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: XYNN2
Calculation Name: 1G2Q-A-Xray30
Preferred Name:
Target Type:
Ligand Name:
Ligand 3-letter code:
Ligand of Interest (LOI):
Structure Source: PDB
PDB ID: 1G2Q
Chain ID: A
UniProt ID: P49435
Base Structure: X-ray
Registration Date: 2018-09-06
Reference:
Apendix: None
Modeling method
| Optimization | MOE:Amber10:EHT |
|---|---|
| Restraint | OptH |
| Protonation | MOE:Protonate 3D |
| Complement | Missing residues were capped by ACE, NME. Missing atoms were corrected by Structure prepareation by MOE. |
| Water | Apo structure with with a 3 angstrom solvent shell. |
| Procedure | Auto-FMO protocol ver. 1.20180227 |
| Remarks |
FMO calculation
| FMO method | FMO2-MP2/6-31G(d) |
|---|---|
| Fragmentation | Auto |
| Number of fragment | 283 |
| LigandResidueName | |
| LigandFragmentNumber | 0 |
| LigandCharge | |
| Software | MIZUHO/ABINIT-MP 3.0 |
Total energy (hartree)
| FMO2-HF: Electronic energy | -2159770.521969 |
|---|---|
| FMO2-HF: Nuclear repulsion | 2084428.322944 |
| FMO2-HF: Total energy | -75342.199025 |
| FMO2-MP2: Total energy | -75563.085676 |
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:1:MET)
Summations of interaction energy for
fragment #1(A:1:MET)
| 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. |
| 0.044 | 4.86 | 2.74 | -2.445 | -5.11 | -0.003 |
Interaction energy analysis for fragmet #1(A:1:MET)
| 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 | 3 | ILE | 0 | 0.104 | 0.041 | 2.547 | -2.106 | 0.437 | 0.609 | -0.859 | -2.292 | -0.001 |
| 4 | A | 4 | ALA | 0 | -0.009 | 0.004 | 2.081 | -0.055 | 1.231 | 2.124 | -1.327 | -2.083 | -0.002 |
| 5 | A | 5 | SER | 0 | -0.036 | -0.019 | 3.221 | 1.318 | 2.054 | 0.009 | -0.237 | -0.508 | 0.000 |
| 6 | A | 6 | TYR | 0 | 0.016 | 0.012 | 5.025 | 0.336 | 0.469 | -0.001 | -0.007 | -0.125 | 0.000 |
| 7 | A | 7 | ALA | 0 | 0.056 | 0.030 | 7.381 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
| 8 | A | 8 | GLN | 0 | -0.064 | -0.033 | 6.845 | 0.331 | 0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
| 9 | A | 9 | GLU | -1 | -0.843 | -0.925 | 9.058 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
| 10 | A | 10 | LEU | 0 | 0.002 | 0.004 | 11.131 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
| 11 | A | 11 | LYS | 1 | 0.971 | 0.986 | 12.078 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
| 12 | A | 12 | LEU | 0 | -0.032 | -0.014 | 12.908 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 13 | A | 13 | ALA | 0 | -0.012 | 0.011 | 15.463 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 14 | A | 14 | LEU | 0 | -0.042 | 0.002 | 16.845 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 15 | A | 15 | HIS | 0 | -0.069 | -0.021 | 19.354 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
| 16 | A | 16 | GLN | 0 | 0.002 | 0.004 | 21.936 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 17 | A | 17 | TYR | 0 | -0.092 | -0.068 | 24.526 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 18 | A | 18 | PRO | 0 | 0.024 | 0.005 | 28.139 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 19 | A | 19 | ASN | 0 | -0.009 | 0.011 | 30.131 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 20 | A | 20 | PHE | 0 | 0.025 | 0.045 | 29.297 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 21 | A | 21 | PRO | 0 | -0.030 | -0.020 | 29.607 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 22 | A | 22 | SER | 0 | 0.048 | 0.011 | 32.564 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 23 | A | 23 | GLU | -1 | -0.888 | -0.952 | 33.315 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 24 | A | 24 | GLY | 0 | 0.005 | -0.003 | 33.010 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 25 | A | 25 | ILE | 0 | -0.073 | -0.012 | 28.134 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 26 | A | 26 | LEU | 0 | -0.017 | 0.000 | 24.533 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 27 | A | 27 | PHE | 0 | -0.010 | -0.011 | 25.310 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 28 | A | 28 | GLU | -1 | -0.760 | -0.882 | 20.631 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 29 | A | 29 | ASP | -1 | -0.795 | -0.900 | 22.834 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 30 | A | 30 | PHE | 0 | 0.037 | -0.005 | 19.359 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 31 | A | 31 | LEU | 0 | -0.010 | -0.010 | 21.056 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 32 | A | 32 | PRO | 0 | -0.013 | -0.007 | 20.997 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 33 | A | 33 | ILE | 0 | 0.027 | 0.026 | 16.642 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 34 | A | 34 | PHE | 0 | -0.015 | -0.007 | 19.574 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 35 | A | 35 | ARG | 1 | 0.845 | 0.923 | 22.310 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 36 | A | 36 | ASN | 0 | 0.031 | 0.029 | 19.369 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 37 | A | 37 | PRO | 0 | 0.092 | 0.049 | 19.880 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 38 | A | 38 | GLY | 0 | 0.022 | 0.020 | 17.809 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 39 | A | 39 | LEU | 0 | 0.006 | 0.002 | 14.665 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 40 | A | 40 | PHE | 0 | 0.004 | -0.002 | 15.633 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
| 41 | A | 41 | GLN | 0 | 0.000 | 0.006 | 14.708 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 42 | A | 42 | LYS | 1 | 0.930 | 0.973 | 10.796 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 43 | A | 43 | LEU | 0 | 0.001 | 0.008 | 11.430 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
| 44 | A | 44 | ILE | 0 | -0.035 | -0.020 | 12.959 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 45 | A | 45 | ASP | -1 | -0.777 | -0.891 | 10.124 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
| 46 | A | 46 | ALA | 0 | -0.024 | -0.011 | 8.233 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
| 47 | A | 47 | PHE | 0 | -0.005 | -0.013 | 9.072 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
| 48 | A | 48 | LYS | 1 | 0.925 | 0.971 | 11.635 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
| 49 | A | 49 | LEU | 0 | 0.031 | 0.022 | 4.083 | -0.191 | -0.073 | -0.001 | -0.015 | -0.102 | 0.000 |
| 50 | A | 50 | HIS | 1 | 0.821 | 0.909 | 8.372 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
| 51 | A | 51 | LEU | 0 | -0.001 | -0.012 | 9.298 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 52 | A | 52 | GLU | -1 | -0.907 | -0.935 | 10.294 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
| 53 | A | 53 | GLU | -1 | -0.963 | -0.968 | 5.990 | 0.346 | 0.346 | 0.000 | 0.000 | 0.000 | 0.000 |
| 54 | A | 54 | ALA | 0 | -0.048 | -0.023 | 10.024 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
| 55 | A | 55 | PHE | 0 | -0.050 | -0.034 | 12.407 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
| 56 | A | 56 | PRO | 0 | -0.033 | -0.008 | 12.668 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 57 | A | 57 | GLU | -1 | -0.940 | -0.973 | 15.343 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
| 58 | A | 58 | VAL | 0 | -0.064 | -0.026 | 18.652 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 59 | A | 59 | LYS | 1 | 0.949 | 0.992 | 19.655 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
| 60 | A | 60 | ILE | 0 | 0.062 | 0.037 | 17.110 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 61 | A | 61 | ASP | -1 | -0.782 | -0.862 | 21.589 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
| 62 | A | 62 | TYR | 0 | 0.011 | -0.003 | 24.255 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 63 | A | 63 | ILE | 0 | 0.026 | 0.038 | 19.001 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 64 | A | 64 | VAL | 0 | 0.001 | -0.013 | 22.822 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 65 | A | 65 | GLY | 0 | 0.025 | 0.013 | 24.123 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 66 | A | 66 | LEU | 0 | -0.017 | -0.010 | 25.115 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 67 | A | 67 | GLU | -1 | -0.817 | -0.855 | 26.982 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 68 | A | 68 | SER | 0 | 0.011 | -0.018 | 29.150 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 69 | A | 69 | ARG | 1 | 0.934 | 0.956 | 24.462 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 70 | A | 70 | GLY | 0 | 0.079 | 0.049 | 23.043 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 71 | A | 71 | PHE | 0 | -0.078 | -0.049 | 23.677 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 72 | A | 72 | LEU | 0 | -0.008 | 0.003 | 23.661 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 73 | A | 73 | PHE | 0 | 0.015 | 0.006 | 17.732 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 74 | A | 74 | GLY | 0 | 0.043 | 0.036 | 20.221 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 75 | A | 75 | PRO | 0 | -0.032 | -0.015 | 21.706 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 76 | A | 76 | THR | 0 | 0.012 | 0.008 | 19.722 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 77 | A | 77 | LEU | 0 | 0.008 | 0.010 | 15.307 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 78 | A | 78 | ALA | 0 | 0.009 | 0.002 | 18.728 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 79 | A | 79 | LEU | 0 | 0.036 | 0.017 | 21.388 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 80 | A | 80 | ALA | 0 | -0.039 | -0.010 | 17.472 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 81 | A | 81 | LEU | 0 | -0.035 | -0.022 | 15.206 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 82 | A | 82 | GLY | 0 | -0.033 | 0.008 | 18.806 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 83 | A | 83 | VAL | 0 | -0.040 | -0.005 | 21.186 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 84 | A | 84 | GLY | 0 | 0.038 | 0.030 | 23.670 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 85 | A | 85 | PHE | 0 | 0.016 | -0.001 | 24.094 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 86 | A | 86 | VAL | 0 | 0.012 | 0.012 | 26.402 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 87 | A | 87 | PRO | 0 | -0.056 | -0.007 | 27.842 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 88 | A | 88 | VAL | 0 | 0.083 | 0.053 | 29.296 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 89 | A | 89 | ARG | 1 | 0.815 | 0.878 | 30.904 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 90 | A | 90 | LYS | 1 | 0.989 | 0.996 | 33.484 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 91 | A | 91 | ALA | 0 | -0.015 | -0.012 | 35.941 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 92 | A | 92 | GLY | 0 | -0.023 | -0.012 | 39.174 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 93 | A | 93 | LYS | 1 | 0.804 | 0.922 | 36.533 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
| 94 | A | 94 | LEU | 0 | 0.003 | 0.013 | 34.636 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 95 | A | 95 | PRO | 0 | 0.020 | 0.039 | 38.526 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 96 | A | 96 | GLY | 0 | 0.045 | 0.001 | 40.263 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 97 | A | 97 | GLU | -1 | -0.867 | -0.919 | 42.236 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 98 | A | 98 | CYS | 0 | -0.025 | -0.011 | 38.629 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 99 | A | 99 | PHE | 0 | 0.049 | 0.040 | 36.159 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 100 | A | 100 | LYS | 1 | 0.836 | 0.886 | 37.723 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 101 | A | 101 | ALA | 0 | 0.060 | 0.049 | 34.726 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 102 | A | 102 | THR | 0 | -0.002 | -0.011 | 36.726 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 103 | A | 103 | TYR | 0 | -0.004 | 0.044 | 32.990 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 104 | A | 104 | GLU | -1 | -0.942 | -0.979 | 35.615 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
| 105 | A | 105 | LYS | 1 | 0.884 | 0.949 | 35.737 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 106 | A | 106 | GLU | -1 | -0.831 | -0.931 | 37.688 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 107 | A | 107 | TYR | 0 | -0.014 | -0.013 | 39.994 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 108 | A | 108 | GLY | 0 | 0.008 | 0.005 | 41.437 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 109 | A | 109 | SER | 0 | -0.026 | -0.018 | 39.071 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 110 | A | 110 | ASP | -1 | -0.865 | -0.886 | 35.461 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 111 | A | 111 | LEU | 0 | 0.011 | 0.004 | 36.976 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 112 | A | 112 | PHE | 0 | -0.021 | -0.025 | 32.487 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 113 | A | 113 | GLU | -1 | -0.699 | -0.840 | 35.229 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
| 114 | A | 114 | ILE | 0 | 0.043 | 0.020 | 30.486 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 115 | A | 115 | GLN | 0 | -0.008 | -0.016 | 34.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 116 | A | 116 | LYS | 1 | 0.885 | 0.940 | 35.540 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 117 | A | 117 | ASN | 0 | -0.008 | -0.012 | 37.031 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 118 | A | 118 | ALA | 0 | -0.035 | -0.007 | 32.592 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 119 | A | 119 | ILE | 0 | 0.003 | 0.005 | 28.633 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 120 | A | 120 | PRO | 0 | -0.003 | 0.022 | 31.558 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 121 | A | 121 | ALA | 0 | 0.072 | 0.054 | 32.177 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 122 | A | 122 | GLY | 0 | -0.039 | -0.023 | 31.031 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 123 | A | 123 | SER | 0 | -0.066 | -0.051 | 28.122 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 124 | A | 124 | ASN | 0 | -0.023 | -0.015 | 23.143 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 125 | A | 125 | VAL | 0 | -0.017 | -0.027 | 23.668 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 126 | A | 126 | ILE | 0 | 0.024 | 0.037 | 17.868 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 127 | A | 127 | ILE | 0 | -0.008 | 0.005 | 21.121 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 128 | A | 128 | VAL | 0 | 0.004 | -0.002 | 18.640 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 129 | A | 129 | ASP | -1 | -0.726 | -0.884 | 20.403 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 130 | A | 130 | ASP | -1 | -0.793 | -0.911 | 20.094 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
| 131 | A | 131 | ILE | 0 | 0.006 | 0.001 | 20.002 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 132 | A | 132 | ILE | 0 | -0.044 | 0.021 | 19.718 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 133 | A | 133 | ALA | 0 | 0.043 | -0.007 | 22.543 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 134 | A | 134 | THR | 0 | -0.019 | -0.008 | 25.305 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 135 | A | 135 | GLY | 0 | 0.037 | 0.017 | 26.320 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 136 | A | 136 | GLY | 0 | 0.027 | 0.007 | 27.075 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 137 | A | 137 | SER | 0 | 0.037 | 0.022 | 27.861 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 138 | A | 138 | ALA | 0 | 0.005 | 0.008 | 24.933 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 139 | A | 139 | ALA | 0 | 0.015 | 0.013 | 26.882 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 140 | A | 140 | ALA | 0 | 0.017 | 0.018 | 28.999 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 141 | A | 141 | ALA | 0 | -0.019 | -0.017 | 27.610 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 142 | A | 142 | GLY | 0 | 0.034 | 0.021 | 27.913 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 143 | A | 143 | GLU | -1 | -0.795 | -0.906 | 28.591 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
| 144 | A | 144 | LEU | 0 | -0.089 | -0.043 | 31.717 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 145 | A | 145 | VAL | 0 | -0.019 | -0.012 | 27.230 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 146 | A | 146 | GLU | -1 | -0.945 | -0.969 | 30.446 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
| 147 | A | 147 | GLN | 0 | 0.042 | 0.037 | 32.237 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 148 | A | 148 | LEU | 0 | -0.079 | -0.018 | 31.624 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 149 | A | 149 | GLU | -1 | -0.905 | -0.947 | 33.658 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
| 150 | A | 150 | ALA | 0 | -0.044 | -0.006 | 28.819 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 151 | A | 151 | ASN | 0 | -0.009 | -0.009 | 25.972 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 152 | A | 152 | LEU | 0 | -0.044 | -0.023 | 23.239 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 153 | A | 153 | LEU | 0 | -0.016 | -0.001 | 19.559 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 154 | A | 154 | GLU | -1 | -0.798 | -0.901 | 14.764 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 155 | A | 155 | TYR | 0 | -0.008 | 0.017 | 18.887 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 156 | A | 156 | ASN | 0 | -0.083 | -0.053 | 15.041 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 157 | A | 157 | PHE | 0 | 0.017 | -0.008 | 16.498 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 158 | A | 158 | VAL | 0 | -0.002 | 0.014 | 15.601 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 159 | A | 159 | MET | 0 | -0.051 | -0.032 | 15.366 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 160 | A | 160 | GLU | -1 | -0.864 | -0.913 | 17.640 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 161 | A | 161 | LEU | 0 | -0.039 | -0.014 | 19.803 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 162 | A | 162 | ASP | -1 | -0.796 | -0.890 | 22.958 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
| 163 | A | 163 | PHE | 0 | -0.026 | -0.043 | 25.940 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 164 | A | 164 | LEU | 0 | -0.037 | -0.015 | 29.160 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 165 | A | 165 | LYS | 1 | 0.836 | 0.931 | 30.734 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
| 166 | A | 166 | GLY | 0 | 0.006 | 0.022 | 29.504 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 167 | A | 167 | ARG | 1 | 0.960 | 0.979 | 20.089 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
| 168 | A | 168 | SER | 0 | -0.040 | -0.018 | 27.889 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 169 | A | 169 | LYS | 1 | 0.934 | 0.955 | 27.038 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
| 170 | A | 170 | LEU | 0 | 0.017 | 0.019 | 22.592 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 171 | A | 171 | ASN | 0 | 0.007 | 0.000 | 25.006 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 172 | A | 172 | ALA | 0 | 0.041 | 0.020 | 21.918 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 173 | A | 173 | PRO | 0 | 0.009 | 0.029 | 17.073 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 174 | A | 174 | VAL | 0 | 0.006 | -0.017 | 17.280 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 175 | A | 175 | PHE | 0 | 0.003 | 0.012 | 9.267 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
| 176 | A | 176 | THR | 0 | -0.009 | -0.008 | 13.651 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 177 | A | 177 | LEU | 0 | -0.025 | -0.005 | 9.319 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
| 178 | A | 178 | LEU | 0 | -0.078 | -0.033 | 10.618 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
| 179 | A | 0 | NME | 0 | 0.007 | 0.008 | 12.885 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
| 180 | A | 305 | HOH | 0 | -0.005 | 0.004 | 32.840 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 181 | A | 306 | HOH | 0 | -0.049 | -0.043 | 24.814 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 182 | A | 307 | HOH | 0 | -0.015 | -0.016 | 25.044 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 183 | A | 308 | HOH | 0 | -0.006 | -0.008 | 30.552 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 184 | A | 310 | HOH | 0 | -0.003 | -0.001 | 22.948 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 185 | A | 314 | HOH | 0 | 0.008 | -0.015 | 37.589 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 186 | A | 315 | HOH | 0 | -0.025 | -0.026 | 24.260 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 187 | A | 316 | HOH | 0 | -0.019 | -0.019 | 23.904 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 188 | A | 317 | HOH | 0 | -0.041 | -0.026 | 25.810 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 189 | A | 320 | HOH | 0 | 0.020 | 0.004 | 39.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 190 | A | 321 | HOH | 0 | -0.005 | -0.017 | 32.700 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 191 | A | 324 | HOH | 0 | 0.000 | -0.005 | 22.972 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 192 | A | 326 | HOH | 0 | 0.009 | 0.014 | 25.308 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 193 | A | 328 | HOH | 0 | 0.003 | -0.011 | 25.984 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 194 | A | 332 | HOH | 0 | -0.010 | 0.006 | 32.491 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 195 | A | 334 | HOH | 0 | -0.036 | -0.026 | 27.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 196 | A | 342 | HOH | 0 | -0.049 | -0.041 | 40.754 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 197 | A | 345 | HOH | 0 | -0.002 | -0.007 | 43.198 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 198 | A | 347 | HOH | 0 | 0.012 | 0.009 | 30.471 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 199 | A | 348 | HOH | 0 | -0.048 | -0.050 | 36.893 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 200 | A | 350 | HOH | 0 | -0.035 | -0.034 | 28.114 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 201 | A | 351 | HOH | 0 | 0.016 | 0.009 | 26.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 202 | A | 353 | HOH | 0 | -0.037 | -0.023 | 41.931 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 203 | A | 355 | HOH | 0 | -0.013 | -0.013 | 26.266 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 204 | A | 356 | HOH | 0 | -0.033 | -0.026 | 42.096 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 205 | A | 359 | HOH | 0 | -0.008 | -0.008 | 21.010 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 206 | A | 362 | HOH | 0 | -0.021 | -0.019 | 15.355 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 207 | A | 367 | HOH | 0 | -0.008 | -0.003 | 36.601 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 208 | A | 370 | HOH | 0 | 0.034 | 0.025 | 27.096 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 209 | A | 372 | HOH | 0 | 0.008 | -0.005 | 26.440 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 210 | A | 375 | HOH | 0 | -0.012 | -0.007 | 20.833 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 211 | A | 376 | HOH | 0 | -0.006 | -0.006 | 34.898 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 212 | A | 377 | HOH | 0 | 0.028 | 0.021 | 45.167 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 213 | A | 379 | HOH | 0 | 0.037 | 0.023 | 22.530 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 214 | A | 380 | HOH | 0 | 0.010 | 0.010 | 29.770 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 215 | A | 383 | HOH | 0 | -0.053 | -0.028 | 38.745 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 216 | A | 385 | HOH | 0 | 0.049 | 0.034 | 35.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 217 | A | 386 | HOH | 0 | -0.026 | -0.026 | 31.807 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 218 | A | 388 | HOH | 0 | 0.032 | 0.018 | 29.547 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 219 | A | 392 | HOH | 0 | -0.032 | -0.034 | 13.190 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 220 | A | 393 | HOH | 0 | -0.025 | -0.006 | 39.464 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 221 | A | 395 | HOH | 0 | 0.007 | 0.007 | 27.985 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 222 | A | 401 | HOH | 0 | 0.006 | 0.009 | 36.983 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 223 | A | 403 | HOH | 0 | 0.021 | 0.017 | 40.684 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 224 | A | 405 | HOH | 0 | -0.038 | -0.033 | 32.027 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 225 | A | 407 | HOH | 0 | 0.022 | 0.008 | 28.514 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 226 | A | 408 | HOH | 0 | -0.070 | -0.055 | 26.674 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 227 | A | 409 | HOH | 0 | 0.003 | 0.002 | 26.797 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 228 | A | 410 | HOH | 0 | -0.036 | -0.017 | 27.462 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 229 | A | 411 | HOH | 0 | -0.011 | -0.023 | 32.745 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 230 | A | 413 | HOH | 0 | -0.005 | -0.002 | 14.961 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
| 231 | A | 415 | HOH | 0 | -0.013 | -0.012 | 29.497 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 232 | A | 417 | HOH | 0 | -0.022 | -0.020 | 38.322 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 233 | A | 420 | HOH | 0 | -0.022 | -0.017 | 18.817 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 234 | A | 426 | HOH | 0 | -0.036 | -0.030 | 40.923 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 235 | A | 427 | HOH | 0 | 0.021 | 0.016 | 17.544 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 236 | A | 429 | HOH | 0 | -0.030 | -0.030 | 19.368 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 237 | A | 431 | HOH | 0 | 0.026 | 0.022 | 23.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 238 | A | 435 | HOH | 0 | -0.002 | 0.003 | 23.501 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 239 | A | 436 | HOH | 0 | -0.037 | -0.024 | 19.306 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
| 240 | A | 440 | HOH | 0 | -0.012 | -0.015 | 23.703 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 241 | A | 441 | HOH | 0 | -0.029 | -0.025 | 36.628 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 242 | A | 445 | HOH | 0 | -0.014 | -0.010 | 20.317 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 243 | A | 448 | HOH | 0 | -0.044 | -0.027 | 23.754 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 244 | A | 450 | HOH | 0 | -0.006 | -0.018 | 38.599 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 245 | A | 455 | HOH | 0 | 0.005 | -0.017 | 30.529 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 246 | A | 457 | HOH | 0 | -0.015 | -0.007 | 19.864 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 247 | A | 458 | HOH | 0 | 0.004 | -0.003 | 23.019 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 248 | A | 461 | HOH | 0 | -0.012 | -0.005 | 39.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 249 | A | 468 | HOH | 0 | -0.048 | -0.036 | 22.742 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 250 | A | 469 | HOH | 0 | 0.003 | 0.002 | 24.847 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 251 | A | 476 | HOH | 0 | -0.022 | -0.021 | 24.676 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 252 | A | 477 | HOH | 0 | -0.046 | -0.029 | 9.734 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
| 253 | A | 480 | HOH | 0 | -0.059 | -0.046 | 29.536 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 254 | A | 483 | HOH | 0 | -0.008 | -0.014 | 9.142 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 255 | A | 488 | HOH | 0 | -0.030 | -0.019 | 23.816 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 256 | A | 493 | HOH | 0 | -0.010 | 0.003 | 44.905 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 257 | A | 497 | HOH | 0 | 0.024 | 0.015 | 13.175 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 258 | A | 499 | HOH | 0 | 0.007 | -0.003 | 28.447 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 259 | A | 504 | HOH | 0 | -0.047 | -0.028 | 39.613 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 260 | A | 511 | HOH | 0 | -0.051 | -0.039 | 17.840 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
| 261 | A | 517 | HOH | 0 | -0.066 | -0.052 | 17.695 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 262 | A | 518 | HOH | 0 | 0.006 | 0.005 | 29.071 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 263 | A | 529 | HOH | 0 | -0.048 | -0.035 | 12.852 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 264 | A | 530 | HOH | 0 | -0.023 | -0.013 | 39.849 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 265 | A | 535 | HOH | 0 | -0.038 | -0.029 | 21.287 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 266 | A | 537 | HOH | 0 | 0.031 | 0.023 | 29.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 267 | A | 541 | HOH | 0 | -0.037 | -0.028 | 24.811 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 268 | A | 546 | HOH | 0 | -0.054 | -0.032 | 27.179 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
| 269 | A | 551 | HOH | 0 | -0.026 | -0.017 | 36.211 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 270 | A | 552 | HOH | 0 | 0.008 | 0.011 | 25.319 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 271 | A | 553 | HOH | 0 | -0.068 | -0.049 | 14.411 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
| 272 | A | 555 | HOH | 0 | -0.047 | -0.023 | 41.916 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 273 | A | 556 | HOH | 0 | -0.006 | -0.007 | 25.995 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 274 | A | 557 | HOH | 0 | -0.027 | -0.015 | 35.715 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 275 | A | 565 | HOH | 0 | -0.034 | -0.026 | 33.749 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 276 | A | 566 | HOH | 0 | 0.039 | 0.028 | 16.875 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 277 | A | 567 | HOH | 0 | -0.051 | -0.031 | 35.169 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 278 | A | 572 | HOH | 0 | -0.051 | -0.028 | 13.669 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
| 279 | A | 578 | HOH | 0 | -0.020 | -0.018 | 28.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 280 | A | 602 | HOH | 0 | -0.060 | -0.048 | 17.040 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
| 281 | A | 603 | HOH | 0 | -0.005 | -0.003 | 42.524 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 282 | A | 604 | HOH | 0 | -0.023 | -0.014 | 36.329 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
| 283 | A | 605 | HOH | 0 | -0.008 | -0.007 | 29.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |