FMODB: The database of quantum mechanical data based on the FMO method
Last updated: 2025-10-17
All entries: 77277
Number of unique PDB entries: 32023
FMODB ID: Q59LY
Calculation Name: 2EBF-X-Xray549
Preferred Name:
Target Type:
Ligand Name: trehalose | phosphonate
Ligand 3-letter code: TRE | 2PO
Ligand of Interest (LOI):
Structure Source: PDB
PDB ID: 2EBF
Chain ID: X
UniProt ID: P17452
Base Structure: X-ray
Registration Date: 2025-10-11
Reference: Sci Data 11, 1164 (2024).
DOI: https://doi.org/10.1038/s41597-024-03999-2
Apendix: None
Modeling method
| Optimization | MOE:Amber10:EHT |
|---|---|
| Restraint | OptH |
| Protonation | MOE:Protonate 3D |
| Complement | ac.sh, 23 2024 Oct |
| Water | No |
| Procedure | Manual calculation |
| Remarks |
FMO calculation
| FMO method | FMO2-MP2/6-31G(d) |
|---|---|
| Fragmentation | Auto |
| Number of fragment | 710 |
| LigandResidueName | |
| LigandFragmentNumber | 0 |
| LigandCharge | |
| Software | ABINIT-MP - Open Ver. 1 Rev. 23 (BINDS Ver. 1) / 20230922 |
Total energy (hartree)
| FMO2-HF: Electronic energy | -16226079.378791 |
|---|---|
| FMO2-HF: Nuclear repulsion | 15944042.348463 |
| FMO2-HF: Total energy | -282037.030327 |
| FMO2-MP2: Total energy | -282857.202581 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
| IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
|---|---|---|---|---|---|
| IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
| N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(X:575:LEU)
Summations of interaction energy for
fragment #1(X:575:LEU)
| IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
|---|---|---|---|---|---|
| IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
| -56.547 | -48.792 | 10.35 | -5.517 | -12.588 | -0.037 |
Interaction energy analysis for fragmet #1(X:575:LEU)
| frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 3 | X | 577 | GLY | 0 | 0.098 | 0.058 | 3.835 | 6.301 | 7.738 | -0.014 | -0.541 | -0.882 | -0.001 |
| 4 | X | 578 | SER | 0 | -0.056 | -0.024 | 1.860 | -3.896 | -3.429 | 4.282 | -1.818 | -2.931 | -0.002 |
| 5 | X | 579 | PRO | 0 | 0.053 | 0.018 | 2.478 | 3.938 | 4.022 | 0.461 | 0.340 | -0.885 | -0.002 |
| 6 | X | 580 | TYR | 0 | 0.013 | -0.009 | 3.745 | 2.272 | 2.597 | 0.004 | -0.053 | -0.276 | 0.000 |
| 537 | X | 1111 | LYS | 1 | 0.925 | 0.944 | 2.258 | 51.370 | 53.150 | 2.360 | -1.218 | -2.923 | -0.011 |
| 538 | X | 1112 | GLN | 0 | 0.007 | 0.017 | 2.110 | 2.478 | 3.522 | 1.338 | -0.675 | -1.707 | -0.007 |
| 539 | X | 1113 | PHE | 0 | -0.040 | -0.027 | 2.635 | -17.261 | -15.337 | 0.781 | -1.182 | -1.523 | -0.015 |
| 540 | X | 1114 | LYS | 1 | 0.900 | 0.941 | 2.283 | 49.134 | 49.828 | 1.138 | -0.370 | -1.461 | 0.001 |
| 7 | X | 581 | SER | 0 | 0.008 | 0.026 | 6.116 | 2.894 | 2.894 | 0.000 | 0.000 | 0.000 | 0.000 |
| 8 | X | 582 | PRO | 0 | 0.008 | 0.013 | 7.858 | 0.599 | 0.599 | 0.000 | 0.000 | 0.000 | 0.000 |
| 9 | X | 583 | PHE | 0 | 0.051 | 0.003 | 10.651 | 0.793 | 0.793 | 0.000 | 0.000 | 0.000 | 0.000 |
| 10 | X | 584 | ARG | 1 | 0.783 | 0.869 | 8.187 | 21.899 | 21.899 | 0.000 | 0.000 | 0.000 | 0.000 |
| 11 | X | 585 | ILE | 0 | 0.002 | 0.006 | 9.616 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
| 12 | X | 586 | GLY | 0 | 0.015 | 0.021 | 12.993 | -0.298 | -0.298 | 0.000 | 0.000 | 0.000 | 0.000 |
| 13 | X | 587 | LEU | 0 | 0.012 | -0.013 | 13.684 | 0.863 | 0.863 | 0.000 | 0.000 | 0.000 | 0.000 |
| 14 | X | 588 | GLU | -1 | -0.842 | -0.905 | 13.368 | -18.432 | -18.432 | 0.000 | 0.000 | 0.000 | 0.000 |
| 15 | X | 589 | GLY | 0 | 0.013 | 0.006 | 17.479 | 0.639 | 0.639 | 0.000 | 0.000 | 0.000 | 0.000 |
| 16 | X | 590 | VAL | 0 | -0.017 | -0.008 | 19.481 | 0.504 | 0.504 | 0.000 | 0.000 | 0.000 | 0.000 |
| 17 | X | 591 | TRP | 0 | 0.002 | 0.005 | 21.702 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
| 18 | X | 592 | THR | 0 | 0.064 | 0.040 | 22.140 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 19 | X | 593 | PRO | 0 | 0.050 | 0.002 | 24.572 | 0.464 | 0.464 | 0.000 | 0.000 | 0.000 | 0.000 |
| 20 | X | 594 | GLU | -1 | -0.800 | -0.877 | 27.755 | -9.448 | -9.448 | 0.000 | 0.000 | 0.000 | 0.000 |
| 21 | X | 595 | VAL | 0 | 0.000 | 0.014 | 26.487 | 0.404 | 0.404 | 0.000 | 0.000 | 0.000 | 0.000 |
| 22 | X | 596 | LEU | 0 | 0.029 | 0.005 | 28.676 | 0.371 | 0.371 | 0.000 | 0.000 | 0.000 | 0.000 |
| 23 | X | 597 | LYS | 1 | 0.790 | 0.872 | 30.487 | 9.846 | 9.846 | 0.000 | 0.000 | 0.000 | 0.000 |
| 24 | X | 598 | ALA | 0 | 0.015 | 0.017 | 32.693 | 0.312 | 0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
| 25 | X | 599 | ARG | 1 | 0.920 | 0.961 | 31.019 | 9.521 | 9.521 | 0.000 | 0.000 | 0.000 | 0.000 |
| 26 | X | 600 | ALA | 0 | 0.012 | 0.017 | 34.016 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
| 27 | X | 601 | SER | 0 | -0.043 | -0.008 | 35.858 | 0.223 | 0.223 | 0.000 | 0.000 | 0.000 | 0.000 |
| 28 | X | 602 | VAL | 0 | 0.000 | -0.019 | 38.434 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
| 29 | X | 603 | ILE | 0 | -0.007 | 0.000 | 42.102 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 30 | X | 604 | GLY | 0 | 0.035 | 0.024 | 44.932 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
| 31 | X | 605 | LYS | 1 | 0.856 | 0.944 | 41.863 | 7.412 | 7.412 | 0.000 | 0.000 | 0.000 | 0.000 |
| 32 | X | 606 | PRO | 0 | 0.061 | 0.038 | 42.373 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
| 33 | X | 607 | ILE | 0 | -0.025 | -0.026 | 35.830 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 34 | X | 608 | GLY | 0 | 0.029 | 0.022 | 39.307 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
| 35 | X | 609 | GLU | -1 | -0.809 | -0.908 | 36.960 | -8.739 | -8.739 | 0.000 | 0.000 | 0.000 | 0.000 |
| 36 | X | 610 | SER | 0 | 0.051 | 0.010 | 35.839 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
| 37 | X | 611 | TYR | 0 | 0.026 | 0.019 | 33.137 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
| 38 | X | 612 | LYS | 1 | 0.923 | 0.958 | 33.197 | 8.146 | 8.146 | 0.000 | 0.000 | 0.000 | 0.000 |
| 39 | X | 613 | ARG | 1 | 0.929 | 0.955 | 31.708 | 8.407 | 8.407 | 0.000 | 0.000 | 0.000 | 0.000 |
| 40 | X | 614 | ILE | 0 | 0.023 | 0.026 | 29.868 | -0.388 | -0.388 | 0.000 | 0.000 | 0.000 | 0.000 |
| 41 | X | 615 | LEU | 0 | -0.022 | -0.012 | 28.428 | -0.445 | -0.445 | 0.000 | 0.000 | 0.000 | 0.000 |
| 42 | X | 616 | ALA | 0 | -0.003 | -0.003 | 27.649 | -0.406 | -0.406 | 0.000 | 0.000 | 0.000 | 0.000 |
| 43 | X | 617 | LYS | 1 | 0.839 | 0.907 | 24.825 | 11.216 | 11.216 | 0.000 | 0.000 | 0.000 | 0.000 |
| 44 | X | 618 | LEU | 0 | 0.031 | 0.017 | 23.463 | -0.552 | -0.552 | 0.000 | 0.000 | 0.000 | 0.000 |
| 45 | X | 619 | GLN | 0 | -0.020 | -0.026 | 22.402 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
| 46 | X | 620 | ARG | 1 | 0.936 | 0.960 | 21.421 | 12.910 | 12.910 | 0.000 | 0.000 | 0.000 | 0.000 |
| 47 | X | 621 | ILE | 0 | -0.014 | 0.009 | 18.851 | -0.751 | -0.751 | 0.000 | 0.000 | 0.000 | 0.000 |
| 48 | X | 622 | HIS | 0 | -0.023 | -0.027 | 17.855 | -1.434 | -1.434 | 0.000 | 0.000 | 0.000 | 0.000 |
| 49 | X | 623 | ASN | 0 | -0.026 | 0.002 | 17.640 | -0.627 | -0.627 | 0.000 | 0.000 | 0.000 | 0.000 |
| 50 | X | 624 | SER | 0 | -0.006 | 0.018 | 16.453 | -0.858 | -0.858 | 0.000 | 0.000 | 0.000 | 0.000 |
| 51 | X | 625 | ASN | 0 | 0.027 | 0.004 | 11.759 | -0.956 | -0.956 | 0.000 | 0.000 | 0.000 | 0.000 |
| 52 | X | 626 | ILE | 0 | 0.024 | 0.027 | 11.290 | -2.718 | -2.718 | 0.000 | 0.000 | 0.000 | 0.000 |
| 53 | X | 627 | LEU | 0 | 0.014 | 0.006 | 8.402 | 1.085 | 1.085 | 0.000 | 0.000 | 0.000 | 0.000 |
| 54 | X | 628 | ASP | -1 | -0.717 | -0.830 | 12.418 | -16.684 | -16.684 | 0.000 | 0.000 | 0.000 | 0.000 |
| 55 | X | 629 | GLU | -1 | -0.904 | -0.957 | 15.206 | -16.006 | -16.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 56 | X | 630 | ARG | 1 | 0.771 | 0.885 | 11.582 | 22.659 | 22.659 | 0.000 | 0.000 | 0.000 | 0.000 |
| 57 | X | 631 | GLN | 0 | 0.032 | -0.011 | 15.860 | 1.667 | 1.667 | 0.000 | 0.000 | 0.000 | 0.000 |
| 58 | X | 632 | GLY | 0 | 0.031 | 0.017 | 17.884 | 0.831 | 0.831 | 0.000 | 0.000 | 0.000 | 0.000 |
| 59 | X | 633 | LEU | 0 | -0.010 | -0.017 | 19.508 | 0.824 | 0.824 | 0.000 | 0.000 | 0.000 | 0.000 |
| 60 | X | 634 | MET | 0 | -0.025 | -0.006 | 18.278 | 0.386 | 0.386 | 0.000 | 0.000 | 0.000 | 0.000 |
| 61 | X | 635 | HIS | 0 | 0.073 | 0.044 | 20.769 | 0.967 | 0.967 | 0.000 | 0.000 | 0.000 | 0.000 |
| 62 | X | 636 | GLU | -1 | -0.833 | -0.906 | 24.094 | -12.006 | -12.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 63 | X | 637 | LEU | 0 | -0.069 | -0.038 | 24.785 | 0.555 | 0.555 | 0.000 | 0.000 | 0.000 | 0.000 |
| 64 | X | 638 | MET | 0 | -0.022 | 0.001 | 23.379 | 0.499 | 0.499 | 0.000 | 0.000 | 0.000 | 0.000 |
| 65 | X | 639 | GLU | -1 | -0.740 | -0.830 | 27.919 | -9.501 | -9.501 | 0.000 | 0.000 | 0.000 | 0.000 |
| 66 | X | 640 | LEU | 0 | -0.020 | -0.013 | 29.093 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
| 67 | X | 641 | ILE | 0 | -0.066 | -0.031 | 28.540 | 0.362 | 0.362 | 0.000 | 0.000 | 0.000 | 0.000 |
| 68 | X | 642 | ASP | -1 | -0.783 | -0.874 | 31.884 | -9.504 | -9.504 | 0.000 | 0.000 | 0.000 | 0.000 |
| 69 | X | 643 | LEU | 0 | 0.045 | 0.033 | 33.929 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
| 70 | X | 644 | TYR | 0 | -0.060 | -0.023 | 35.251 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
| 71 | X | 645 | GLU | -1 | -0.829 | -0.882 | 35.886 | -8.374 | -8.374 | 0.000 | 0.000 | 0.000 | 0.000 |
| 72 | X | 646 | GLU | -1 | -0.875 | -0.934 | 38.011 | -7.735 | -7.735 | 0.000 | 0.000 | 0.000 | 0.000 |
| 73 | X | 647 | SER | 0 | -0.047 | -0.037 | 39.386 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
| 74 | X | 648 | GLN | 0 | -0.039 | -0.030 | 40.542 | 0.299 | 0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
| 75 | X | 649 | PRO | 0 | 0.069 | 0.039 | 41.474 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
| 76 | X | 650 | SER | 0 | -0.037 | -0.019 | 42.517 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
| 77 | X | 651 | SER | 0 | -0.053 | -0.030 | 40.674 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 78 | X | 652 | GLU | -1 | -0.768 | -0.889 | 40.710 | -7.362 | -7.362 | 0.000 | 0.000 | 0.000 | 0.000 |
| 79 | X | 653 | ARG | 1 | 0.813 | 0.902 | 36.765 | 7.831 | 7.831 | 0.000 | 0.000 | 0.000 | 0.000 |
| 80 | X | 654 | LEU | 0 | 0.020 | 0.012 | 36.120 | -0.308 | -0.308 | 0.000 | 0.000 | 0.000 | 0.000 |
| 81 | X | 655 | ASN | 0 | -0.013 | -0.009 | 35.419 | -0.218 | -0.218 | 0.000 | 0.000 | 0.000 | 0.000 |
| 82 | X | 656 | ALA | 0 | -0.044 | -0.009 | 32.740 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
| 83 | X | 657 | PHE | 0 | -0.002 | -0.011 | 31.256 | -0.331 | -0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
| 84 | X | 658 | ARG | 1 | 0.918 | 0.947 | 30.825 | 7.900 | 7.900 | 0.000 | 0.000 | 0.000 | 0.000 |
| 85 | X | 659 | GLU | -1 | -0.854 | -0.894 | 27.524 | -10.781 | -10.781 | 0.000 | 0.000 | 0.000 | 0.000 |
| 86 | X | 660 | LEU | 0 | -0.006 | -0.006 | 25.377 | -0.353 | -0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
| 87 | X | 661 | ARG | 1 | 0.841 | 0.878 | 26.073 | 9.019 | 9.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 88 | X | 662 | THR | 0 | 0.024 | 0.002 | 26.274 | -0.325 | -0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
| 89 | X | 663 | GLN | 0 | -0.055 | -0.055 | 23.172 | -0.627 | -0.627 | 0.000 | 0.000 | 0.000 | 0.000 |
| 90 | X | 664 | LEU | 0 | -0.033 | -0.020 | 21.857 | -0.629 | -0.629 | 0.000 | 0.000 | 0.000 | 0.000 |
| 91 | X | 665 | GLU | -1 | -0.849 | -0.928 | 21.511 | -11.494 | -11.494 | 0.000 | 0.000 | 0.000 | 0.000 |
| 92 | X | 666 | LYS | 1 | 0.911 | 0.952 | 21.554 | 11.313 | 11.313 | 0.000 | 0.000 | 0.000 | 0.000 |
| 93 | X | 667 | ALA | 0 | -0.024 | 0.003 | 17.670 | -0.481 | -0.481 | 0.000 | 0.000 | 0.000 | 0.000 |
| 94 | X | 668 | LEU | 0 | -0.059 | -0.030 | 16.772 | -1.213 | -1.213 | 0.000 | 0.000 | 0.000 | 0.000 |
| 95 | X | 669 | TYR | 0 | -0.026 | -0.038 | 18.440 | -0.476 | -0.476 | 0.000 | 0.000 | 0.000 | 0.000 |
| 96 | X | 670 | LEU | 0 | -0.003 | -0.013 | 14.827 | 0.302 | 0.302 | 0.000 | 0.000 | 0.000 | 0.000 |
| 97 | X | 671 | PRO | 0 | -0.015 | -0.023 | 19.556 | 0.379 | 0.379 | 0.000 | 0.000 | 0.000 | 0.000 |
| 98 | X | 672 | GLU | -1 | -0.751 | -0.851 | 17.702 | -15.447 | -15.447 | 0.000 | 0.000 | 0.000 | 0.000 |
| 99 | X | 673 | MET | 0 | -0.028 | 0.018 | 18.206 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
| 100 | X | 674 | GLU | -1 | -0.906 | -0.952 | 22.604 | -10.990 | -10.990 | 0.000 | 0.000 | 0.000 | 0.000 |
| 101 | X | 675 | ALA | 0 | 0.032 | 0.026 | 26.161 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
| 102 | X | 676 | LEU | 0 | 0.018 | 0.010 | 21.046 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
| 103 | X | 677 | LYS | 1 | 0.876 | 0.936 | 24.403 | 11.423 | 11.423 | 0.000 | 0.000 | 0.000 | 0.000 |
| 104 | X | 678 | LYS | 1 | 0.780 | 0.865 | 25.632 | 9.280 | 9.280 | 0.000 | 0.000 | 0.000 | 0.000 |
| 105 | X | 679 | GLN | 0 | -0.008 | -0.010 | 28.014 | 0.345 | 0.345 | 0.000 | 0.000 | 0.000 | 0.000 |
| 106 | X | 680 | ILE | 0 | 0.031 | 0.015 | 23.383 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
| 107 | X | 681 | LEU | 0 | -0.065 | -0.041 | 25.133 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
| 108 | X | 682 | GLN | 0 | 0.006 | 0.010 | 28.666 | 0.487 | 0.487 | 0.000 | 0.000 | 0.000 | 0.000 |
| 109 | X | 683 | ILE | 0 | 0.005 | 0.022 | 28.449 | 0.292 | 0.292 | 0.000 | 0.000 | 0.000 | 0.000 |
| 110 | X | 684 | PRO | 0 | -0.028 | -0.009 | 31.280 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
| 111 | X | 685 | ASN | 0 | 0.010 | 0.004 | 32.102 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 112 | X | 686 | LYS | 1 | 0.909 | 0.961 | 27.202 | 9.827 | 9.827 | 0.000 | 0.000 | 0.000 | 0.000 |
| 113 | X | 687 | GLY | 0 | -0.029 | -0.033 | 26.655 | -0.547 | -0.547 | 0.000 | 0.000 | 0.000 | 0.000 |
| 114 | X | 688 | SER | 0 | -0.016 | -0.021 | 27.997 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
| 115 | X | 689 | GLY | 0 | -0.021 | -0.002 | 24.869 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
| 116 | X | 690 | ALA | 0 | 0.071 | 0.032 | 24.617 | -0.557 | -0.557 | 0.000 | 0.000 | 0.000 | 0.000 |
| 117 | X | 691 | ALA | 0 | 0.041 | 0.012 | 24.589 | -0.365 | -0.365 | 0.000 | 0.000 | 0.000 | 0.000 |
| 118 | X | 692 | ARG | 1 | 0.822 | 0.922 | 18.311 | 15.485 | 15.485 | 0.000 | 0.000 | 0.000 | 0.000 |
| 119 | X | 693 | PHE | 0 | 0.068 | 0.040 | 20.110 | -1.052 | -1.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 120 | X | 694 | LEU | 0 | 0.056 | 0.037 | 21.267 | -0.583 | -0.583 | 0.000 | 0.000 | 0.000 | 0.000 |
| 121 | X | 695 | LEU | 0 | 0.001 | 0.003 | 17.648 | -0.398 | -0.398 | 0.000 | 0.000 | 0.000 | 0.000 |
| 122 | X | 696 | ARG | 1 | 0.831 | 0.883 | 16.337 | 15.660 | 15.660 | 0.000 | 0.000 | 0.000 | 0.000 |
| 123 | X | 697 | THR | 0 | 0.027 | 0.014 | 16.975 | -1.059 | -1.059 | 0.000 | 0.000 | 0.000 | 0.000 |
| 124 | X | 698 | ALA | 0 | 0.059 | 0.032 | 18.520 | -0.624 | -0.624 | 0.000 | 0.000 | 0.000 | 0.000 |
| 125 | X | 699 | MET | 0 | -0.048 | -0.026 | 13.779 | -0.804 | -0.804 | 0.000 | 0.000 | 0.000 | 0.000 |
| 126 | X | 700 | ASN | 0 | -0.039 | -0.027 | 13.414 | -3.376 | -3.376 | 0.000 | 0.000 | 0.000 | 0.000 |
| 127 | X | 701 | GLU | -1 | -0.729 | -0.830 | 15.220 | -14.359 | -14.359 | 0.000 | 0.000 | 0.000 | 0.000 |
| 128 | X | 702 | MET | 0 | 0.014 | 0.006 | 16.143 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 129 | X | 703 | ALA | 0 | -0.095 | -0.056 | 11.484 | -0.596 | -0.596 | 0.000 | 0.000 | 0.000 | 0.000 |
| 130 | X | 704 | GLY | 0 | -0.004 | 0.002 | 13.113 | -1.136 | -1.136 | 0.000 | 0.000 | 0.000 | 0.000 |
| 131 | X | 705 | LYS | 1 | 0.764 | 0.877 | 9.973 | 27.558 | 27.558 | 0.000 | 0.000 | 0.000 | 0.000 |
| 132 | X | 706 | THR | 0 | 0.012 | 0.012 | 14.863 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
| 133 | X | 707 | SER | 0 | -0.003 | -0.018 | 18.441 | -0.359 | -0.359 | 0.000 | 0.000 | 0.000 | 0.000 |
| 134 | X | 708 | GLU | -1 | -0.966 | -0.979 | 21.984 | -11.817 | -11.817 | 0.000 | 0.000 | 0.000 | 0.000 |
| 135 | X | 709 | SER | 0 | -0.023 | -0.010 | 22.671 | 0.381 | 0.381 | 0.000 | 0.000 | 0.000 | 0.000 |
| 136 | X | 710 | THR | 0 | -0.008 | -0.057 | 22.252 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
| 137 | X | 711 | ALA | 0 | 0.004 | 0.005 | 24.621 | 0.329 | 0.329 | 0.000 | 0.000 | 0.000 | 0.000 |
| 138 | X | 712 | ASP | -1 | -0.748 | -0.886 | 27.972 | -9.733 | -9.733 | 0.000 | 0.000 | 0.000 | 0.000 |
| 139 | X | 713 | LEU | 0 | 0.002 | 0.000 | 24.783 | 0.311 | 0.311 | 0.000 | 0.000 | 0.000 | 0.000 |
| 140 | X | 714 | ILE | 0 | -0.031 | -0.015 | 25.885 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
| 141 | X | 715 | ARG | 1 | 0.838 | 0.905 | 29.403 | 9.987 | 9.987 | 0.000 | 0.000 | 0.000 | 0.000 |
| 142 | X | 716 | PHE | 0 | 0.025 | 0.009 | 30.629 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
| 143 | X | 717 | ALA | 0 | 0.016 | 0.003 | 29.832 | 0.265 | 0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
| 144 | X | 718 | LEU | 0 | -0.040 | -0.029 | 31.984 | 0.219 | 0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
| 145 | X | 719 | GLN | 0 | -0.055 | -0.030 | 34.578 | 0.483 | 0.483 | 0.000 | 0.000 | 0.000 | 0.000 |
| 146 | X | 720 | ASP | -1 | -0.750 | -0.841 | 34.813 | -8.798 | -8.798 | 0.000 | 0.000 | 0.000 | 0.000 |
| 147 | X | 721 | THR | 0 | 0.004 | 0.009 | 36.849 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
| 148 | X | 722 | VAL | 0 | -0.029 | -0.005 | 35.199 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
| 149 | X | 723 | ILE | 0 | -0.048 | -0.028 | 30.823 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
| 150 | X | 724 | SER | 0 | -0.044 | -0.026 | 33.532 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
| 151 | X | 725 | ALA | 0 | 0.043 | 0.028 | 35.727 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
| 152 | X | 726 | PRO | 0 | -0.040 | -0.024 | 37.060 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
| 153 | X | 727 | PHE | 0 | 0.002 | 0.000 | 36.309 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
| 154 | X | 728 | ARG | 1 | 0.794 | 0.885 | 38.310 | 7.798 | 7.798 | 0.000 | 0.000 | 0.000 | 0.000 |
| 155 | X | 729 | GLY | 0 | 0.095 | 0.090 | 40.486 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
| 156 | X | 730 | TYR | 0 | -0.028 | -0.025 | 41.230 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 157 | X | 731 | ALA | 0 | -0.007 | -0.029 | 37.665 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
| 158 | X | 732 | GLY | 0 | 0.002 | 0.015 | 38.684 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
| 159 | X | 733 | ALA | 0 | -0.028 | -0.015 | 39.720 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
| 160 | X | 734 | ILE | 0 | 0.027 | 0.021 | 39.792 | 0.170 | 0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
| 161 | X | 735 | PRO | 0 | 0.004 | 0.006 | 42.152 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
| 162 | X | 736 | GLU | -1 | -0.919 | -0.968 | 41.958 | -7.509 | -7.509 | 0.000 | 0.000 | 0.000 | 0.000 |
| 163 | X | 737 | ALA | 0 | -0.010 | 0.007 | 44.275 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 164 | X | 738 | ILE | 0 | -0.057 | -0.023 | 43.941 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
| 165 | X | 739 | ASP | -1 | -0.847 | -0.912 | 44.267 | -6.926 | -6.926 | 0.000 | 0.000 | 0.000 | 0.000 |
| 166 | X | 740 | PHE | 0 | -0.012 | 0.002 | 43.619 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
| 167 | X | 741 | PRO | 0 | -0.015 | -0.028 | 38.525 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
| 168 | X | 742 | VAL | 0 | -0.032 | -0.002 | 40.530 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
| 169 | X | 743 | LYS | 1 | 0.867 | 0.954 | 39.001 | 7.962 | 7.962 | 0.000 | 0.000 | 0.000 | 0.000 |
| 170 | X | 744 | TYR | 0 | -0.017 | -0.038 | 40.462 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
| 171 | X | 745 | VAL | 0 | -0.038 | -0.026 | 42.778 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
| 172 | X | 746 | ILE | 0 | -0.003 | 0.019 | 45.256 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
| 173 | X | 747 | GLU | -1 | -0.903 | -0.967 | 45.520 | -7.026 | -7.026 | 0.000 | 0.000 | 0.000 | 0.000 |
| 174 | X | 748 | ASP | -1 | -0.812 | -0.865 | 48.269 | -5.885 | -5.885 | 0.000 | 0.000 | 0.000 | 0.000 |
| 175 | X | 749 | ILE | 0 | 0.006 | -0.001 | 51.967 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 176 | X | 750 | SER | 0 | 0.004 | -0.015 | 54.656 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
| 177 | X | 751 | VAL | 0 | -0.039 | -0.026 | 51.613 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
| 178 | X | 752 | PHE | 0 | 0.064 | 0.015 | 52.582 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 179 | X | 753 | ASP | -1 | -0.788 | -0.853 | 56.698 | -5.297 | -5.297 | 0.000 | 0.000 | 0.000 | 0.000 |
| 180 | X | 754 | LYS | 1 | 0.822 | 0.907 | 56.104 | 5.742 | 5.742 | 0.000 | 0.000 | 0.000 | 0.000 |
| 181 | X | 755 | ILE | 0 | -0.044 | 0.003 | 56.173 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 182 | X | 756 | GLN | 0 | -0.045 | -0.019 | 58.809 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
| 183 | X | 757 | THR | 0 | -0.035 | -0.035 | 61.222 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
| 184 | X | 758 | ASN | 0 | -0.020 | -0.009 | 62.437 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
| 185 | X | 759 | TYR | 0 | -0.003 | -0.046 | 59.530 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
| 186 | X | 760 | TRP | 0 | -0.057 | -0.035 | 64.059 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
| 187 | X | 761 | GLU | -1 | -0.904 | -0.934 | 66.343 | -4.600 | -4.600 | 0.000 | 0.000 | 0.000 | 0.000 |
| 188 | X | 762 | LEU | 0 | -0.032 | -0.006 | 66.142 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
| 189 | X | 763 | PRO | 0 | 0.042 | 0.006 | 69.065 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 190 | X | 764 | ALA | 0 | -0.085 | -0.028 | 67.217 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 191 | X | 765 | TYR | 0 | -0.006 | -0.030 | 63.180 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
| 192 | X | 766 | GLU | -1 | -0.887 | -0.936 | 68.763 | -4.416 | -4.416 | 0.000 | 0.000 | 0.000 | 0.000 |
| 193 | X | 767 | SER | 0 | -0.082 | -0.045 | 71.431 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 194 | X | 768 | TRP | 0 | -0.030 | -0.017 | 63.034 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
| 195 | X | 769 | ASN | 0 | -0.083 | -0.040 | 69.859 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 196 | X | 770 | GLU | -1 | -0.884 | -0.938 | 65.670 | -4.930 | -4.930 | 0.000 | 0.000 | 0.000 | 0.000 |
| 197 | X | 771 | GLY | 0 | -0.013 | -0.011 | 67.613 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
| 198 | X | 772 | SER | 0 | -0.042 | -0.029 | 62.651 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 199 | X | 773 | ASN | 0 | 0.030 | -0.002 | 59.827 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
| 200 | X | 774 | SER | 0 | -0.078 | -0.083 | 58.752 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 201 | X | 775 | ALA | 0 | -0.046 | -0.015 | 59.757 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
| 202 | X | 776 | LEU | 0 | 0.061 | 0.038 | 61.607 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 203 | X | 777 | LEU | 0 | -0.008 | 0.019 | 54.428 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 204 | X | 778 | PRO | 0 | -0.027 | -0.037 | 58.238 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
| 205 | X | 779 | GLY | 0 | -0.016 | 0.006 | 59.367 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 206 | X | 780 | LEU | 0 | 0.026 | 0.007 | 58.834 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 207 | X | 781 | LEU | 0 | -0.025 | 0.014 | 53.889 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 208 | X | 782 | ARG | 1 | 0.929 | 0.978 | 57.322 | 5.267 | 5.267 | 0.000 | 0.000 | 0.000 | 0.000 |
| 209 | X | 783 | GLU | -1 | -0.885 | -0.962 | 59.661 | -4.996 | -4.996 | 0.000 | 0.000 | 0.000 | 0.000 |
| 210 | X | 784 | SER | 0 | -0.060 | -0.033 | 56.687 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 211 | X | 785 | GLN | 0 | 0.038 | -0.012 | 53.162 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 212 | X | 786 | SER | 0 | -0.090 | -0.032 | 56.845 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 213 | X | 787 | LYS | 1 | 0.876 | 0.958 | 59.160 | 5.326 | 5.326 | 0.000 | 0.000 | 0.000 | 0.000 |
| 214 | X | 788 | GLY | 0 | -0.048 | -0.036 | 56.031 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 215 | X | 789 | MET | 0 | -0.005 | 0.016 | 54.301 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
| 216 | X | 790 | LEU | 0 | -0.008 | -0.012 | 52.126 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 217 | X | 791 | SER | 0 | 0.057 | 0.029 | 51.088 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
| 218 | X | 792 | LYS | 1 | 0.856 | 0.936 | 44.862 | 7.091 | 7.091 | 0.000 | 0.000 | 0.000 | 0.000 |
| 219 | X | 793 | CYS | 0 | -0.015 | 0.017 | 47.783 | -0.191 | -0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
| 220 | X | 794 | ARG | 1 | 0.841 | 0.896 | 48.882 | 6.702 | 6.702 | 0.000 | 0.000 | 0.000 | 0.000 |
| 221 | X | 795 | ILE | 0 | 0.031 | 0.019 | 50.349 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
| 222 | X | 796 | ILE | 0 | -0.042 | -0.031 | 49.032 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 223 | X | 797 | GLU | -1 | -0.963 | -0.979 | 51.516 | -6.244 | -6.244 | 0.000 | 0.000 | 0.000 | 0.000 |
| 224 | X | 798 | ASN | 0 | -0.048 | -0.031 | 52.663 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
| 225 | X | 799 | SER | 0 | 0.022 | 0.015 | 48.447 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 226 | X | 800 | LEU | 0 | -0.027 | -0.017 | 49.705 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
| 227 | X | 801 | TYR | 0 | 0.007 | 0.000 | 44.408 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
| 228 | X | 802 | ILE | 0 | 0.044 | 0.007 | 45.517 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
| 229 | X | 803 | GLY | 0 | 0.048 | 0.015 | 43.338 | -0.217 | -0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
| 230 | X | 804 | HIS | 0 | -0.055 | -0.033 | 43.533 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
| 231 | X | 805 | SER | 0 | 0.010 | -0.005 | 41.969 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 232 | X | 806 | TYR | 0 | 0.056 | 0.031 | 43.511 | 0.246 | 0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
| 233 | X | 807 | GLU | -1 | -0.834 | -0.930 | 41.475 | -7.668 | -7.668 | 0.000 | 0.000 | 0.000 | 0.000 |
| 234 | X | 808 | GLU | -1 | -0.777 | -0.874 | 45.194 | -6.982 | -6.982 | 0.000 | 0.000 | 0.000 | 0.000 |
| 235 | X | 809 | MET | 0 | -0.034 | 0.004 | 46.814 | 0.201 | 0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
| 236 | X | 810 | PHE | 0 | 0.017 | 0.002 | 48.517 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
| 237 | X | 811 | TYR | 0 | -0.036 | -0.040 | 46.454 | 0.196 | 0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
| 238 | X | 812 | SER | 0 | -0.072 | -0.060 | 50.701 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
| 239 | X | 813 | ILE | 0 | -0.043 | -0.008 | 52.612 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
| 240 | X | 814 | SER | 0 | 0.014 | -0.011 | 54.933 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 241 | X | 815 | PRO | 0 | 0.020 | 0.005 | 57.498 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
| 242 | X | 816 | TYR | 0 | -0.025 | -0.008 | 57.848 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
| 243 | X | 817 | SER | 0 | 0.028 | 0.012 | 57.516 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
| 244 | X | 818 | ASN | 0 | -0.105 | -0.044 | 57.998 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
| 245 | X | 819 | GLN | 0 | 0.021 | 0.001 | 61.270 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 246 | X | 820 | VAL | 0 | -0.004 | -0.016 | 64.959 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 247 | X | 821 | GLY | 0 | -0.025 | -0.012 | 67.810 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
| 248 | X | 822 | GLY | 0 | 0.003 | 0.019 | 65.000 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 249 | X | 823 | PRO | 0 | -0.031 | -0.010 | 61.890 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 250 | X | 824 | TYR | 0 | -0.078 | -0.103 | 58.438 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
| 251 | X | 825 | GLU | -1 | -0.858 | -0.910 | 61.026 | -4.965 | -4.965 | 0.000 | 0.000 | 0.000 | 0.000 |
| 252 | X | 826 | LEU | 0 | 0.055 | 0.022 | 61.903 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
| 253 | X | 827 | TYR | 0 | 0.031 | 0.015 | 60.955 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
| 254 | X | 828 | PRO | 0 | 0.029 | 0.005 | 56.050 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
| 255 | X | 829 | PHE | 0 | 0.067 | 0.021 | 56.409 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
| 256 | X | 830 | THR | 0 | -0.011 | 0.029 | 58.055 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 257 | X | 831 | PHE | 0 | 0.022 | -0.005 | 51.502 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 258 | X | 832 | PHE | 0 | 0.009 | -0.003 | 49.404 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
| 259 | X | 833 | SER | 0 | 0.015 | 0.004 | 53.800 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
| 260 | X | 834 | MET | 0 | -0.002 | 0.000 | 55.798 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 261 | X | 835 | LEU | 0 | -0.038 | -0.016 | 49.813 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
| 262 | X | 836 | GLN | 0 | 0.009 | 0.001 | 50.848 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 263 | X | 837 | GLU | -1 | -0.791 | -0.870 | 52.519 | -5.497 | -5.497 | 0.000 | 0.000 | 0.000 | 0.000 |
| 264 | X | 838 | VAL | 0 | -0.058 | -0.027 | 50.672 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 265 | X | 839 | GLN | 0 | -0.079 | -0.039 | 47.234 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 266 | X | 840 | GLY | 0 | 0.000 | 0.004 | 49.190 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
| 267 | X | 841 | ASP | -1 | -0.972 | -0.988 | 48.971 | -6.537 | -6.537 | 0.000 | 0.000 | 0.000 | 0.000 |
| 268 | X | 842 | LEU | 0 | -0.038 | 0.004 | 44.766 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
| 269 | X | 843 | GLY | 0 | 0.053 | 0.020 | 42.842 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
| 270 | X | 844 | PHE | 0 | 0.020 | 0.005 | 43.914 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 271 | X | 845 | GLU | -1 | -0.831 | -0.935 | 38.986 | -7.841 | -7.841 | 0.000 | 0.000 | 0.000 | 0.000 |
| 272 | X | 846 | GLN | 0 | -0.052 | -0.021 | 40.245 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 273 | X | 847 | ALA | 0 | 0.031 | 0.022 | 41.246 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 274 | X | 848 | PHE | 0 | 0.028 | 0.011 | 43.670 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
| 275 | X | 849 | ALA | 0 | -0.019 | 0.001 | 38.643 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 276 | X | 850 | THR | 0 | -0.010 | 0.000 | 37.401 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
| 277 | X | 851 | ARG | 1 | 0.820 | 0.890 | 31.889 | 9.260 | 9.260 | 0.000 | 0.000 | 0.000 | 0.000 |
| 278 | X | 852 | ASN | 0 | -0.036 | -0.023 | 31.717 | -0.329 | -0.329 | 0.000 | 0.000 | 0.000 | 0.000 |
| 279 | X | 853 | PHE | 0 | 0.038 | 0.031 | 33.025 | -0.319 | -0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
| 280 | X | 854 | PHE | 0 | 0.018 | 0.010 | 33.525 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
| 281 | X | 855 | ASN | 0 | 0.040 | -0.003 | 29.366 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
| 282 | X | 856 | THR | 0 | -0.057 | -0.012 | 29.617 | -0.454 | -0.454 | 0.000 | 0.000 | 0.000 | 0.000 |
| 283 | X | 857 | LEU | 0 | 0.042 | 0.031 | 30.483 | -0.249 | -0.249 | 0.000 | 0.000 | 0.000 | 0.000 |
| 284 | X | 858 | VAL | 0 | -0.004 | -0.004 | 28.872 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
| 285 | X | 859 | SER | 0 | -0.067 | -0.046 | 25.970 | -0.309 | -0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
| 286 | X | 860 | ASP | -1 | -0.869 | -0.924 | 27.267 | -11.293 | -11.293 | 0.000 | 0.000 | 0.000 | 0.000 |
| 287 | X | 861 | ARG | 1 | 0.788 | 0.858 | 29.527 | 8.816 | 8.816 | 0.000 | 0.000 | 0.000 | 0.000 |
| 288 | X | 862 | LEU | 0 | -0.053 | -0.027 | 26.457 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
| 289 | X | 863 | SER | 0 | -0.019 | -0.022 | 25.304 | -0.398 | -0.398 | 0.000 | 0.000 | 0.000 | 0.000 |
| 290 | X | 864 | LEU | 0 | -0.005 | 0.002 | 26.428 | -0.194 | -0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
| 291 | X | 865 | MET | 0 | -0.027 | 0.009 | 29.572 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
| 292 | X | 866 | GLU | -1 | -0.932 | -0.973 | 21.773 | -14.613 | -14.613 | 0.000 | 0.000 | 0.000 | 0.000 |
| 293 | X | 867 | ASN | 0 | -0.020 | -0.014 | 25.352 | -0.373 | -0.373 | 0.000 | 0.000 | 0.000 | 0.000 |
| 294 | X | 868 | THR | 0 | -0.014 | 0.002 | 27.349 | 0.246 | 0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
| 295 | X | 869 | MET | 0 | -0.056 | -0.026 | 27.642 | 0.201 | 0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
| 296 | X | 870 | LEU | 0 | 0.024 | 0.031 | 23.263 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
| 297 | X | 871 | LEU | 0 | 0.012 | 0.015 | 27.083 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
| 298 | X | 872 | THR | 0 | -0.019 | -0.001 | 30.074 | 0.339 | 0.339 | 0.000 | 0.000 | 0.000 | 0.000 |
| 299 | X | 873 | GLU | -1 | -0.919 | -0.931 | 25.137 | -12.582 | -12.582 | 0.000 | 0.000 | 0.000 | 0.000 |
| 300 | X | 874 | SER | 0 | -0.061 | -0.039 | 28.252 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 301 | X | 875 | PHE | 0 | -0.007 | 0.011 | 30.873 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
| 302 | X | 876 | ASP | -1 | -0.818 | -0.895 | 33.628 | -8.363 | -8.363 | 0.000 | 0.000 | 0.000 | 0.000 |
| 303 | X | 877 | TYR | 0 | 0.017 | -0.022 | 36.215 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 304 | X | 878 | THR | 0 | -0.056 | -0.036 | 39.237 | 0.292 | 0.292 | 0.000 | 0.000 | 0.000 | 0.000 |
| 305 | X | 879 | PRO | 0 | -0.057 | -0.035 | 38.471 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
| 306 | X | 880 | TRP | 0 | -0.011 | 0.001 | 41.756 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
| 307 | X | 881 | ASP | -1 | -0.735 | -0.863 | 43.539 | -7.147 | -7.147 | 0.000 | 0.000 | 0.000 | 0.000 |
| 308 | X | 882 | ALA | 0 | -0.054 | -0.021 | 44.949 | 0.186 | 0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
| 309 | X | 883 | ILE | 0 | -0.086 | -0.033 | 46.203 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
| 310 | X | 884 | TYR | 0 | -0.019 | -0.029 | 45.975 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
| 311 | X | 885 | GLY | 0 | -0.009 | 0.000 | 47.852 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
| 312 | X | 886 | ASP | -1 | -0.863 | -0.930 | 48.823 | -5.956 | -5.956 | 0.000 | 0.000 | 0.000 | 0.000 |
| 313 | X | 887 | ILE | 0 | -0.082 | -0.035 | 51.956 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 314 | X | 888 | ASN | 0 | -0.003 | 0.003 | 54.379 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 315 | X | 889 | TYR | 0 | 0.041 | 0.022 | 52.775 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 316 | X | 890 | ASP | -1 | -0.872 | -0.944 | 55.053 | -5.645 | -5.645 | 0.000 | 0.000 | 0.000 | 0.000 |
| 317 | X | 891 | GLU | -1 | -0.909 | -0.953 | 56.999 | -5.204 | -5.204 | 0.000 | 0.000 | 0.000 | 0.000 |
| 318 | X | 892 | GLN | 0 | -0.081 | -0.050 | 55.778 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 319 | X | 893 | PHE | 0 | -0.059 | -0.034 | 55.306 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 320 | X | 894 | ALA | 0 | -0.005 | -0.017 | 58.032 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 321 | X | 895 | ALA | 0 | -0.039 | -0.014 | 61.441 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
| 322 | X | 896 | MET | 0 | -0.041 | 0.009 | 56.577 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
| 323 | X | 897 | SER | 0 | -0.015 | -0.028 | 62.307 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 324 | X | 898 | ILE | 0 | 0.031 | -0.002 | 61.818 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
| 325 | X | 899 | ASN | 0 | 0.019 | 0.005 | 61.056 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
| 326 | X | 900 | GLU | -1 | -0.770 | -0.842 | 60.620 | -5.184 | -5.184 | 0.000 | 0.000 | 0.000 | 0.000 |
| 327 | X | 901 | ARG | 1 | 0.803 | 0.910 | 57.788 | 5.211 | 5.211 | 0.000 | 0.000 | 0.000 | 0.000 |
| 328 | X | 902 | ILE | 0 | 0.000 | 0.011 | 56.427 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
| 329 | X | 903 | GLU | -1 | -0.911 | -0.962 | 56.046 | -5.405 | -5.405 | 0.000 | 0.000 | 0.000 | 0.000 |
| 330 | X | 904 | LYS | 1 | 0.888 | 0.956 | 53.675 | 5.844 | 5.844 | 0.000 | 0.000 | 0.000 | 0.000 |
| 331 | X | 905 | CYS | 0 | -0.037 | -0.031 | 52.173 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
| 332 | X | 906 | MET | 0 | -0.017 | 0.011 | 51.187 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
| 333 | X | 907 | ASN | 0 | -0.053 | -0.049 | 51.668 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
| 334 | X | 908 | THR | 0 | -0.102 | -0.048 | 50.378 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 335 | X | 909 | TYR | 0 | 0.029 | -0.004 | 48.268 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
| 336 | X | 910 | ARG | 1 | 0.850 | 0.940 | 46.062 | 6.704 | 6.704 | 0.000 | 0.000 | 0.000 | 0.000 |
| 337 | X | 911 | GLY | 0 | 0.087 | 0.030 | 47.895 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
| 338 | X | 912 | VAL | 0 | -0.019 | -0.010 | 48.783 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
| 339 | X | 913 | ALA | 0 | 0.013 | 0.020 | 47.540 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
| 340 | X | 914 | PHE | 0 | 0.007 | 0.009 | 49.697 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
| 341 | X | 915 | GLN | 0 | 0.033 | 0.002 | 51.097 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 342 | X | 916 | ASN | 0 | -0.076 | -0.048 | 50.974 | 0.170 | 0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
| 343 | X | 917 | SER | 0 | 0.016 | 0.028 | 53.006 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
| 344 | X | 918 | SER | 0 | 0.060 | 0.017 | 56.857 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 345 | X | 919 | LYS | 1 | 0.855 | 0.917 | 59.611 | 5.126 | 5.126 | 0.000 | 0.000 | 0.000 | 0.000 |
| 346 | X | 920 | SER | 0 | 0.024 | 0.006 | 56.395 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
| 347 | X | 921 | ILE | 0 | -0.001 | 0.013 | 55.171 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 348 | X | 922 | ASP | -1 | -0.863 | -0.938 | 58.286 | -5.173 | -5.173 | 0.000 | 0.000 | 0.000 | 0.000 |
| 349 | X | 923 | PHE | 0 | -0.036 | -0.009 | 59.501 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
| 350 | X | 924 | PHE | 0 | 0.034 | 0.019 | 55.278 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
| 351 | X | 925 | LEU | 0 | -0.021 | -0.013 | 59.093 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
| 352 | X | 926 | ASN | 0 | -0.062 | -0.035 | 61.284 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
| 353 | X | 927 | ASN | 0 | -0.053 | -0.035 | 61.202 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 354 | X | 928 | LEU | 0 | 0.015 | 0.026 | 57.438 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 355 | X | 929 | THR | 0 | 0.011 | -0.005 | 59.736 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
| 356 | X | 930 | THR | 0 | 0.055 | 0.039 | 61.153 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
| 357 | X | 931 | PHE | 0 | 0.021 | -0.003 | 54.680 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
| 358 | X | 932 | ILE | 0 | -0.011 | 0.000 | 56.601 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
| 359 | X | 933 | ASP | -1 | -0.897 | -0.944 | 57.894 | -5.248 | -5.248 | 0.000 | 0.000 | 0.000 | 0.000 |
| 360 | X | 934 | ASN | 0 | -0.047 | -0.027 | 56.415 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
| 361 | X | 935 | GLY | 0 | -0.006 | -0.007 | 54.400 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
| 362 | X | 936 | LEU | 0 | -0.023 | -0.017 | 51.654 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
| 363 | X | 937 | THR | 0 | 0.005 | 0.004 | 48.167 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 364 | X | 938 | GLU | -1 | -0.840 | -0.924 | 45.235 | -7.267 | -7.267 | 0.000 | 0.000 | 0.000 | 0.000 |
| 365 | X | 939 | ILE | 0 | 0.028 | 0.017 | 49.177 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 366 | X | 940 | ALA | 0 | -0.008 | -0.005 | 45.445 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
| 367 | X | 941 | ILE | 0 | -0.002 | -0.004 | 47.140 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
| 368 | X | 942 | SER | 0 | 0.019 | -0.010 | 44.920 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
| 369 | X | 943 | ASP | -1 | -0.850 | -0.909 | 45.555 | -6.739 | -6.739 | 0.000 | 0.000 | 0.000 | 0.000 |
| 370 | X | 944 | LEU | 0 | 0.008 | 0.003 | 47.254 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
| 371 | X | 945 | PRO | 0 | 0.008 | 0.008 | 43.178 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
| 372 | X | 946 | TYR | 0 | 0.066 | 0.013 | 36.198 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 373 | X | 947 | ASP | -1 | -0.851 | -0.892 | 38.714 | -8.023 | -8.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 374 | X | 948 | ILE | 0 | -0.061 | -0.011 | 40.597 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 375 | X | 949 | VAL | 0 | 0.025 | 0.001 | 44.121 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
| 376 | X | 950 | GLN | 0 | 0.011 | 0.010 | 39.371 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
| 377 | X | 951 | GLN | 0 | -0.032 | -0.007 | 44.851 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
| 378 | X | 952 | GLU | -1 | -0.769 | -0.863 | 46.387 | -6.311 | -6.311 | 0.000 | 0.000 | 0.000 | 0.000 |
| 379 | X | 953 | ILE | 0 | 0.014 | 0.006 | 47.257 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
| 380 | X | 954 | SER | 0 | -0.045 | -0.023 | 47.570 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
| 381 | X | 955 | GLN | 0 | -0.005 | -0.023 | 48.804 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
| 382 | X | 956 | PHE | 0 | 0.003 | 0.008 | 52.190 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
| 383 | X | 957 | LEU | 0 | -0.009 | -0.008 | 50.369 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
| 384 | X | 958 | GLN | 0 | -0.039 | -0.008 | 50.028 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 385 | X | 959 | GLY | 0 | -0.006 | 0.007 | 54.821 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
| 386 | X | 960 | SER | 0 | -0.013 | 0.001 | 54.777 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
| 387 | X | 961 | ASN | 0 | -0.012 | -0.026 | 56.902 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 388 | X | 962 | GLU | -1 | -0.995 | -0.992 | 51.901 | -6.162 | -6.162 | 0.000 | 0.000 | 0.000 | 0.000 |
| 389 | X | 963 | TRP | 0 | -0.013 | -0.017 | 52.663 | -0.126 | -0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
| 390 | X | 964 | LYS | 1 | 0.964 | 0.987 | 53.727 | 5.641 | 5.641 | 0.000 | 0.000 | 0.000 | 0.000 |
| 391 | X | 965 | THR | 0 | 0.014 | -0.012 | 49.005 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
| 392 | X | 966 | LEU | 0 | 0.009 | -0.002 | 50.527 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 393 | X | 967 | ASP | -1 | -0.784 | -0.856 | 52.285 | -5.496 | -5.496 | 0.000 | 0.000 | 0.000 | 0.000 |
| 394 | X | 968 | ALA | 0 | 0.007 | 0.009 | 54.440 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
| 395 | X | 969 | MET | 0 | -0.020 | 0.001 | 47.496 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 396 | X | 970 | LEU | 0 | -0.018 | -0.004 | 53.219 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 397 | X | 971 | PHE | 0 | 0.000 | -0.007 | 55.603 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
| 398 | X | 972 | ASN | 0 | 0.010 | 0.020 | 54.377 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
| 399 | X | 973 | LEU | 0 | -0.023 | 0.007 | 51.328 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
| 400 | X | 974 | ASP | -1 | -0.792 | -0.907 | 55.438 | -5.567 | -5.567 | 0.000 | 0.000 | 0.000 | 0.000 |
| 401 | X | 975 | LYS | 1 | 0.849 | 0.929 | 56.636 | 5.839 | 5.839 | 0.000 | 0.000 | 0.000 | 0.000 |
| 402 | X | 976 | GLY | 0 | 0.031 | 0.010 | 60.492 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
| 403 | X | 977 | ASP | -1 | -0.848 | -0.910 | 62.405 | -4.932 | -4.932 | 0.000 | 0.000 | 0.000 | 0.000 |
| 404 | X | 978 | ILE | 0 | -0.027 | -0.017 | 62.799 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
| 405 | X | 979 | ASN | 0 | -0.149 | -0.081 | 64.339 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 406 | X | 980 | GLY | 0 | 0.029 | 0.013 | 61.077 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
| 407 | X | 981 | ALA | 0 | -0.006 | -0.002 | 59.000 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 408 | X | 982 | PHE | 0 | 0.020 | -0.012 | 52.296 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
| 409 | X | 983 | ARG | 1 | 0.814 | 0.908 | 56.325 | 5.402 | 5.402 | 0.000 | 0.000 | 0.000 | 0.000 |
| 410 | X | 984 | LYS | 1 | 0.847 | 0.916 | 58.496 | 5.123 | 5.123 | 0.000 | 0.000 | 0.000 | 0.000 |
| 411 | X | 985 | LEU | 0 | -0.006 | 0.008 | 53.589 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 412 | X | 986 | LEU | 0 | 0.027 | 0.029 | 52.878 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 413 | X | 987 | GLN | 0 | -0.005 | -0.006 | 55.613 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 414 | X | 988 | SER | 0 | -0.036 | -0.022 | 57.716 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 415 | X | 989 | ALA | 0 | 0.035 | 0.021 | 53.673 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 416 | X | 990 | LYS | 1 | 0.866 | 0.938 | 55.819 | 5.410 | 5.410 | 0.000 | 0.000 | 0.000 | 0.000 |
| 417 | X | 991 | ASP | -1 | -0.897 | -0.943 | 57.011 | -5.272 | -5.272 | 0.000 | 0.000 | 0.000 | 0.000 |
| 418 | X | 992 | ASN | 0 | -0.102 | -0.063 | 58.368 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
| 419 | X | 993 | ASN | 0 | -0.077 | -0.033 | 55.917 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
| 420 | X | 994 | ILE | 0 | -0.010 | 0.010 | 52.346 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
| 421 | X | 995 | LYS | 1 | 0.852 | 0.932 | 45.112 | 7.032 | 7.032 | 0.000 | 0.000 | 0.000 | 0.000 |
| 422 | X | 996 | PHE | 0 | 0.060 | 0.017 | 49.762 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 423 | X | 997 | ARG | 1 | 0.828 | 0.908 | 41.478 | 7.509 | 7.509 | 0.000 | 0.000 | 0.000 | 0.000 |
| 424 | X | 998 | ALA | 0 | 0.007 | 0.015 | 44.504 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
| 425 | X | 999 | ILE | 0 | 0.000 | -0.013 | 41.502 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
| 426 | X | 1000 | GLY | 0 | 0.074 | 0.050 | 41.144 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
| 427 | X | 1001 | HIS | 0 | -0.083 | -0.048 | 36.202 | -0.252 | -0.252 | 0.000 | 0.000 | 0.000 | 0.000 |
| 428 | X | 1002 | SER | 0 | -0.016 | -0.056 | 40.401 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
| 429 | X | 1003 | ASP | -1 | -0.728 | -0.817 | 35.877 | -8.911 | -8.911 | 0.000 | 0.000 | 0.000 | 0.000 |
| 430 | X | 1004 | ASN | 0 | -0.020 | -0.018 | 37.017 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
| 431 | X | 1005 | SER | 0 | -0.014 | -0.023 | 40.202 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
| 432 | X | 1006 | VAL | 0 | -0.022 | 0.019 | 43.123 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
| 433 | X | 1007 | PRO | 0 | -0.014 | 0.020 | 45.017 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
| 434 | X | 1008 | PRO | 0 | 0.005 | -0.008 | 46.307 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
| 435 | X | 1009 | PHE | 0 | 0.034 | 0.002 | 41.794 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
| 436 | X | 1010 | ASN | 0 | -0.038 | -0.015 | 45.169 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
| 437 | X | 1011 | ASN | 0 | 0.082 | 0.030 | 39.315 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
| 438 | X | 1012 | PRO | 0 | 0.046 | 0.037 | 39.191 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 439 | X | 1013 | TYR | 0 | 0.003 | -0.005 | 33.368 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 440 | X | 1014 | LYS | 1 | 0.864 | 0.940 | 36.602 | 7.583 | 7.583 | 0.000 | 0.000 | 0.000 | 0.000 |
| 441 | X | 1015 | SER | 0 | -0.021 | -0.027 | 38.775 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 442 | X | 1016 | LEU | 0 | -0.014 | -0.005 | 33.584 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
| 443 | X | 1017 | TYR | 0 | -0.029 | -0.049 | 32.341 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
| 444 | X | 1018 | TYR | 0 | -0.001 | 0.007 | 35.702 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 445 | X | 1019 | LYS | 1 | 0.813 | 0.907 | 38.636 | 8.006 | 8.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 446 | X | 1020 | GLY | 0 | 0.021 | 0.003 | 34.645 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
| 447 | X | 1021 | ASN | 0 | 0.014 | -0.001 | 33.752 | -0.292 | -0.292 | 0.000 | 0.000 | 0.000 | 0.000 |
| 448 | X | 1022 | ILE | 0 | -0.028 | -0.002 | 35.769 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
| 449 | X | 1023 | ILE | 0 | -0.032 | -0.017 | 35.871 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
| 450 | X | 1024 | ALA | 0 | 0.005 | 0.006 | 32.868 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 451 | X | 1025 | GLU | -1 | -0.811 | -0.880 | 34.633 | -8.639 | -8.639 | 0.000 | 0.000 | 0.000 | 0.000 |
| 452 | X | 1026 | ALA | 0 | -0.033 | -0.028 | 37.068 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
| 453 | X | 1027 | ILE | 0 | 0.004 | 0.003 | 33.806 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
| 454 | X | 1028 | GLU | -1 | -0.950 | -0.963 | 32.782 | -9.645 | -9.645 | 0.000 | 0.000 | 0.000 | 0.000 |
| 455 | X | 1029 | LYS | 1 | 0.767 | 0.854 | 35.664 | 8.820 | 8.820 | 0.000 | 0.000 | 0.000 | 0.000 |
| 456 | X | 1030 | LEU | 0 | -0.011 | 0.008 | 39.391 | 0.260 | 0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
| 457 | X | 1031 | ASP | -1 | -0.819 | -0.887 | 38.255 | -8.336 | -8.336 | 0.000 | 0.000 | 0.000 | 0.000 |
| 458 | X | 1032 | ARG | 1 | 0.856 | 0.931 | 37.899 | 7.969 | 7.969 | 0.000 | 0.000 | 0.000 | 0.000 |
| 459 | X | 1033 | GLU | -1 | -0.922 | -0.973 | 40.342 | -7.285 | -7.285 | 0.000 | 0.000 | 0.000 | 0.000 |
| 460 | X | 1034 | GLY | 0 | 0.019 | 0.014 | 42.315 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 461 | X | 1035 | GLN | 0 | -0.104 | -0.052 | 42.615 | 0.162 | 0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
| 462 | X | 1036 | LYS | 1 | 0.829 | 0.934 | 46.146 | 6.155 | 6.155 | 0.000 | 0.000 | 0.000 | 0.000 |
| 463 | X | 1037 | PHE | 0 | 0.023 | 0.011 | 44.006 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
| 464 | X | 1038 | VAL | 0 | 0.017 | 0.015 | 48.613 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 465 | X | 1039 | VAL | 0 | -0.004 | 0.000 | 45.507 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 466 | X | 1040 | PHE | 0 | -0.001 | 0.000 | 48.687 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
| 467 | X | 1041 | ALA | 0 | 0.045 | 0.010 | 46.333 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 468 | X | 1042 | ASP | -1 | -0.786 | -0.866 | 47.278 | -6.548 | -6.548 | 0.000 | 0.000 | 0.000 | 0.000 |
| 469 | X | 1043 | SER | 0 | 0.040 | -0.002 | 47.390 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
| 470 | X | 1044 | SER | 0 | -0.084 | -0.056 | 44.941 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
| 471 | X | 1045 | LEU | 0 | 0.017 | 0.001 | 42.051 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
| 472 | X | 1046 | LEU | 0 | -0.034 | -0.002 | 43.113 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
| 473 | X | 1047 | ASN | 0 | 0.022 | 0.019 | 44.457 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
| 474 | X | 1048 | SER | 0 | 0.012 | -0.009 | 41.571 | -0.251 | -0.251 | 0.000 | 0.000 | 0.000 | 0.000 |
| 475 | X | 1049 | THR | 0 | -0.051 | -0.015 | 40.081 | 0.211 | 0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
| 476 | X | 1050 | PRO | 0 | 0.001 | -0.004 | 39.963 | -0.185 | -0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
| 477 | X | 1051 | GLY | 0 | 0.042 | 0.028 | 36.046 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
| 478 | X | 1052 | THR | 0 | -0.014 | -0.013 | 31.193 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
| 479 | X | 1053 | GLY | 0 | 0.020 | 0.013 | 32.115 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
| 480 | X | 1054 | ARG | 1 | 0.859 | 0.928 | 28.494 | 10.840 | 10.840 | 0.000 | 0.000 | 0.000 | 0.000 |
| 481 | X | 1055 | PRO | 0 | 0.018 | 0.014 | 35.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 482 | X | 1056 | MET | 0 | 0.002 | 0.017 | 35.248 | -0.383 | -0.383 | 0.000 | 0.000 | 0.000 | 0.000 |
| 483 | X | 1057 | PRO | 0 | 0.020 | 0.015 | 36.115 | 0.319 | 0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
| 484 | X | 1058 | GLY | 0 | 0.053 | 0.012 | 38.962 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
| 485 | X | 1059 | LEU | 0 | -0.002 | -0.026 | 40.649 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
| 486 | X | 1060 | VAL | 0 | -0.040 | -0.014 | 41.832 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 487 | X | 1061 | GLN | 0 | 0.004 | 0.008 | 40.395 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
| 488 | X | 1062 | TYR | 0 | -0.024 | -0.044 | 33.381 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 489 | X | 1063 | LEU | 0 | -0.043 | -0.015 | 38.585 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
| 490 | X | 1064 | LYS | 1 | 0.781 | 0.879 | 38.674 | 8.319 | 8.319 | 0.000 | 0.000 | 0.000 | 0.000 |
| 491 | X | 1065 | ILE | 0 | -0.007 | 0.022 | 42.697 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
| 492 | X | 1066 | PRO | 0 | 0.019 | 0.016 | 46.269 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 493 | X | 1067 | ALA | 0 | 0.029 | 0.020 | 48.195 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 494 | X | 1068 | THR | 0 | -0.038 | -0.035 | 49.915 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
| 495 | X | 1069 | VAL | 0 | 0.008 | -0.003 | 53.583 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
| 496 | X | 1070 | VAL | 0 | -0.019 | -0.011 | 56.307 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
| 497 | X | 1071 | ASP | -1 | -0.826 | -0.889 | 59.918 | -5.254 | -5.254 | 0.000 | 0.000 | 0.000 | 0.000 |
| 498 | X | 1072 | SER | 0 | -0.026 | -0.028 | 62.573 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 499 | X | 1073 | ASP | -1 | -0.896 | -0.948 | 65.451 | -4.797 | -4.797 | 0.000 | 0.000 | 0.000 | 0.000 |
| 500 | X | 1074 | GLY | 0 | -0.060 | -0.032 | 64.580 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 501 | X | 1075 | ALA | 0 | 0.004 | 0.009 | 63.828 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 502 | X | 1076 | TRP | 0 | 0.000 | -0.002 | 55.455 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 503 | X | 1077 | GLN | 0 | -0.019 | -0.021 | 58.258 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 504 | X | 1078 | PHE | 0 | 0.057 | 0.020 | 49.694 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 505 | X | 1079 | LEU | 0 | -0.025 | -0.007 | 50.533 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
| 506 | X | 1080 | PRO | 0 | 0.032 | 0.024 | 50.497 | -0.166 | -0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
| 507 | X | 1081 | ASP | -1 | -0.756 | -0.855 | 44.222 | -7.409 | -7.409 | 0.000 | 0.000 | 0.000 | 0.000 |
| 508 | X | 1082 | VAL | 0 | -0.017 | 0.001 | 47.493 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
| 509 | X | 1083 | ALA | 0 | 0.074 | 0.022 | 46.234 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
| 510 | X | 1084 | SER | 0 | -0.036 | -0.022 | 45.649 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
| 511 | X | 1085 | SER | 0 | -0.007 | -0.006 | 45.048 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
| 512 | X | 1086 | ARG | 1 | 0.711 | 0.825 | 41.261 | 7.275 | 7.275 | 0.000 | 0.000 | 0.000 | 0.000 |
| 513 | X | 1087 | VAL | 0 | -0.008 | -0.002 | 40.994 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
| 514 | X | 1088 | PRO | 0 | 0.017 | -0.002 | 36.482 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
| 515 | X | 1089 | ILE | 0 | -0.045 | -0.018 | 35.939 | 0.277 | 0.277 | 0.000 | 0.000 | 0.000 | 0.000 |
| 516 | X | 1090 | GLU | -1 | -0.952 | -0.962 | 37.955 | -7.447 | -7.447 | 0.000 | 0.000 | 0.000 | 0.000 |
| 517 | X | 1091 | VAL | 0 | -0.030 | -0.017 | 34.855 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
| 518 | X | 1092 | THR | 0 | -0.037 | -0.010 | 37.901 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
| 519 | X | 1093 | GLU | -1 | -0.869 | -0.937 | 31.586 | -10.113 | -10.113 | 0.000 | 0.000 | 0.000 | 0.000 |
| 520 | X | 1094 | LEU | 0 | -0.015 | -0.001 | 29.495 | 0.163 | 0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
| 521 | X | 1095 | GLU | -1 | -0.840 | -0.916 | 32.946 | -8.961 | -8.961 | 0.000 | 0.000 | 0.000 | 0.000 |
| 522 | X | 1096 | ASN | 0 | -0.057 | -0.039 | 31.633 | -0.151 | -0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
| 523 | X | 1097 | TRP | 0 | 0.004 | 0.010 | 25.356 | -0.405 | -0.405 | 0.000 | 0.000 | 0.000 | 0.000 |
| 524 | X | 1098 | GLN | 0 | -0.026 | -0.022 | 25.234 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
| 525 | X | 1099 | VAL | 0 | 0.021 | 0.017 | 24.027 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
| 526 | X | 1100 | LEU | 0 | -0.018 | -0.010 | 20.300 | -0.385 | -0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
| 527 | X | 1101 | THR | 0 | 0.035 | 0.021 | 19.625 | -0.665 | -0.665 | 0.000 | 0.000 | 0.000 | 0.000 |
| 528 | X | 1102 | PRO | 0 | -0.082 | -0.050 | 16.248 | 0.403 | 0.403 | 0.000 | 0.000 | 0.000 | 0.000 |
| 529 | X | 1103 | PRO | 0 | -0.021 | 0.005 | 19.081 | 0.310 | 0.310 | 0.000 | 0.000 | 0.000 | 0.000 |
| 530 | X | 1104 | GLN | 0 | 0.032 | 0.008 | 20.590 | 0.662 | 0.662 | 0.000 | 0.000 | 0.000 | 0.000 |
| 531 | X | 1105 | GLY | 0 | -0.023 | -0.005 | 19.690 | -0.708 | -0.708 | 0.000 | 0.000 | 0.000 | 0.000 |
| 532 | X | 1106 | LYS | 1 | 0.973 | 0.984 | 12.766 | 22.158 | 22.158 | 0.000 | 0.000 | 0.000 | 0.000 |
| 533 | X | 1107 | ILE | 0 | 0.013 | 0.027 | 10.876 | -0.557 | -0.557 | 0.000 | 0.000 | 0.000 | 0.000 |
| 534 | X | 1108 | LEU | 0 | 0.004 | 0.005 | 10.284 | -0.657 | -0.657 | 0.000 | 0.000 | 0.000 | 0.000 |
| 535 | X | 1109 | GLY | 0 | 0.002 | -0.018 | 7.335 | -2.680 | -2.680 | 0.000 | 0.000 | 0.000 | 0.000 |
| 536 | X | 1110 | LEU | 0 | 0.003 | 0.018 | 7.200 | -0.253 | -0.253 | 0.000 | 0.000 | 0.000 | 0.000 |
| 541 | X | 1115 | LEU | 0 | 0.064 | 0.049 | 6.594 | -1.214 | -1.214 | 0.000 | 0.000 | 0.000 | 0.000 |
| 542 | X | 1116 | THR | 0 | -0.046 | -0.023 | 8.505 | -2.877 | -2.877 | 0.000 | 0.000 | 0.000 | 0.000 |
| 543 | X | 1117 | ALA | 0 | 0.020 | 0.007 | 9.519 | 0.514 | 0.514 | 0.000 | 0.000 | 0.000 | 0.000 |
| 544 | X | 1118 | GLY | 0 | 0.003 | 0.009 | 12.711 | -0.377 | -0.377 | 0.000 | 0.000 | 0.000 | 0.000 |
| 545 | X | 1119 | PHE | 0 | -0.017 | -0.017 | 14.597 | -1.092 | -1.092 | 0.000 | 0.000 | 0.000 | 0.000 |
| 546 | X | 1120 | PRO | 0 | 0.004 | 0.020 | 15.090 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
| 547 | X | 1121 | THR | 0 | 0.029 | 0.006 | 17.692 | 0.798 | 0.798 | 0.000 | 0.000 | 0.000 | 0.000 |
| 548 | X | 1122 | GLU | -1 | -0.715 | -0.836 | 21.481 | -12.723 | -12.723 | 0.000 | 0.000 | 0.000 | 0.000 |
| 549 | X | 1123 | GLN | 0 | -0.011 | 0.000 | 23.647 | 0.356 | 0.356 | 0.000 | 0.000 | 0.000 | 0.000 |
| 550 | X | 1124 | SER | 0 | -0.069 | -0.049 | 18.619 | -0.396 | -0.396 | 0.000 | 0.000 | 0.000 | 0.000 |
| 551 | X | 1125 | ARG | 1 | 0.734 | 0.787 | 19.421 | 14.112 | 14.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 552 | X | 1126 | LEU | 0 | 0.028 | 0.033 | 21.500 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 553 | X | 1127 | PRO | 0 | 0.040 | 0.015 | 20.930 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
| 554 | X | 1128 | LEU | 0 | -0.035 | -0.012 | 17.203 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
| 555 | X | 1129 | LEU | 0 | -0.017 | -0.013 | 21.122 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
| 556 | X | 1130 | GLU | -1 | -0.895 | -0.931 | 24.563 | -11.651 | -11.651 | 0.000 | 0.000 | 0.000 | 0.000 |
| 557 | X | 1131 | ASN | 0 | -0.031 | -0.013 | 22.302 | 0.746 | 0.746 | 0.000 | 0.000 | 0.000 | 0.000 |
| 558 | X | 1132 | SER | 0 | -0.081 | -0.046 | 23.626 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
| 559 | X | 1133 | VAL | 0 | -0.018 | 0.002 | 24.468 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
| 560 | X | 1134 | SER | 0 | 0.004 | -0.021 | 28.149 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
| 561 | X | 1135 | GLU | -1 | -0.867 | -0.945 | 30.809 | -9.900 | -9.900 | 0.000 | 0.000 | 0.000 | 0.000 |
| 562 | X | 1136 | ASP | -1 | -0.880 | -0.919 | 33.007 | -9.041 | -9.041 | 0.000 | 0.000 | 0.000 | 0.000 |
| 563 | X | 1137 | LEU | 0 | 0.004 | 0.014 | 32.810 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
| 564 | X | 1138 | ARG | 1 | 0.833 | 0.913 | 27.445 | 10.695 | 10.695 | 0.000 | 0.000 | 0.000 | 0.000 |
| 565 | X | 1139 | GLU | -1 | -0.823 | -0.914 | 32.488 | -9.138 | -9.138 | 0.000 | 0.000 | 0.000 | 0.000 |
| 566 | X | 1140 | GLU | -1 | -0.848 | -0.937 | 35.321 | -8.577 | -8.577 | 0.000 | 0.000 | 0.000 | 0.000 |
| 567 | X | 1141 | LEU | 0 | -0.025 | -0.003 | 27.620 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 568 | X | 1142 | MET | 0 | -0.011 | -0.015 | 28.730 | -0.260 | -0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
| 569 | X | 1143 | GLN | 0 | -0.011 | 0.003 | 32.181 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
| 570 | X | 1144 | LYS | 1 | 0.855 | 0.923 | 33.187 | 8.934 | 8.934 | 0.000 | 0.000 | 0.000 | 0.000 |
| 571 | X | 1145 | ILE | 0 | -0.017 | -0.015 | 27.942 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
| 572 | X | 1146 | ASP | -1 | -0.899 | -0.937 | 31.200 | -8.959 | -8.959 | 0.000 | 0.000 | 0.000 | 0.000 |
| 573 | X | 1147 | ALA | 0 | 0.032 | 0.007 | 33.679 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
| 574 | X | 1148 | ILE | 0 | -0.051 | -0.033 | 30.857 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
| 575 | X | 1149 | LYS | 1 | 0.823 | 0.895 | 26.147 | 11.518 | 11.518 | 0.000 | 0.000 | 0.000 | 0.000 |
| 576 | X | 1150 | ASN | 0 | -0.018 | -0.003 | 32.243 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
| 577 | X | 1151 | ASP | -1 | -0.735 | -0.830 | 35.536 | -7.910 | -7.910 | 0.000 | 0.000 | 0.000 | 0.000 |
| 578 | X | 1152 | VAL | 0 | 0.017 | 0.004 | 36.350 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
| 579 | X | 1153 | LYS | 1 | 0.910 | 0.964 | 38.140 | 7.351 | 7.351 | 0.000 | 0.000 | 0.000 | 0.000 |
| 580 | X | 1154 | MET | 0 | 0.005 | 0.010 | 32.769 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
| 581 | X | 1155 | ASN | 0 | -0.032 | -0.045 | 33.138 | -0.393 | -0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
| 582 | X | 1156 | SER | 0 | -0.074 | -0.040 | 34.446 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
| 583 | X | 1157 | LEU | 0 | -0.083 | -0.038 | 32.618 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
| 584 | X | 1158 | VAL | 0 | -0.034 | 0.001 | 29.140 | -0.306 | -0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
| 585 | X | 1159 | CYS | 0 | -0.069 | -0.032 | 26.176 | 0.506 | 0.506 | 0.000 | 0.000 | 0.000 | 0.000 |
| 586 | X | 1160 | MET | 0 | -0.003 | -0.019 | 25.797 | -0.365 | -0.365 | 0.000 | 0.000 | 0.000 | 0.000 |
| 587 | X | 1161 | GLU | -1 | -0.925 | -0.946 | 25.765 | -10.085 | -10.085 | 0.000 | 0.000 | 0.000 | 0.000 |
| 588 | X | 1162 | ALA | 0 | 0.006 | -0.002 | 22.591 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 589 | X | 1163 | GLY | 0 | 0.002 | 0.013 | 24.398 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
| 590 | X | 1164 | SER | 0 | -0.040 | -0.027 | 25.678 | 0.437 | 0.437 | 0.000 | 0.000 | 0.000 | 0.000 |
| 591 | X | 1166 | ASP | -1 | -0.840 | -0.918 | 26.449 | -11.252 | -11.252 | 0.000 | 0.000 | 0.000 | 0.000 |
| 592 | X | 1167 | SER | 0 | -0.044 | -0.011 | 28.045 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
| 593 | X | 1168 | VAL | 0 | 0.034 | 0.009 | 28.678 | 0.323 | 0.323 | 0.000 | 0.000 | 0.000 | 0.000 |
| 594 | X | 1169 | SER | 0 | 0.053 | 0.036 | 27.116 | 0.311 | 0.311 | 0.000 | 0.000 | 0.000 | 0.000 |
| 595 | X | 1170 | PRO | 0 | 0.013 | -0.009 | 29.231 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
| 596 | X | 1171 | LYS | 1 | 0.900 | 0.965 | 32.750 | 9.068 | 9.068 | 0.000 | 0.000 | 0.000 | 0.000 |
| 597 | X | 1172 | VAL | 0 | 0.037 | 0.019 | 29.446 | 0.235 | 0.235 | 0.000 | 0.000 | 0.000 | 0.000 |
| 598 | X | 1173 | ALA | 0 | 0.035 | 0.014 | 31.472 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
| 599 | X | 1174 | ALA | 0 | -0.032 | -0.014 | 32.995 | 0.192 | 0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
| 600 | X | 1175 | ARG | 1 | 0.808 | 0.873 | 35.306 | 8.241 | 8.241 | 0.000 | 0.000 | 0.000 | 0.000 |
| 601 | X | 1176 | LEU | 0 | 0.032 | 0.003 | 30.564 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
| 602 | X | 1177 | LYS | 1 | 0.994 | 1.010 | 35.298 | 7.854 | 7.854 | 0.000 | 0.000 | 0.000 | 0.000 |
| 603 | X | 1178 | ASP | -1 | -0.962 | -0.985 | 38.130 | -7.484 | -7.484 | 0.000 | 0.000 | 0.000 | 0.000 |
| 604 | X | 1179 | MET | 0 | -0.132 | -0.060 | 36.196 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
| 605 | X | 1180 | GLY | 0 | -0.007 | 0.005 | 39.579 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
| 606 | X | 1181 | LEU | 0 | -0.058 | -0.029 | 34.223 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
| 607 | X | 1182 | GLU | -1 | -0.906 | -0.946 | 34.849 | -8.335 | -8.335 | 0.000 | 0.000 | 0.000 | 0.000 |
| 608 | X | 1183 | ALA | 0 | -0.016 | -0.014 | 33.289 | -0.318 | -0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
| 609 | X | 1184 | GLY | 0 | -0.016 | -0.005 | 29.498 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 610 | X | 1185 | MET | 0 | -0.048 | -0.027 | 26.479 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
| 611 | X | 1186 | GLY | 0 | -0.009 | 0.007 | 26.299 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
| 612 | X | 1187 | ALA | 0 | -0.030 | -0.017 | 20.902 | -0.280 | -0.280 | 0.000 | 0.000 | 0.000 | 0.000 |
| 613 | X | 1188 | SER | 0 | -0.006 | -0.023 | 20.859 | 0.448 | 0.448 | 0.000 | 0.000 | 0.000 | 0.000 |
| 614 | X | 1189 | ILE | 0 | -0.050 | -0.007 | 12.771 | -0.599 | -0.599 | 0.000 | 0.000 | 0.000 | 0.000 |
| 615 | X | 1190 | THR | 0 | 0.008 | -0.021 | 15.785 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
| 616 | X | 1191 | TRP | 0 | -0.019 | -0.014 | 10.797 | -1.844 | -1.844 | 0.000 | 0.000 | 0.000 | 0.000 |
| 617 | X | 1192 | TRP | 0 | 0.031 | 0.003 | 10.584 | 1.887 | 1.887 | 0.000 | 0.000 | 0.000 | 0.000 |
| 618 | X | 1193 | ARG | 1 | 0.869 | 0.916 | 10.719 | 14.036 | 14.036 | 0.000 | 0.000 | 0.000 | 0.000 |
| 619 | X | 1194 | ARG | 1 | 0.826 | 0.904 | 11.004 | 17.948 | 17.948 | 0.000 | 0.000 | 0.000 | 0.000 |
| 620 | X | 1195 | GLU | -1 | -0.764 | -0.837 | 12.811 | -14.965 | -14.965 | 0.000 | 0.000 | 0.000 | 0.000 |
| 621 | X | 1196 | GLY | 0 | 0.014 | 0.002 | 16.292 | -0.341 | -0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
| 622 | X | 1197 | GLY | 0 | 0.032 | 0.002 | 18.886 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
| 623 | X | 1198 | MET | 0 | -0.063 | -0.014 | 12.475 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
| 624 | X | 1199 | GLU | -1 | -0.882 | -0.925 | 16.019 | -13.416 | -13.416 | 0.000 | 0.000 | 0.000 | 0.000 |
| 625 | X | 1200 | PHE | 0 | -0.029 | -0.040 | 9.790 | -1.286 | -1.286 | 0.000 | 0.000 | 0.000 | 0.000 |
| 626 | X | 1201 | SER | 0 | -0.017 | -0.030 | 15.258 | 0.454 | 0.454 | 0.000 | 0.000 | 0.000 | 0.000 |
| 627 | X | 1202 | HIS | 0 | -0.009 | -0.016 | 14.980 | -1.525 | -1.525 | 0.000 | 0.000 | 0.000 | 0.000 |
| 628 | X | 1203 | GLN | 0 | -0.034 | -0.018 | 14.886 | 0.804 | 0.804 | 0.000 | 0.000 | 0.000 | 0.000 |
| 629 | X | 1204 | MET | 0 | -0.020 | -0.002 | 16.008 | -0.779 | -0.779 | 0.000 | 0.000 | 0.000 | 0.000 |
| 630 | X | 1205 | HIS | 0 | -0.023 | -0.021 | 18.207 | 0.264 | 0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
| 631 | X | 1206 | THR | 0 | -0.030 | -0.037 | 20.044 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 632 | X | 1207 | THR | 0 | -0.008 | -0.008 | 22.240 | 0.213 | 0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
| 633 | X | 1208 | ALA | 0 | 0.022 | 0.021 | 24.394 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
| 634 | X | 1209 | SER | 0 | 0.005 | -0.019 | 25.996 | -0.418 | -0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
| 635 | X | 1210 | PHE | 0 | 0.010 | 0.025 | 27.905 | 0.377 | 0.377 | 0.000 | 0.000 | 0.000 | 0.000 |
| 636 | X | 1211 | LYS | 1 | 0.870 | 0.922 | 29.171 | 10.171 | 10.171 | 0.000 | 0.000 | 0.000 | 0.000 |
| 637 | X | 1212 | PHE | 0 | 0.010 | -0.008 | 30.155 | 0.302 | 0.302 | 0.000 | 0.000 | 0.000 | 0.000 |
| 638 | X | 1213 | ALA | 0 | 0.054 | 0.029 | 29.927 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
| 639 | X | 1214 | GLY | 0 | -0.003 | 0.007 | 29.976 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
| 640 | X | 1215 | LYS | 1 | 0.866 | 0.929 | 23.070 | 12.900 | 12.900 | 0.000 | 0.000 | 0.000 | 0.000 |
| 641 | X | 1216 | GLU | -1 | -0.748 | -0.856 | 25.464 | -10.958 | -10.958 | 0.000 | 0.000 | 0.000 | 0.000 |
| 642 | X | 1217 | PHE | 0 | 0.002 | -0.003 | 24.539 | -0.756 | -0.756 | 0.000 | 0.000 | 0.000 | 0.000 |
| 643 | X | 1218 | ALA | 0 | 0.003 | 0.004 | 22.463 | 0.423 | 0.423 | 0.000 | 0.000 | 0.000 | 0.000 |
| 644 | X | 1219 | VAL | 0 | -0.020 | -0.015 | 24.454 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
| 645 | X | 1220 | ASP | -1 | -0.703 | -0.830 | 21.882 | -13.112 | -13.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 646 | X | 1221 | ALA | 0 | 0.025 | 0.005 | 25.206 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
| 647 | X | 1222 | SER | 0 | -0.022 | -0.026 | 24.620 | 0.215 | 0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
| 648 | X | 1223 | HIS | 0 | 0.030 | 0.032 | 20.665 | -0.931 | -0.931 | 0.000 | 0.000 | 0.000 | 0.000 |
| 649 | X | 1224 | LEU | 0 | -0.010 | -0.004 | 20.988 | -0.589 | -0.589 | 0.000 | 0.000 | 0.000 | 0.000 |
| 650 | X | 1225 | GLN | 0 | -0.006 | -0.001 | 21.656 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
| 651 | X | 1226 | PHE | 0 | 0.004 | 0.003 | 17.010 | -0.419 | -0.419 | 0.000 | 0.000 | 0.000 | 0.000 |
| 652 | X | 1227 | VAL | 0 | -0.024 | -0.006 | 14.750 | 0.327 | 0.327 | 0.000 | 0.000 | 0.000 | 0.000 |
| 653 | X | 1228 | HIS | 1 | 0.886 | 0.937 | 17.198 | 12.411 | 12.411 | 0.000 | 0.000 | 0.000 | 0.000 |
| 654 | X | 1229 | ASP | -1 | -0.815 | -0.915 | 19.294 | -13.283 | -13.283 | 0.000 | 0.000 | 0.000 | 0.000 |
| 655 | X | 1230 | GLN | 0 | -0.028 | -0.011 | 21.099 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
| 656 | X | 1231 | LEU | 0 | -0.050 | -0.014 | 24.406 | 0.484 | 0.484 | 0.000 | 0.000 | 0.000 | 0.000 |
| 657 | X | 1232 | ASP | -1 | -0.799 | -0.861 | 21.648 | -13.649 | -13.649 | 0.000 | 0.000 | 0.000 | 0.000 |
| 658 | X | 1233 | THR | 0 | -0.005 | 0.007 | 24.347 | 0.595 | 0.595 | 0.000 | 0.000 | 0.000 | 0.000 |
| 659 | X | 1234 | THR | 0 | 0.042 | 0.011 | 25.563 | -0.422 | -0.422 | 0.000 | 0.000 | 0.000 | 0.000 |
| 660 | X | 1235 | ILE | 0 | -0.019 | -0.005 | 27.016 | -0.191 | -0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
| 661 | X | 1236 | LEU | 0 | -0.038 | -0.002 | 19.438 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
| 662 | X | 1237 | ILE | 0 | 0.005 | -0.012 | 24.027 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
| 663 | X | 1238 | LEU | 0 | -0.015 | 0.001 | 18.454 | -0.222 | -0.222 | 0.000 | 0.000 | 0.000 | 0.000 |
| 664 | X | 1239 | PRO | 0 | 0.058 | 0.036 | 20.727 | 0.471 | 0.471 | 0.000 | 0.000 | 0.000 | 0.000 |
| 665 | X | 1240 | VAL | 0 | 0.001 | -0.008 | 20.413 | -0.739 | -0.739 | 0.000 | 0.000 | 0.000 | 0.000 |
| 666 | X | 1241 | ASP | -1 | -0.830 | -0.896 | 16.434 | -17.584 | -17.584 | 0.000 | 0.000 | 0.000 | 0.000 |
| 667 | X | 1242 | ASP | -1 | -0.863 | -0.940 | 15.839 | -18.927 | -18.927 | 0.000 | 0.000 | 0.000 | 0.000 |
| 668 | X | 1243 | TRP | 0 | -0.057 | -0.035 | 16.170 | -1.052 | -1.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 669 | X | 1244 | ALA | 0 | 0.032 | 0.017 | 15.370 | -0.570 | -0.570 | 0.000 | 0.000 | 0.000 | 0.000 |
| 670 | X | 1245 | LEU | 0 | -0.028 | -0.016 | 10.888 | -1.848 | -1.848 | 0.000 | 0.000 | 0.000 | 0.000 |
| 671 | X | 1246 | GLU | -1 | -0.716 | -0.835 | 11.720 | -18.190 | -18.190 | 0.000 | 0.000 | 0.000 | 0.000 |
| 672 | X | 1247 | ILE | 0 | 0.006 | 0.002 | 13.425 | -0.637 | -0.637 | 0.000 | 0.000 | 0.000 | 0.000 |
| 673 | X | 1248 | ALA | 0 | 0.019 | 0.005 | 9.671 | -0.403 | -0.403 | 0.000 | 0.000 | 0.000 | 0.000 |
| 674 | X | 1249 | GLN | 0 | -0.088 | -0.050 | 8.084 | -0.825 | -0.825 | 0.000 | 0.000 | 0.000 | 0.000 |
| 675 | X | 1250 | ARG | 1 | 0.746 | 0.837 | 9.723 | 15.567 | 15.567 | 0.000 | 0.000 | 0.000 | 0.000 |
| 676 | X | 1251 | ASN | 0 | -0.042 | -0.016 | 12.467 | 0.981 | 0.981 | 0.000 | 0.000 | 0.000 | 0.000 |
| 677 | X | 1252 | ARG | 1 | 0.844 | 0.929 | 6.244 | 28.112 | 28.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 678 | X | 1253 | ALA | 0 | 0.055 | 0.044 | 8.160 | -0.971 | -0.971 | 0.000 | 0.000 | 0.000 | 0.000 |
| 679 | X | 1254 | ILE | 0 | -0.046 | -0.034 | 5.982 | -4.812 | -4.812 | 0.000 | 0.000 | 0.000 | 0.000 |
| 680 | X | 1255 | ASN | 0 | -0.093 | -0.071 | 6.453 | -0.663 | -0.663 | 0.000 | 0.000 | 0.000 | 0.000 |
| 681 | X | 1256 | PRO | 0 | 0.004 | 0.011 | 7.760 | 2.006 | 2.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 682 | X | 1257 | PHE | 0 | -0.001 | -0.004 | 10.830 | -1.126 | -1.126 | 0.000 | 0.000 | 0.000 | 0.000 |
| 683 | X | 1258 | VAL | 0 | 0.030 | 0.006 | 14.283 | 0.489 | 0.489 | 0.000 | 0.000 | 0.000 | 0.000 |
| 684 | X | 1259 | GLU | -1 | -0.762 | -0.872 | 17.252 | -13.145 | -13.145 | 0.000 | 0.000 | 0.000 | 0.000 |
| 685 | X | 1260 | TYR | 0 | -0.073 | -0.059 | 17.927 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 686 | X | 1261 | VAL | 0 | 0.061 | 0.021 | 23.124 | 0.551 | 0.551 | 0.000 | 0.000 | 0.000 | 0.000 |
| 687 | X | 1262 | SER | 0 | -0.057 | 0.007 | 24.402 | -0.354 | -0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
| 688 | X | 1263 | LYS | 1 | 0.799 | 0.891 | 22.092 | 13.051 | 13.051 | 0.000 | 0.000 | 0.000 | 0.000 |
| 689 | X | 1264 | THR | 0 | -0.007 | -0.037 | 26.718 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
| 690 | X | 1265 | GLY | 0 | 0.042 | 0.022 | 28.684 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
| 691 | X | 1266 | ASN | 0 | 0.017 | -0.006 | 27.796 | -0.415 | -0.415 | 0.000 | 0.000 | 0.000 | 0.000 |
| 692 | X | 1267 | MET | 0 | -0.004 | -0.001 | 26.871 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
| 693 | X | 1268 | LEU | 0 | 0.016 | 0.026 | 22.722 | -0.434 | -0.434 | 0.000 | 0.000 | 0.000 | 0.000 |
| 694 | X | 1269 | ALA | 0 | 0.075 | 0.024 | 23.045 | -0.508 | -0.508 | 0.000 | 0.000 | 0.000 | 0.000 |
| 695 | X | 1270 | LEU | 0 | -0.026 | -0.011 | 23.273 | -0.251 | -0.251 | 0.000 | 0.000 | 0.000 | 0.000 |
| 696 | X | 1271 | PHE | 0 | -0.004 | 0.011 | 19.118 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
| 697 | X | 1272 | MET | 0 | -0.019 | 0.007 | 17.642 | -0.561 | -0.561 | 0.000 | 0.000 | 0.000 | 0.000 |
| 698 | X | 1273 | PRO | 0 | -0.004 | 0.009 | 13.133 | 0.332 | 0.332 | 0.000 | 0.000 | 0.000 | 0.000 |
| 699 | X | 1274 | PRO | 0 | 0.049 | 0.032 | 15.102 | 0.686 | 0.686 | 0.000 | 0.000 | 0.000 | 0.000 |
| 700 | X | 1275 | LEU | 0 | 0.040 | 0.026 | 15.603 | -1.028 | -1.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 701 | X | 1276 | PHE | 0 | 0.024 | 0.024 | 13.845 | -0.352 | -0.352 | 0.000 | 0.000 | 0.000 | 0.000 |
| 702 | X | 1277 | THR | 0 | -0.012 | -0.017 | 11.308 | -1.209 | -1.209 | 0.000 | 0.000 | 0.000 | 0.000 |
| 703 | X | 1278 | LYS | 1 | 0.920 | 0.985 | 11.172 | 13.886 | 13.886 | 0.000 | 0.000 | 0.000 | 0.000 |
| 704 | X | 1279 | PRO | 0 | -0.056 | -0.028 | 9.078 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
| 705 | X | 1280 | ARG | 1 | 0.800 | 0.876 | 11.290 | 18.585 | 18.585 | 0.000 | 0.000 | 0.000 | 0.000 |
| 706 | X | 1281 | LEU | 0 | 0.016 | 0.004 | 12.168 | -1.207 | -1.207 | 0.000 | 0.000 | 0.000 | 0.000 |
| 707 | X | 1282 | THR | 0 | -0.013 | -0.040 | 13.448 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
| 708 | X | 1283 | ARG | 1 | 0.877 | 0.962 | 15.275 | 13.357 | 13.357 | 0.000 | 0.000 | 0.000 | 0.000 |
| 709 | X | 1284 | ALA | 0 | 0.011 | 0.006 | 18.651 | 0.390 | 0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
| 710 | X | 1285 | LEU | -1 | -0.933 | -0.941 | 20.745 | -12.851 | -12.851 | 0.000 | 0.000 | 0.000 | 0.000 |