![FMODB](./images/FMODB-Logo_20190201-0_300ppi.png)
FMODB ID: XM94Z
Calculation Name: 3TPD-A-Xray34
Preferred Name:
Target Type:
Ligand Name: phosphate ion
ligand 3-letter code: PO4
PDB ID: 3TPD
Chain ID: A
UniProt ID: P23874
Base Structure: X-ray
Registration Date: 2018-09-07
Reference:
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 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 637 |
LigandCharge | CL-=-1,PO4=-3 |
Software | MIZUHO/ABINIT-MP 3.0 |
Total energy (hartree)
FMO2-HF: Electronic energy | -8382222.56308 |
---|---|
FMO2-HF: Nuclear repulsion | 8207722.788891 |
FMO2-HF: Total energy | -174499.774188 |
FMO2-MP2: Total energy | -175004.267358 |
3D Structure
Ligand structure
![ligand structure](./Kdata/F002249/ligand_interaction/ligand_F002249.png)
Ligand Interaction
![ligand interaction](./Kdata/F002249/ligand_interaction/ligand_interaction_F002249.png)
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:ACE)
Summations of interaction energy for
fragment #1(A:1:ACE)
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. |
9.906 | 1.773 | 7.43 | 2.356 | -1.654 | -0.017 |
Interaction energy analysis for fragmet #1(A:1:ACE)
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 | LYS | 1 | 0.912 | 0.922 | 3.791 | 2.719 | 3.479 | -0.003 | -0.299 | -0.459 | 0.000 |
4 | A | 4 | LEU | 0 | 0.019 | 0.028 | 5.972 | 0.016 | 0.024 | -0.001 | -0.007 | 0.000 | 0.000 |
5 | A | 5 | VAL | 0 | -0.011 | -0.001 | 9.170 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 6 | THR | 0 | -0.007 | -0.006 | 11.307 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 7 | TRP | 0 | 0.020 | 0.003 | 13.556 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 8 | MET | 0 | 0.028 | 0.049 | 17.752 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 9 | ASN | 0 | -0.046 | -0.036 | 21.461 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 10 | ASN | 0 | -0.002 | -0.005 | 20.967 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 11 | GLN | 0 | 0.027 | 0.023 | 21.338 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 12 | ARG | 1 | 0.901 | 0.951 | 11.235 | 0.274 | 0.274 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 13 | VAL | 0 | 0.008 | -0.001 | 17.469 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 14 | GLY | 0 | 0.022 | -0.012 | 15.378 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 15 | GLU | -1 | -0.856 | -0.896 | 9.777 | -0.544 | -0.544 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 16 | LEU | 0 | 0.036 | 0.056 | 10.844 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 17 | THR | 0 | -0.041 | -0.025 | 6.714 | -0.360 | -0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 18 | LYS | 1 | 0.960 | 0.987 | 7.388 | 0.900 | 0.900 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 19 | LEU | 0 | -0.020 | -0.013 | 7.419 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 20 | ALA | 0 | 0.042 | 0.015 | 8.448 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 21 | ASN | 0 | 0.004 | 0.005 | 9.446 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 22 | GLY | 0 | 0.009 | 0.006 | 11.466 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 23 | ALA | 0 | -0.033 | -0.009 | 12.892 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 24 | HIS | 0 | -0.018 | 0.013 | 11.807 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 25 | THR | 0 | 0.004 | -0.005 | 11.610 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 26 | PHE | 0 | 0.049 | 0.025 | 12.440 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 27 | LYS | 1 | 0.888 | 0.967 | 13.526 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 28 | TYR | 0 | 0.010 | -0.002 | 15.148 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 29 | ALA | 0 | -0.020 | -0.011 | 16.440 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 30 | PRO | 0 | 0.010 | -0.004 | 17.257 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 31 | GLU | -1 | -0.827 | -0.931 | 17.921 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 32 | TRP | 0 | -0.064 | -0.019 | 20.227 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 33 | LEU | 0 | -0.051 | -0.038 | 20.651 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 34 | ALA | 0 | 0.023 | 0.030 | 23.863 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 35 | SER | 0 | 0.023 | 0.035 | 25.805 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 36 | ARG | 1 | 0.977 | 0.996 | 27.758 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 37 | TYR | 0 | 0.008 | -0.013 | 29.703 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 38 | ALA | 0 | -0.033 | 0.000 | 25.483 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 39 | ARG | 1 | 0.936 | 0.978 | 25.606 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 40 | PRO | 0 | 0.013 | 0.020 | 23.718 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 41 | LEU | 0 | 0.022 | 0.002 | 18.101 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 42 | SER | 0 | 0.026 | -0.027 | 22.262 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 43 | LEU | 0 | -0.015 | 0.003 | 24.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 44 | SER | 0 | -0.003 | 0.021 | 24.260 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 45 | LEU | 0 | -0.036 | -0.014 | 19.303 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 46 | PRO | 0 | 0.039 | 0.036 | 22.922 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 47 | LEU | 0 | 0.017 | 0.002 | 23.133 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 48 | GLN | 0 | -0.018 | -0.010 | 20.920 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 49 | ARG | 1 | 0.994 | 0.994 | 19.397 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 50 | GLY | 0 | -0.013 | 0.007 | 18.783 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 51 | ASN | 0 | 0.013 | -0.011 | 13.686 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 52 | ILE | 0 | 0.022 | 0.042 | 16.499 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 53 | THR | 0 | 0.000 | -0.032 | 15.643 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 54 | SER | 0 | 0.048 | 0.028 | 17.627 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 55 | ASP | -1 | -0.804 | -0.909 | 19.352 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 56 | ALA | 0 | 0.010 | 0.012 | 21.112 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 57 | VAL | 0 | -0.052 | -0.017 | 15.124 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 58 | PHE | 0 | -0.009 | -0.008 | 16.027 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 59 | ASN | 0 | -0.042 | -0.040 | 17.860 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 60 | PHE | 0 | 0.018 | 0.017 | 18.909 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 61 | PHE | 0 | 0.025 | -0.010 | 16.049 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 62 | ASP | -1 | -0.834 | -0.911 | 18.314 | -0.221 | -0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 63 | ASN | 0 | 0.004 | 0.002 | 19.903 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 64 | LEU | 0 | -0.041 | -0.003 | 18.380 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 65 | LEU | 0 | -0.035 | -0.006 | 17.560 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 66 | PRO | 0 | 0.030 | 0.013 | 22.035 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 67 | ASP | -1 | -0.695 | -0.855 | 24.249 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 68 | SER | 0 | -0.052 | -0.034 | 26.581 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 69 | PRO | 0 | 0.029 | 0.007 | 24.826 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 70 | ILE | 0 | 0.061 | 0.034 | 25.189 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 71 | VAL | 0 | -0.004 | -0.005 | 24.922 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 72 | ARG | 1 | 0.777 | 0.874 | 20.379 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 73 | ASP | -1 | -0.794 | -0.886 | 21.458 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 74 | ARG | 1 | 0.832 | 0.911 | 23.074 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 75 | ILE | 0 | -0.022 | 0.004 | 18.958 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 76 | VAL | 0 | 0.004 | -0.002 | 17.942 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 77 | LYS | 1 | 0.924 | 0.966 | 19.381 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 78 | ARG | 1 | 0.777 | 0.860 | 21.820 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 79 | TYR | 0 | -0.022 | -0.013 | 17.538 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 80 | HIS | 0 | -0.001 | 0.013 | 16.969 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 81 | ALA | 0 | -0.001 | 0.013 | 14.644 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 82 | LYS | 1 | 0.930 | 0.948 | 6.701 | 0.592 | 0.592 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 83 | SER | 0 | -0.022 | -0.023 | 13.007 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 84 | ARG | 1 | 0.982 | 0.993 | 15.132 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 85 | GLN | 0 | -0.038 | -0.002 | 13.544 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 86 | PRO | 0 | 0.077 | 0.033 | 14.846 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 87 | PHE | 0 | -0.018 | 0.004 | 6.643 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 88 | ASP | -1 | -0.842 | -0.905 | 9.990 | -0.663 | -0.663 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 89 | LEU | 0 | 0.013 | 0.008 | 12.001 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 90 | LEU | 0 | -0.002 | -0.009 | 13.812 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 91 | SER | 0 | -0.060 | -0.034 | 9.976 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 92 | GLU | -1 | -0.916 | -0.940 | 12.063 | -0.284 | -0.284 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 93 | ILE | 0 | -0.026 | -0.024 | 15.087 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 94 | GLY | 0 | 0.042 | 0.028 | 15.997 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 95 | ARG | 1 | 0.879 | 0.952 | 16.947 | 0.215 | 0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 96 | ASP | -1 | -0.780 | -0.838 | 18.169 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 97 | SER | 0 | 0.013 | 0.018 | 19.605 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 98 | VAL | 0 | 0.032 | 0.023 | 22.345 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 99 | GLY | 0 | 0.010 | 0.032 | 23.775 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 100 | ALA | 0 | -0.063 | -0.057 | 23.677 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 101 | VAL | 0 | -0.016 | -0.001 | 17.766 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 102 | THR | 0 | -0.038 | -0.001 | 16.824 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 103 | LEU | 0 | -0.029 | -0.025 | 13.085 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 104 | ILE | 0 | -0.022 | -0.010 | 11.800 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 105 | PRO | 0 | 0.027 | -0.001 | 8.296 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 106 | NME | 0 | 0.013 | 0.023 | 6.195 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 113 | ACE | 0 | 0.018 | 0.000 | 26.946 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 114 | ILE | 0 | -0.012 | -0.028 | 24.571 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 115 | MET | 0 | -0.035 | 0.008 | 26.331 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 116 | ALA | 0 | 0.003 | 0.008 | 27.730 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 117 | TRP | 0 | -0.024 | -0.021 | 28.270 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 118 | GLU | -1 | -0.945 | -0.966 | 30.166 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 119 | LYS | 1 | 0.947 | 0.971 | 31.814 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 120 | LEU | 0 | 0.004 | 0.003 | 31.997 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 121 | THR | 0 | -0.007 | -0.002 | 35.842 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 122 | GLU | -1 | -0.784 | -0.893 | 38.408 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 123 | ALA | 0 | 0.052 | 0.025 | 39.810 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 124 | ARG | 1 | 0.944 | 0.964 | 30.811 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 125 | LEU | 0 | -0.009 | -0.010 | 34.963 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 126 | GLU | -1 | -0.864 | -0.944 | 35.578 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 127 | GLU | -1 | -0.912 | -0.949 | 32.756 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 128 | VAL | 0 | -0.068 | -0.033 | 29.963 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 129 | LEU | 0 | -0.001 | -0.014 | 31.317 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 130 | THR | 0 | 0.005 | 0.009 | 33.632 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 131 | ALA | 0 | 0.013 | 0.015 | 28.976 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 132 | TYR | 0 | -0.087 | -0.038 | 26.121 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 133 | NME | 0 | 0.007 | 0.029 | 30.829 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 153 | ACE | 0 | 0.073 | 0.026 | 33.587 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 154 | ALA | 0 | -0.018 | -0.006 | 30.715 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 155 | GLN | 0 | 0.060 | 0.065 | 31.741 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 156 | GLU | -1 | -0.817 | -0.895 | 25.721 | -0.123 | -0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 157 | LYS | 1 | 0.981 | 1.009 | 28.752 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 158 | THR | 0 | 0.024 | 0.015 | 27.515 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 159 | ALA | 0 | 0.019 | 0.007 | 27.448 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 160 | LEU | 0 | -0.022 | 0.002 | 28.817 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 161 | LEU | 0 | -0.009 | -0.003 | 29.888 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 162 | ARG | 1 | 0.812 | 0.901 | 31.721 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 163 | ILE | 0 | 0.016 | 0.001 | 33.521 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 164 | GLY | 0 | 0.018 | 0.022 | 37.011 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 165 | ASN | 0 | 0.009 | -0.015 | 40.582 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 166 | ASP | -1 | -0.794 | -0.874 | 38.294 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 167 | TRP | 0 | 0.030 | 0.004 | 34.855 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 168 | CYS | 0 | -0.060 | -0.037 | 32.558 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 169 | ILE | 0 | 0.050 | 0.043 | 26.939 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 170 | PRO | 0 | -0.007 | -0.001 | 25.632 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 171 | LYS | 1 | 0.972 | 0.982 | 24.801 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 172 | GLY | 0 | 0.023 | 0.008 | 20.891 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 173 | ILE | 0 | 0.044 | 0.029 | 17.487 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 174 | THR | 0 | -0.019 | 0.001 | 21.447 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 175 | PRO | 0 | -0.010 | -0.003 | 24.975 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 176 | THR | 0 | -0.007 | -0.017 | 26.250 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 177 | THR | 0 | 0.001 | -0.041 | 28.568 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 178 | HIS | 0 | 0.085 | 0.054 | 31.794 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 179 | ILE | 0 | 0.005 | 0.013 | 29.296 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 180 | ILE | 0 | -0.043 | -0.018 | 31.720 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 181 | LYS | 1 | 0.771 | 0.867 | 32.611 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 182 | LEU | 0 | 0.032 | 0.010 | 33.775 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 183 | PRO | 0 | -0.005 | -0.002 | 36.586 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 184 | ILE | 0 | 0.023 | 0.010 | 36.948 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 185 | NME | 0 | -0.013 | 0.013 | 37.531 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 195 | ACE | 0 | 0.049 | 0.020 | 43.642 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 196 | LEU | 0 | -0.006 | -0.002 | 41.266 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 197 | SER | 0 | 0.000 | 0.013 | 42.154 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 198 | GLN | 0 | -0.027 | -0.019 | 43.882 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 199 | SER | 0 | 0.010 | -0.007 | 39.418 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 200 | VAL | 0 | 0.015 | 0.034 | 39.473 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 201 | ASP | -1 | -0.736 | -0.845 | 41.735 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 202 | ASN | 0 | -0.022 | -0.010 | 43.838 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 203 | GLU | -1 | -0.714 | -0.848 | 38.343 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 204 | TYR | 0 | -0.056 | -0.027 | 42.671 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 205 | TYR | 0 | 0.064 | 0.052 | 44.189 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 206 | CYS | 0 | -0.051 | -0.028 | 44.240 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 207 | LEU | 0 | -0.026 | -0.014 | 39.729 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 208 | LEU | 0 | 0.062 | 0.046 | 44.206 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 209 | LEU | 0 | 0.017 | 0.004 | 47.401 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 210 | ALA | 0 | -0.044 | -0.020 | 45.095 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 211 | LYS | 1 | 0.876 | 0.952 | 45.539 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 212 | GLU | -1 | -0.912 | -0.963 | 47.343 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 213 | LEU | 0 | -0.051 | -0.014 | 50.200 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 214 | GLY | 0 | -0.003 | -0.004 | 49.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 215 | LEU | 0 | -0.065 | -0.032 | 44.668 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 216 | ASN | 0 | -0.017 | 0.003 | 39.947 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 217 | VAL | 0 | 0.003 | 0.000 | 40.431 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 218 | PRO | 0 | -0.027 | 0.001 | 37.287 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 219 | ASP | -1 | -0.703 | -0.813 | 39.609 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 220 | ALA | 0 | -0.034 | -0.036 | 39.697 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 221 | GLU | -1 | -0.879 | -0.911 | 40.519 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 222 | ILE | 0 | 0.018 | 0.011 | 41.079 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 223 | ILE | 0 | -0.063 | -0.031 | 37.189 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 224 | LYS | 1 | 0.896 | 0.943 | 41.822 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 225 | ALA | 0 | -0.032 | -0.011 | 39.591 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 226 | GLY | 0 | 0.051 | 0.031 | 41.541 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 227 | ASN | 0 | -0.058 | -0.029 | 42.820 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 228 | VAL | 0 | -0.047 | -0.009 | 37.628 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 229 | ARG | 1 | 0.827 | 0.895 | 41.064 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 230 | ALA | 0 | -0.001 | -0.010 | 37.157 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 231 | LEU | 0 | -0.012 | 0.000 | 38.116 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 232 | ALA | 0 | -0.019 | 0.005 | 36.405 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 233 | VAL | 0 | 0.022 | -0.007 | 35.322 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 234 | GLU | -1 | -0.889 | -0.944 | 34.956 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 235 | ARG | 1 | 0.742 | 0.865 | 26.181 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 236 | PHE | 0 | 0.103 | 0.056 | 32.567 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 237 | ASP | -1 | -0.741 | -0.827 | 28.084 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 238 | ARG | 1 | 0.771 | 0.871 | 25.039 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 239 | ARG | 1 | 0.997 | 1.003 | 30.921 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 240 | TRP | 0 | 0.016 | 0.008 | 32.462 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 241 | ASN | 0 | 0.007 | 0.010 | 33.720 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 242 | ALA | 0 | 0.026 | -0.008 | 35.456 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 243 | ARG | 1 | 0.880 | 0.909 | 36.955 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 244 | ARG | 1 | 0.896 | 0.953 | 36.345 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 245 | THR | 0 | -0.002 | -0.007 | 34.244 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 246 | VAL | 0 | -0.020 | -0.019 | 29.023 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 247 | LEU | 0 | 0.006 | 0.022 | 29.495 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 248 | LEU | 0 | -0.044 | -0.023 | 27.984 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 249 | ARG | 1 | 0.868 | 0.948 | 22.664 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 250 | LEU | 0 | -0.078 | -0.039 | 27.104 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 251 | PRO | 0 | -0.067 | -0.035 | 25.315 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 252 | GLN | 0 | 0.058 | 0.010 | 26.239 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 253 | GLU | -1 | -0.704 | -0.783 | 25.890 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 254 | ASP | -1 | -0.708 | -0.842 | 27.411 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 255 | MET | 0 | 0.016 | -0.013 | 29.091 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 256 | CYS | 0 | -0.020 | 0.013 | 27.734 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 257 | GLN | 0 | 0.003 | 0.031 | 22.643 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 258 | THR | 0 | -0.014 | 0.009 | 26.301 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 259 | PHE | 0 | 0.003 | 0.003 | 28.719 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 260 | GLY | 0 | 0.033 | 0.019 | 25.328 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 261 | LEU | 0 | -0.037 | 0.008 | 25.789 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 262 | PRO | 0 | 0.054 | 0.034 | 24.991 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 263 | SER | 0 | 0.095 | 0.033 | 25.571 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 264 | SER | 0 | -0.030 | -0.012 | 27.398 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 265 | VAL | 0 | -0.018 | 0.004 | 29.352 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 266 | LYS | 1 | 0.897 | 0.968 | 30.998 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 267 | TYR | 0 | -0.029 | -0.082 | 32.624 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 268 | GLU | -1 | -0.744 | -0.837 | 36.242 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 269 | SER | 0 | -0.045 | -0.029 | 38.659 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 270 | ASP | -1 | -0.798 | -0.847 | 34.589 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 271 | GLY | 0 | 0.017 | 0.010 | 35.034 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 272 | GLY | 0 | 0.031 | 0.041 | 34.106 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 273 | PRO | 0 | -0.093 | -0.055 | 33.706 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 274 | GLY | 0 | 0.081 | 0.045 | 36.615 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 275 | ILE | 0 | 0.021 | -0.003 | 39.902 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 276 | ALA | 0 | -0.015 | -0.007 | 42.276 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 277 | ARG | 1 | 0.868 | 0.913 | 32.723 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 278 | ILE | 0 | 0.042 | 0.020 | 36.546 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 279 | MET | 0 | 0.003 | 0.013 | 38.754 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 280 | ALA | 0 | 0.012 | 0.010 | 40.355 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 281 | PHE | 0 | 0.055 | 0.037 | 32.781 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 282 | LEU | 0 | -0.001 | 0.002 | 37.614 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 283 | MET | 0 | -0.080 | -0.031 | 39.656 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 284 | GLY | 0 | 0.007 | 0.019 | 38.142 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 285 | SER | 0 | -0.040 | -0.020 | 37.479 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 286 | SER | 0 | -0.034 | -0.017 | 37.442 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 287 | GLU | -1 | -0.908 | -0.966 | 39.519 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 288 | ALA | 0 | 0.001 | 0.016 | 41.875 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 289 | LEU | 0 | 0.011 | -0.006 | 43.073 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 290 | LYS | 1 | 1.006 | 1.007 | 44.000 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 291 | ASP | -1 | -0.657 | -0.793 | 39.377 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 292 | ARG | 1 | 0.822 | 0.889 | 42.556 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 293 | TYR | 0 | -0.059 | -0.027 | 44.535 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 294 | ASP | -1 | -0.836 | -0.922 | 43.446 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 295 | PHE | 0 | -0.006 | -0.005 | 39.359 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 296 | MET | 0 | 0.011 | -0.015 | 43.389 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 297 | LYS | 1 | 0.833 | 0.936 | 46.774 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 298 | PHE | 0 | 0.019 | 0.000 | 40.966 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 299 | GLN | 0 | -0.026 | -0.004 | 41.955 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 300 | VAL | 0 | -0.002 | 0.002 | 46.215 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 301 | PHE | 0 | 0.016 | 0.007 | 45.189 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 302 | GLN | 0 | 0.015 | -0.017 | 42.023 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 303 | TRP | 0 | -0.022 | -0.006 | 46.460 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 304 | LEU | 0 | -0.019 | -0.006 | 49.485 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 305 | ILE | 0 | 0.003 | 0.000 | 45.284 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 306 | GLY | 0 | 0.047 | 0.031 | 48.431 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 307 | ALA | 0 | -0.021 | 0.006 | 43.128 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 308 | THR | 0 | -0.004 | -0.008 | 43.740 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 309 | ASP | -1 | -0.736 | -0.803 | 37.427 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 310 | GLY | 0 | 0.010 | 0.026 | 38.067 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 311 | HIS | 0 | 0.052 | 0.023 | 32.957 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 312 | ALA | 0 | 0.033 | -0.001 | 33.118 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 313 | LYS | 1 | 0.712 | 0.852 | 26.394 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 314 | ASN | 0 | -0.017 | 0.018 | 31.813 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 315 | PHE | 0 | 0.006 | 0.022 | 33.936 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 316 | SER | 0 | 0.036 | 0.002 | 31.011 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 317 | VAL | 0 | -0.024 | -0.003 | 30.705 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 318 | PHE | 0 | -0.009 | -0.001 | 30.552 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 319 | ILE | 0 | -0.004 | 0.010 | 26.089 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 320 | GLN | 0 | -0.006 | -0.026 | 29.612 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 321 | ALA | 0 | 0.001 | -0.005 | 29.908 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 322 | GLY | 0 | 0.004 | 0.007 | 30.036 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 323 | GLY | 0 | -0.024 | -0.020 | 29.649 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 324 | SER | 0 | -0.012 | 0.016 | 30.491 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 325 | TYR | 0 | -0.036 | -0.044 | 32.198 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 326 | ARG | 1 | 0.875 | 0.954 | 33.931 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 327 | LEU | 0 | -0.022 | -0.003 | 34.964 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 328 | THR | 0 | -0.039 | 0.005 | 32.337 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 329 | PRO | 0 | -0.020 | -0.011 | 35.778 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 330 | PHE | 0 | 0.035 | 0.025 | 36.758 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 331 | TYR | 0 | -0.037 | -0.028 | 32.070 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 332 | ASP | -1 | -0.802 | -0.891 | 33.480 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 333 | ILE | 0 | -0.003 | 0.022 | 37.033 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 334 | ILE | 0 | 0.001 | -0.002 | 38.748 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 335 | SER | 0 | 0.011 | -0.006 | 42.545 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 336 | ALA | 0 | 0.014 | -0.002 | 45.704 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 337 | PHE | 0 | 0.032 | 0.002 | 46.788 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 338 | PRO | 0 | -0.023 | -0.013 | 47.823 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 339 | VAL | 0 | -0.016 | 0.003 | 45.360 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 340 | LEU | 0 | -0.050 | -0.007 | 48.730 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 341 | GLY | 0 | -0.023 | -0.006 | 51.951 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 342 | GLY | 0 | -0.021 | 0.000 | 50.685 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 343 | THR | 0 | -0.037 | -0.045 | 48.527 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 344 | GLY | 0 | 0.034 | 0.006 | 51.397 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 345 | ILE | 0 | -0.081 | -0.022 | 47.208 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 346 | HIS | 0 | 0.100 | 0.046 | 51.219 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 347 | ILE | 0 | 0.039 | 0.028 | 52.308 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 348 | SER | 0 | -0.043 | -0.011 | 53.112 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 349 | ASP | -1 | -0.858 | -0.921 | 49.692 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 350 | LEU | 0 | -0.027 | -0.005 | 47.769 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 351 | LYS | 1 | 0.922 | 0.957 | 46.101 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 352 | LEU | 0 | 0.027 | 0.028 | 45.212 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 353 | ALA | 0 | 0.033 | 0.030 | 39.784 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 354 | MET | 0 | -0.112 | -0.012 | 37.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 355 | GLY | 0 | 0.015 | 0.014 | 42.708 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 356 | LEU | 0 | 0.020 | 0.012 | 46.086 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 357 | ASN | 0 | -0.005 | -0.006 | 48.854 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 358 | ALA | 0 | 0.006 | 0.012 | 51.215 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 359 | SER | 0 | -0.062 | -0.054 | 54.215 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 360 | LYS | 1 | 0.929 | 0.978 | 55.973 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 361 | GLY | 0 | 0.026 | 0.037 | 51.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 362 | LYS | 1 | 0.867 | 0.948 | 44.317 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 363 | LYS | 1 | 0.813 | 0.891 | 50.220 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 364 | THR | 0 | -0.009 | -0.018 | 46.880 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 365 | ALA | 0 | 0.036 | 0.006 | 49.018 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 366 | ILE | 0 | 0.066 | 0.041 | 48.003 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 367 | ASP | -1 | -0.774 | -0.874 | 51.864 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 368 | LYS | 1 | 0.913 | 0.956 | 54.604 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 369 | ILE | 0 | 0.019 | 0.032 | 50.528 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 370 | TYR | 0 | -0.066 | -0.044 | 54.942 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 371 | PRO | 0 | 0.077 | 0.035 | 56.118 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 372 | ARG | 1 | 0.840 | 0.908 | 56.529 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 373 | HIS | 0 | 0.016 | 0.011 | 53.217 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 374 | PHE | 0 | 0.039 | 0.028 | 49.290 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 375 | LEU | 0 | 0.011 | 0.020 | 52.776 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 376 | ALA | 0 | 0.027 | 0.017 | 54.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 377 | THR | 0 | 0.002 | -0.023 | 48.287 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 378 | ALA | 0 | 0.039 | 0.017 | 50.401 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 379 | LYS | 1 | 0.976 | 1.003 | 51.500 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 380 | VAL | 0 | -0.043 | -0.012 | 49.752 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 381 | LEU | 0 | 0.001 | 0.025 | 45.502 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 382 | ARG | 1 | 0.934 | 0.970 | 47.437 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 383 | PHE | 0 | -0.016 | 0.003 | 48.661 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 384 | PRO | 0 | -0.009 | -0.021 | 50.619 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 385 | GLU | -1 | -0.766 | -0.875 | 53.963 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 386 | VAL | 0 | 0.007 | -0.003 | 56.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 387 | GLN | 0 | 0.051 | 0.048 | 51.017 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 388 | MET | 0 | 0.004 | 0.018 | 51.812 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 389 | HIS | 0 | 0.055 | 0.057 | 54.240 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 390 | GLU | -1 | -0.846 | -0.882 | 54.696 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 391 | ILE | 0 | 0.001 | 0.013 | 50.129 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 392 | LEU | 0 | -0.042 | -0.019 | 54.068 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 393 | SER | 0 | 0.010 | -0.013 | 56.323 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 394 | ASP | -1 | -0.790 | -0.862 | 55.238 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 395 | PHE | 0 | 0.005 | -0.004 | 49.751 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 396 | ALA | 0 | -0.012 | 0.000 | 55.993 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 397 | ARG | 1 | 0.856 | 0.911 | 58.715 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 398 | MET | 0 | -0.005 | 0.008 | 54.845 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 399 | ILE | 0 | 0.016 | 0.016 | 53.510 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 400 | PRO | 0 | -0.020 | -0.008 | 57.066 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 401 | ALA | 0 | 0.072 | 0.029 | 59.470 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 402 | ALA | 0 | -0.013 | 0.005 | 53.820 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 403 | LEU | 0 | -0.060 | -0.034 | 54.071 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 404 | ASP | -1 | -0.912 | -0.951 | 56.064 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 405 | ASN | 0 | -0.048 | -0.025 | 55.704 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 406 | VAL | 0 | 0.003 | 0.001 | 50.926 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 407 | LYS | 1 | 0.906 | 0.952 | 52.984 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 408 | THR | 0 | -0.031 | 0.002 | 55.214 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 409 | SER | 0 | -0.001 | 0.010 | 50.061 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 410 | LEU | 0 | -0.051 | -0.009 | 50.214 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 411 | PRO | 0 | -0.001 | 0.011 | 48.584 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 412 | THR | 0 | 0.095 | 0.058 | 51.699 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 413 | ASP | -1 | -0.770 | -0.858 | 49.620 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 414 | PHE | 0 | 0.015 | 0.010 | 47.566 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 415 | PRO | 0 | 0.008 | 0.017 | 48.922 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 416 | GLU | -1 | -0.778 | -0.879 | 52.153 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 417 | ASN | 0 | 0.002 | 0.005 | 50.928 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 418 | VAL | 0 | -0.017 | -0.007 | 48.580 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 419 | VAL | 0 | 0.054 | 0.029 | 51.549 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 420 | THR | 0 | 0.029 | 0.020 | 53.830 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 421 | ALA | 0 | -0.002 | 0.024 | 52.554 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 422 | VAL | 0 | 0.012 | 0.000 | 49.819 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 423 | GLU | -1 | -0.829 | -0.917 | 52.759 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 424 | SER | 0 | -0.017 | -0.010 | 55.804 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 425 | ASN | 0 | 0.015 | 0.010 | 54.110 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 426 | VAL | 0 | 0.052 | 0.036 | 52.420 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 427 | LEU | 0 | 0.025 | 0.013 | 55.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 428 | ARG | 1 | 0.849 | 0.935 | 57.497 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 429 | LEU | 0 | -0.034 | -0.013 | 53.529 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 430 | HIS | 0 | 0.004 | 0.009 | 57.460 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 431 | GLY | 0 | 0.055 | 0.031 | 58.485 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 432 | ARG | 1 | 0.766 | 0.858 | 56.686 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 433 | LEU | 0 | 0.024 | 0.018 | 55.601 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 434 | SER | 0 | -0.033 | -0.007 | 60.164 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 435 | ARG | 1 | 0.868 | 0.910 | 63.176 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 436 | GLU | -1 | -0.946 | -0.967 | 61.483 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 437 | TYR | 0 | -0.015 | -0.052 | 59.523 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 438 | NME | 0 | -0.026 | 0.015 | 62.789 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 441 | CL- | -1 | -0.859 | -0.872 | 52.990 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 833 | PO4 | -3 | -2.275 | -2.550 | 57.248 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 442 | HOH | 0 | 0.010 | 0.006 | 42.501 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 443 | HOH | 0 | -0.009 | -0.017 | 40.443 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 445 | HOH | 0 | -0.030 | -0.040 | 33.154 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 446 | HOH | 0 | 0.030 | 0.017 | 40.742 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 447 | HOH | 0 | -0.020 | -0.033 | 42.952 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 449 | HOH | 0 | 0.037 | 0.026 | 27.526 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 450 | HOH | 0 | -0.027 | -0.022 | 44.533 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 451 | HOH | 0 | -0.021 | -0.019 | 38.912 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 452 | HOH | 0 | -0.004 | -0.018 | 24.021 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 453 | HOH | 0 | -0.022 | -0.013 | 51.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 454 | HOH | 0 | -0.038 | -0.026 | 30.038 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 455 | HOH | 0 | 0.002 | -0.003 | 36.938 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 456 | HOH | 0 | 0.012 | -0.013 | 23.735 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 457 | HOH | 0 | 0.000 | -0.004 | 38.839 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 458 | HOH | 0 | -0.058 | -0.048 | 43.127 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 459 | HOH | 0 | -0.007 | -0.006 | 36.294 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 460 | HOH | 0 | -0.033 | -0.021 | 38.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 461 | HOH | 0 | 0.007 | 0.026 | 43.542 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 463 | HOH | 0 | -0.007 | -0.020 | 16.571 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 464 | HOH | 0 | 0.030 | 0.020 | 51.334 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 465 | HOH | 0 | -0.003 | 0.000 | 22.518 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 466 | HOH | 0 | -0.004 | 0.008 | 38.363 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 467 | HOH | 0 | -0.019 | -0.035 | 37.429 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 468 | HOH | 0 | 0.050 | 0.057 | 35.243 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 469 | HOH | 0 | 0.028 | 0.023 | 45.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 470 | HOH | 0 | -0.078 | -0.067 | 39.529 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 471 | HOH | 0 | -0.001 | 0.004 | 38.452 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 472 | HOH | 0 | -0.012 | -0.010 | 38.639 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 474 | HOH | 0 | -0.028 | -0.042 | 40.963 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 475 | HOH | 0 | -0.022 | -0.007 | 53.581 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 476 | HOH | 0 | -0.029 | -0.028 | 34.260 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 477 | HOH | 0 | 0.039 | 0.038 | 62.912 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 478 | HOH | 0 | 0.013 | 0.004 | 56.228 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 479 | HOH | 0 | -0.028 | -0.018 | 44.999 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 480 | HOH | 0 | 0.006 | 0.002 | 35.704 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 481 | HOH | 0 | -0.013 | -0.007 | 55.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 482 | HOH | 0 | -0.015 | -0.022 | 38.249 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 484 | HOH | 0 | -0.031 | -0.015 | 39.926 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 485 | HOH | 0 | 0.024 | 0.021 | 48.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 486 | HOH | 0 | -0.026 | -0.020 | 29.996 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 488 | HOH | 0 | -0.022 | -0.019 | 27.729 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 489 | HOH | 0 | 0.013 | 0.001 | 24.748 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 490 | HOH | 0 | -0.063 | -0.044 | 35.151 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 491 | HOH | 0 | -0.010 | 0.001 | 37.441 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 492 | HOH | 0 | -0.044 | -0.033 | 60.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 493 | HOH | 0 | 0.012 | 0.011 | 55.779 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 494 | HOH | 0 | -0.027 | -0.034 | 54.634 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 495 | HOH | 0 | 0.022 | 0.014 | 36.051 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 496 | HOH | 0 | 0.011 | 0.002 | 41.641 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 497 | HOH | 0 | 0.001 | -0.015 | 49.342 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 498 | HOH | 0 | 0.022 | 0.011 | 24.183 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 499 | HOH | 0 | 0.012 | 0.003 | 25.819 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 500 | HOH | 0 | -0.021 | -0.011 | 18.574 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 501 | HOH | 0 | 0.027 | 0.039 | 39.683 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 502 | HOH | 0 | -0.028 | -0.015 | 36.481 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 503 | HOH | 0 | -0.004 | -0.004 | 36.708 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 505 | HOH | 0 | -0.025 | -0.030 | 33.098 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 506 | HOH | 0 | -0.019 | -0.023 | 56.581 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 507 | HOH | 0 | -0.022 | -0.023 | 23.892 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 508 | HOH | 0 | -0.008 | -0.002 | 46.295 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 509 | HOH | 0 | -0.052 | -0.035 | 28.736 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 510 | HOH | 0 | -0.047 | -0.046 | 61.528 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 511 | HOH | 0 | -0.049 | -0.040 | 41.494 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 512 | HOH | 0 | 0.041 | 0.025 | 24.711 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 513 | HOH | 0 | 0.036 | 0.023 | 43.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 514 | HOH | 0 | -0.035 | -0.053 | 52.750 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 515 | HOH | 0 | -0.028 | -0.046 | 48.146 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 516 | HOH | 0 | -0.050 | -0.047 | 42.511 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 517 | HOH | 0 | -0.016 | -0.031 | 57.353 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 518 | HOH | 0 | -0.005 | 0.000 | 59.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 519 | HOH | 0 | -0.033 | -0.029 | 33.915 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 522 | HOH | 0 | -0.010 | -0.020 | 39.464 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 523 | HOH | 0 | 0.056 | 0.030 | 36.369 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 526 | HOH | 0 | 0.041 | 0.038 | 5.940 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 527 | HOH | 0 | -0.004 | 0.003 | 61.717 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 529 | HOH | 0 | -0.050 | -0.029 | 42.825 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 530 | HOH | 0 | 0.013 | 0.012 | 43.044 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 531 | HOH | 0 | -0.036 | -0.035 | 54.408 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 532 | HOH | 0 | 0.008 | -0.006 | 44.434 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 533 | HOH | 0 | 0.008 | 0.003 | 25.138 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 534 | HOH | 0 | -0.038 | -0.041 | 11.029 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 536 | HOH | 0 | -0.013 | -0.004 | 25.329 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 537 | HOH | 0 | -0.047 | -0.045 | 30.622 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 538 | HOH | 0 | -0.047 | -0.040 | 20.958 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 539 | HOH | 0 | -0.028 | -0.027 | 57.840 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 541 | HOH | 0 | 0.040 | 0.024 | 37.348 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 542 | HOH | 0 | 0.001 | 0.002 | 39.414 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 543 | HOH | 0 | 0.001 | -0.006 | 43.411 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 545 | HOH | 0 | -0.049 | -0.034 | 29.349 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 547 | HOH | 0 | 0.008 | -0.006 | 24.811 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 549 | HOH | 0 | 0.002 | -0.028 | 54.398 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 551 | HOH | 0 | -0.009 | 0.011 | 24.227 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 553 | HOH | 0 | 0.029 | 0.019 | 38.200 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 554 | HOH | 0 | 0.039 | 0.019 | 20.915 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 556 | HOH | 0 | -0.050 | -0.031 | 34.734 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 557 | HOH | 0 | -0.018 | -0.012 | 52.925 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 558 | HOH | 0 | 0.071 | 0.075 | 44.506 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 561 | HOH | 0 | -0.054 | -0.046 | 54.009 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 562 | HOH | 0 | -0.053 | -0.046 | 36.251 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 564 | HOH | 0 | -0.007 | -0.008 | 30.292 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 565 | HOH | 0 | -0.033 | -0.023 | 34.853 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 566 | HOH | 0 | -0.009 | -0.009 | 60.108 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 568 | HOH | 0 | -0.039 | -0.030 | 38.422 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 569 | HOH | 0 | -0.014 | -0.023 | 51.820 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 570 | HOH | 0 | -0.015 | -0.039 | 13.650 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 571 | HOH | 0 | 0.020 | 0.016 | 37.208 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 572 | HOH | 0 | 0.025 | 0.023 | 58.072 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 575 | HOH | 0 | -0.029 | -0.017 | 40.552 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 576 | HOH | 0 | -0.070 | -0.050 | 57.131 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 577 | HOH | 0 | -0.033 | -0.023 | 25.110 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 579 | HOH | 0 | -0.038 | -0.030 | 43.386 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 580 | HOH | 0 | -0.039 | -0.031 | 52.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 581 | HOH | 0 | -0.026 | -0.013 | 23.432 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 583 | HOH | 0 | -0.026 | -0.019 | 54.376 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 584 | HOH | 0 | -0.031 | -0.020 | 54.194 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 587 | HOH | 0 | -0.022 | -0.030 | 38.016 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 588 | HOH | 0 | -0.001 | -0.012 | 7.650 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 589 | HOH | 0 | -0.024 | -0.020 | 13.976 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 592 | HOH | 0 | -0.006 | 0.001 | 46.448 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 593 | HOH | 0 | -0.018 | -0.015 | 22.399 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 594 | HOH | 0 | 0.000 | -0.002 | 54.751 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 596 | HOH | 0 | -0.043 | -0.028 | 36.693 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 597 | HOH | 0 | -0.032 | -0.034 | 39.003 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 600 | HOH | 0 | -0.043 | -0.038 | 28.581 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 601 | HOH | 0 | 0.023 | 0.017 | 33.830 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 603 | HOH | 0 | 0.014 | 0.016 | 22.938 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 604 | HOH | 0 | -0.006 | -0.006 | 56.424 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 605 | HOH | 0 | -0.044 | -0.034 | 56.666 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 606 | HOH | 0 | 0.009 | -0.005 | 26.339 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 609 | HOH | 0 | -0.011 | -0.007 | 41.199 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 610 | HOH | 0 | -0.007 | -0.010 | 39.533 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 612 | HOH | 0 | -0.029 | -0.031 | 51.908 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 613 | HOH | 0 | -0.017 | -0.025 | 60.458 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 615 | HOH | 0 | -0.025 | -0.021 | 15.624 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 616 | HOH | 0 | -0.028 | -0.023 | 62.107 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 617 | HOH | 0 | -0.058 | -0.054 | 54.033 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 620 | HOH | 0 | -0.023 | -0.015 | 54.615 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 621 | HOH | 0 | 0.023 | 0.012 | 15.768 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 622 | HOH | 0 | 0.009 | 0.007 | 63.993 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 623 | HOH | 0 | 0.011 | 0.005 | 48.659 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 624 | HOH | 0 | -0.037 | -0.046 | 20.632 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 625 | HOH | 0 | -0.008 | -0.016 | 28.735 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 628 | HOH | 0 | -0.045 | -0.086 | 22.984 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 629 | HOH | 0 | -0.052 | -0.048 | 47.160 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 630 | HOH | 0 | -0.035 | -0.057 | 45.023 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 631 | HOH | 0 | 0.006 | 0.021 | 2.399 | 6.946 | -1.955 | 7.434 | 2.662 | -1.195 | -0.017 |
553 | A | 634 | HOH | 0 | -0.007 | -0.034 | 44.147 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 636 | HOH | 0 | -0.042 | -0.039 | 28.907 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 637 | HOH | 0 | -0.021 | -0.014 | 34.456 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 640 | HOH | 0 | -0.028 | -0.027 | 44.021 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 641 | HOH | 0 | -0.026 | -0.014 | 49.440 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 647 | HOH | 0 | -0.011 | -0.035 | 45.658 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 651 | HOH | 0 | -0.035 | -0.027 | 56.691 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 654 | HOH | 0 | -0.052 | -0.058 | 23.622 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 655 | HOH | 0 | -0.028 | -0.017 | 39.786 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 659 | HOH | 0 | -0.008 | -0.017 | 11.977 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 664 | HOH | 0 | -0.072 | -0.062 | 55.735 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 667 | HOH | 0 | -0.023 | -0.024 | 29.993 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 668 | HOH | 0 | 0.007 | 0.007 | 47.148 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 669 | HOH | 0 | -0.039 | -0.032 | 25.140 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 670 | HOH | 0 | -0.014 | -0.009 | 31.995 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 672 | HOH | 0 | -0.030 | -0.022 | 30.198 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 673 | HOH | 0 | -0.026 | -0.017 | 41.973 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 675 | HOH | 0 | -0.017 | -0.011 | 32.357 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 676 | HOH | 0 | -0.053 | -0.034 | 46.705 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 677 | HOH | 0 | -0.028 | -0.019 | 27.827 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 679 | HOH | 0 | -0.026 | -0.021 | 58.213 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 680 | HOH | 0 | -0.016 | -0.028 | 58.062 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 685 | HOH | 0 | 0.032 | 0.024 | 17.657 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 686 | HOH | 0 | -0.022 | -0.020 | 25.525 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 687 | HOH | 0 | -0.033 | -0.034 | 21.398 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 688 | HOH | 0 | -0.054 | -0.038 | 37.652 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 690 | HOH | 0 | -0.041 | -0.035 | 55.696 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 691 | HOH | 0 | -0.020 | -0.025 | 19.529 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 692 | HOH | 0 | 0.031 | 0.032 | 47.499 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 693 | HOH | 0 | -0.040 | -0.034 | 14.120 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 694 | HOH | 0 | 0.003 | -0.001 | 22.798 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 695 | HOH | 0 | -0.026 | -0.015 | 58.437 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 696 | HOH | 0 | 0.017 | 0.016 | 21.573 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 697 | HOH | 0 | -0.041 | -0.037 | 63.395 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 698 | HOH | 0 | 0.041 | 0.021 | 41.783 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 699 | HOH | 0 | -0.043 | -0.036 | 50.083 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 701 | HOH | 0 | -0.001 | -0.003 | 35.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 702 | HOH | 0 | -0.038 | -0.024 | 29.273 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 703 | HOH | 0 | -0.008 | -0.008 | 58.712 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 707 | HOH | 0 | -0.018 | -0.027 | 41.354 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 709 | HOH | 0 | -0.011 | -0.009 | 48.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 712 | HOH | 0 | 0.012 | -0.005 | 16.442 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 713 | HOH | 0 | -0.020 | -0.018 | 40.396 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 714 | HOH | 0 | -0.045 | -0.032 | 49.857 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 715 | HOH | 0 | -0.012 | -0.019 | 10.368 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 716 | HOH | 0 | 0.043 | 0.027 | 24.279 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 719 | HOH | 0 | 0.022 | 0.027 | 42.277 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 721 | HOH | 0 | 0.035 | 0.026 | 34.361 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 723 | HOH | 0 | -0.009 | -0.012 | 62.572 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 726 | HOH | 0 | 0.043 | 0.027 | 19.384 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 728 | HOH | 0 | -0.019 | -0.015 | 33.057 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 729 | HOH | 0 | -0.035 | -0.018 | 59.190 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 730 | HOH | 0 | -0.043 | -0.035 | 37.059 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 732 | HOH | 0 | 0.013 | 0.012 | 48.634 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 736 | HOH | 0 | 0.041 | 0.026 | 41.298 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 737 | HOH | 0 | 0.034 | 0.029 | 30.856 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 740 | HOH | 0 | -0.016 | 0.002 | 11.299 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 743 | HOH | 0 | -0.003 | 0.005 | 23.446 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 747 | HOH | 0 | -0.010 | -0.020 | 33.582 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 749 | HOH | 0 | 0.022 | 0.009 | 61.604 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 750 | HOH | 0 | 0.015 | 0.019 | 35.410 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 751 | HOH | 0 | -0.031 | -0.020 | 25.535 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 752 | HOH | 0 | -0.057 | -0.053 | 57.582 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 753 | HOH | 0 | 0.023 | 0.016 | 48.607 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 757 | HOH | 0 | -0.005 | -0.007 | 61.236 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 760 | HOH | 0 | -0.003 | -0.002 | 19.326 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 761 | HOH | 0 | -0.006 | -0.009 | 28.681 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 762 | HOH | 0 | -0.057 | -0.036 | 44.336 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 763 | HOH | 0 | 0.024 | 0.023 | 62.087 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 764 | HOH | 0 | 0.006 | 0.014 | 18.916 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 770 | HOH | 0 | 0.027 | 0.012 | 41.153 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 777 | HOH | 0 | -0.012 | -0.020 | 24.622 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 778 | HOH | 0 | -0.051 | -0.043 | 31.248 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 781 | HOH | 0 | -0.041 | -0.027 | 66.297 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 783 | HOH | 0 | -0.035 | -0.018 | 37.320 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 785 | HOH | 0 | 0.036 | 0.024 | 22.077 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 787 | HOH | 0 | -0.003 | -0.027 | 40.861 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 788 | HOH | 0 | -0.011 | -0.008 | 43.928 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 789 | HOH | 0 | -0.053 | -0.045 | 18.166 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 792 | HOH | 0 | 0.011 | 0.004 | 43.997 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 793 | HOH | 0 | -0.033 | -0.021 | 54.121 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 798 | HOH | 0 | 0.014 | 0.009 | 45.896 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 800 | HOH | 0 | 0.035 | 0.025 | 30.189 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 802 | HOH | 0 | 0.025 | 0.024 | 26.088 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 803 | HOH | 0 | -0.029 | -0.023 | 25.876 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |