FMODB ID: PG5Y1
Calculation Name: 4OH5-A-Xray15
Preferred Name: Androgen Receptor
Target Type: SINGLE PROTEIN
Ligand Name: hydroxyflutamide
ligand 3-letter code: HFT
PDB ID: 4OH5
Chain ID: A
ChEMBL ID: CHEMBL1871
UniProt ID: P10275
Base Structure: X-ray
Registration Date: 2018-03-20
Reference:
Modeling method
Optimization | Other |
---|---|
Restraint | Other |
Protonation | Other |
Complement | SWISS Model |
Water | Crystal waters in PDB |
Procedure | Manual calculation |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 358 |
LigandCharge | HFT=0 |
Software | MIZUHO/ABINIT-MP 4.0(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -4022730.069966 |
---|---|
FMO2-HF: Nuclear repulsion | 3910654.666425 |
FMO2-HF: Total energy | -112075.403541 |
FMO2-MP2: Total energy | -112391.627859 |
3D Structure
Ligand structure
HFT
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. |
-105.336 | -83.634 | 78.814 | -34.968 | -65.544 | -0.002 |
Interactive mode: IFIE and PIEDA for fragment #358(:1029:HFT)
Summations of interaction energy for
fragment #358(:1029:HFT)
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. |
-105.336 | -83.634 | 78.814 | -34.968 | -65.544 | 0.002 |
Interaction energy analysis for fragmet #358(:1029:HFT)
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]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1 | 672 | ILE | 0 | 0.080 | 0.013 | 27.032 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | |
2 | 673 | PHE | 0 | -0.001 | -0.001 | 20.260 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
3 | 674 | LEU | 0 | 0.043 | 0.000 | 20.553 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 | |
4 | 675 | ASN | 0 | 0.035 | 0.038 | 21.316 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 | |
5 | 676 | VAL | 0 | 0.029 | 0.012 | 20.718 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
6 | 677 | LEU | 0 | -0.021 | -0.003 | 17.266 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 | |
7 | 678 | GLU | -1 | -0.881 | -0.935 | 17.025 | 1.354 | 1.354 | 0.000 | 0.000 | 0.000 | 0.000 | |
8 | 679 | ALA | 0 | -0.010 | 0.000 | 18.066 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
9 | 680 | ILE | 0 | -0.059 | -0.027 | 16.224 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 | |
10 | 681 | GLU | -1 | -0.774 | -0.843 | 11.101 | 3.560 | 3.560 | 0.000 | 0.000 | 0.000 | 0.000 | |
11 | 682 | PRO | 0 | -0.080 | -0.028 | 10.156 | -0.194 | -0.194 | 0.000 | 0.000 | 0.000 | 0.000 | |
12 | 683 | GLY | 0 | 0.014 | 0.019 | 11.944 | 0.275 | 0.275 | 0.000 | 0.000 | 0.000 | 0.000 | |
13 | 684 | VAL | 0 | -0.020 | -0.014 | 9.677 | 0.423 | 0.423 | 0.000 | 0.000 | 0.000 | 0.000 | |
14 | 685 | VAL | 0 | -0.063 | -0.023 | 6.752 | -0.763 | -0.763 | 0.000 | 0.000 | 0.000 | 0.000 | |
15 | 686 | CYS | 0 | -0.009 | -0.015 | 7.260 | 0.982 | 0.982 | 0.000 | 0.000 | 0.000 | 0.000 | |
16 | 687 | ALA | 0 | 0.011 | 0.000 | 6.054 | -0.702 | -0.702 | 0.000 | 0.000 | 0.000 | 0.000 | |
17 | 688 | GLY | 0 | -0.004 | 0.006 | 7.413 | -0.776 | -0.776 | 0.000 | 0.000 | 0.000 | 0.000 | |
18 | 689 | HIS | 1 | 0.834 | 0.903 | 9.326 | 2.093 | 2.093 | 0.000 | 0.000 | 0.000 | 0.000 | |
19 | 690 | ASP | -1 | -0.766 | -0.877 | 11.114 | -0.708 | -0.708 | 0.000 | 0.000 | 0.000 | 0.000 | |
20 | 691 | ASN | 0 | -0.076 | -0.065 | 12.360 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
21 | 692 | ASN | 0 | -0.066 | -0.011 | 15.809 | 0.245 | 0.245 | 0.000 | 0.000 | 0.000 | 0.000 | |
22 | 693 | GLN | 0 | 0.028 | 0.033 | 16.088 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 | |
23 | 694 | PRO | 0 | 0.008 | -0.013 | 16.822 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
24 | 695 | ASP | -1 | -0.787 | -0.869 | 13.563 | -0.991 | -0.991 | 0.000 | 0.000 | 0.000 | 0.000 | |
25 | 696 | SER | 0 | -0.054 | -0.039 | 12.968 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
26 | 697 | PHE | 0 | -0.039 | -0.019 | 7.509 | -0.198 | -0.198 | 0.000 | 0.000 | 0.000 | 0.000 | |
27 | 698 | ALA | 0 | 0.064 | 0.031 | 8.201 | -0.726 | -0.726 | 0.000 | 0.000 | 0.000 | 0.000 | |
28 | 699 | ALA | 0 | 0.036 | 0.022 | 9.023 | -0.664 | -0.664 | 0.000 | 0.000 | 0.000 | 0.000 | |
29 | 700 | LEU | 0 | -0.064 | -0.037 | 7.531 | -0.470 | -0.470 | 0.000 | 0.000 | 0.000 | 0.000 | |
30 | 701 | LEU | 0 | -0.001 | -0.010 | 2.437 | -1.529 | -1.060 | 0.733 | -0.174 | -1.028 | -0.001 | |
31 | 702 | SER | 0 | 0.071 | 0.036 | 4.178 | -3.829 | -3.667 | 0.000 | -0.024 | -0.137 | 0.000 | |
32 | 703 | SER | 0 | 0.002 | 0.028 | 6.235 | -0.249 | -0.249 | 0.000 | 0.000 | 0.000 | 0.000 | |
33 | 704 | LEU | 0 | -0.016 | -0.009 | 2.445 | -4.062 | -0.217 | 1.645 | -1.266 | -4.224 | 0.008 | |
34 | 705 | ASN | 0 | -0.008 | 0.049 | 1.512 | -42.017 | -53.469 | 37.120 | -16.107 | -9.561 | -0.100 | |
35 | 706 | GLU | -1 | -0.707 | -0.813 | 3.078 | -3.457 | -3.748 | 0.099 | 0.788 | -0.595 | 0.000 | |
36 | 707 | LEU | 0 | -0.071 | -0.030 | 2.303 | -1.180 | 0.916 | 1.256 | -0.671 | -2.682 | 0.000 | |
37 | 708 | GLY | 0 | 0.007 | -0.009 | 2.706 | -0.493 | 1.337 | 0.820 | -0.917 | -1.732 | -0.007 | |
38 | 709 | GLU | -1 | -0.782 | -0.907 | 3.210 | -0.689 | -0.763 | 0.122 | 0.347 | -0.395 | 0.000 | |
39 | 710 | ARG | 1 | 0.803 | 0.889 | 6.469 | 4.842 | 4.842 | 0.000 | 0.000 | 0.000 | 0.000 | |
40 | 711 | GLN | 0 | -0.006 | -0.037 | 2.335 | 3.997 | 6.038 | 4.266 | -1.907 | -4.400 | -0.010 | |
41 | 712 | LEU | 0 | 0.018 | 0.022 | 6.256 | 1.554 | 1.554 | 0.000 | 0.000 | 0.000 | 0.000 | |
42 | 713 | VAL | 0 | 0.052 | 0.029 | 8.697 | 0.700 | 0.700 | 0.000 | 0.000 | 0.000 | 0.000 | |
43 | 714 | HIS | 1 | 0.839 | 0.908 | 9.095 | -0.215 | -0.215 | 0.000 | 0.000 | 0.000 | 0.000 | |
44 | 715 | VAL | 0 | 0.020 | 0.020 | 7.910 | 0.296 | 0.296 | 0.000 | 0.000 | 0.000 | 0.000 | |
45 | 716 | VAL | 0 | 0.023 | 0.012 | 10.820 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 | |
46 | 717 | LYS | 1 | 0.898 | 0.937 | 14.007 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 | |
47 | 718 | TRP | 0 | 0.009 | 0.011 | 12.203 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 | |
48 | 719 | ALA | 0 | 0.034 | 0.013 | 14.198 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
49 | 720 | LYS | 1 | 0.941 | 0.964 | 15.762 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 | |
50 | 721 | ALA | 0 | -0.015 | 0.019 | 18.176 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 | |
51 | 722 | LEU | 0 | 0.012 | 0.026 | 15.432 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
52 | 723 | PRO | 0 | -0.033 | 0.006 | 19.598 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
53 | 724 | GLY | 0 | 0.116 | 0.058 | 22.507 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
54 | 725 | PHE | 0 | -0.005 | 0.005 | 18.004 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
55 | 726 | ARG | 1 | 0.924 | 0.951 | 22.283 | -0.429 | -0.429 | 0.000 | 0.000 | 0.000 | 0.000 | |
56 | 727 | ASN | 0 | -0.075 | -0.030 | 25.230 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
57 | 728 | LEU | 0 | -0.020 | 0.010 | 20.591 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 | |
58 | 729 | HIS | 1 | 0.915 | 0.951 | 24.956 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
59 | 730 | VAL | 0 | 0.065 | 0.017 | 22.967 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
60 | 731 | ASP | -1 | -0.805 | -0.917 | 21.583 | -0.197 | -0.197 | 0.000 | 0.000 | 0.000 | 0.000 | |
61 | 732 | ASP | -1 | -0.707 | -0.801 | 20.313 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 | |
62 | 733 | GLN | 0 | -0.031 | -0.007 | 19.669 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 | |
63 | 734 | MET | 0 | -0.021 | -0.011 | 17.324 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
64 | 735 | ALA | 0 | 0.048 | 0.027 | 15.600 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
65 | 736 | VAL | 0 | -0.022 | -0.011 | 15.110 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 | |
66 | 737 | ILE | 0 | -0.015 | -0.009 | 12.435 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 | |
67 | 738 | GLN | 0 | 0.012 | 0.000 | 11.018 | 0.356 | 0.356 | 0.000 | 0.000 | 0.000 | 0.000 | |
68 | 739 | TYR | 0 | -0.010 | -0.011 | 10.142 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | |
69 | 740 | SER | 0 | 0.010 | 0.005 | 10.532 | 0.335 | 0.335 | 0.000 | 0.000 | 0.000 | 0.000 | |
70 | 741 | TRP | 0 | 0.016 | 0.014 | 2.853 | 0.802 | 1.603 | 0.113 | -0.149 | -0.765 | 0.000 | |
71 | 742 | MET | 0 | 0.007 | 0.020 | 2.568 | -0.730 | 1.677 | 1.401 | -1.016 | -2.792 | 0.011 | |
72 | 743 | GLY | 0 | 0.037 | 0.007 | 3.883 | 2.771 | 2.916 | 0.001 | -0.021 | -0.125 | 0.000 | |
73 | 744 | LEU | 0 | -0.039 | -0.017 | 6.115 | 0.930 | 0.930 | 0.000 | 0.000 | 0.000 | 0.000 | |
74 | 745 | MET | 0 | -0.054 | 0.013 | 2.381 | -5.686 | -2.258 | 6.068 | -2.023 | -7.472 | 0.021 | |
75 | 746 | VAL | 0 | 0.024 | 0.014 | 2.671 | 3.531 | 6.518 | 2.856 | -1.685 | -4.158 | 0.008 | |
76 | 747 | PHE | 0 | -0.006 | -0.018 | 3.356 | -0.723 | -0.725 | 0.084 | 0.192 | -0.275 | 0.002 | |
77 | 748 | ALA | 0 | -0.002 | -0.008 | 5.077 | -0.839 | -0.838 | -0.001 | -0.006 | 0.005 | 0.000 | |
78 | 749 | MET | 0 | -0.053 | 0.009 | 2.375 | -7.614 | -4.533 | 2.953 | -1.914 | -4.119 | 0.018 | |
79 | 750 | GLY | 0 | 0.054 | 0.011 | 4.428 | -3.144 | -2.972 | 0.001 | -0.042 | -0.131 | 0.000 | |
80 | 751 | TRP | 0 | 0.055 | 0.019 | 7.328 | -1.437 | -1.437 | 0.000 | 0.000 | 0.000 | 0.000 | |
81 | 752 | ARG | 1 | 0.841 | 0.907 | 2.586 | -19.446 | -18.082 | 1.673 | -1.009 | -2.027 | 0.012 | |
82 | 753 | SER | 0 | 0.001 | -0.007 | 7.122 | -1.162 | -1.162 | 0.000 | 0.000 | 0.000 | 0.000 | |
83 | 754 | PHE | 0 | -0.070 | -0.016 | 9.503 | -0.814 | -0.814 | 0.000 | 0.000 | 0.000 | 0.000 | |
84 | 755 | THR | 0 | 0.030 | 0.016 | 12.143 | -0.349 | -0.349 | 0.000 | 0.000 | 0.000 | 0.000 | |
85 | 756 | ASN | 0 | -0.054 | -0.003 | 10.416 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
86 | 757 | VAL | 0 | -0.009 | -0.018 | 11.431 | -0.375 | -0.375 | 0.000 | 0.000 | 0.000 | 0.000 | |
87 | 758 | ASN | 0 | 0.015 | 0.020 | 14.192 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
88 | 759 | SER | 0 | -0.035 | -0.040 | 11.710 | -0.305 | -0.305 | 0.000 | 0.000 | 0.000 | 0.000 | |
89 | 760 | ARG | 1 | 0.909 | 0.958 | 12.772 | -1.228 | -1.228 | 0.000 | 0.000 | 0.000 | 0.000 | |
90 | 761 | MET | 0 | -0.051 | -0.026 | 11.535 | -0.409 | -0.409 | 0.000 | 0.000 | 0.000 | 0.000 | |
91 | 762 | LEU | 0 | 0.002 | 0.010 | 6.087 | 0.267 | 0.267 | 0.000 | 0.000 | 0.000 | 0.000 | |
92 | 763 | TYR | 0 | 0.031 | -0.009 | 6.886 | -0.920 | -0.920 | 0.000 | 0.000 | 0.000 | 0.000 | |
93 | 764 | PHE | 0 | 0.017 | 0.006 | 2.475 | -3.560 | 0.944 | 3.936 | -2.488 | -5.952 | 0.023 | |
94 | 765 | ALA | 0 | 0.031 | 0.022 | 3.462 | 1.850 | 2.628 | 0.054 | -0.181 | -0.651 | -0.001 | |
95 | 766 | PRO | 0 | 0.009 | 0.020 | 6.187 | -0.492 | -0.492 | 0.000 | 0.000 | 0.000 | 0.000 | |
96 | 767 | ASP | -1 | -0.726 | -0.811 | 9.213 | -0.641 | -0.641 | 0.000 | 0.000 | 0.000 | 0.000 | |
97 | 768 | LEU | 0 | -0.003 | -0.007 | 5.258 | -0.861 | -0.861 | 0.000 | 0.000 | 0.000 | 0.000 | |
98 | 769 | VAL | 0 | 0.011 | 0.017 | 7.039 | 1.224 | 1.224 | 0.000 | 0.000 | 0.000 | 0.000 | |
99 | 770 | PHE | 0 | 0.013 | -0.016 | 6.870 | -0.693 | -0.693 | 0.000 | 0.000 | 0.000 | 0.000 | |
100 | 771 | ASN | 0 | 0.111 | 0.048 | 10.335 | 0.289 | 0.289 | 0.000 | 0.000 | 0.000 | 0.000 | |
101 | 772 | GLU | -1 | -0.854 | -0.951 | 12.876 | 1.008 | 1.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
102 | 773 | TYR | 0 | 0.029 | 0.014 | 14.736 | -0.220 | -0.220 | 0.000 | 0.000 | 0.000 | 0.000 | |
103 | 774 | ARG | 1 | 0.838 | 0.881 | 10.768 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 | |
104 | 775 | MET | 0 | -0.041 | -0.011 | 9.998 | -0.341 | -0.341 | 0.000 | 0.000 | 0.000 | 0.000 | |
105 | 776 | HIS | 1 | 0.919 | 0.972 | 10.750 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 | |
106 | 777 | LYS | 1 | 0.888 | 0.947 | 11.876 | 0.745 | 0.745 | 0.000 | 0.000 | 0.000 | 0.000 | |
107 | 778 | SER | 0 | 0.100 | 0.053 | 6.326 | -0.298 | -0.298 | 0.000 | 0.000 | 0.000 | 0.000 | |
108 | 779 | ARG | 1 | 0.894 | 0.942 | 7.164 | 1.353 | 1.353 | 0.000 | 0.000 | 0.000 | 0.000 | |
109 | 780 | MET | 0 | 0.033 | 0.034 | 3.960 | -1.451 | -0.838 | 0.028 | -0.130 | -0.511 | 0.000 | |
110 | 781 | TYR | 0 | 0.033 | 0.028 | 8.013 | 0.770 | 0.770 | 0.000 | 0.000 | 0.000 | 0.000 | |
111 | 782 | SER | 0 | 0.033 | 0.020 | 11.078 | 0.341 | 0.341 | 0.000 | 0.000 | 0.000 | 0.000 | |
112 | 783 | GLN | 0 | 0.116 | 0.053 | 6.470 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 | |
113 | 784 | CYS | 0 | -0.050 | -0.035 | 6.910 | 0.881 | 0.881 | 0.000 | 0.000 | 0.000 | 0.000 | |
114 | 785 | VAL | 0 | 0.006 | 0.011 | 7.872 | 0.409 | 0.409 | 0.000 | 0.000 | 0.000 | 0.000 | |
115 | 786 | ARG | 1 | 0.829 | 0.925 | 8.679 | -1.943 | -1.943 | 0.000 | 0.000 | 0.000 | 0.000 | |
116 | 787 | MET | 0 | 0.014 | 0.019 | 3.273 | -0.734 | 0.997 | 0.441 | -0.833 | -1.339 | 0.007 | |
117 | 788 | ARG | 1 | 0.981 | 1.006 | 7.448 | -1.796 | -1.796 | 0.000 | 0.000 | 0.000 | 0.000 | |
118 | 789 | HIS | 1 | 0.844 | 0.932 | 9.847 | -2.299 | -2.299 | 0.000 | 0.000 | 0.000 | 0.000 | |
119 | 790 | LEU | 0 | 0.033 | 0.008 | 7.199 | -0.166 | -0.166 | 0.000 | 0.000 | 0.000 | 0.000 | |
120 | 791 | SER | 0 | -0.025 | -0.006 | 8.888 | -0.333 | -0.333 | 0.000 | 0.000 | 0.000 | 0.000 | |
121 | 792 | GLN | 0 | 0.067 | 0.092 | 10.602 | -0.478 | -0.478 | 0.000 | 0.000 | 0.000 | 0.000 | |
122 | 793 | GLU | -1 | -0.876 | -0.936 | 13.623 | 1.789 | 1.789 | 0.000 | 0.000 | 0.000 | 0.000 | |
123 | 794 | PHE | 0 | -0.053 | -0.015 | 9.571 | -0.271 | -0.271 | 0.000 | 0.000 | 0.000 | 0.000 | |
124 | 795 | GLY | 0 | 0.006 | 0.015 | 14.889 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 | |
125 | 796 | TRP | 0 | -0.015 | -0.008 | 17.300 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 | |
126 | 797 | LEU | 0 | 0.007 | 0.003 | 17.239 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
127 | 798 | GLN | 0 | 0.016 | 0.008 | 19.692 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
128 | 799 | ILE | 0 | -0.042 | 0.033 | 15.396 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 | |
129 | 800 | THR | 0 | 0.087 | 0.041 | 17.826 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 | |
130 | 801 | PRO | 0 | 0.063 | 0.024 | 16.043 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 | |
131 | 802 | GLN | 0 | 0.010 | -0.011 | 16.407 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 | |
132 | 803 | GLU | -1 | -0.735 | -0.838 | 18.246 | 1.591 | 1.591 | 0.000 | 0.000 | 0.000 | 0.000 | |
133 | 804 | PHE | 0 | 0.014 | 0.009 | 9.120 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 | |
134 | 805 | LEU | 0 | 0.001 | 0.012 | 13.564 | 0.180 | 0.180 | 0.000 | 0.000 | 0.000 | 0.000 | |
135 | 806 | CYS | 0 | -0.018 | -0.001 | 15.083 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
136 | 807 | MET | 0 | -0.029 | 0.013 | 14.260 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
137 | 808 | LYS | 1 | 0.806 | 0.888 | 8.765 | -3.505 | -3.505 | 0.000 | 0.000 | 0.000 | 0.000 | |
138 | 809 | ALA | 0 | 0.014 | 0.003 | 12.348 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 | |
139 | 810 | LEU | 0 | 0.025 | 0.007 | 15.061 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 | |
140 | 811 | LEU | 0 | -0.015 | 0.009 | 8.835 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 | |
141 | 812 | LEU | 0 | -0.025 | 0.013 | 12.697 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
142 | 813 | PHE | 0 | -0.007 | -0.006 | 13.571 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 | |
143 | 814 | SER | 0 | -0.003 | -0.005 | 13.897 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 | |
144 | 815 | ILE | 0 | -0.037 | -0.016 | 12.390 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
145 | 816 | ILE | 0 | 0.030 | 0.040 | 15.601 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 | |
146 | 817 | PRO | 0 | 0.023 | 0.002 | 18.727 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
147 | 818 | VAL | 0 | -0.015 | -0.009 | 20.212 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 | |
148 | 819 | ASP | -1 | -0.951 | -0.960 | 22.864 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
149 | 820 | GLY | 0 | -0.022 | -0.004 | 23.926 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 | |
150 | 821 | LEU | 0 | -0.087 | -0.056 | 20.092 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 | |
151 | 822 | LYS | 1 | 0.906 | 0.947 | 23.559 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
152 | 823 | ASN | 0 | -0.085 | -0.037 | 26.072 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
153 | 824 | GLN | 0 | 0.030 | 0.010 | 23.583 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
154 | 825 | LYS | 1 | 1.018 | 1.011 | 26.408 | -0.169 | -0.169 | 0.000 | 0.000 | 0.000 | 0.000 | |
155 | 826 | PHE | 0 | 0.007 | 0.010 | 26.943 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
156 | 827 | PHE | 0 | 0.027 | 0.019 | 18.750 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
157 | 828 | ASP | -1 | -0.821 | -0.874 | 23.473 | 0.570 | 0.570 | 0.000 | 0.000 | 0.000 | 0.000 | |
158 | 829 | GLU | -1 | -0.849 | -0.922 | 25.521 | 0.553 | 0.553 | 0.000 | 0.000 | 0.000 | 0.000 | |
159 | 830 | LEU | 0 | 0.006 | 0.016 | 21.724 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 | |
160 | 831 | ARG | 1 | 0.861 | 0.923 | 17.925 | -1.067 | -1.067 | 0.000 | 0.000 | 0.000 | 0.000 | |
161 | 832 | MET | 0 | -0.025 | 0.000 | 22.013 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 | |
162 | 833 | ASN | 0 | -0.031 | -0.033 | 25.167 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
163 | 834 | TYR | 0 | 0.063 | 0.010 | 19.167 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
164 | 835 | ILE | 0 | -0.028 | -0.007 | 21.380 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
165 | 836 | LYS | 1 | 1.001 | 1.006 | 22.694 | -0.626 | -0.626 | 0.000 | 0.000 | 0.000 | 0.000 | |
166 | 837 | GLU | -1 | -0.788 | -0.822 | 22.692 | 0.870 | 0.870 | 0.000 | 0.000 | 0.000 | 0.000 | |
167 | 838 | LEU | 0 | 0.018 | 0.000 | 19.077 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
168 | 839 | ASP | -1 | -0.878 | -0.932 | 22.348 | 0.931 | 0.931 | 0.000 | 0.000 | 0.000 | 0.000 | |
169 | 840 | ARG | 1 | 0.826 | 0.913 | 25.832 | -0.804 | -0.804 | 0.000 | 0.000 | 0.000 | 0.000 | |
170 | 841 | ILE | 0 | -0.010 | -0.005 | 21.659 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
171 | 842 | ILE | 0 | -0.014 | 0.012 | 22.352 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 | |
172 | 843 | ALA | 0 | 0.051 | 0.013 | 25.372 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
173 | 844 | CYS | 0 | -0.019 | 0.005 | 26.682 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
174 | 845 | LYS | 1 | 0.898 | 0.938 | 25.465 | -0.976 | -0.976 | 0.000 | 0.000 | 0.000 | 0.000 | |
175 | 846 | ARG | 1 | 0.835 | 0.904 | 24.719 | -1.096 | -1.096 | 0.000 | 0.000 | 0.000 | 0.000 | |
176 | 847 | LYS | 1 | 0.984 | 0.996 | 31.390 | -0.579 | -0.579 | 0.000 | 0.000 | 0.000 | 0.000 | |
177 | 848 | ASN | 0 | -0.065 | -0.045 | 33.710 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
178 | 849 | PRO | 0 | 0.074 | 0.059 | 33.625 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
179 | 850 | THR | 0 | 0.079 | 0.026 | 32.492 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
180 | 851 | SER | 0 | 0.002 | 0.006 | 30.456 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
181 | 852 | CYS | 0 | 0.030 | 0.013 | 28.243 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
182 | 853 | SER | 0 | 0.051 | 0.027 | 27.115 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 | |
183 | 854 | ARG | 1 | 0.965 | 0.992 | 26.659 | -0.912 | -0.912 | 0.000 | 0.000 | 0.000 | 0.000 | |
184 | 855 | ARG | 1 | 0.746 | 0.859 | 20.881 | -1.435 | -1.435 | 0.000 | 0.000 | 0.000 | 0.000 | |
185 | 856 | PHE | 0 | 0.059 | 0.019 | 22.728 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 | |
186 | 857 | TYR | 0 | 0.012 | 0.018 | 22.341 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 | |
187 | 858 | GLN | 0 | 0.007 | -0.007 | 20.986 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
188 | 859 | LEU | 0 | 0.032 | 0.014 | 18.153 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 | |
189 | 860 | THR | 0 | 0.030 | 0.012 | 17.252 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 | |
190 | 861 | LYS | 1 | 0.871 | 0.949 | 17.850 | -1.223 | -1.223 | 0.000 | 0.000 | 0.000 | 0.000 | |
191 | 862 | LEU | 0 | 0.028 | 0.025 | 13.471 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
192 | 863 | LEU | 0 | 0.035 | 0.043 | 12.747 | 0.273 | 0.273 | 0.000 | 0.000 | 0.000 | 0.000 | |
193 | 864 | ASP | -1 | -0.702 | -0.808 | 13.016 | 1.634 | 1.634 | 0.000 | 0.000 | 0.000 | 0.000 | |
194 | 865 | SER | 0 | -0.069 | -0.066 | 13.080 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
195 | 866 | VAL | 0 | 0.056 | 0.045 | 7.495 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 | |
196 | 867 | GLN | 0 | 0.008 | 0.035 | 8.996 | 0.360 | 0.360 | 0.000 | 0.000 | 0.000 | 0.000 | |
197 | 868 | PRO | 0 | 0.045 | 0.030 | 10.919 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
198 | 869 | ILE | 0 | 0.015 | 0.021 | 5.732 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 | |
199 | 870 | ALA | 0 | 0.041 | 0.024 | 6.367 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 | |
200 | 871 | ARG | 1 | 0.927 | 0.974 | 7.431 | -1.021 | -1.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
201 | 872 | GLU | -1 | -0.864 | -0.941 | 8.871 | 1.349 | 1.349 | 0.000 | 0.000 | 0.000 | 0.000 | |
202 | 873 | LEU | 0 | -0.052 | -0.041 | 2.708 | -2.530 | -0.735 | 0.482 | -0.671 | -1.605 | 0.006 | |
203 | 874 | HIS | 0 | 0.004 | -0.004 | 5.274 | -0.901 | -0.901 | 0.000 | 0.000 | 0.000 | 0.000 | |
204 | 875 | GLN | 0 | 0.034 | 0.013 | 6.700 | -0.898 | -0.898 | 0.000 | 0.000 | 0.000 | 0.000 | |
205 | 876 | PHE | 0 | -0.008 | 0.013 | 2.598 | -1.404 | -0.649 | 0.465 | -0.138 | -1.082 | 0.001 | |
206 | 877 | THR | 0 | 0.010 | -0.003 | 2.072 | 0.132 | -4.342 | 9.641 | -1.260 | -3.907 | -0.002 | |
207 | 878 | PHE | 0 | 0.047 | 0.024 | 4.167 | -1.576 | -1.379 | 0.001 | -0.036 | -0.163 | 0.000 | |
208 | 879 | ASP | -1 | -0.833 | -0.908 | 7.240 | -1.885 | -1.885 | 0.000 | 0.000 | 0.000 | 0.000 | |
209 | 880 | LEU | 0 | -0.048 | -0.023 | 2.850 | -0.293 | 0.145 | 0.090 | -0.091 | -0.437 | 0.000 | |
210 | 881 | LEU | 0 | 0.016 | 0.007 | 5.900 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
211 | 882 | ILE | 0 | -0.034 | -0.001 | 7.203 | 0.554 | 0.554 | 0.000 | 0.000 | 0.000 | 0.000 | |
212 | 883 | LYS | 1 | 0.908 | 0.961 | 9.014 | 3.077 | 3.077 | 0.000 | 0.000 | 0.000 | 0.000 | |
213 | 884 | SER | 0 | 0.007 | 0.009 | 8.063 | 0.441 | 0.441 | 0.000 | 0.000 | 0.000 | 0.000 | |
214 | 885 | HIS | 1 | 0.993 | 0.986 | 9.673 | 2.372 | 2.372 | 0.000 | 0.000 | 0.000 | 0.000 | |
215 | 886 | MET | 0 | -0.069 | -0.023 | 13.024 | 0.284 | 0.284 | 0.000 | 0.000 | 0.000 | 0.000 | |
216 | 887 | VAL | 0 | -0.065 | -0.027 | 8.945 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 | |
217 | 888 | SER | 0 | -0.011 | -0.002 | 11.387 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 | |
218 | 889 | VAL | 0 | -0.048 | -0.018 | 5.177 | -0.169 | -0.169 | 0.000 | 0.000 | 0.000 | 0.000 | |
219 | 890 | ASP | -1 | -0.885 | -0.935 | 8.456 | -4.140 | -4.140 | 0.000 | 0.000 | 0.000 | 0.000 | |
220 | 891 | PHE | 0 | -0.076 | -0.067 | 2.803 | -3.422 | -2.850 | 0.100 | -0.129 | -0.542 | -0.001 | |
221 | 892 | PRO | 0 | -0.016 | 0.005 | 5.805 | 0.951 | 0.951 | 0.000 | 0.000 | 0.000 | 0.000 | |
222 | 893 | GLU | -1 | -0.883 | -0.957 | 8.147 | -2.976 | -2.976 | 0.000 | 0.000 | 0.000 | 0.000 | |
223 | 894 | MET | 0 | -0.007 | 0.005 | 8.646 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 | |
224 | 895 | MET | 0 | -0.062 | -0.009 | 3.722 | -1.635 | -1.080 | 0.078 | -0.131 | -0.501 | -0.001 | |
225 | 896 | ALA | 0 | 0.031 | 0.012 | 5.990 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 | |
226 | 897 | GLU | -1 | -0.916 | -0.925 | 8.076 | -1.286 | -1.286 | 0.000 | 0.000 | 0.000 | 0.000 | |
227 | 898 | ILE | 0 | 0.013 | -0.006 | 7.168 | 0.585 | 0.585 | 0.000 | 0.000 | 0.000 | 0.000 | |
228 | 899 | ILE | 0 | -0.027 | -0.026 | 2.875 | 0.166 | 0.604 | 0.250 | -0.129 | -0.559 | -0.001 | |
229 | 900 | SER | 0 | -0.005 | -0.018 | 7.242 | 0.645 | 0.645 | 0.000 | 0.000 | 0.000 | 0.000 | |
230 | 901 | VAL | 0 | -0.020 | 0.002 | 10.617 | 0.436 | 0.436 | 0.000 | 0.000 | 0.000 | 0.000 | |
231 | 902 | GLN | 0 | 0.060 | 0.019 | 10.534 | 0.507 | 0.507 | 0.000 | 0.000 | 0.000 | 0.000 | |
232 | 903 | VAL | 0 | -0.013 | 0.009 | 6.240 | 0.384 | 0.384 | 0.000 | 0.000 | 0.000 | 0.000 | |
233 | 904 | PRO | 0 | 0.046 | 0.018 | 9.715 | 0.389 | 0.389 | 0.000 | 0.000 | 0.000 | 0.000 | |
234 | 905 | LYS | 1 | 0.861 | 0.947 | 12.619 | 0.738 | 0.738 | 0.000 | 0.000 | 0.000 | 0.000 | |
235 | 906 | ILE | 0 | 0.009 | 0.016 | 10.370 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 | |
236 | 907 | LEU | 0 | -0.049 | -0.012 | 9.366 | 0.180 | 0.180 | 0.000 | 0.000 | 0.000 | 0.000 | |
237 | 908 | SER | 0 | -0.062 | -0.019 | 13.553 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
238 | 909 | GLY | 0 | -0.023 | -0.011 | 16.398 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
239 | 910 | LYS | 1 | 0.982 | 0.997 | 17.848 | 0.408 | 0.408 | 0.000 | 0.000 | 0.000 | 0.000 | |
240 | 911 | VAL | 0 | 0.027 | 0.035 | 15.047 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 | |
241 | 912 | LYS | 1 | 0.952 | 1.015 | 16.328 | -0.346 | -0.346 | 0.000 | 0.000 | 0.000 | 0.000 | |
242 | 913 | PRO | 0 | -0.004 | 0.003 | 14.209 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 | |
243 | 914 | ILE | 0 | 0.006 | 0.021 | 16.100 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 | |
244 | 915 | TYR | 0 | -0.071 | -0.022 | 15.450 | 0.274 | 0.274 | 0.000 | 0.000 | 0.000 | 0.000 | |
245 | 916 | PHE | 0 | -0.005 | -0.009 | 18.025 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
246 | 917 | HIS | 1 | 0.801 | 0.896 | 20.353 | -1.258 | -1.258 | 0.000 | 0.000 | 0.000 | 0.000 | |
247 | 918 | WAT | 0 | -0.011 | -0.033 | 14.044 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
248 | 919 | WAT | 0 | 0.021 | 0.015 | 2.404 | -4.949 | -4.300 | 2.038 | -1.113 | -1.574 | 0.009 | |
249 | 920 | WAT | 0 | -0.017 | -0.010 | 8.068 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 | |
250 | 921 | WAT | 0 | 0.039 | 0.017 | 15.417 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
251 | 922 | WAT | 0 | -0.016 | -0.023 | 15.705 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
252 | 923 | WAT | 0 | 0.029 | 0.012 | 27.431 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
253 | 924 | WAT | 0 | -0.030 | -0.042 | 8.844 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 | |
254 | 925 | WAT | 0 | 0.022 | 0.010 | 19.112 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
255 | 926 | WAT | 0 | 0.006 | 0.003 | 12.105 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
256 | 927 | WAT | 0 | -0.023 | -0.049 | 21.818 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
257 | 928 | WAT | 0 | -0.019 | -0.028 | 9.658 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 | |
258 | 929 | WAT | 0 | -0.028 | -0.019 | 13.865 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 | |
259 | 930 | WAT | 0 | -0.014 | -0.011 | 24.077 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
260 | 931 | WAT | 0 | -0.006 | -0.019 | 26.329 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
261 | 932 | WAT | 0 | -0.004 | -0.016 | 4.068 | -0.098 | -0.045 | 0.000 | -0.013 | -0.040 | 0.000 | |
262 | 933 | WAT | 0 | -0.068 | -0.059 | 16.901 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 | |
263 | 934 | WAT | 0 | -0.009 | -0.019 | 11.863 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
264 | 935 | WAT | 0 | 0.007 | 0.000 | 9.120 | -0.270 | -0.270 | 0.000 | 0.000 | 0.000 | 0.000 | |
265 | 936 | WAT | 0 | -0.012 | -0.037 | 13.183 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
266 | 937 | WAT | 0 | -0.017 | -0.032 | 12.111 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
267 | 938 | WAT | 0 | -0.030 | -0.037 | 25.163 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
268 | 939 | WAT | 0 | -0.028 | -0.037 | 15.636 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 | |
269 | 940 | WAT | 0 | -0.046 | -0.033 | 12.202 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
270 | 941 | WAT | 0 | -0.036 | -0.045 | 17.114 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
271 | 942 | WAT | 0 | 0.059 | 0.035 | 10.666 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
272 | 943 | WAT | 0 | -0.034 | -0.024 | 15.679 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
273 | 944 | WAT | 0 | 0.010 | 0.011 | 27.917 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
274 | 945 | WAT | 0 | 0.003 | -0.002 | 6.284 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 | |
275 | 946 | WAT | 0 | 0.014 | 0.012 | 11.368 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 | |
276 | 947 | WAT | 0 | -0.043 | -0.022 | 22.476 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
277 | 948 | WAT | 0 | 0.029 | 0.015 | 30.571 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
278 | 949 | WAT | 0 | 0.014 | 0.023 | 15.039 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
279 | 950 | WAT | 0 | 0.009 | 0.008 | 14.801 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
280 | 951 | WAT | 0 | -0.033 | -0.047 | 22.147 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 | |
281 | 952 | WAT | 0 | -0.002 | -0.014 | 18.992 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 | |
282 | 953 | WAT | 0 | -0.035 | -0.025 | 16.846 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
283 | 954 | WAT | 0 | -0.016 | -0.024 | 11.304 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 | |
284 | 955 | WAT | 0 | -0.026 | -0.009 | 20.265 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
285 | 956 | WAT | 0 | -0.027 | -0.010 | 13.919 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 | |
286 | 957 | WAT | 0 | 0.016 | 0.001 | 11.057 | 0.201 | 0.201 | 0.000 | 0.000 | 0.000 | 0.000 | |
287 | 958 | WAT | 0 | -0.010 | -0.008 | 11.034 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 | |
288 | 959 | WAT | 0 | 0.009 | 0.002 | 10.172 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
289 | 960 | WAT | 0 | 0.019 | 0.005 | 21.854 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
290 | 961 | WAT | 0 | -0.079 | -0.090 | 15.446 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 | |
291 | 962 | WAT | 0 | -0.052 | -0.055 | 29.181 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
292 | 963 | WAT | 0 | 0.020 | 0.005 | 20.223 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
293 | 964 | WAT | 0 | -0.024 | -0.022 | 24.691 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
294 | 965 | WAT | 0 | -0.025 | -0.023 | 12.090 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 | |
295 | 966 | WAT | 0 | 0.020 | 0.027 | 7.684 | 0.803 | 0.803 | 0.000 | 0.000 | 0.000 | 0.000 | |
296 | 967 | WAT | 0 | -0.019 | -0.021 | 17.890 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
297 | 968 | WAT | 0 | 0.048 | 0.034 | 8.029 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 | |
298 | 969 | WAT | 0 | -0.007 | -0.003 | 19.561 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
299 | 970 | WAT | 0 | 0.028 | 0.049 | 27.011 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 | |
300 | 971 | WAT | 0 | -0.027 | -0.033 | 18.664 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
301 | 972 | WAT | 0 | 0.002 | -0.012 | 11.704 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
302 | 973 | WAT | 0 | -0.038 | -0.028 | 7.260 | 0.383 | 0.383 | 0.000 | 0.000 | 0.000 | 0.000 | |
303 | 974 | WAT | 0 | 0.015 | 0.001 | 13.714 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
304 | 975 | WAT | 0 | 0.009 | -0.008 | 12.895 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
305 | 976 | WAT | 0 | -0.049 | -0.041 | 11.989 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
306 | 977 | WAT | 0 | -0.011 | 0.004 | 22.778 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
307 | 978 | WAT | 0 | 0.030 | 0.020 | 14.277 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
308 | 979 | WAT | 0 | 0.003 | 0.000 | 10.392 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 | |
309 | 980 | WAT | 0 | -0.073 | -0.093 | 24.115 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
310 | 981 | WAT | 0 | 0.054 | 0.033 | 21.183 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
311 | 982 | WAT | 0 | -0.021 | -0.025 | 11.591 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
312 | 983 | WAT | 0 | -0.043 | -0.043 | 9.981 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 | |
313 | 984 | WAT | 0 | -0.030 | -0.029 | 28.114 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
314 | 985 | WAT | 0 | -0.032 | -0.029 | 6.212 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 | |
315 | 986 | WAT | 0 | 0.013 | 0.004 | 15.413 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 | |
316 | 987 | WAT | 0 | 0.011 | 0.004 | 27.713 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
317 | 988 | WAT | 0 | 0.019 | -0.002 | 8.824 | 0.295 | 0.295 | 0.000 | 0.000 | 0.000 | 0.000 | |
318 | 989 | WAT | 0 | -0.014 | -0.015 | 11.967 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 | |
319 | 990 | WAT | 0 | -0.028 | -0.023 | 26.976 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
320 | 991 | WAT | 0 | 0.048 | 0.037 | 25.516 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
321 | 992 | WAT | 0 | -0.011 | -0.032 | 14.463 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
322 | 993 | WAT | 0 | -0.033 | -0.023 | 16.576 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
323 | 994 | WAT | 0 | -0.029 | -0.055 | 17.186 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
324 | 995 | WAT | 0 | 0.034 | 0.038 | 13.876 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
325 | 996 | WAT | 0 | -0.049 | -0.048 | 11.269 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 | |
326 | 997 | WAT | 0 | 0.035 | 0.021 | 13.103 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 | |
327 | 998 | WAT | 0 | -0.018 | -0.026 | 5.995 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 | |
328 | 999 | WAT | 0 | -0.046 | -0.037 | 17.578 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
329 | 1000 | WAT | 0 | -0.022 | -0.017 | 11.303 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
330 | 1001 | WAT | 0 | -0.031 | -0.031 | 10.530 | 0.296 | 0.296 | 0.000 | 0.000 | 0.000 | 0.000 | |
331 | 1002 | WAT | 0 | 0.004 | 0.001 | 16.005 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
332 | 1003 | WAT | 0 | -0.042 | -0.046 | 15.446 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
333 | 1004 | WAT | 0 | 0.012 | -0.001 | 13.139 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
334 | 1005 | WAT | 0 | 0.011 | 0.019 | 13.253 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 | |
335 | 1006 | WAT | 0 | 0.021 | 0.007 | 10.280 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
336 | 1007 | WAT | 0 | -0.006 | -0.019 | 14.142 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
337 | 1008 | WAT | 0 | 0.013 | 0.015 | 15.001 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
338 | 1009 | WAT | 0 | 0.023 | 0.007 | 14.173 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
339 | 1010 | WAT | 0 | 0.037 | 0.014 | 30.783 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
340 | 1011 | WAT | 0 | -0.025 | -0.013 | 19.112 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
341 | 1012 | WAT | 0 | 0.037 | 0.020 | 16.659 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
342 | 1013 | WAT | 0 | 0.003 | -0.003 | 12.090 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
343 | 1014 | WAT | 0 | -0.029 | -0.029 | 13.484 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
344 | 1015 | WAT | 0 | -0.009 | -0.012 | 8.844 | -0.205 | -0.205 | 0.000 | 0.000 | 0.000 | 0.000 | |
345 | 1016 | WAT | 0 | 0.046 | 0.023 | 12.242 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 | |
346 | 1017 | WAT | 0 | 0.051 | 0.034 | 10.133 | -0.286 | -0.286 | 0.000 | 0.000 | 0.000 | 0.000 | |
347 | 1018 | WAT | 0 | 0.006 | 0.004 | 4.293 | -0.854 | -0.766 | 0.000 | -0.021 | -0.068 | 0.000 | |
348 | 1019 | WAT | 0 | -0.011 | -0.021 | 23.001 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
349 | 1020 | WAT | 0 | -0.004 | 0.006 | 21.933 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
350 | 1021 | WAT | 0 | 0.020 | 0.028 | 26.660 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
351 | 1022 | WAT | 0 | -0.072 | -0.088 | 24.531 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
352 | 1023 | WAT | 0 | -0.020 | -0.014 | 31.706 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
353 | 1024 | WAT | 0 | -0.019 | -0.009 | 32.687 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
354 | 1025 | WAT | 0 | -0.018 | -0.008 | 26.104 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 | |
355 | 1026 | WAT | 0 | -0.032 | -0.044 | 20.956 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 | |
356 | 1027 | WAT | 0 | 0.006 | -0.002 | 12.865 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
357 | 1028 | WAT | 0 | -0.011 | -0.006 | 15.062 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |