 9.815 8.908 0.907 2
1 36 . 1 1 A 6 6 CYS HA H 6 5.310 4.668 0.642 2
1 38 . 1 1 A 7 7 ARG H H 7 9.154 8.434 0.720 2
1 41 . 1 1 A 8 8 PRO HA H 8 4.594 4.650 -0.056 2
1 47 . 1 1 A 9 9 LYS H H 9 8.179 8.451 -0.272 2
1 48 . 1 1 A 9 9 LYS HA H 9 4.857 4.811 0.046 2
1 52 . 1 1 A 10 10 LEU H H 10 9.108 8.392 0.717 2
1 53 . 1 1 A 10 10 LEU HA H 10 5.147 4.556 0.592 2
1 63 . 1 1 A 11 11 ASP H H 11 9.835 8.075 1.760 2
1 64 . 1 1 A 11 11 ASP HA H 11 4.471 4.745 -0.274 2
1 67 . 1 1 A 12 12 GLY H H 12 8.847 8.032 0.815 2
1 68 . 1 1 A 12 12 GLY HA2 H 12 3.782 3.928 -0.146 2
1 69 . 1 1 A 12 12 GLY HA3 H 12 4.427 3.934 0.493 2
1 70 . 1 1 A 13 13 ARG H H 13 7.933 7.743 0.190 2
1 71 . 1 1 A 13 13 ARG HA H 13 4.886 4.603 0.283 2
1 77 . 1 1 A 14 14 GLU H H 14 9.179 8.562 0.617 2
1 78 . 1 1 A 14 14 GLU HA H 14 4.178 4.693 -0.515 2
1 82 . 1 1 A 15 15 LYS H H 15 9.078 8.926 0.152 2
1 83 . 1 1 A 15 15 LYS HA H 15 4.890 4.758 0.132 2
1 84 . 1 1 A 16 16 PRO HA H 16 5.144 4.905 0.239 2
1 91 . 1 1 A 17 17 PHE H H 17 9.487 8.636 0.852 2
1 92 . 1 1 A 17 17 PHE HA H 17 4.760 4.644 0.116 2
1 100 . 1 1 A 18 18 LYS H H 18 9.315 8.707 0.608 2
1 101 . 1 1 A 18 18 LYS HA H 18 5.197 4.288 0.909 2
1 108 . 1 1 A 19 19 VAL H H 19 9.643 8.650 0.993 2
1 109 . 1 1 A 19 19 VAL HA H 19 4.796 4.879 -0.083 2
1 117 . 1 1 A 20 20 ASP H H 20 9.555 8.778 0.777 2
1 118 . 1 1 A 20 20 ASP HA H 20 5.151 5.157 -0.006 2
1 121 . 1 1 A 21 21 VAL H H 21 9.607 8.741 0.866 2
1 122 . 1 1 A 21 21 VAL HA H 21 3.611 3.788 -0.177 2
1 130 . 1 1 A 22 22 ALA H H 22 8.531 8.123 0.408 2
1 131 . 1 1 A 22 22 ALA HA H 22 4.299 3.893 0.406 2
1 135 . 1 1 A 23 23 THR H H 23 7.294 8.237 -0.943 2
1 136 . 1 1 A 23 23 THR HA H 23 4.264 3.846 0.418 2
1 141 . 1 1 A 24 24 ALA H H 24 8.346 8.206 0.140 2
1 142 . 1 1 A 24 24 ALA HA H 24 4.082 4.078 0.004 2
1 146 . 1 1 A 25 25 GLN H H 25 8.866 8.335 0.531 2
1 147 . 1 1 A 25 25 GLN HA H 25 3.804 3.838 -0.034 2
1 153 . 1 1 A 26 26 ALA H H 26 7.767 8.138 -0.371 2
1 154 . 1 1 A 26 26 ALA HA H 26 4.208 3.998 0.210 2
1 158 . 1 1 A 27 27 GLN H H 27 8.881 8.303 0.578 2
1 159 . 1 1 A 27 27 GLN HA H 27 4.041 3.924 0.117 2
1 165 . 1 1 A 28 28 ALA H H 28 8.142 8.017 0.125 2
1 166 . 1 1 A 28 28 ALA HA H 28 3.475 3.513 -0.038 2
1 170 . 1 1 A 29 29 ARG H H 29 7.291 7.702 -0.411 2
1 171 . 1 1 A 29 29 ARG HA H 29 3.688 3.825 -0.137 2
1 174 . 1 1 A 30 30 LYS H H 30 7.768 7.968 -0.200 2
1 175 . 1 1 A 30 30 LYS HA H 30 4.038 3.925 0.113 2
1 179 . 1 1 A 31 31 ALA H H 31 8.127 7.456 0.671 2
1 180 . 1 1 A 31 31 ALA HA H 31 3.656 3.933 -0.277 2
1 184 . 1 1 A 32 32 GLY H H 32 7.670 7.663 0.007 2
1 185 . 1 1 A 32 32 GLY HA2 H 32 3.380 3.768 -0.388 2
1 186 . 1 1 A 32 32 GLY HA3 H 32 3.844 3.803 0.042 2
1 187 . 1 1 A 33 33 LEU H H 33 8.057 8.169 -0.112 2
1 188 . 1 1 A 33 33 LEU HA H 33 3.259 3.109 0.150 2
1 197 . 1 1 A 34 34 THR H H 34 6.862 7.089 -0.227 2
1 198 . 1 1 A 34 34 THR HA H 34 4.738 4.952 -0.214 2
1 203 . 1 1 A 35 35 THR H H 35 9.161 9.002 0.158 2
1 204 . 1 1 A 35 35 THR HA H 35 4.247 5.167 -0.920 2
1 209 . 1 1 A 36 36 GLY H H 36 8.407 8.485 -0.078 2
1 210 . 1 1 A 36 36 GLY HA2 H 36 4.349 4.056 0.293 2
1 211 . 1 1 A 36 36 GLY HA3 H 36 4.967 4.061 0.906 2
1 212 . 1 1 A 37 37 LYS H H 37 10.152 8.166 1.986 2
1 213 . 1 1 A 37 37 LYS HA H 37 4.383 4.229 0.154 2
1 221 . 1 1 A 38 38 SER H H 38 9.085 8.156 0.929 2
1 222 . 1 1 A 38 38 SER HA H 38 4.338 4.746 -0.408 2
1 226 . 1 1 A 39 39 GLY H H 39 8.474 7.715 0.759 2
1 227 . 1 1 A 39 39 GLY HA2 H 39 3.840 4.143 -0.303 2
1 228 . 1 1 A 40 40 ASP H H 40 9.424 7.854 1.570 2
1 229 . 1 1 A 40 40 ASP HA H 40 5.374 4.539 0.835 2
1 231 . 1 1 A 41 41 PRO HA H 41 5.624 4.600 1.024 2
1 238 . 1 1 A 42 42 HIS H H 42 8.343 8.633 -0.290 2
1 239 . 1 1 A 42 42 HIS HA H 42 5.189 5.222 -0.033 2
1 244 . 1 1 A 43 43 ARG H H 43 8.634 8.280 0.353 2
1 245 . 1 1 A 43 43 ARG HA H 43 3.654 3.236 0.418 2
1 252 . 1 1 A 44 44 TYR H H 44 8.188 8.583 -0.395 2
1 253 . 1 1 A 44 44 TYR HA H 44 5.021 4.794 0.227 2
1 260 . 1 1 A 45 45 PHE H H 45 8.728 8.263 0.465 2
1 261 . 1 1 A 45 45 PHE HA H 45 4.480 5.032 -0.552 2
1 268 . 1 1 A 46 46 ALA H H 46 5.979 8.251 -2.272 2
1 269 . 1 1 A 46 46 ALA HA H 46 3.797 4.235 -0.438 2
1 273 . 1 1 A 47 47 GLY H H 47 8.510 8.021 0.489 2
1 274 . 1 1 A 47 47 GLY HA2 H 47 3.953 3.871 0.082 2
1 275 . 1 1 A 47 47 GLY HA3 H 47 4.075 3.914 0.161 2
1 276 . 1 1 A 48 48 ASP H H 48 7.504 7.640 -0.136 2
1 277 . 1 1 A 48 48 ASP HA H 48 5.020 4.693 0.327 2
1 280 . 1 1 A 49 49 HIS H H 49 8.240 8.414 -0.174 2
1 281 . 1 1 A 49 49 HIS HA H 49 4.373 4.380 -0.007 2
1 285 . 1 1 A 50 50 ILE H H 50 8.468 7.994 0.474 2
1 286 . 1 1 A 50 50 ILE HA H 50 3.651 4.363 -0.712 2
1 296 . 1 1 A 51 51 ARG H H 51 8.404 8.426 -0.022 2
1 297 . 1 1 A 51 51 ARG HA H 51 4.450 4.699 -0.249 2
1 303 . 1 1 A 52 52 TRP H H 52 11.176 8.229 2.947 2
1 304 . 1 1 A 52 52 TRP HA H 52 4.423 4.448 -0.025 2
1 312 . 1 1 A 53 53 GLY H H 53 10.422 8.404 2.018 2
1 313 . 1 1 A 53 53 GLY HA2 H 53 3.832 3.953 -0.121 2
1 314 . 1 1 A 53 53 GLY HA3 H 53 4.411 3.980 0.431 2
1 315 . 1 1 A 54 54 VAL H H 54 7.040 7.713 -0.673 2
1 316 . 1 1 A 54 54 VAL HA H 54 4.489 4.392 0.097 2
1 324 . 1 1 A 55 55 ASN H H 55 9.530 9.052 0.478 2
1 325 . 1 1 A 55 55 ASN HA H 55 4.569 4.423 0.146 2
1 330 . 1 1 A 56 56 ASN H H 56 9.175 8.262 0.913 2
1 331 . 1 1 A 56 56 ASN HA H 56 4.649 4.402 0.247 2
1 336 . 1 1 A 57 57 CYS H H 57 7.613 8.223 -0.610 2
1 337 . 1 1 A 57 57 CYS HA H 57 4.645 4.351 0.294 2
1 340 . 1 1 A 58 58 ASP H H 58 7.626 8.296 -0.670 2
1 341 . 1 1 A 58 58 ASP HA H 58 5.206 4.643 0.563 2
1 344 . 1 1 A 59 59 LYS H H 59 7.349 7.422 -0.073 2
1 345 . 1 1 A 59 59 LYS HA H 59 4.548 4.416 0.132 2
1 350 . 1 1 A 60 60 ALA H H 60 9.155 8.630 0.525 2
1 351 . 1 1 A 60 60 ALA HA H 60 4.330 4.251 0.079 2
1 355 . 1 1 A 61 61 ASP H H 61 8.548 8.021 0.527 2
1 356 . 1 1 A 61 61 ASP HA H 61 4.827 4.719 0.108 2
1 359 . 1 1 A 62 62 ALA H H 62 7.463 7.404 0.059 2
1 360 . 1 1 A 62 62 ALA HA H 62 4.217 4.333 -0.116 2
1 364 . 1 1 A 63 63 ILE H H 63 9.302 8.596 0.706 2
1 365 . 1 1 A 63 63 ILE HA H 63 4.332 4.493 -0.161 2
1 374 . 1 1 A 64 64 LEU H H 64 8.724 8.933 -0.209 2
1 375 . 1 1 A 64 64 LEU HA H 64 5.463 5.155 0.308 2
1 385 . 1 1 A 65 65 TRP H H 65 9.621 8.439 1.182 2
1 386 . 1 1 A 65 65 TRP HA H 65 4.605 5.331 -0.726 2
1 395 . 1 1 A 66 66 GLU H H 66 8.388 9.250 -0.862 2
1 396 . 1 1 A 66 66 GLU HA H 66 6.014 5.691 0.323 2
1 401 . 1 1 A 67 67 TYR H H 67 8.766 9.119 -0.353 2
1 402 . 1 1 A 67 67 TYR HA H 67 5.204 5.125 0.079 2
1 405 . 1 1 A 68 68 PRO HA H 68 4.523 4.440 0.083 2
1 412 . 1 1 A 69 69 ILE H H 69 7.308 8.136 -0.828 2
1 413 . 1 1 A 69 69 ILE HA H 69 4.870 5.035 -0.165 2
1 414 . 1 1 A 70 70 TYR H H 70 9.219 9.049 0.170 2
1 415 . 1 1 A 70 70 TYR HA H 70 4.854 4.663 0.191 2
1 423 . 1 1 A 71 71 TRP H H 71 6.662 8.226 -1.564 2
1 424 . 1 1 A 71 71 TRP HA H 71 5.496 4.842 0.654 2
1 432 . 1 1 A 72 72 VAL H H 72 9.510 8.951 0.559 2
1 433 . 1 1 A 72 72 VAL HA H 72 3.999 3.754 0.245 2
1 441 . 1 1 A 73 73 GLY H H 73 9.221 8.593 0.628 2
1 442 . 1 1 A 73 73 GLY HA2 H 73 3.877 3.946 -0.069 2
1 443 . 1 1 A 73 73 GLY HA3 H 73 4.682 3.976 0.706 2
1 444 . 1 1 A 74 74 LYS H H 74 7.962 7.629 0.333 2
1 445 . 1 1 A 74 74 LYS HA H 74 4.469 4.392 0.077 2
1 457 . 1 1 A 75 75 ASN H H 75 8.928 8.815 0.113 2
1 458 . 1 1 A 75 75 ASN HA H 75 4.837 4.954 -0.117 2
1 463 . 1 1 A 76 76 ALA H H 76 7.544 7.639 -0.095 2
1 464 . 1 1 A 76 76 ALA HA H 76 4.555 4.403 0.152 2
1 468 . 1 1 A 77 77 GLU H H 77 8.290 8.296 -0.006 2
1 469 . 1 1 A 77 77 GLU HA H 77 4.900 3.997 0.903 2
1 474 . 1 1 A 78 78 TRP H H 78 10.065 8.778 1.287 2
1 475 . 1 1 A 78 78 TRP HA H 78 4.600 5.014 -0.414 2
1 484 . 1 1 A 79 79 ALA H H 79 9.850 8.308 1.542 2
1 485 . 1 1 A 79 79 ALA HA H 79 5.022 4.686 0.336 2
1 489 . 1 1 A 80 80 LYS H H 80 9.255 8.792 0.463 2
1 490 . 1 1 A 80 80 LYS HA H 80 4.511 4.465 0.046 2
1 494 . 1 1 A 81 81 ASP H H 81 9.332 8.006 1.326 2
1 495 . 1 1 A 81 81 ASP HA H 81 5.429 4.775 0.654 2
1 498 . 1 1 A 82 82 VAL H H 82 7.226 7.444 -0.219 2
1 499 . 1 1 A 82 82 VAL HA H 82 4.248 4.667 -0.419 2
1 507 . 1 1 A 83 83 LYS H H 83 8.407 8.690 -0.283 2
1 508 . 1 1 A 83 83 LYS HA H 83 4.356 4.592 -0.236 2
1 510 . 1 1 A 84 84 THR H H 84 9.088 9.088 -0.000 2
1 511 . 1 1 A 84 84 THR HA H 84 3.989 4.113 -0.124 2
1 516 . 1 1 A 85 85 SER H H 85 8.391 8.225 0.166 2
1 517 . 1 1 A 85 85 SER HA H 85 4.442 4.077 0.365 2
1 520 . 1 1 A 86 86 GLN H H 86 7.974 8.038 -0.064 2
1 521 . 1 1 A 86 86 GLN HA H 86 4.585 4.014 0.571 2
1 527 . 1 1 A 87 87 GLN H H 87 7.083 7.693 -0.610 2
1 528 . 1 1 A 87 87 GLN HA H 87 3.903 3.881 0.022 2
1 534 . 1 1 A 88 88 LYS H H 88 9.453 8.425 1.028 2
1 535 . 1 1 A 88 88 LYS HA H 88 4.114 4.313 -0.199 2
1 539 . 1 1 A 89 89 GLY H H 89 9.466 8.162 1.304 2
1 540 . 1 1 A 89 89 GLY HA2 H 89 3.965 4.009 -0.044 2
1 541 . 1 1 A 89 89 GLY HA3 H 89 3.148 4.035 -0.887 2
1 542 . 1 1 A 90 90 GLY H H 90 7.228 7.481 -0.253 2
1 543 . 1 1 A 90 90 GLY HA2 H 90 4.290 4.068 0.222 2
1 544 . 1 1 A 90 90 GLY HA3 H 90 4.682 4.087 0.595 2
1 545 . 1 1 A 91 91 PRO HA H 91 4.902 4.790 0.112 2
1 552 . 1 1 A 92 92 THR H H 92 8.585 8.256 0.329 2
1 553 . 1 1 A 92 92 THR HA H 92 5.701 4.777 0.924 2
1 559 . 1 1 A 93 93 PRO HA H 93 5.551 4.137 1.414 2
1 563 . 1 1 A 94 94 ILE H H 94 8.155 7.415 0.740 2
1 564 . 1 1 A 94 94 ILE HA H 94 4.794 4.344 0.450 2
1 571 . 1 1 A 95 95 ARG H H 95 9.538 9.110 0.428 2
1 572 . 1 1 A 95 95 ARG HA H 95 5.278 5.305 -0.027 2
1 576 . 1 1 A 96 96 VAL H H 96 9.276 8.985 0.291 2
1 577 . 1 1 A 96 96 VAL HA H 96 5.222 4.312 0.910 2
1 585 . 1 1 A 97 97 VAL H H 97 8.739 8.950 -0.211 2
1 586 . 1 1 A 97 97 VAL HA H 97 5.160 5.263 -0.103 2
1 594 . 1 1 A 98 98 TYR H H 98 8.596 8.468 0.128 2
1 595 . 1 1 A 98 98 TYR HA H 98 5.266 5.158 0.108 2
1 603 . 1 1 A 99 99 ALA H H 99 9.685 8.637 1.048 2
1 604 . 1 1 A 99 99 ALA HA H 99 5.680 4.743 0.937 2
1 608 . 1 1 A 100 100 ASN H H 100 8.468 8.890 -0.422 2
1 609 . 1 1 A 100 100 ASN HA H 100 4.885 4.925 -0.040 2
1 614 . 1 1 A 101 101 SER H H 101 9.342 8.101 1.241 2
1 615 . 1 1 A 101 101 SER HA H 101 4.993 4.431 0.562 2
1 618 . 1 1 A 102 102 ARG H H 102 9.349 8.675 0.674 2
1 619 . 1 1 A 102 102 ARG HA H 102 4.068 4.174 -0.106 2
1 620 . 1 1 A 103 103 GLY H H 103 8.632 8.424 0.208 2
1 621 . 1 1 A 103 103 GLY HA2 H 103 3.691 3.906 -0.215 2
1 622 . 1 1 A 103 103 GLY HA3 H 103 4.341 3.918 0.423 2
1 623 . 1 1 A 104 104 ALA H H 104 7.820 7.740 0.080 2
1 624 . 1 1 A 104 104 ALA HA H 104 4.775 4.567 0.208 2
1 628 . 1 1 A 105 105 VAL H H 105 8.402 8.623 -0.221 2
1 629 . 1 1 A 105 105 VAL HA H 105 4.218 4.441 -0.223 2
1 637 . 1 1 A 106 106 GLN H H 106 9.352 8.451 0.901 2
1 638 . 1 1 A 106 106 GLN HA H 106 4.900 4.595 0.306 2
1 645 . 1 1 A 107 107 TYR H H 107 9.075 8.067 1.008 2
1 646 . 1 1 A 107 107 TYR HA H 107 4.007 4.116 -0.109 2
1 653 . 1 1 A 108 108 CYS H H 108 8.197 7.764 0.433 2
1 654 . 1 1 A 108 108 CYS HA H 108 4.823 4.082 0.741 2
1 657 . 1 1 A 109 109 GLY H H 109 6.856 6.745 0.111 2
1 658 . 1 1 A 109 109 GLY HA2 H 109 3.983 3.290 0.693 2
1 659 . 1 1 A 109 109 GLY HA3 H 109 4.422 3.336 1.086 2
1 660 . 1 1 A 110 110 VAL H H 110 9.418 8.480 0.938 2
1 661 . 1 1 A 110 110 VAL HA H 110 5.073 4.863 0.210 2
1 669 . 1 1 A 111 111 MET H H 111 9.327 9.548 -0.221 2
1 670 . 1 1 A 111 111 MET HA H 111 5.678 5.544 0.134 2
1 678 . 1 1 A 112 112 THR H H 112 9.310 9.258 0.052 2
1 679 . 1 1 A 112 112 THR HA H 112 5.726 4.696 1.030 2
1 685 . 1 1 A 113 113 HIS H H 113 8.960 8.350 0.610 2
1 686 . 1 1 A 113 113 HIS HA H 113 3.876 4.491 -0.615 2
1 691 . 1 1 A 114 114 SER H H 114 8.367 8.477 -0.110 2
1 692 . 1 1 A 114 114 SER HA H 114 4.024 4.259 -0.235 2
1 695 . 1 1 A 115 115 LYS H H 115 8.140 7.521 0.619 2
1 696 . 1 1 A 115 115 LYS HA H 115 5.403 4.424 0.979 2
1 699 . 1 1 A 116 116 VAL H H 116 8.525 8.226 0.299 2
1 700 . 1 1 A 116 116 VAL HA H 116 5.378 4.694 0.684 2
1 708 . 1 1 A 117 117 ASP H H 117 8.025 8.742 -0.717 2
1 709 . 1 1 A 117 117 ASP HA H 117 5.243 4.649 0.594 2
1 712 . 1 1 A 118 118 LYS H H 118 8.930 8.080 0.850 2
1 713 . 1 1 A 118 118 LYS HA H 118 4.216 4.458 -0.242 2
1 716 . 1 1 A 119 119 ASN H H 119 8.425 7.945 0.480 2
1 717 . 1 1 A 119 119 ASN HA H 119 5.061 4.887 0.174 2
1 722 . 1 1 A 120 120 ASN H H 120 8.061 8.305 -0.244 2
1 723 . 1 1 A 120 120 ASN HA H 120 4.212 4.529 -0.317 2
1 728 . 1 1 A 121 121 GLN H H 121 8.359 8.199 0.160 2
1 729 . 1 1 A 121 121 GLN HA H 121 4.373 4.381 -0.008 2
1 735 . 1 1 A 122 122 GLY H H 122 8.770 8.050 0.720 2
1 736 . 1 1 A 122 122 GLY HA2 H 122 3.182 3.943 -0.761 2
1 737 . 1 1 A 122 122 GLY HA3 H 122 5.268 4.033 1.235 2
1 738 . 1 1 A 123 123 LYS H H 123 8.587 8.434 0.153 2
1 739 . 1 1 A 123 123 LYS HA H 123 4.016 4.425 -0.409 2
1 745 . 1 1 A 124 124 GLU H H 124 8.527 7.847 0.680 2
1 746 . 1 1 A 124 124 GLU HA H 124 4.152 4.387 -0.235 2
1 750 . 1 1 A 125 125 PHE H H 125 7.936 8.316 -0.380 2
1 751 . 1 1 A 125 125 PHE HA H 125 4.670 4.719 -0.049 2
1 758 . 1 1 A 126 126 PHE H H 126 8.214 9.045 -0.831 2
1 759 . 1 1 A 126 126 PHE HA H 126 5.177 5.021 0.156 2
1 767 . 1 1 A 127 127 GLU H H 127 9.169 8.825 0.344 2
1 768 . 1 1 A 127 127 GLU HA H 127 4.852 4.556 0.296 2
1 773 . 1 1 A 128 128 LYS H H 128 9.000 8.283 0.717 2
1 774 . 1 1 A 128 128 LYS HA H 128 4.191 3.947 0.244 2
1 777 . 1 1 A 129 129 CYS H H 129 8.938 8.913 0.025 2
1 778 . 1 1 A 129 129 CYS HA H 129 5.268 4.815 0.453 2
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