FMODB ID: XNNZQ
Calculation Name: 4OKW-A-Xray15
Preferred Name: Androgen Receptor
Target Type: SINGLE PROTEIN
Ligand Name: r-bicalutamide
ligand 3-letter code: 198
PDB ID: 4OKW
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 | 338 |
LigandCharge | 198=0 |
Software | MIZUHO/ABINIT-MP 4.0(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -3926379.104514 |
---|---|
FMO2-HF: Nuclear repulsion | 3815585.133274 |
FMO2-HF: Total energy | -110793.97124 |
FMO2-MP2: Total energy | -111105.884393 |
3D Structure
Ligand structure
198
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. |
-120.510 | -87.617 | 89.748 | -39.523 | -83.116 | -0.010 |
Interactive mode: IFIE and PIEDA for fragment #338(:1009:198)
Summations of interaction energy for
fragment #338(:1009:198)
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. |
-120.51 | -87.617 | 89.748 | -39.523 | -83.116 | 0.01 |
Interaction energy analysis for fragmet #338(:1009:198)
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 | 0.071 | 0.007 | 27.241 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
2 | 673 | PHE | 0 | -0.012 | 0.000 | 20.750 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
3 | 674 | LEU | 0 | 0.022 | -0.011 | 20.595 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
4 | 675 | ASN | 0 | 0.035 | 0.045 | 21.592 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 | |
5 | 676 | VAL | 0 | 0.032 | 0.037 | 21.163 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 | |
6 | 677 | LEU | 0 | -0.013 | -0.002 | 17.597 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
7 | 678 | GLU | -1 | -0.888 | -0.946 | 17.217 | 1.385 | 1.385 | 0.000 | 0.000 | 0.000 | 0.000 | |
8 | 679 | ALA | 0 | -0.008 | 0.002 | 18.139 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 | |
9 | 680 | ILE | 0 | -0.054 | -0.022 | 16.660 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
10 | 681 | GLU | -1 | -0.785 | -0.869 | 11.320 | 3.249 | 3.249 | 0.000 | 0.000 | 0.000 | 0.000 | |
11 | 682 | PRO | 0 | -0.082 | -0.032 | 10.161 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 | |
12 | 683 | GLY | 0 | -0.002 | 0.010 | 11.691 | 0.218 | 0.218 | 0.000 | 0.000 | 0.000 | 0.000 | |
13 | 684 | VAL | 0 | -0.022 | -0.022 | 9.819 | 0.419 | 0.419 | 0.000 | 0.000 | 0.000 | 0.000 | |
14 | 685 | VAL | 0 | -0.085 | -0.040 | 6.402 | -0.503 | -0.503 | 0.000 | 0.000 | 0.000 | 0.000 | |
15 | 686 | CYS | 0 | -0.021 | -0.020 | 7.230 | 0.499 | 0.499 | 0.000 | 0.000 | 0.000 | 0.000 | |
16 | 687 | ALA | 0 | -0.020 | -0.021 | 5.893 | -0.387 | -0.387 | 0.000 | 0.000 | 0.000 | 0.000 | |
17 | 688 | GLY | 0 | -0.019 | -0.007 | 7.309 | -0.314 | -0.314 | 0.000 | 0.000 | 0.000 | 0.000 | |
18 | 689 | HIS | 1 | 0.827 | 0.900 | 9.243 | 1.371 | 1.371 | 0.000 | 0.000 | 0.000 | 0.000 | |
19 | 690 | ASP | -1 | -0.741 | -0.841 | 11.027 | -0.377 | -0.377 | 0.000 | 0.000 | 0.000 | 0.000 | |
20 | 691 | ASN | 0 | -0.131 | -0.105 | 12.267 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
21 | 692 | ASN | 0 | -0.016 | -0.019 | 15.730 | 0.186 | 0.186 | 0.000 | 0.000 | 0.000 | 0.000 | |
22 | 693 | GLN | 0 | -0.004 | 0.011 | 16.192 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
23 | 694 | PRO | 0 | -0.012 | -0.002 | 17.188 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
24 | 695 | ASP | -1 | -0.798 | -0.885 | 13.266 | -0.831 | -0.831 | 0.000 | 0.000 | 0.000 | 0.000 | |
25 | 696 | SER | 0 | -0.016 | -0.013 | 13.294 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
26 | 697 | PHE | 0 | -0.025 | -0.028 | 7.467 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 | |
27 | 698 | ALA | 0 | 0.055 | 0.024 | 8.559 | -0.698 | -0.698 | 0.000 | 0.000 | 0.000 | 0.000 | |
28 | 699 | ALA | 0 | 0.037 | 0.034 | 9.001 | -0.574 | -0.574 | 0.000 | 0.000 | 0.000 | 0.000 | |
29 | 700 | LEU | 0 | -0.027 | -0.008 | 7.802 | -0.210 | -0.210 | 0.000 | 0.000 | 0.000 | 0.000 | |
30 | 701 | LEU | 0 | 0.004 | 0.004 | 4.251 | -0.945 | -0.744 | 0.000 | -0.016 | -0.184 | 0.000 | |
31 | 702 | SER | 0 | 0.058 | 0.034 | 4.361 | -2.611 | -2.508 | -0.001 | -0.012 | -0.090 | 0.000 | |
32 | 703 | SER | 0 | 0.036 | 0.038 | 6.038 | 0.542 | 0.542 | 0.000 | 0.000 | 0.000 | 0.000 | |
33 | 704 | LEU | 0 | 0.013 | 0.014 | 2.448 | -3.755 | 0.050 | 1.998 | -1.230 | -4.574 | 0.009 | |
34 | 705 | ASN | 0 | -0.010 | 0.030 | 1.487 | -41.062 | -54.665 | 42.720 | -18.380 | -10.738 | -0.099 | |
35 | 706 | GLU | -1 | -0.725 | -0.819 | 2.819 | 5.916 | 3.477 | 0.278 | 3.139 | -0.978 | -0.001 | |
36 | 707 | LEU | 0 | -0.067 | -0.033 | 2.163 | -1.236 | -0.150 | 2.906 | -0.846 | -3.146 | 0.000 | |
37 | 708 | GLY | 0 | 0.013 | 0.001 | 2.401 | -3.172 | -0.475 | 2.651 | -2.014 | -3.333 | 0.004 | |
38 | 709 | GLU | -1 | -0.748 | -0.868 | 3.200 | 0.992 | 0.476 | 0.123 | 1.148 | -0.755 | 0.001 | |
39 | 710 | ARG | 1 | 0.831 | 0.898 | 6.119 | 0.711 | 0.711 | 0.000 | 0.000 | 0.000 | 0.000 | |
40 | 711 | GLN | 0 | -0.012 | -0.025 | 2.692 | -1.812 | 0.520 | 1.628 | -1.299 | -2.661 | 0.001 | |
41 | 712 | LEU | 0 | 0.038 | 0.028 | 6.045 | 0.266 | 0.266 | 0.000 | 0.000 | 0.000 | 0.000 | |
42 | 713 | VAL | 0 | 0.001 | 0.006 | 8.034 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 | |
43 | 714 | HIS | 1 | 0.889 | 0.936 | 9.096 | -1.498 | -1.498 | 0.000 | 0.000 | 0.000 | 0.000 | |
44 | 715 | VAL | 0 | 0.026 | 0.023 | 8.056 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
45 | 716 | VAL | 0 | 0.006 | 0.005 | 10.505 | -0.167 | -0.167 | 0.000 | 0.000 | 0.000 | 0.000 | |
46 | 717 | LYS | 1 | 0.881 | 0.941 | 12.529 | -0.787 | -0.787 | 0.000 | 0.000 | 0.000 | 0.000 | |
47 | 718 | TRP | 0 | 0.021 | 0.000 | 11.605 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
48 | 719 | ALA | 0 | 0.031 | 0.020 | 12.714 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
49 | 720 | LYS | 1 | 0.905 | 0.941 | 14.804 | -0.525 | -0.525 | 0.000 | 0.000 | 0.000 | 0.000 | |
50 | 721 | ALA | 0 | 0.015 | 0.051 | 17.574 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 | |
51 | 722 | LEU | 0 | 0.013 | 0.023 | 15.714 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
52 | 723 | PRO | 0 | -0.032 | -0.013 | 19.517 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
53 | 724 | GLY | 0 | 0.101 | 0.029 | 21.476 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
54 | 725 | PHE | 0 | -0.005 | 0.009 | 13.565 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
55 | 726 | ARG | 1 | 0.901 | 0.942 | 19.057 | -0.476 | -0.476 | 0.000 | 0.000 | 0.000 | 0.000 | |
56 | 727 | ASN | 0 | -0.053 | -0.019 | 21.067 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
57 | 728 | LEU | 0 | -0.023 | 0.012 | 16.138 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
58 | 729 | HIS | 1 | 0.930 | 0.968 | 18.554 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
59 | 730 | VAL | 0 | 0.068 | 0.028 | 17.105 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
60 | 731 | ASP | -1 | -0.794 | -0.890 | 15.395 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 | |
61 | 732 | ASP | -1 | -0.689 | -0.792 | 13.893 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
62 | 733 | GLN | 0 | -0.015 | -0.006 | 13.362 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
63 | 734 | MET | 0 | -0.042 | -0.024 | 11.407 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 | |
64 | 735 | ALA | 0 | 0.029 | 0.026 | 9.433 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
65 | 736 | VAL | 0 | 0.006 | 0.001 | 8.487 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
66 | 737 | ILE | 0 | -0.013 | 0.013 | 7.986 | 0.140 | 0.140 | 0.000 | 0.000 | 0.000 | 0.000 | |
67 | 738 | GLN | 0 | 0.009 | -0.010 | 5.076 | 0.084 | 0.189 | -0.001 | -0.003 | -0.101 | 0.000 | |
68 | 739 | TYR | 0 | -0.021 | -0.006 | 3.816 | 0.237 | 0.415 | 0.002 | -0.040 | -0.140 | 0.000 | |
69 | 740 | SER | 0 | -0.004 | -0.014 | 5.785 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 | |
70 | 741 | LEU | 0 | 0.041 | 0.043 | 2.813 | -1.324 | 0.275 | 1.422 | -0.536 | -2.485 | 0.004 | |
71 | 742 | MET | 0 | -0.001 | 0.000 | 2.338 | -3.958 | 0.170 | 5.733 | -2.367 | -7.495 | 0.010 | |
72 | 743 | GLY | 0 | 0.020 | 0.003 | 3.322 | 3.631 | 3.929 | 0.045 | 0.062 | -0.406 | 0.000 | |
73 | 744 | LEU | 0 | -0.023 | -0.012 | 6.238 | 1.204 | 1.204 | 0.000 | 0.000 | 0.000 | 0.000 | |
74 | 745 | MET | 0 | -0.076 | -0.016 | 2.152 | -5.714 | -1.086 | 5.042 | -2.188 | -7.482 | 0.020 | |
75 | 746 | VAL | 0 | 0.027 | 0.019 | 2.560 | 1.962 | 5.413 | 1.353 | -1.722 | -3.081 | 0.010 | |
76 | 747 | PHE | 0 | 0.012 | -0.005 | 3.589 | -0.549 | -0.244 | 0.044 | -0.072 | -0.276 | 0.002 | |
77 | 748 | ALA | 0 | -0.001 | -0.006 | 5.610 | -0.526 | -0.526 | 0.000 | 0.000 | 0.000 | 0.000 | |
78 | 749 | MET | 0 | -0.044 | 0.006 | 2.454 | -5.219 | -3.843 | 2.918 | -1.194 | -3.100 | 0.012 | |
79 | 750 | GLY | 0 | 0.043 | 0.008 | 4.356 | -3.074 | -2.898 | 0.004 | -0.062 | -0.118 | 0.000 | |
80 | 751 | TRP | 0 | 0.065 | 0.023 | 7.388 | -1.215 | -1.215 | 0.000 | 0.000 | 0.000 | 0.000 | |
81 | 752 | ARG | 1 | 0.852 | 0.921 | 2.353 | -18.646 | -19.665 | 3.419 | -0.775 | -1.625 | 0.012 | |
82 | 753 | SER | 0 | 0.015 | 0.000 | 7.090 | -1.121 | -1.121 | 0.000 | 0.000 | 0.000 | 0.000 | |
83 | 754 | PHE | 0 | -0.044 | 0.002 | 9.386 | -0.785 | -0.785 | 0.000 | 0.000 | 0.000 | 0.000 | |
84 | 755 | THR | 0 | -0.002 | -0.006 | 11.560 | -0.460 | -0.460 | 0.000 | 0.000 | 0.000 | 0.000 | |
85 | 756 | ASN | 0 | -0.075 | -0.034 | 10.495 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
86 | 757 | VAL | 0 | 0.005 | 0.004 | 11.367 | -0.317 | -0.317 | 0.000 | 0.000 | 0.000 | 0.000 | |
87 | 758 | ASN | 0 | -0.005 | 0.013 | 14.174 | -0.241 | -0.241 | 0.000 | 0.000 | 0.000 | 0.000 | |
88 | 759 | SER | 0 | -0.026 | -0.028 | 12.050 | -0.288 | -0.288 | 0.000 | 0.000 | 0.000 | 0.000 | |
89 | 760 | ALA | 0 | -0.029 | -0.007 | 13.115 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
90 | 761 | MET | 0 | -0.063 | -0.039 | 11.933 | -0.319 | -0.319 | 0.000 | 0.000 | 0.000 | 0.000 | |
91 | 762 | LEU | 0 | -0.022 | -0.010 | 6.221 | 0.298 | 0.298 | 0.000 | 0.000 | 0.000 | 0.000 | |
92 | 763 | TYR | 0 | 0.068 | 0.024 | 7.050 | -0.802 | -0.802 | 0.000 | 0.000 | 0.000 | 0.000 | |
93 | 764 | PHE | 0 | -0.001 | 0.002 | 2.485 | -1.874 | 1.627 | 4.218 | -2.006 | -5.712 | 0.020 | |
94 | 765 | ALA | 0 | 0.054 | 0.041 | 3.921 | 1.564 | 2.067 | 0.018 | -0.088 | -0.433 | 0.000 | |
95 | 766 | PRO | 0 | 0.015 | 0.015 | 6.695 | -0.320 | -0.320 | 0.000 | 0.000 | 0.000 | 0.000 | |
96 | 767 | ASP | -1 | -0.715 | -0.833 | 8.999 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 | |
97 | 768 | LEU | 0 | -0.033 | -0.020 | 5.234 | -0.759 | -0.759 | 0.000 | 0.000 | 0.000 | 0.000 | |
98 | 769 | VAL | 0 | 0.037 | 0.027 | 7.533 | 1.027 | 1.027 | 0.000 | 0.000 | 0.000 | 0.000 | |
99 | 770 | PHE | 0 | -0.006 | -0.027 | 7.144 | -0.698 | -0.698 | 0.000 | 0.000 | 0.000 | 0.000 | |
100 | 771 | ASN | 0 | 0.102 | 0.051 | 10.691 | 0.285 | 0.285 | 0.000 | 0.000 | 0.000 | 0.000 | |
101 | 772 | GLU | -1 | -0.822 | -0.959 | 12.854 | 0.662 | 0.662 | 0.000 | 0.000 | 0.000 | 0.000 | |
102 | 773 | TYR | 0 | -0.002 | 0.012 | 14.702 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 | |
103 | 774 | ARG | 1 | 0.814 | 0.891 | 11.119 | -0.312 | -0.312 | 0.000 | 0.000 | 0.000 | 0.000 | |
104 | 775 | MET | 0 | -0.018 | -0.002 | 9.603 | -0.402 | -0.402 | 0.000 | 0.000 | 0.000 | 0.000 | |
105 | 776 | HIS | 1 | 0.923 | 0.978 | 11.064 | 0.281 | 0.281 | 0.000 | 0.000 | 0.000 | 0.000 | |
106 | 777 | LYS | 1 | 0.882 | 0.942 | 12.255 | 0.837 | 0.837 | 0.000 | 0.000 | 0.000 | 0.000 | |
107 | 778 | SER | 0 | 0.039 | 0.008 | 6.675 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 | |
108 | 779 | ARG | 1 | 0.900 | 0.951 | 7.590 | 1.677 | 1.677 | 0.000 | 0.000 | 0.000 | 0.000 | |
109 | 780 | MET | 0 | 0.002 | 0.018 | 4.292 | -1.241 | -0.895 | 0.005 | -0.045 | -0.305 | 0.000 | |
110 | 781 | TYR | 0 | 0.026 | 0.020 | 8.530 | 0.766 | 0.766 | 0.000 | 0.000 | 0.000 | 0.000 | |
111 | 782 | SER | 0 | 0.054 | 0.033 | 10.924 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 | |
112 | 783 | GLN | 0 | 0.040 | 0.015 | 6.699 | 0.458 | 0.458 | 0.000 | 0.000 | 0.000 | 0.000 | |
113 | 784 | CYS | 0 | -0.027 | -0.012 | 6.897 | 0.960 | 0.960 | 0.000 | 0.000 | 0.000 | 0.000 | |
114 | 785 | VAL | 0 | 0.037 | 0.029 | 7.870 | 0.510 | 0.510 | 0.000 | 0.000 | 0.000 | 0.000 | |
115 | 786 | ARG | 1 | 0.808 | 0.908 | 9.230 | -0.829 | -0.829 | 0.000 | 0.000 | 0.000 | 0.000 | |
116 | 787 | MET | 0 | -0.001 | 0.011 | 3.033 | -0.627 | 0.933 | 0.242 | -0.691 | -1.112 | 0.006 | |
117 | 788 | ARG | 1 | 0.986 | 1.006 | 7.709 | -1.348 | -1.348 | 0.000 | 0.000 | 0.000 | 0.000 | |
118 | 789 | HIS | 1 | 0.844 | 0.925 | 10.287 | -1.713 | -1.713 | 0.000 | 0.000 | 0.000 | 0.000 | |
119 | 790 | LEU | 0 | 0.030 | 0.012 | 7.703 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 | |
120 | 791 | SER | 0 | -0.002 | 0.000 | 9.164 | -0.260 | -0.260 | 0.000 | 0.000 | 0.000 | 0.000 | |
121 | 792 | GLN | 0 | 0.026 | -0.001 | 10.809 | -0.354 | -0.354 | 0.000 | 0.000 | 0.000 | 0.000 | |
122 | 793 | GLU | -1 | -0.841 | -0.914 | 13.913 | 1.356 | 1.356 | 0.000 | 0.000 | 0.000 | 0.000 | |
123 | 794 | PHE | 0 | -0.041 | -0.012 | 9.585 | -0.214 | -0.214 | 0.000 | 0.000 | 0.000 | 0.000 | |
124 | 795 | GLY | 0 | 0.021 | 0.018 | 15.061 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 | |
125 | 796 | TRP | 0 | -0.082 | -0.049 | 17.194 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 | |
126 | 797 | LEU | 0 | -0.011 | -0.003 | 17.243 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 | |
127 | 798 | GLN | 0 | -0.028 | -0.029 | 19.820 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 | |
128 | 799 | ILE | 0 | -0.063 | -0.010 | 15.757 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 | |
129 | 800 | THR | 0 | 0.034 | 0.000 | 18.056 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 | |
130 | 801 | PRO | 0 | 0.046 | 0.011 | 16.313 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 | |
131 | 802 | GLN | 0 | 0.047 | 0.015 | 16.849 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 | |
132 | 803 | GLU | -1 | -0.727 | -0.815 | 18.795 | 1.334 | 1.334 | 0.000 | 0.000 | 0.000 | 0.000 | |
133 | 804 | PHE | 0 | 0.002 | -0.006 | 9.505 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 | |
134 | 805 | LEU | 0 | 0.026 | 0.019 | 13.761 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 | |
135 | 806 | CYS | 0 | -0.007 | 0.001 | 15.577 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
136 | 807 | MET | 0 | -0.022 | 0.013 | 14.429 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 | |
137 | 808 | LYS | 1 | 0.798 | 0.889 | 9.339 | -3.168 | -3.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
138 | 809 | ALA | 0 | 0.000 | -0.005 | 12.764 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
139 | 810 | LEU | 0 | 0.003 | -0.015 | 15.014 | -0.143 | -0.143 | 0.000 | 0.000 | 0.000 | 0.000 | |
140 | 811 | LEU | 0 | -0.022 | 0.006 | 9.033 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 | |
141 | 812 | LEU | 0 | -0.055 | -0.003 | 10.718 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
142 | 813 | PHE | 0 | -0.028 | -0.011 | 11.841 | -0.239 | -0.239 | 0.000 | 0.000 | 0.000 | 0.000 | |
143 | 814 | SER | 0 | -0.001 | -0.020 | 12.623 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 | |
144 | 815 | ILE | 0 | -0.058 | -0.024 | 7.985 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
145 | 816 | ILE | 0 | 0.025 | 0.029 | 11.529 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
146 | 817 | PRO | 0 | 0.033 | 0.012 | 12.887 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
147 | 818 | VAL | 0 | -0.033 | -0.018 | 14.326 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 | |
148 | 819 | ASP | -1 | -0.928 | -0.964 | 17.346 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 | |
149 | 820 | GLY | 0 | -0.061 | -0.013 | 17.783 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
150 | 821 | LEU | 0 | -0.079 | -0.044 | 13.871 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 | |
151 | 822 | LYS | 1 | 0.846 | 0.898 | 17.341 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 | |
152 | 823 | ASN | 0 | -0.077 | -0.044 | 19.701 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
153 | 824 | GLN | 0 | -0.004 | -0.021 | 18.641 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
154 | 825 | LYS | 1 | 0.975 | 0.970 | 21.181 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
155 | 826 | PHE | 0 | 0.041 | 0.020 | 22.235 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
156 | 827 | PHE | 0 | 0.011 | 0.011 | 14.810 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
157 | 828 | ASP | -1 | -0.853 | -0.918 | 19.876 | 0.377 | 0.377 | 0.000 | 0.000 | 0.000 | 0.000 | |
158 | 829 | GLU | -1 | -0.938 | -0.977 | 22.055 | 0.453 | 0.453 | 0.000 | 0.000 | 0.000 | 0.000 | |
159 | 830 | LEU | 0 | 0.018 | 0.030 | 18.873 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 | |
160 | 831 | ARG | 1 | 0.872 | 0.921 | 16.821 | -0.719 | -0.719 | 0.000 | 0.000 | 0.000 | 0.000 | |
161 | 832 | MET | 0 | -0.022 | 0.002 | 20.332 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
162 | 833 | ASN | 0 | -0.038 | -0.031 | 23.916 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
163 | 834 | TYR | 0 | 0.083 | 0.024 | 19.273 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
164 | 835 | ILE | 0 | -0.009 | -0.007 | 20.975 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
165 | 836 | LYS | 1 | 0.972 | 0.996 | 22.789 | -0.519 | -0.519 | 0.000 | 0.000 | 0.000 | 0.000 | |
166 | 837 | GLU | -1 | -0.915 | -0.963 | 22.961 | 0.783 | 0.783 | 0.000 | 0.000 | 0.000 | 0.000 | |
167 | 838 | LEU | 0 | -0.036 | -0.007 | 19.111 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
168 | 839 | ASP | -1 | -0.884 | -0.952 | 22.461 | 0.755 | 0.755 | 0.000 | 0.000 | 0.000 | 0.000 | |
169 | 840 | ARG | 1 | 0.910 | 0.952 | 25.757 | -0.719 | -0.719 | 0.000 | 0.000 | 0.000 | 0.000 | |
170 | 841 | ILE | 0 | -0.033 | -0.012 | 21.738 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
171 | 842 | ILE | 0 | 0.010 | -0.005 | 22.488 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
172 | 843 | ALA | 0 | 0.031 | 0.015 | 26.194 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
173 | 844 | CYS | 0 | -0.058 | -0.027 | 26.518 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
174 | 845 | LYS | 1 | 0.926 | 0.953 | 25.650 | -0.867 | -0.867 | 0.000 | 0.000 | 0.000 | 0.000 | |
175 | 846 | ARG | 1 | 0.779 | 0.902 | 23.830 | -1.037 | -1.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
176 | 847 | LYS | 1 | 0.987 | 0.997 | 31.381 | -0.508 | -0.508 | 0.000 | 0.000 | 0.000 | 0.000 | |
177 | 848 | ASN | 0 | -0.056 | -0.038 | 33.921 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
178 | 849 | PRO | 0 | 0.075 | 0.056 | 33.777 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
179 | 850 | THR | 0 | 0.095 | 0.032 | 32.922 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
180 | 851 | SER | 0 | -0.028 | -0.013 | 28.669 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 | |
181 | 852 | CYS | 0 | -0.003 | 0.012 | 28.565 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
182 | 853 | SER | 0 | 0.069 | 0.043 | 27.621 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
183 | 854 | ARG | 1 | 1.015 | 1.009 | 27.341 | -0.704 | -0.704 | 0.000 | 0.000 | 0.000 | 0.000 | |
184 | 855 | ARG | 1 | 0.764 | 0.882 | 21.251 | -1.212 | -1.212 | 0.000 | 0.000 | 0.000 | 0.000 | |
185 | 856 | PHE | 0 | 0.094 | 0.045 | 22.876 | 0.106 | 0.106 | 0.000 | 0.000 | 0.000 | 0.000 | |
186 | 857 | TYR | 0 | 0.022 | 0.015 | 22.507 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 | |
187 | 858 | GLN | 0 | 0.010 | -0.014 | 21.177 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
188 | 859 | LEU | 0 | 0.005 | 0.007 | 18.311 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 | |
189 | 860 | THR | 0 | 0.007 | 0.023 | 17.409 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 | |
190 | 861 | LYS | 1 | 0.917 | 0.972 | 17.738 | -0.773 | -0.773 | 0.000 | 0.000 | 0.000 | 0.000 | |
191 | 862 | LEU | 0 | 0.042 | 0.056 | 13.565 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
192 | 863 | LEU | 0 | 0.037 | 0.036 | 13.160 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 | |
193 | 864 | ASP | -1 | -0.749 | -0.872 | 12.979 | 1.039 | 1.039 | 0.000 | 0.000 | 0.000 | 0.000 | |
194 | 865 | SER | 0 | -0.095 | -0.066 | 13.175 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
195 | 866 | VAL | 0 | 0.070 | 0.053 | 7.476 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
196 | 867 | GLN | 0 | 0.021 | 0.035 | 8.904 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
197 | 868 | PRO | 0 | 0.004 | 0.019 | 10.683 | -0.222 | -0.222 | 0.000 | 0.000 | 0.000 | 0.000 | |
198 | 869 | ILE | 0 | 0.032 | 0.022 | 5.951 | -0.328 | -0.328 | 0.000 | 0.000 | 0.000 | 0.000 | |
199 | 870 | ALA | 0 | 0.040 | 0.018 | 6.295 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 | |
200 | 871 | ARG | 1 | 0.934 | 0.984 | 6.937 | -0.243 | -0.243 | 0.000 | 0.000 | 0.000 | 0.000 | |
201 | 872 | GLU | -1 | -0.857 | -0.942 | 9.303 | -0.256 | -0.256 | 0.000 | 0.000 | 0.000 | 0.000 | |
202 | 873 | LEU | 0 | -0.008 | -0.006 | 2.909 | -2.384 | -0.975 | 0.198 | -0.429 | -1.178 | 0.003 | |
203 | 874 | HIS | 0 | 0.030 | 0.018 | 3.544 | -3.956 | -2.571 | 0.062 | -0.352 | -1.095 | 0.001 | |
204 | 875 | GLN | 0 | 0.003 | -0.005 | 6.296 | -1.236 | -1.236 | 0.000 | 0.000 | 0.000 | 0.000 | |
205 | 876 | PHE | 0 | -0.012 | -0.006 | 3.323 | -0.691 | -0.028 | 0.045 | -0.097 | -0.611 | 0.001 | |
206 | 877 | THR | 0 | -0.002 | -0.022 | 2.485 | -8.547 | -5.820 | 3.215 | -1.582 | -4.360 | -0.014 | |
207 | 878 | PHE | 0 | 0.026 | 0.014 | 4.427 | -0.550 | -0.340 | 0.000 | -0.025 | -0.185 | 0.000 | |
208 | 879 | ASP | -1 | -0.838 | -0.893 | 7.560 | -2.729 | -2.729 | 0.000 | 0.000 | 0.000 | 0.000 | |
209 | 880 | LEU | 0 | -0.064 | -0.024 | 3.209 | 0.510 | 0.833 | 0.022 | -0.060 | -0.285 | 0.000 | |
210 | 881 | LEU | 0 | 0.039 | 0.019 | 6.067 | 0.439 | 0.439 | 0.000 | 0.000 | 0.000 | 0.000 | |
211 | 882 | ILE | 0 | -0.031 | 0.001 | 7.653 | 0.876 | 0.876 | 0.000 | 0.000 | 0.000 | 0.000 | |
212 | 883 | LYS | 1 | 0.922 | 0.954 | 9.989 | 3.603 | 3.603 | 0.000 | 0.000 | 0.000 | 0.000 | |
213 | 884 | SER | 0 | -0.047 | -0.017 | 8.371 | 0.414 | 0.414 | 0.000 | 0.000 | 0.000 | 0.000 | |
214 | 885 | HIS | 1 | 0.930 | 0.942 | 10.046 | 2.909 | 2.909 | 0.000 | 0.000 | 0.000 | 0.000 | |
215 | 886 | MET | 0 | 0.020 | 0.020 | 13.622 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 | |
216 | 887 | VAL | 0 | -0.057 | -0.024 | 9.369 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 | |
217 | 888 | SER | 0 | -0.005 | 0.003 | 11.896 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 | |
218 | 889 | VAL | 0 | -0.059 | -0.019 | 5.642 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 | |
219 | 890 | ASP | -1 | -0.898 | -0.939 | 8.075 | -2.813 | -2.813 | 0.000 | 0.000 | 0.000 | 0.000 | |
220 | 891 | PHE | 0 | -0.009 | -0.020 | 2.707 | -3.638 | -2.409 | 0.116 | -0.266 | -1.080 | 0.000 | |
221 | 892 | PRO | 0 | 0.063 | 0.048 | 4.786 | 0.268 | 0.428 | -0.001 | -0.003 | -0.156 | 0.000 | |
222 | 893 | GLU | -1 | -0.881 | -0.951 | 6.861 | -1.308 | -1.308 | 0.000 | 0.000 | 0.000 | 0.000 | |
223 | 894 | MET | 0 | 0.007 | 0.000 | 7.534 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 | |
224 | 895 | MET | 0 | -0.025 | 0.000 | 2.597 | -4.318 | -1.981 | 3.247 | -1.143 | -4.441 | 0.009 | |
225 | 896 | ALA | 0 | 0.012 | 0.000 | 3.865 | -3.959 | -3.402 | 0.003 | -0.215 | -0.345 | -0.001 | |
226 | 897 | GLU | -1 | -0.848 | -0.895 | 6.221 | -1.679 | -1.679 | 0.000 | 0.000 | 0.000 | 0.000 | |
227 | 898 | ILE | 0 | -0.016 | -0.005 | 2.316 | -1.349 | -0.225 | 1.335 | -0.609 | -1.849 | 0.002 | |
228 | 899 | ILE | 0 | -0.053 | -0.031 | 2.159 | -2.521 | -0.931 | 3.180 | -1.078 | -3.691 | 0.000 | |
229 | 900 | SER | 0 | -0.007 | -0.012 | 3.917 | 1.084 | 1.216 | 0.004 | -0.044 | -0.091 | 0.000 | |
230 | 901 | VAL | 0 | 0.005 | 0.015 | 6.938 | 0.507 | 0.507 | 0.000 | 0.000 | 0.000 | 0.000 | |
231 | 902 | GLN | 0 | 0.000 | -0.015 | 4.907 | 0.415 | 0.530 | -0.001 | -0.002 | -0.112 | 0.000 | |
232 | 903 | VAL | 0 | -0.008 | 0.009 | 3.023 | -1.106 | 0.447 | 0.539 | -0.709 | -1.383 | 0.005 | |
233 | 904 | PRO | 0 | 0.061 | 0.031 | 5.477 | 0.309 | 0.357 | -0.001 | -0.002 | -0.045 | 0.000 | |
234 | 905 | LYS | 1 | 0.865 | 0.957 | 8.906 | 1.054 | 1.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
235 | 906 | ILE | 0 | 0.016 | 0.021 | 5.173 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 | |
236 | 907 | LEU | 0 | -0.073 | -0.029 | 8.368 | 0.224 | 0.224 | 0.000 | 0.000 | 0.000 | 0.000 | |
237 | 908 | SER | 0 | -0.049 | -0.036 | 10.812 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 | |
238 | 909 | GLY | 0 | -0.005 | 0.004 | 12.715 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
239 | 910 | LYS | 1 | 0.957 | 0.982 | 12.984 | 0.785 | 0.785 | 0.000 | 0.000 | 0.000 | 0.000 | |
240 | 911 | VAL | 0 | -0.002 | 0.024 | 9.099 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 | |
241 | 912 | LYS | 1 | 0.920 | 0.963 | 11.502 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
242 | 913 | PRO | 0 | 0.010 | 0.001 | 11.688 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
243 | 914 | ILE | 0 | 0.003 | 0.021 | 13.379 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
244 | 915 | TYR | 0 | -0.044 | -0.013 | 14.532 | 0.222 | 0.222 | 0.000 | 0.000 | 0.000 | 0.000 | |
245 | 916 | PHE | 0 | -0.007 | -0.027 | 18.001 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 | |
246 | 917 | HIS | 1 | 0.802 | 0.900 | 20.348 | -0.855 | -0.855 | 0.000 | 0.000 | 0.000 | 0.000 | |
247 | 918 | WAT | 0 | -0.017 | -0.040 | 14.392 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 | |
248 | 919 | WAT | 0 | -0.027 | -0.016 | 14.325 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
249 | 920 | WAT | 0 | -0.013 | -0.015 | 2.962 | -3.328 | -1.560 | 0.410 | -1.157 | -1.021 | -0.006 | |
250 | 921 | WAT | 0 | -0.001 | -0.012 | 11.723 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
251 | 922 | WAT | 0 | 0.014 | 0.006 | 3.125 | 1.468 | 2.175 | 0.608 | -0.505 | -0.811 | -0.001 | |
252 | 923 | WAT | 0 | -0.031 | -0.044 | 19.047 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
253 | 924 | WAT | 0 | -0.018 | -0.036 | 4.556 | -0.740 | -0.685 | 0.000 | -0.008 | -0.047 | 0.000 | |
254 | 925 | WAT | 0 | 0.004 | 0.018 | 15.158 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
255 | 926 | WAT | 0 | 0.043 | 0.038 | 10.356 | 0.287 | 0.287 | 0.000 | 0.000 | 0.000 | 0.000 | |
256 | 927 | WAT | 0 | -0.021 | -0.043 | 5.679 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
257 | 928 | WAT | 0 | -0.034 | -0.057 | 13.288 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
258 | 929 | WAT | 0 | 0.001 | -0.005 | 8.112 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 | |
259 | 930 | WAT | 0 | 0.047 | 0.022 | 15.270 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
260 | 931 | WAT | 0 | 0.021 | 0.016 | 12.185 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
261 | 932 | WAT | 0 | 0.009 | 0.002 | 20.383 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
262 | 933 | WAT | 0 | -0.039 | -0.035 | 22.450 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
263 | 934 | WAT | 0 | 0.034 | 0.027 | 25.002 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
264 | 935 | WAT | 0 | -0.016 | -0.028 | 13.921 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
265 | 936 | WAT | 0 | 0.046 | 0.028 | 19.199 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
266 | 937 | WAT | 0 | -0.028 | -0.022 | 9.258 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 | |
267 | 938 | WAT | 0 | 0.030 | 0.010 | 14.546 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
268 | 939 | WAT | 0 | -0.042 | -0.043 | 22.618 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
269 | 940 | WAT | 0 | 0.042 | 0.024 | 16.261 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
270 | 941 | WAT | 0 | 0.031 | 0.013 | 11.235 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
271 | 942 | WAT | 0 | 0.038 | 0.016 | 16.482 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
272 | 943 | WAT | 0 | -0.059 | -0.059 | 20.672 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
273 | 944 | WAT | 0 | 0.024 | 0.036 | 16.610 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
274 | 945 | WAT | 0 | 0.002 | -0.004 | 23.320 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
275 | 946 | WAT | 0 | -0.046 | -0.053 | 27.423 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
276 | 947 | WAT | 0 | 0.075 | 0.075 | 10.704 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
277 | 948 | WAT | 0 | -0.031 | -0.030 | 12.173 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 | |
278 | 949 | WAT | 0 | 0.015 | 0.019 | 13.727 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
279 | 950 | WAT | 0 | -0.036 | -0.032 | 14.909 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
280 | 951 | WAT | 0 | 0.027 | 0.016 | 7.760 | 0.649 | 0.649 | 0.000 | 0.000 | 0.000 | 0.000 | |
281 | 952 | WAT | 0 | 0.019 | 0.008 | 6.696 | -0.381 | -0.381 | 0.000 | 0.000 | 0.000 | 0.000 | |
282 | 953 | WAT | 0 | -0.029 | -0.030 | 11.191 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 | |
283 | 954 | WAT | 0 | -0.020 | -0.049 | 10.468 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 | |
284 | 955 | WAT | 0 | -0.049 | -0.046 | 11.775 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
285 | 956 | WAT | 0 | -0.025 | -0.035 | 12.134 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
286 | 957 | WAT | 0 | -0.030 | -0.029 | 9.883 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 | |
287 | 958 | WAT | 0 | 0.029 | 0.018 | 14.501 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
288 | 959 | WAT | 0 | 0.005 | 0.003 | 26.611 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
289 | 960 | WAT | 0 | 0.013 | 0.007 | 16.247 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
290 | 961 | WAT | 0 | -0.045 | -0.028 | 19.230 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
291 | 962 | WAT | 0 | 0.019 | 0.007 | 16.105 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
292 | 963 | WAT | 0 | -0.016 | -0.014 | 12.122 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
293 | 964 | WAT | 0 | 0.042 | 0.027 | 20.024 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
294 | 965 | WAT | 0 | 0.032 | 0.018 | 23.175 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
295 | 966 | WAT | 0 | -0.006 | 0.010 | 15.583 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 | |
296 | 967 | WAT | 0 | -0.030 | -0.035 | 9.819 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 | |
297 | 968 | WAT | 0 | 0.022 | 0.019 | 27.891 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
298 | 969 | WAT | 0 | 0.058 | 0.061 | 17.883 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
299 | 970 | WAT | 0 | -0.005 | -0.022 | 14.064 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
300 | 971 | WAT | 0 | -0.010 | -0.021 | 14.949 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
301 | 972 | WAT | 0 | 0.023 | 0.007 | 22.135 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
302 | 973 | WAT | 0 | -0.025 | -0.010 | 16.738 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
303 | 974 | WAT | 0 | 0.020 | 0.030 | 7.899 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 | |
304 | 975 | WAT | 0 | -0.023 | -0.032 | 12.383 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
305 | 976 | WAT | 0 | -0.011 | -0.010 | 12.503 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
306 | 977 | WAT | 0 | -0.037 | -0.036 | 6.461 | 0.449 | 0.449 | 0.000 | 0.000 | 0.000 | 0.000 | |
307 | 978 | WAT | 0 | -0.024 | -0.055 | 17.619 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
308 | 979 | WAT | 0 | 0.016 | 0.006 | 16.711 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
309 | 980 | WAT | 0 | -0.062 | -0.037 | 9.737 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
310 | 981 | WAT | 0 | -0.018 | -0.013 | 14.800 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
311 | 982 | WAT | 0 | -0.031 | -0.043 | 6.375 | 0.361 | 0.361 | 0.000 | 0.000 | 0.000 | 0.000 | |
312 | 983 | WAT | 0 | -0.010 | -0.013 | 14.160 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
313 | 984 | WAT | 0 | -0.035 | -0.043 | 17.079 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
314 | 985 | WAT | 0 | -0.009 | -0.005 | 20.806 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
315 | 986 | WAT | 0 | -0.013 | -0.009 | 15.869 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 | |
316 | 987 | WAT | 0 | -0.014 | -0.026 | 7.953 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
317 | 988 | WAT | 0 | 0.021 | 0.013 | 25.571 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
318 | 989 | WAT | 0 | 0.016 | 0.014 | 12.112 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
319 | 990 | WAT | 0 | 0.020 | 0.007 | 23.925 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
320 | 991 | WAT | 0 | -0.078 | -0.056 | 9.707 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
321 | 992 | WAT | 0 | -0.005 | -0.009 | 23.502 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 | |
322 | 993 | WAT | 0 | -0.027 | -0.017 | 27.964 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
323 | 994 | WAT | 0 | 0.037 | 0.028 | 25.388 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 | |
324 | 995 | WAT | 0 | 0.046 | 0.028 | 8.170 | 0.406 | 0.406 | 0.000 | 0.000 | 0.000 | 0.000 | |
325 | 996 | WAT | 0 | 0.029 | 0.014 | 26.733 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
326 | 997 | WAT | 0 | 0.020 | 0.008 | 23.245 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
327 | 998 | WAT | 0 | -0.058 | -0.053 | 12.761 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
328 | 999 | WAT | 0 | -0.017 | -0.010 | 15.363 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 | |
329 | 1000 | WAT | 0 | 0.008 | 0.002 | 14.133 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 | |
330 | 1001 | WAT | 0 | -0.019 | -0.016 | 12.325 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 | |
331 | 1002 | WAT | 0 | -0.015 | -0.005 | 14.161 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
332 | 1003 | WAT | 0 | -0.028 | -0.013 | 17.071 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
333 | 1004 | WAT | 0 | 0.006 | -0.009 | 12.769 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
334 | 1005 | WAT | 0 | 0.044 | 0.034 | 27.621 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
335 | 1006 | WAT | 0 | -0.026 | -0.014 | 11.895 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 | |
336 | 1007 | WAT | 0 | 0.035 | 0.042 | 18.082 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 | |
337 | 1008 | WAT | 0 | -0.035 | -0.042 | 19.143 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |