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: YZ5V2
Calculation Name: 2NLK-A-Xray372
Preferred Name: Receptor-type tyrosine-protein phosphatase gamma
Target Type: SINGLE PROTEIN
Ligand Name:
Ligand 3-letter code:
Ligand of Interest (LOI):
Structure Source: PDB
PDB ID: 2NLK
Chain ID: A
ChEMBL ID: CHEMBL4905
UniProt ID: P23470
Base Structure: X-ray
Registration Date: 2023-09-20
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Apendix: None
Modeling method
| Optimization | MOE:Amber10:EHT |
|---|---|
| Restraint | OptH |
| Protonation | MOE:Protonate 3D |
| Complement | MOE:Structure Preparation |
| Water | No |
| Procedure | Auto-FMO protocol ver. 2.20220422 |
| Remarks |
FMO calculation
| FMO method | FMO2-MP2/6-31G(d) |
|---|---|
| Fragmentation | Auto |
| Number of fragment | 563 |
| LigandResidueName | |
| LigandFragmentNumber | 0 |
| LigandCharge | CYM=-1 |
| Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
| FMO2-HF: Electronic energy | -12347230.351093 |
|---|---|
| FMO2-HF: Nuclear repulsion | 12118559.668351 |
| FMO2-HF: Total energy | -228670.682742 |
| FMO2-MP2: Total energy | -229334.169881 |
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(A:827:ALA)
Summations of interaction energy for
fragment #1(A:827:ALA)
| 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. |
| -8.399 | -2.491 | 3.847 | -4.115 | -5.641 | -0.015 |
Interaction energy analysis for fragmet #1(A:827:ALA)
| 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 | A | 829 | PRO | 0 | 0.009 | -0.006 | 3.860 | 0.771 | 2.144 | -0.014 | -0.645 | -0.714 | 0.001 |
| 4 | A | 830 | VAL | 0 | 0.066 | 0.015 | 6.490 | -0.632 | -0.632 | 0.000 | 0.000 | 0.000 | 0.000 |
| 5 | A | 831 | LYS | 1 | 0.909 | 0.956 | 8.549 | -0.460 | -0.460 | 0.000 | 0.000 | 0.000 | 0.000 |
| 6 | A | 832 | GLN | 0 | -0.033 | -0.016 | 8.303 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 7 | A | 833 | PHE | 0 | 0.062 | 0.023 | 7.030 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
| 8 | A | 834 | VAL | 0 | 0.040 | 0.011 | 10.404 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
| 9 | A | 835 | LYS | 1 | 0.816 | 0.899 | 11.838 | 0.322 | 0.322 | 0.000 | 0.000 | 0.000 | 0.000 |
| 10 | A | 836 | HIS | 0 | 0.013 | 0.006 | 7.120 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 11 | A | 837 | ILE | 0 | -0.006 | -0.004 | 10.619 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
| 12 | A | 838 | GLY | 0 | 0.025 | 0.020 | 13.016 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 13 | A | 839 | GLU | -1 | -0.817 | -0.907 | 12.151 | -0.387 | -0.387 | 0.000 | 0.000 | 0.000 | 0.000 |
| 14 | A | 840 | LEU | 0 | -0.050 | -0.007 | 9.905 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 15 | A | 841 | TYR | 0 | -0.035 | -0.073 | 14.120 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 16 | A | 842 | SER | 0 | -0.089 | -0.021 | 17.317 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
| 17 | A | 843 | ASN | 0 | -0.005 | -0.017 | 18.888 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 18 | A | 844 | ASN | 0 | 0.002 | -0.013 | 20.949 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 19 | A | 845 | GLN | 0 | 0.010 | 0.012 | 18.298 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 20 | A | 846 | HIS | 0 | 0.038 | 0.036 | 17.329 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 21 | A | 847 | GLY | 0 | 0.038 | 0.019 | 14.136 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 22 | A | 848 | PHE | 0 | 0.010 | -0.025 | 12.933 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
| 23 | A | 849 | SER | 0 | -0.006 | 0.010 | 14.734 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 24 | A | 850 | GLU | -1 | -0.927 | -0.962 | 14.810 | -0.295 | -0.295 | 0.000 | 0.000 | 0.000 | 0.000 |
| 25 | A | 851 | ASP | -1 | -0.850 | -0.915 | 9.811 | -0.675 | -0.675 | 0.000 | 0.000 | 0.000 | 0.000 |
| 26 | A | 852 | PHE | 0 | -0.067 | -0.048 | 12.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 27 | A | 853 | GLU | -1 | -0.876 | -0.941 | 14.832 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
| 28 | A | 854 | GLU | -1 | -0.807 | -0.869 | 10.804 | -0.595 | -0.595 | 0.000 | 0.000 | 0.000 | 0.000 |
| 29 | A | 855 | VAL | 0 | -0.060 | -0.058 | 11.651 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 30 | A | 856 | GLN | 0 | -0.024 | -0.008 | 14.080 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 31 | A | 857 | ARG | 1 | 0.935 | 0.971 | 17.427 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
| 32 | A | 858 | CYS | 0 | -0.097 | -0.027 | 14.038 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 33 | A | 859 | THR | 0 | 0.011 | -0.021 | 16.056 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 34 | A | 860 | ALA | 0 | -0.037 | -0.008 | 18.432 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 35 | A | 861 | ASP | -1 | -0.852 | -0.932 | 20.277 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
| 36 | A | 862 | MET | 0 | -0.109 | -0.044 | 15.331 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 37 | A | 863 | ASN | 0 | -0.045 | -0.006 | 21.468 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 38 | A | 864 | ILE | 0 | -0.020 | -0.001 | 19.318 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 39 | A | 865 | THR | 0 | 0.035 | 0.016 | 24.034 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 40 | A | 866 | ALA | 0 | 0.010 | -0.018 | 26.715 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 41 | A | 867 | GLU | -1 | -0.917 | -0.961 | 28.980 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 42 | A | 868 | HIS | 0 | -0.102 | -0.057 | 31.642 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 43 | A | 869 | SER | 0 | 0.011 | -0.015 | 30.218 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 44 | A | 870 | ASN | 0 | 0.028 | 0.016 | 31.707 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 45 | A | 871 | HIS | 0 | 0.038 | 0.048 | 34.654 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 46 | A | 872 | PRO | 0 | 0.040 | 0.000 | 37.603 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 47 | A | 873 | GLU | -1 | -0.833 | -0.919 | 40.654 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 48 | A | 874 | ASN | 0 | -0.032 | -0.045 | 35.853 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 49 | A | 875 | LYS | 1 | 0.997 | 1.010 | 36.851 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 50 | A | 876 | HIS | 0 | -0.005 | -0.016 | 37.804 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 51 | A | 877 | LYS | 1 | 0.814 | 0.914 | 36.219 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 52 | A | 878 | ASN | 0 | 0.007 | 0.018 | 33.143 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 53 | A | 879 | ARG | 1 | 0.814 | 0.922 | 31.848 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 54 | A | 880 | TYR | 0 | -0.022 | -0.038 | 30.191 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 55 | A | 881 | ILE | 0 | 0.001 | 0.000 | 32.219 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 56 | A | 882 | ASN | 0 | 0.053 | 0.019 | 28.767 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 57 | A | 883 | ILE | 0 | -0.061 | -0.014 | 25.822 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 58 | A | 884 | LEU | 0 | -0.005 | 0.014 | 27.101 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 59 | A | 885 | ALA | 0 | -0.027 | -0.023 | 25.948 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 60 | A | 886 | TYR | 0 | 0.005 | 0.001 | 20.357 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 61 | A | 887 | ASP | -1 | -0.764 | -0.894 | 25.457 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 62 | A | 888 | HIS | 0 | -0.038 | -0.017 | 19.813 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 63 | A | 889 | SER | 0 | -0.020 | -0.018 | 21.417 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 64 | A | 890 | ARG | 1 | 0.847 | 0.961 | 23.417 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
| 65 | A | 891 | VAL | 0 | -0.006 | -0.006 | 25.918 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 66 | A | 892 | LYS | 1 | 0.910 | 0.956 | 28.052 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
| 67 | A | 893 | LEU | 0 | -0.020 | 0.000 | 31.490 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 68 | A | 894 | ARG | 1 | 0.861 | 0.929 | 31.950 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 69 | A | 895 | PRO | 0 | 0.032 | 0.017 | 36.930 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 70 | A | 896 | LEU | 0 | -0.022 | -0.009 | 39.957 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 71 | A | 897 | PRO | 0 | 0.020 | 0.016 | 43.095 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 72 | A | 898 | GLY | 0 | 0.013 | 0.002 | 46.720 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 73 | A | 899 | LYS | 1 | 0.884 | 0.937 | 43.222 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 74 | A | 900 | ASP | -1 | -0.811 | -0.896 | 41.585 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 75 | A | 901 | SER | 0 | 0.046 | 0.039 | 42.499 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 76 | A | 902 | LYS | 1 | 0.861 | 0.929 | 36.304 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 77 | A | 903 | HIS | 1 | 0.831 | 0.904 | 38.141 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 78 | A | 904 | SER | 0 | 0.045 | 0.027 | 38.374 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 79 | A | 905 | ASP | -1 | -0.839 | -0.937 | 34.767 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 80 | A | 906 | TYR | 0 | -0.071 | -0.013 | 31.068 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 81 | A | 907 | ILE | 0 | 0.073 | 0.037 | 30.450 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 82 | A | 908 | ASN | 0 | -0.021 | 0.003 | 28.372 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 83 | A | 909 | ALA | 0 | 0.026 | 0.007 | 26.695 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 84 | A | 910 | ASN | 0 | -0.015 | -0.001 | 22.313 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 85 | A | 911 | TYR | 0 | -0.056 | -0.054 | 21.257 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 86 | A | 912 | VAL | 0 | 0.004 | 0.003 | 16.320 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 87 | A | 913 | ASP | -1 | -0.822 | -0.903 | 13.623 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
| 88 | A | 914 | GLY | 0 | 0.022 | -0.011 | 13.633 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 89 | A | 915 | TYR | 0 | -0.076 | -0.077 | 7.250 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 90 | A | 916 | ASN | 0 | -0.017 | -0.001 | 10.439 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 91 | A | 917 | LYS | 1 | 0.959 | 0.983 | 11.987 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
| 92 | A | 918 | ALA | 0 | 0.029 | 0.026 | 15.114 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
| 93 | A | 919 | LYS | 1 | 0.907 | 0.947 | 16.856 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
| 94 | A | 920 | ALA | 0 | -0.026 | 0.012 | 16.698 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 95 | A | 921 | TYR | 0 | -0.031 | -0.076 | 15.103 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 96 | A | 922 | ILE | 0 | -0.003 | -0.005 | 20.395 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 97 | A | 923 | ALA | 0 | -0.006 | 0.007 | 20.964 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 98 | A | 924 | THR | 0 | -0.019 | -0.045 | 23.031 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 99 | A | 925 | GLN | 0 | 0.009 | 0.009 | 26.582 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 100 | A | 926 | GLY | 0 | 0.028 | 0.004 | 29.012 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 101 | A | 927 | PRO | 0 | 0.007 | 0.011 | 31.313 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 102 | A | 928 | LEU | 0 | 0.009 | -0.001 | 34.084 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 103 | A | 929 | LYS | 1 | 0.979 | 0.973 | 37.506 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 104 | A | 930 | SER | 0 | -0.035 | -0.001 | 40.200 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 105 | A | 931 | THR | 0 | 0.039 | 0.020 | 35.500 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 106 | A | 932 | PHE | 0 | -0.012 | 0.003 | 36.755 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 107 | A | 933 | GLU | -1 | -0.829 | -0.923 | 37.723 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 108 | A | 934 | ASP | -1 | -0.900 | -0.946 | 35.734 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 109 | A | 935 | PHE | 0 | 0.010 | -0.008 | 30.296 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 110 | A | 936 | TRP | 0 | 0.027 | -0.006 | 33.444 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 111 | A | 937 | ARG | 1 | 0.846 | 0.934 | 35.490 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 112 | A | 938 | MET | 0 | 0.020 | 0.020 | 29.473 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 113 | A | 939 | ILE | 0 | -0.009 | -0.002 | 30.262 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 114 | A | 940 | TRP | 0 | -0.006 | -0.010 | 31.896 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 115 | A | 941 | GLU | -1 | -0.884 | -0.973 | 33.257 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 116 | A | 942 | GLN | 0 | -0.001 | 0.032 | 27.745 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 117 | A | 943 | ASN | 0 | -0.016 | -0.001 | 28.360 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 118 | A | 944 | THR | 0 | -0.029 | -0.002 | 26.789 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 119 | A | 945 | GLY | 0 | 0.047 | 0.022 | 27.834 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 120 | A | 946 | ILE | 0 | -0.027 | -0.011 | 24.930 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 121 | A | 947 | ILE | 0 | -0.001 | 0.007 | 26.518 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 122 | A | 948 | VAL | 0 | -0.004 | -0.004 | 22.382 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 123 | A | 949 | MET | 0 | -0.045 | -0.001 | 25.545 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 124 | A | 950 | ILE | 0 | -0.013 | -0.016 | 22.094 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 125 | A | 951 | THR | 0 | -0.029 | -0.040 | 26.462 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 126 | A | 952 | ASN | 0 | 0.021 | 0.033 | 29.652 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 127 | A | 953 | LEU | 0 | -0.011 | 0.004 | 33.261 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 128 | A | 954 | VAL | 0 | 0.015 | 0.003 | 35.922 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 129 | A | 955 | GLU | -1 | -0.743 | -0.862 | 31.397 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
| 130 | A | 956 | LYS | 1 | 1.002 | 0.996 | 35.399 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
| 131 | A | 957 | GLY | 0 | 0.033 | 0.020 | 37.900 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 132 | A | 958 | ARG | 1 | 0.936 | 0.977 | 36.035 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
| 133 | A | 959 | ARG | 1 | 0.924 | 0.953 | 37.183 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 134 | A | 960 | LYS | 1 | 0.925 | 0.978 | 30.487 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
| 135 | A | 961 | CYS | 0 | -0.028 | 0.005 | 32.731 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 136 | A | 962 | ASP | -1 | -0.839 | -0.894 | 34.790 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 137 | A | 963 | GLN | 0 | -0.040 | -0.035 | 36.373 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 138 | A | 964 | TYR | 0 | -0.036 | -0.031 | 31.036 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 139 | A | 965 | TRP | 0 | 0.034 | 0.014 | 34.723 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 140 | A | 966 | PRO | 0 | 0.029 | 0.031 | 38.713 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 141 | A | 967 | THR | 0 | 0.017 | -0.010 | 41.245 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 142 | A | 968 | GLU | -1 | -0.885 | -0.938 | 42.948 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 143 | A | 969 | ASN | 0 | -0.009 | -0.001 | 44.822 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 144 | A | 970 | SER | 0 | 0.016 | 0.027 | 43.978 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 145 | A | 971 | GLU | -1 | -0.838 | -0.894 | 43.106 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 146 | A | 972 | GLU | -1 | -1.029 | -1.000 | 43.487 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 147 | A | 973 | TYR | 0 | 0.064 | 0.022 | 40.627 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 148 | A | 974 | GLY | 0 | 0.054 | 0.037 | 41.895 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 149 | A | 975 | ASN | 0 | -0.045 | -0.035 | 42.743 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 150 | A | 976 | ILE | 0 | -0.020 | -0.019 | 38.269 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 151 | A | 977 | ILE | 0 | 0.001 | 0.011 | 41.602 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 152 | A | 978 | VAL | 0 | 0.006 | 0.003 | 38.300 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 153 | A | 979 | THR | 0 | -0.030 | -0.088 | 40.774 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 154 | A | 980 | LEU | 0 | -0.010 | 0.006 | 38.621 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 155 | A | 981 | LYS | 1 | 0.805 | 0.891 | 39.158 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 156 | A | 982 | SER | 0 | 0.039 | 0.010 | 38.079 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 157 | A | 983 | THR | 0 | 0.057 | 0.018 | 37.166 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 158 | A | 984 | LYS | 1 | 0.904 | 0.958 | 33.267 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 159 | A | 985 | ILE | 0 | 0.061 | 0.033 | 34.629 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 160 | A | 986 | HIS | 1 | 0.861 | 0.940 | 31.592 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
| 161 | A | 987 | ALA | 0 | 0.031 | 0.045 | 32.203 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 162 | A | 988 | CYS | 0 | 0.018 | -0.002 | 28.298 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 163 | A | 989 | TYR | 0 | -0.001 | 0.027 | 27.968 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 164 | A | 990 | THR | 0 | 0.035 | 0.021 | 30.227 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 165 | A | 991 | VAL | 0 | -0.070 | -0.037 | 29.991 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 166 | A | 992 | ARG | 1 | 0.913 | 0.961 | 32.499 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 167 | A | 993 | ARG | 1 | 0.972 | 1.001 | 33.855 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
| 168 | A | 994 | PHE | 0 | 0.045 | 0.022 | 34.375 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 169 | A | 995 | SER | 0 | -0.013 | -0.015 | 36.581 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 170 | A | 996 | ILE | 0 | -0.017 | 0.004 | 35.189 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 171 | A | 997 | ARG | 1 | 0.977 | 0.987 | 39.116 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 172 | A | 998 | ASN | 0 | 0.019 | 0.020 | 39.082 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 173 | A | 999 | THR | 0 | -0.036 | -0.041 | 42.035 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 174 | A | 1000 | LYS | 1 | 0.926 | 0.969 | 44.323 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 175 | A | 1001 | VAL | 0 | -0.011 | 0.021 | 40.248 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 176 | A | 1002 | LYS | 1 | 0.965 | 0.970 | 43.546 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 177 | A | 1003 | LYS | 1 | 0.967 | 0.976 | 43.749 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 178 | A | 1004 | GLY | 0 | 0.030 | 0.027 | 44.335 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 179 | A | 1005 | GLN | 0 | 0.015 | 0.010 | 45.224 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 180 | A | 1006 | LYS | 1 | 0.999 | 0.970 | 46.291 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 181 | A | 1007 | GLY | 0 | 0.014 | 0.012 | 47.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 182 | A | 1008 | ASN | 0 | -0.036 | 0.002 | 41.292 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 183 | A | 1009 | PRO | 0 | 0.093 | 0.040 | 40.370 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 184 | A | 1010 | LYS | 1 | 0.957 | 0.987 | 34.784 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 185 | A | 1011 | GLY | 0 | 0.029 | 0.035 | 39.241 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 186 | A | 1012 | ARG | 1 | 0.934 | 0.957 | 42.041 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 187 | A | 1013 | GLN | 0 | 0.029 | -0.006 | 38.519 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 188 | A | 1014 | ASN | 0 | -0.064 | -0.024 | 39.735 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 189 | A | 1015 | GLU | -1 | -0.952 | -0.980 | 40.257 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 190 | A | 1016 | ARG | 1 | 0.915 | 0.961 | 33.894 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
| 191 | A | 1017 | VAL | 0 | 0.003 | 0.006 | 33.854 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 192 | A | 1018 | VAL | 0 | -0.011 | 0.003 | 31.020 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 193 | A | 1019 | ILE | 0 | -0.024 | -0.014 | 29.718 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 194 | A | 1020 | GLN | 0 | 0.032 | 0.013 | 29.413 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 195 | A | 1021 | TYR | 0 | 0.012 | 0.006 | 26.416 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 196 | A | 1022 | HIS | 0 | 0.017 | -0.006 | 27.457 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 197 | A | 1023 | TYR | 0 | -0.007 | -0.002 | 25.584 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 198 | A | 1024 | THR | 0 | -0.052 | -0.057 | 28.194 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 199 | A | 1025 | GLN | 0 | 0.059 | 0.026 | 29.449 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 200 | A | 1026 | TRP | 0 | -0.052 | -0.021 | 20.950 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 201 | A | 1027 | PRO | 0 | 0.016 | 0.040 | 26.695 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 202 | A | 1028 | ASP | -1 | -0.908 | -0.982 | 28.875 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
| 203 | A | 1029 | MET | 0 | -0.062 | -0.034 | 29.618 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 204 | A | 1030 | GLY | 0 | 0.029 | 0.025 | 25.582 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 205 | A | 1031 | VAL | 0 | -0.024 | -0.017 | 20.855 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 206 | A | 1032 | PRO | 0 | -0.021 | -0.023 | 22.298 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 207 | A | 1033 | GLU | -1 | -0.829 | -0.881 | 23.835 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
| 208 | A | 1034 | TYR | 0 | 0.061 | 0.013 | 24.451 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 209 | A | 1035 | ALA | 0 | 0.054 | 0.029 | 19.325 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 210 | A | 1036 | LEU | 0 | 0.029 | 0.020 | 21.118 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 211 | A | 1037 | PRO | 0 | 0.061 | 0.027 | 23.062 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 212 | A | 1038 | VAL | 0 | -0.024 | -0.002 | 19.854 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 213 | A | 1039 | LEU | 0 | -0.005 | -0.005 | 16.369 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 214 | A | 1040 | THR | 0 | 0.009 | 0.015 | 19.988 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 215 | A | 1041 | PHE | 0 | -0.003 | -0.008 | 22.644 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 216 | A | 1042 | VAL | 0 | -0.017 | -0.001 | 16.720 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 217 | A | 1043 | ARG | 1 | 0.981 | 0.985 | 16.717 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
| 218 | A | 1044 | ARG | 1 | 0.801 | 0.873 | 20.281 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
| 219 | A | 1045 | SER | 0 | -0.032 | -0.006 | 22.368 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 220 | A | 1046 | SER | 0 | -0.076 | -0.029 | 17.496 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 221 | A | 1047 | ALA | 0 | 0.009 | -0.003 | 20.619 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 222 | A | 1048 | ALA | 0 | -0.023 | -0.002 | 22.202 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 223 | A | 1049 | ARG | 1 | 0.849 | 0.930 | 18.565 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
| 224 | A | 1050 | MET | 0 | -0.011 | 0.005 | 23.800 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 225 | A | 1051 | PRO | 0 | 0.034 | -0.008 | 24.352 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 226 | A | 1052 | GLU | -1 | -0.967 | -0.977 | 25.284 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
| 227 | A | 1053 | THR | 0 | -0.043 | -0.003 | 24.541 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 228 | A | 1054 | GLY | 0 | -0.029 | -0.018 | 24.991 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 229 | A | 1055 | PRO | 0 | -0.081 | -0.039 | 22.510 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 230 | A | 1056 | VAL | 0 | 0.009 | 0.017 | 21.373 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 231 | A | 1057 | LEU | 0 | -0.006 | 0.013 | 22.738 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 232 | A | 1058 | VAL | 0 | -0.013 | 0.003 | 20.469 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 233 | A | 1059 | HIS | 0 | 0.076 | 0.046 | 23.747 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 234 | A | 1060 | CYM | -1 | -0.834 | -0.845 | 25.141 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
| 235 | A | 1061 | SER | 0 | -0.023 | -0.034 | 27.236 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 236 | A | 1062 | ALA | 0 | 0.041 | 0.003 | 26.434 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 237 | A | 1063 | GLY | 0 | 0.046 | 0.009 | 25.149 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 238 | A | 1064 | VAL | 0 | -0.047 | -0.012 | 21.662 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 239 | A | 1065 | GLY | 0 | 0.097 | 0.044 | 20.293 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 240 | A | 1066 | ARG | 1 | 0.833 | 0.925 | 20.001 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
| 241 | A | 1067 | THR | 0 | 0.043 | -0.038 | 20.693 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 242 | A | 1068 | GLY | 0 | 0.051 | 0.007 | 17.649 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 243 | A | 1069 | THR | 0 | -0.030 | -0.044 | 15.938 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 244 | A | 1070 | TYR | 0 | -0.020 | -0.031 | 15.847 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 245 | A | 1071 | ILE | 0 | 0.033 | 0.018 | 14.394 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 246 | A | 1072 | VAL | 0 | 0.000 | 0.023 | 10.285 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 247 | A | 1073 | ILE | 0 | 0.025 | 0.011 | 11.344 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 248 | A | 1074 | ASP | -1 | -0.744 | -0.831 | 12.997 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
| 249 | A | 1075 | SER | 0 | -0.017 | -0.026 | 10.641 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
| 250 | A | 1076 | MET | 0 | -0.065 | -0.032 | 6.782 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
| 251 | A | 1077 | LEU | 0 | -0.009 | 0.000 | 9.190 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
| 252 | A | 1078 | GLN | 0 | -0.060 | -0.034 | 11.943 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
| 253 | A | 1079 | GLN | 0 | -0.002 | 0.007 | 3.818 | 0.713 | 1.105 | 0.006 | -0.104 | -0.293 | -0.001 |
| 254 | A | 1080 | ILE | 0 | -0.014 | -0.002 | 8.053 | 0.326 | 0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
| 255 | A | 1081 | LYS | 1 | 0.945 | 0.962 | 9.106 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
| 256 | A | 1082 | ASP | -1 | -0.870 | -0.877 | 10.196 | 0.723 | 0.723 | 0.000 | 0.000 | 0.000 | 0.000 |
| 257 | A | 1083 | LYS | 1 | 0.987 | 0.988 | 5.556 | -1.903 | -1.903 | 0.000 | 0.000 | 0.000 | 0.000 |
| 258 | A | 1084 | SER | 0 | -0.025 | 0.005 | 8.626 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 259 | A | 1085 | THR | 0 | -0.071 | -0.027 | 3.113 | -2.063 | -0.882 | 0.279 | -0.653 | -0.807 | 0.007 |
| 260 | A | 1086 | VAL | 0 | 0.022 | 0.006 | 3.593 | -1.227 | -0.904 | 0.003 | -0.091 | -0.235 | 0.000 |
| 261 | A | 1087 | ASN | 0 | -0.007 | -0.023 | 2.167 | -4.785 | -2.364 | 3.557 | -2.609 | -3.370 | -0.022 |
| 262 | A | 1088 | VAL | 0 | 0.035 | 0.011 | 3.599 | 0.161 | 0.379 | 0.016 | -0.013 | -0.222 | 0.000 |
| 263 | A | 1089 | LEU | 0 | 0.065 | 0.053 | 5.938 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
| 264 | A | 1090 | GLY | 0 | 0.043 | 0.018 | 5.046 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
| 265 | A | 1091 | PHE | 0 | -0.025 | -0.018 | 6.173 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
| 266 | A | 1092 | LEU | 0 | -0.011 | -0.009 | 8.082 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
| 267 | A | 1093 | LYS | 1 | 0.867 | 0.878 | 9.232 | 0.642 | 0.642 | 0.000 | 0.000 | 0.000 | 0.000 |
| 268 | A | 1094 | HIS | 0 | -0.036 | -0.005 | 9.824 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 269 | A | 1095 | ILE | 0 | 0.006 | 0.039 | 11.557 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
| 270 | A | 1096 | ARG | 1 | 0.852 | 0.943 | 14.060 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
| 271 | A | 1097 | THR | 0 | 0.008 | -0.031 | 14.775 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
| 272 | A | 1098 | GLN | 0 | -0.045 | -0.017 | 15.651 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
| 273 | A | 1099 | ARG | 1 | 0.830 | 0.897 | 18.681 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
| 274 | A | 1100 | ASN | 0 | 0.054 | 0.028 | 19.343 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 275 | A | 1101 | TYR | 0 | 0.002 | -0.018 | 20.406 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 276 | A | 1102 | LEU | 0 | 0.007 | 0.022 | 16.739 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 277 | A | 1103 | VAL | 0 | -0.013 | 0.024 | 14.922 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 278 | A | 1104 | GLN | 0 | -0.015 | -0.015 | 17.477 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 279 | A | 1105 | THR | 0 | -0.003 | -0.008 | 19.763 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 280 | A | 1106 | GLU | -1 | -0.761 | -0.892 | 17.423 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
| 281 | A | 1107 | GLU | -1 | -0.850 | -0.934 | 17.843 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
| 282 | A | 1108 | GLN | 0 | -0.020 | -0.023 | 18.406 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 283 | A | 1109 | TYR | 0 | -0.042 | -0.023 | 9.793 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 284 | A | 1110 | ILE | 0 | 0.045 | 0.051 | 13.897 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 285 | A | 1111 | PHE | 0 | 0.065 | 0.034 | 15.945 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 286 | A | 1112 | ILE | 0 | -0.042 | -0.024 | 11.650 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 287 | A | 1113 | HIS | 1 | 0.794 | 0.875 | 8.985 | 0.425 | 0.425 | 0.000 | 0.000 | 0.000 | 0.000 |
| 288 | A | 1114 | ASP | -1 | -0.772 | -0.836 | 13.007 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
| 289 | A | 1115 | ALA | 0 | 0.021 | 0.000 | 16.000 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
| 290 | A | 1116 | LEU | 0 | -0.006 | -0.015 | 9.474 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
| 291 | A | 1117 | LEU | 0 | -0.011 | 0.005 | 13.118 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
| 292 | A | 1118 | GLU | -1 | -0.927 | -0.978 | 14.143 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 293 | A | 1119 | ALA | 0 | -0.078 | -0.035 | 14.142 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 294 | A | 1120 | ILE | 0 | -0.037 | -0.024 | 10.040 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
| 295 | A | 1121 | LEU | 0 | -0.005 | 0.007 | 14.453 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 296 | A | 1122 | GLY | 0 | 0.007 | 0.006 | 17.766 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 297 | A | 1123 | LYS | 1 | 0.761 | 0.893 | 18.894 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
| 298 | A | 1124 | GLU | -1 | -0.914 | -0.980 | 18.880 | 0.211 | 0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
| 299 | A | 1125 | THR | 0 | -0.075 | -0.050 | 22.056 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 300 | A | 1126 | GLU | -1 | -0.870 | -0.887 | 25.376 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
| 301 | A | 1127 | VAL | 0 | -0.055 | -0.029 | 26.996 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 302 | A | 1128 | SER | 0 | 0.013 | 0.003 | 29.763 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 303 | A | 1129 | SER | 0 | 0.072 | 0.023 | 32.179 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 304 | A | 1130 | ASN | 0 | -0.004 | -0.021 | 35.713 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 305 | A | 1131 | GLN | 0 | -0.004 | 0.011 | 28.816 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 306 | A | 1132 | LEU | 0 | 0.013 | 0.018 | 33.448 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 307 | A | 1133 | HIS | 0 | 0.106 | 0.034 | 34.789 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 308 | A | 1134 | SER | 0 | -0.031 | -0.004 | 33.957 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 309 | A | 1135 | TYR | 0 | 0.017 | 0.007 | 26.999 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 310 | A | 1136 | VAL | 0 | 0.009 | -0.001 | 32.214 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 311 | A | 1137 | ASN | 0 | 0.030 | 0.011 | 34.689 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 312 | A | 1138 | SER | 0 | -0.005 | -0.009 | 31.081 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 313 | A | 1139 | ILE | 0 | -0.098 | -0.041 | 29.191 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 314 | A | 1140 | LEU | 0 | 0.040 | 0.020 | 31.630 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 315 | A | 1141 | ILE | 0 | -0.019 | 0.013 | 32.792 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 316 | A | 1142 | PRO | 0 | -0.018 | -0.016 | 32.530 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 317 | A | 1143 | GLY | 0 | 0.020 | 0.003 | 31.467 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 318 | A | 1144 | VAL | 0 | 0.028 | -0.005 | 32.075 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 319 | A | 1145 | GLY | 0 | 0.015 | 0.016 | 33.003 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 320 | A | 1146 | GLY | 0 | -0.008 | 0.016 | 29.213 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 321 | A | 1147 | LYS | 1 | 0.862 | 0.917 | 28.924 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 322 | A | 1148 | THR | 0 | 0.036 | 0.043 | 30.009 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 323 | A | 1149 | ARG | 1 | 0.926 | 0.945 | 25.432 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
| 324 | A | 1150 | LEU | 0 | 0.032 | 0.031 | 28.554 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 325 | A | 1151 | GLU | -1 | -0.757 | -0.894 | 31.153 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
| 326 | A | 1152 | LYS | 1 | 0.814 | 0.904 | 25.472 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
| 327 | A | 1153 | GLN | 0 | 0.002 | 0.030 | 26.612 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 328 | A | 1154 | PHE | 0 | 0.099 | 0.053 | 27.688 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 329 | A | 1155 | LYS | 1 | 0.973 | 1.012 | 27.117 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 330 | A | 1156 | LEU | 0 | -0.013 | -0.025 | 22.514 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 331 | A | 1157 | VAL | 0 | -0.025 | -0.016 | 26.590 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 332 | A | 1158 | THR | 0 | -0.025 | 0.000 | 29.472 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 333 | A | 1159 | GLN | 0 | -0.078 | -0.031 | 23.737 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 334 | A | 1160 | CYS | 0 | 0.006 | 0.037 | 29.012 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 335 | A | 1168 | PHE | 0 | 0.014 | -0.012 | 34.523 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 336 | A | 1169 | SER | 0 | -0.005 | 0.001 | 36.121 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 337 | A | 1170 | ALA | 0 | 0.107 | 0.044 | 37.912 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 338 | A | 1171 | GLN | 0 | 0.035 | -0.003 | 38.797 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 339 | A | 1172 | LYS | 1 | 0.876 | 0.991 | 39.063 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 340 | A | 1173 | GLH | 0 | -0.107 | -0.064 | 42.186 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 341 | A | 1174 | CYS | 0 | 0.011 | 0.018 | 44.848 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 342 | A | 1175 | ASN | 0 | 0.053 | -0.015 | 44.932 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 343 | A | 1176 | LYS | 1 | 0.943 | 0.967 | 46.711 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 344 | A | 1177 | GLU | -1 | -0.941 | -0.967 | 48.177 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 345 | A | 1178 | LYS | 1 | 0.950 | 0.987 | 48.908 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 346 | A | 1179 | ASN | 0 | -0.019 | 0.033 | 44.704 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 347 | A | 1180 | ARG | 1 | 0.883 | 0.952 | 48.248 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 348 | A | 1181 | ASN | 0 | 0.057 | 0.022 | 45.104 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 349 | A | 1182 | SER | 0 | -0.029 | -0.026 | 43.807 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 350 | A | 1183 | SER | 0 | -0.035 | -0.011 | 41.068 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 351 | A | 1184 | VAL | 0 | -0.046 | -0.006 | 39.941 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 352 | A | 1185 | VAL | 0 | -0.032 | -0.006 | 39.123 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 353 | A | 1186 | PRO | 0 | -0.008 | 0.010 | 38.393 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 354 | A | 1187 | SER | 0 | 0.006 | -0.010 | 33.229 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 355 | A | 1188 | GLU | -1 | -0.790 | -0.924 | 34.049 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 356 | A | 1189 | ARG | 1 | 0.808 | 0.896 | 28.810 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
| 357 | A | 1190 | ALA | 0 | 0.001 | 0.008 | 33.836 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 358 | A | 1191 | ARG | 1 | 0.818 | 0.917 | 35.865 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 359 | A | 1192 | VAL | 0 | 0.033 | 0.015 | 39.194 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 360 | A | 1193 | GLY | 0 | -0.038 | -0.008 | 42.163 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 361 | A | 1194 | LEU | 0 | -0.041 | -0.012 | 43.993 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 362 | A | 1195 | ALA | 0 | 0.000 | 0.005 | 47.628 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 363 | A | 1196 | PRO | 0 | -0.019 | -0.013 | 48.340 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 364 | A | 1204 | ASP | -1 | -0.827 | -0.920 | 44.180 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 365 | A | 1205 | TYR | 0 | -0.068 | -0.045 | 42.651 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 366 | A | 1206 | ILE | 0 | 0.081 | 0.036 | 45.494 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 367 | A | 1207 | ASN | 0 | -0.011 | 0.004 | 43.627 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 368 | A | 1208 | ALA | 0 | 0.017 | 0.022 | 43.466 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 369 | A | 1209 | SER | 0 | -0.008 | 0.008 | 38.025 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 370 | A | 1210 | TYR | 0 | -0.024 | -0.032 | 37.143 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 371 | A | 1211 | ILE | 0 | -0.038 | -0.028 | 36.142 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 372 | A | 1212 | MET | 0 | -0.077 | -0.039 | 30.272 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 373 | A | 1213 | GLY | 0 | 0.088 | 0.047 | 35.446 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 374 | A | 1214 | TYR | 0 | -0.101 | -0.074 | 33.341 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 375 | A | 1215 | TYR | 0 | -0.051 | -0.057 | 34.883 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 376 | A | 1216 | ARG | 1 | 0.971 | 0.992 | 36.459 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 377 | A | 1217 | SER | 0 | -0.006 | 0.002 | 33.333 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 378 | A | 1218 | ASN | 0 | -0.001 | -0.027 | 35.324 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 379 | A | 1219 | GLU | -1 | -0.905 | -0.936 | 38.243 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 380 | A | 1220 | PHE | 0 | 0.045 | 0.009 | 39.128 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 381 | A | 1221 | ILE | 0 | 0.026 | 0.002 | 40.474 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 382 | A | 1222 | ILE | 0 | -0.026 | 0.016 | 39.544 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 383 | A | 1223 | THR | 0 | -0.044 | -0.070 | 42.812 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 384 | A | 1224 | GLN | 0 | -0.033 | -0.022 | 45.444 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 385 | A | 1225 | HIS | 0 | -0.006 | -0.005 | 47.953 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 386 | A | 1226 | PRO | 0 | 0.011 | 0.018 | 51.654 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 387 | A | 1227 | LEU | 0 | 0.014 | -0.003 | 52.298 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 388 | A | 1228 | PRO | 0 | 0.056 | 0.014 | 55.253 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 389 | A | 1229 | HIS | 0 | -0.015 | 0.001 | 54.426 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 390 | A | 1230 | THR | 0 | -0.067 | -0.039 | 51.378 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 391 | A | 1231 | THR | 0 | 0.008 | 0.013 | 53.589 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 392 | A | 1232 | LYS | 1 | 0.924 | 0.961 | 55.894 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 393 | A | 1233 | ASP | -1 | -0.888 | -0.957 | 51.077 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 394 | A | 1234 | PHE | 0 | -0.009 | -0.019 | 50.255 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 395 | A | 1235 | TRP | 0 | 0.041 | -0.001 | 51.663 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 396 | A | 1236 | ARG | 1 | 0.914 | 0.968 | 51.786 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 397 | A | 1237 | MET | 0 | 0.011 | 0.049 | 46.584 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 398 | A | 1238 | ILE | 0 | -0.040 | -0.013 | 48.918 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 399 | A | 1239 | TRP | 0 | 0.031 | 0.011 | 50.691 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 400 | A | 1240 | ASP | -1 | -0.842 | -0.915 | 48.205 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 401 | A | 1241 | HIS | 0 | -0.106 | -0.043 | 43.655 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 402 | A | 1242 | ASN | 0 | 0.007 | 0.002 | 47.236 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 403 | A | 1243 | ALA | 0 | -0.003 | 0.008 | 48.000 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 404 | A | 1244 | GLN | 0 | 0.088 | 0.054 | 49.384 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 405 | A | 1245 | ILE | 0 | 0.022 | 0.029 | 48.710 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 406 | A | 1246 | ILE | 0 | -0.041 | -0.013 | 49.573 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 407 | A | 1247 | VAL | 0 | 0.012 | 0.008 | 48.416 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 408 | A | 1248 | MET | 0 | -0.013 | 0.000 | 49.920 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 409 | A | 1249 | LEU | 0 | -0.030 | -0.027 | 47.067 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 410 | A | 1250 | PRO | 0 | -0.001 | 0.005 | 51.321 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 411 | A | 1260 | PHE | 0 | -0.012 | -0.018 | 57.415 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 412 | A | 1261 | VAL | 0 | 0.039 | 0.025 | 58.664 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 413 | A | 1262 | TYR | 0 | 0.000 | -0.001 | 53.736 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 414 | A | 1263 | TRP | 0 | 0.029 | -0.003 | 57.373 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 415 | A | 1264 | PRO | 0 | 0.007 | 0.014 | 60.420 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 416 | A | 1265 | SER | 0 | 0.017 | 0.008 | 63.819 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 417 | A | 1266 | ARG | 1 | 0.860 | 0.909 | 67.015 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 418 | A | 1267 | GLU | -1 | -0.938 | -0.961 | 69.486 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 419 | A | 1268 | GLU | -1 | -0.960 | -0.975 | 68.976 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 420 | A | 1269 | SER | 0 | 0.004 | 0.000 | 65.951 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 421 | A | 1270 | MET | 0 | -0.050 | -0.021 | 60.463 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 422 | A | 1271 | ASN | 0 | 0.017 | 0.005 | 63.046 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 423 | A | 1272 | CYS | 0 | -0.108 | -0.048 | 58.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 424 | A | 1273 | GLU | -1 | -0.866 | -0.939 | 59.255 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 425 | A | 1274 | ALA | 0 | 0.029 | 0.033 | 57.044 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 426 | A | 1275 | PHE | 0 | -0.008 | -0.001 | 55.642 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 427 | A | 1276 | THR | 0 | 0.038 | 0.010 | 60.090 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 428 | A | 1277 | VAL | 0 | -0.011 | 0.010 | 58.455 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 429 | A | 1278 | THR | 0 | 0.069 | 0.037 | 61.425 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 430 | A | 1279 | LEU | 0 | -0.041 | -0.004 | 62.982 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 431 | A | 1280 | ILE | 0 | 0.016 | -0.007 | 62.710 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 432 | A | 1281 | SER | 0 | -0.059 | -0.018 | 63.901 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 433 | A | 1282 | LYS | 1 | 0.963 | 0.994 | 63.675 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 434 | A | 1283 | ASP | -1 | -0.848 | -0.919 | 62.661 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 435 | A | 1284 | ARG | 1 | 0.820 | 0.900 | 61.503 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 436 | A | 1285 | LEU | 0 | 0.052 | 0.039 | 56.489 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 437 | A | 1286 | CYS | 0 | -0.026 | -0.023 | 60.250 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 438 | A | 1287 | LEU | 0 | -0.005 | 0.004 | 54.867 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 439 | A | 1288 | SER | 0 | -0.026 | -0.016 | 55.646 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 440 | A | 1289 | ASN | 0 | -0.085 | -0.050 | 56.979 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 441 | A | 1290 | GLU | -1 | -0.891 | -0.940 | 60.019 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 442 | A | 1291 | GLU | -1 | -0.900 | -0.932 | 56.320 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 443 | A | 1292 | GLN | 0 | -0.004 | -0.023 | 59.877 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 444 | A | 1293 | ILE | 0 | -0.005 | 0.012 | 54.625 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 445 | A | 1294 | ILE | 0 | -0.053 | -0.030 | 58.155 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 446 | A | 1295 | ILE | 0 | 0.030 | 0.017 | 57.394 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 447 | A | 1296 | HIS | 0 | -0.005 | -0.007 | 59.121 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 448 | A | 1297 | ASP | -1 | -0.791 | -0.876 | 59.044 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 449 | A | 1298 | PHE | 0 | 0.012 | -0.027 | 58.320 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 450 | A | 1299 | ILE | 0 | 0.022 | 0.016 | 59.418 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 451 | A | 1300 | LEU | 0 | -0.050 | -0.038 | 55.365 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 452 | A | 1301 | GLU | -1 | -0.883 | -0.936 | 59.202 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 453 | A | 1302 | ALA | 0 | 0.014 | 0.001 | 58.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 454 | A | 1303 | THR | 0 | -0.058 | -0.044 | 60.559 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 455 | A | 1304 | GLN | 0 | -0.102 | -0.060 | 61.268 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 456 | A | 1305 | ASP | -1 | -0.906 | -0.967 | 58.763 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 457 | A | 1306 | ASP | -1 | -0.925 | -0.958 | 61.545 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 458 | A | 1307 | TYR | 0 | -0.042 | 0.004 | 53.740 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 459 | A | 1308 | VAL | 0 | 0.036 | 0.005 | 59.068 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 460 | A | 1309 | LEU | 0 | -0.054 | -0.012 | 52.619 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 461 | A | 1310 | GLU | -1 | -0.930 | -0.961 | 56.541 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 462 | A | 1311 | VAL | 0 | -0.047 | -0.037 | 53.602 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 463 | A | 1312 | ARG | 1 | 0.792 | 0.896 | 54.687 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 464 | A | 1313 | HIS | 0 | -0.082 | -0.051 | 54.107 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 465 | A | 1314 | PHE | 0 | 0.041 | 0.006 | 52.868 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 466 | A | 1315 | GLN | 0 | -0.012 | -0.021 | 54.147 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 467 | A | 1316 | CYS | 0 | -0.040 | -0.007 | 52.655 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 468 | A | 1317 | PRO | 0 | 0.048 | 0.022 | 54.703 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 469 | A | 1318 | LYS | 1 | 0.809 | 0.908 | 53.159 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 470 | A | 1319 | TRP | 0 | -0.044 | -0.019 | 44.454 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 471 | A | 1320 | PRO | 0 | -0.029 | -0.030 | 46.044 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 472 | A | 1321 | ASN | 0 | 0.094 | 0.034 | 49.231 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 473 | A | 1322 | PRO | 0 | -0.048 | -0.018 | 50.787 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 474 | A | 1323 | ASP | -1 | -0.958 | -0.978 | 51.813 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 475 | A | 1324 | ALA | 0 | 0.036 | 0.041 | 53.139 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 476 | A | 1325 | PRO | 0 | -0.016 | -0.017 | 51.378 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 477 | A | 1326 | ILE | 0 | 0.051 | 0.027 | 43.958 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 478 | A | 1327 | SER | 0 | 0.021 | 0.015 | 46.668 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 479 | A | 1328 | SER | 0 | 0.044 | 0.013 | 47.717 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 480 | A | 1329 | THR | 0 | -0.047 | -0.033 | 45.019 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 481 | A | 1330 | PHE | 0 | -0.010 | -0.027 | 41.781 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 482 | A | 1331 | GLU | -1 | -0.815 | -0.883 | 47.162 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 483 | A | 1332 | LEU | 0 | 0.046 | 0.013 | 49.368 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 484 | A | 1333 | ILE | 0 | -0.034 | -0.019 | 43.290 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 485 | A | 1334 | ASN | 0 | -0.016 | -0.032 | 46.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 486 | A | 1335 | VAL | 0 | 0.038 | 0.031 | 48.619 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 487 | A | 1336 | ILE | 0 | -0.018 | -0.007 | 47.139 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 488 | A | 1337 | LYS | 1 | 0.885 | 0.933 | 42.604 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 489 | A | 1338 | GLU | -1 | -0.929 | -0.964 | 47.234 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
| 490 | A | 1339 | GLU | -1 | -0.884 | -0.944 | 50.423 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
| 491 | A | 1340 | ALA | 0 | -0.023 | -0.028 | 46.392 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 492 | A | 1341 | LEU | 0 | -0.075 | -0.022 | 46.554 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 493 | A | 1342 | THR | 0 | -0.093 | -0.038 | 48.839 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 494 | A | 1343 | ARG | 1 | 0.881 | 0.955 | 50.230 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 495 | A | 1344 | ASP | -1 | -0.893 | -0.938 | 47.736 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 496 | A | 1345 | GLY | 0 | -0.026 | -0.016 | 45.901 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 497 | A | 1346 | PRO | 0 | -0.080 | -0.048 | 43.030 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 498 | A | 1347 | THR | 0 | -0.012 | 0.008 | 44.314 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 499 | A | 1348 | ILE | 0 | -0.009 | -0.015 | 44.771 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 500 | A | 1349 | VAL | 0 | 0.003 | 0.001 | 44.434 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 501 | A | 1350 | HIS | 0 | 0.029 | 0.030 | 45.720 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 502 | A | 1351 | ASP | -1 | -0.743 | -0.863 | 46.266 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 503 | A | 1352 | GLU | -1 | -0.915 | -0.964 | 49.053 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 504 | A | 1353 | TYR | 0 | 0.006 | -0.031 | 45.733 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 505 | A | 1354 | GLY | 0 | 0.063 | 0.038 | 44.369 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 506 | A | 1355 | ALA | 0 | -0.005 | -0.014 | 42.102 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 507 | A | 1356 | VAL | 0 | 0.047 | 0.017 | 41.213 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 508 | A | 1357 | SER | 0 | 0.016 | 0.007 | 42.609 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 509 | A | 1358 | ALA | 0 | 0.059 | 0.023 | 43.683 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 510 | A | 1359 | GLY | 0 | 0.041 | 0.006 | 40.027 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 511 | A | 1360 | MET | 0 | -0.029 | -0.001 | 39.760 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 512 | A | 1361 | LEU | 0 | 0.050 | 0.031 | 41.483 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 513 | A | 1362 | CYS | 0 | -0.013 | 0.021 | 39.168 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 514 | A | 1363 | ALA | 0 | -0.002 | -0.019 | 36.715 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 515 | A | 1364 | LEU | 0 | 0.005 | -0.003 | 37.608 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 516 | A | 1365 | THR | 0 | -0.007 | -0.010 | 40.162 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 517 | A | 1366 | THR | 0 | 0.001 | -0.009 | 34.422 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 518 | A | 1367 | LEU | 0 | -0.037 | -0.031 | 33.173 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 519 | A | 1368 | SER | 0 | -0.024 | -0.001 | 36.556 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 520 | A | 1369 | GLN | 0 | 0.095 | 0.038 | 38.514 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 521 | A | 1370 | GLN | 0 | 0.009 | 0.007 | 30.121 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 522 | A | 1371 | LEU | 0 | -0.041 | -0.017 | 35.636 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 523 | A | 1372 | GLU | -1 | -0.929 | -0.948 | 37.140 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
| 524 | A | 1373 | ASN | 0 | 0.010 | 0.020 | 36.750 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 525 | A | 1374 | GLU | -1 | -0.907 | -0.952 | 31.185 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
| 526 | A | 1375 | ASN | 0 | -0.008 | 0.012 | 33.972 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 527 | A | 1376 | ALA | 0 | -0.010 | -0.015 | 30.790 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 528 | A | 1377 | VAL | 0 | 0.033 | 0.013 | 31.954 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 529 | A | 1378 | ASP | -1 | -0.794 | -0.885 | 26.904 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
| 530 | A | 1379 | VAL | 0 | 0.037 | 0.015 | 30.023 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 531 | A | 1380 | PHE | 0 | 0.001 | 0.003 | 24.244 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 532 | A | 1381 | GLN | 0 | -0.029 | -0.015 | 25.463 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 533 | A | 1382 | VAL | 0 | 0.014 | 0.012 | 28.127 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 534 | A | 1383 | ALA | 0 | 0.018 | 0.006 | 31.736 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 535 | A | 1384 | LYS | 1 | 0.873 | 0.941 | 25.128 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 536 | A | 1385 | MET | 0 | -0.017 | -0.017 | 28.163 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 537 | A | 1386 | ILE | 0 | 0.009 | 0.017 | 30.502 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 538 | A | 1387 | ASN | 0 | 0.010 | -0.020 | 32.138 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 539 | A | 1388 | LEU | 0 | -0.101 | -0.049 | 26.405 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 540 | A | 1389 | MET | 0 | -0.062 | -0.022 | 30.978 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 541 | A | 1390 | ARG | 1 | 0.852 | 0.903 | 33.807 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 542 | A | 1391 | PRO | 0 | -0.015 | -0.006 | 33.793 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 543 | A | 1392 | GLY | 0 | 0.027 | 0.012 | 35.858 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 544 | A | 1393 | VAL | 0 | -0.016 | 0.015 | 37.307 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 545 | A | 1394 | PHE | 0 | -0.058 | -0.025 | 35.070 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 546 | A | 1395 | THR | 0 | -0.001 | -0.018 | 36.176 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 547 | A | 1396 | ASP | -1 | -0.886 | -0.930 | 37.732 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
| 548 | A | 1397 | ILE | 0 | -0.023 | -0.027 | 34.107 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 549 | A | 1398 | GLU | -1 | -0.873 | -0.951 | 37.223 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
| 550 | A | 1399 | GLN | 0 | 0.079 | 0.040 | 39.153 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 551 | A | 1400 | TYR | 0 | 0.013 | -0.016 | 30.006 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 552 | A | 1401 | GLN | 0 | -0.011 | -0.019 | 36.460 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 553 | A | 1402 | PHE | 0 | 0.051 | 0.024 | 37.774 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 554 | A | 1403 | ILE | 0 | 0.030 | 0.026 | 35.773 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 555 | A | 1404 | TYR | 0 | -0.038 | -0.040 | 30.355 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 556 | A | 1405 | LYS | 1 | 0.914 | 0.954 | 37.048 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
| 557 | A | 1406 | ALA | 0 | 0.032 | 0.028 | 40.626 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 558 | A | 1407 | MET | 0 | 0.010 | 0.021 | 36.766 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 559 | A | 1408 | LEU | 0 | -0.013 | -0.026 | 38.137 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 560 | A | 1409 | SER | 0 | -0.102 | -0.054 | 40.180 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 561 | A | 1410 | LEU | 0 | 0.017 | 0.011 | 41.623 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 562 | A | 1411 | VAL | 0 | -0.060 | -0.017 | 38.466 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 563 | A | 1412 | SER | 0 | -0.045 | -0.007 | 41.428 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |