FMODB ID: Q8GMY
Calculation Name: 6YB7-A-Xray93
Preferred Name:
Target Type:
Ligand Name: di(hydroxyethyl)ether
ligand 3-letter code: PEG
PDB ID: 6YB7
Chain ID: A
UniProt ID: P0DTD1
Base Structure: X-ray
Registration Date: 2020-04-15
Reference: Y.Handa, K. Kato, Y. Kawashima, K. Fukuzawa et.al., FMO calculation for SARS Cov-2 related proteins. To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptHSideSolv |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | Selected crystal waters in PDB |
Procedure | Manual calculation |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 730 |
LigandCharge | |
Software | ABINIT-MP - Open Ver.1 Rev. 15 / 20190524 |
Total energy (hartree)
FMO2-HF: Electronic energy | -6256398.361183 |
---|---|
FMO2-HF: Nuclear repulsion | 6102095.185858 |
FMO2-HF: Total energy | -154303.175326 |
FMO2-MP2: Total energy | -154729.914854 |
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:SER )
Summations of interaction energy for
fragment #1(A:1:SER )
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. |
-155.782 | -152.025 | 13.928 | -9.054 | -8.629 | -0.104 |
Interaction energy analysis for fragmet #1(A:1:SER )
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 | PHE | 0 | 0.019 | 3.788 | -3.287 | -2.179 | -0.009 | -0.532 | -0.567 | 0.000 | |
4 | A | 4 | ARG | 1 | 0.897 | 6.447 | 30.832 | 30.832 | 0.000 | 0.000 | 0.000 | 0.000 | |
5 | A | 5 | LYS | 1 | 0.845 | 9.739 | 19.060 | 19.060 | 0.000 | 0.000 | 0.000 | 0.000 | |
6 | A | 6 | MET | 0 | -0.018 | 8.337 | 0.647 | 0.647 | 0.000 | 0.000 | 0.000 | 0.000 | |
7 | A | 7 | ALA | 0 | 0.045 | 13.318 | 0.645 | 0.645 | 0.000 | 0.000 | 0.000 | 0.000 | |
8 | A | 8 | PHE | 0 | -0.009 | 15.362 | -1.110 | -1.110 | 0.000 | 0.000 | 0.000 | 0.000 | |
9 | A | 9 | PRO | 0 | 0.001 | 16.018 | 0.507 | 0.507 | 0.000 | 0.000 | 0.000 | 0.000 | |
10 | A | 10 | SER | 0 | 0.018 | 18.390 | 0.309 | 0.309 | 0.000 | 0.000 | 0.000 | 0.000 | |
11 | A | 11 | GLY | 0 | 0.023 | 21.880 | 0.630 | 0.630 | 0.000 | 0.000 | 0.000 | 0.000 | |
12 | A | 12 | LYS | 1 | 0.882 | 22.751 | 13.603 | 13.603 | 0.000 | 0.000 | 0.000 | 0.000 | |
13 | A | 13 | VAL | 0 | 0.040 | 24.839 | 0.582 | 0.582 | 0.000 | 0.000 | 0.000 | 0.000 | |
14 | A | 14 | GLU | -1 | -0.782 | 23.743 | -12.563 | -12.563 | 0.000 | 0.000 | 0.000 | 0.000 | |
15 | A | 15 | GLY | 0 | -0.025 | 27.858 | 0.431 | 0.431 | 0.000 | 0.000 | 0.000 | 0.000 | |
16 | A | 16 | CYS | 0 | -0.051 | 29.707 | 0.414 | 0.414 | 0.000 | 0.000 | 0.000 | 0.000 | |
17 | A | 17 | MET | 0 | -0.043 | 29.935 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 | |
18 | A | 18 | VAL | 0 | 0.010 | 32.799 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 | |
19 | A | 19 | GLN | 0 | -0.005 | 36.414 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 | |
20 | A | 20 | VAL | 0 | -0.005 | 38.728 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 | |
21 | A | 21 | THR | 0 | -0.002 | 41.504 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 | |
22 | A | 22 | CYS | 0 | -0.049 | 44.520 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 | |
23 | A | 23 | GLY | 0 | 0.035 | 47.458 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
24 | A | 24 | THR | 0 | -0.008 | 48.559 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
25 | A | 25 | THR | 0 | -0.057 | 43.303 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 | |
26 | A | 26 | THR | 0 | -0.004 | 40.150 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 | |
27 | A | 27 | LEU | 0 | -0.023 | 38.104 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 | |
28 | A | 28 | ASN | 0 | -0.041 | 34.222 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
29 | A | 29 | GLY | 0 | 0.030 | 36.297 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 | |
30 | A | 30 | LEU | 0 | -0.001 | 30.878 | -0.223 | -0.223 | 0.000 | 0.000 | 0.000 | 0.000 | |
31 | A | 31 | TRP | 0 | -0.027 | 34.609 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 | |
32 | A | 32 | LEU | 0 | -0.001 | 31.660 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 | |
33 | A | 33 | ASP | -1 | -0.771 | 35.665 | -8.486 | -8.486 | 0.000 | 0.000 | 0.000 | 0.000 | |
34 | A | 34 | ASP | -1 | -0.804 | 38.260 | -7.438 | -7.438 | 0.000 | 0.000 | 0.000 | 0.000 | |
35 | A | 35 | VAL | 0 | 0.000 | 39.772 | 0.246 | 0.246 | 0.000 | 0.000 | 0.000 | 0.000 | |
36 | A | 36 | VAL | 0 | 0.000 | 38.365 | -0.284 | -0.284 | 0.000 | 0.000 | 0.000 | 0.000 | |
37 | A | 37 | TYR | 0 | -0.019 | 36.484 | 0.254 | 0.254 | 0.000 | 0.000 | 0.000 | 0.000 | |
38 | A | 38 | CYS | 0 | 0.007 | 37.337 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 | |
39 | A | 39 | PRO | 0 | 0.035 | 37.337 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 | |
40 | A | 40 | ARG | 1 | 0.815 | 39.931 | 7.288 | 7.288 | 0.000 | 0.000 | 0.000 | 0.000 | |
41 | A | 41 | HIS | 0 | -0.032 | 39.138 | 0.335 | 0.335 | 0.000 | 0.000 | 0.000 | 0.000 | |
42 | A | 42 | VAL | 0 | 0.026 | 42.444 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 | |
43 | A | 43 | ILE | 0 | -0.005 | 44.062 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 | |
44 | A | 44 | CYS | 0 | -0.077 | 46.574 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 | |
45 | A | 45 | THR | 0 | 0.046 | 47.361 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 | |
46 | A | 46 | SER | 0 | 0.043 | 47.202 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
47 | A | 47 | GLU | -1 | -0.955 | 48.205 | -5.950 | -5.950 | 0.000 | 0.000 | 0.000 | 0.000 | |
48 | A | 48 | ASP | -1 | -0.717 | 50.062 | -6.187 | -6.187 | 0.000 | 0.000 | 0.000 | 0.000 | |
49 | A | 49 | MET | 0 | 0.019 | 43.270 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
50 | A | 50 | LEU | 0 | 0.005 | 47.557 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 | |
51 | A | 51 | ASN | 0 | -0.005 | 49.786 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 | |
52 | A | 52 | PRO | 0 | 0.016 | 47.552 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 | |
53 | A | 53 | ASN | 0 | 0.021 | 50.779 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 | |
54 | A | 54 | TYR | 0 | 0.041 | 45.295 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 | |
55 | A | 55 | GLU | -1 | -0.758 | 50.446 | -6.336 | -6.336 | 0.000 | 0.000 | 0.000 | 0.000 | |
56 | A | 56 | ASP | -1 | -0.776 | 52.916 | -5.676 | -5.676 | 0.000 | 0.000 | 0.000 | 0.000 | |
57 | A | 57 | LEU | 0 | -0.035 | 50.769 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 | |
58 | A | 58 | LEU | 0 | -0.002 | 49.051 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
59 | A | 59 | ILE | 0 | 0.020 | 52.333 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
60 | A | 60 | ARG | 1 | 0.809 | 55.518 | 5.543 | 5.543 | 0.000 | 0.000 | 0.000 | 0.000 | |
61 | A | 61 | LYS | 1 | 0.821 | 50.585 | 6.264 | 6.264 | 0.000 | 0.000 | 0.000 | 0.000 | |
62 | A | 62 | SER | 0 | 0.004 | 53.547 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 | |
63 | A | 63 | ASN | 0 | 0.038 | 50.539 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 | |
64 | A | 64 | HIS | 0 | -0.002 | 50.127 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 | |
65 | A | 65 | ASN | 0 | 0.007 | 51.350 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
66 | A | 66 | PHE | 0 | 0.049 | 45.972 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 | |
67 | A | 67 | LEU | 0 | -0.004 | 46.181 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 | |
68 | A | 68 | VAL | 0 | 0.034 | 40.876 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 | |
69 | A | 69 | GLN | 0 | 0.022 | 40.961 | 0.262 | 0.262 | 0.000 | 0.000 | 0.000 | 0.000 | |
70 | A | 70 | ALA | 0 | 0.054 | 37.615 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 | |
71 | A | 71 | GLY | 0 | 0.048 | 36.834 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
72 | A | 72 | ASN | 0 | -0.022 | 37.602 | 0.246 | 0.246 | 0.000 | 0.000 | 0.000 | 0.000 | |
73 | A | 73 | VAL | 0 | -0.016 | 40.733 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 | |
74 | A | 74 | GLN | 0 | -0.028 | 42.058 | -0.205 | -0.205 | 0.000 | 0.000 | 0.000 | 0.000 | |
75 | A | 75 | LEU | 0 | -0.016 | 39.932 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
76 | A | 76 | ARG | 1 | 0.836 | 44.539 | 6.363 | 6.363 | 0.000 | 0.000 | 0.000 | 0.000 | |
77 | A | 77 | VAL | 0 | 0.000 | 45.665 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
78 | A | 78 | ILE | 0 | -0.003 | 47.956 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 | |
79 | A | 79 | GLY | 0 | 0.002 | 48.735 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 | |
80 | A | 80 | HIS | 0 | -0.035 | 47.268 | -0.126 | -0.126 | 0.000 | 0.000 | 0.000 | 0.000 | |
81 | A | 81 | SER | 0 | -0.027 | 46.494 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 | |
82 | A | 82 | MET | 0 | -0.038 | 45.720 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 | |
83 | A | 83 | GLN | 0 | 0.004 | 41.678 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
84 | A | 84 | ASN | 0 | -0.053 | 41.560 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
85 | A | 85 | CYS | 0 | -0.002 | 40.467 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 | |
86 | A | 86 | VAL | 0 | 0.008 | 37.853 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 | |
87 | A | 87 | LEU | 0 | -0.015 | 41.235 | 0.230 | 0.230 | 0.000 | 0.000 | 0.000 | 0.000 | |
88 | A | 88 | LYS | 1 | 0.861 | 41.064 | 7.378 | 7.378 | 0.000 | 0.000 | 0.000 | 0.000 | |
89 | A | 89 | LEU | 0 | -0.001 | 42.470 | 0.267 | 0.267 | 0.000 | 0.000 | 0.000 | 0.000 | |
90 | A | 90 | LYS | 1 | 0.866 | 43.126 | 7.075 | 7.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
91 | A | 91 | VAL | 0 | 0.039 | 41.857 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 | |
92 | A | 92 | ASP | -1 | -0.756 | 45.079 | -6.819 | -6.819 | 0.000 | 0.000 | 0.000 | 0.000 | |
93 | A | 93 | THR | 0 | -0.041 | 41.529 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
94 | A | 94 | ALA | 0 | 0.046 | 39.709 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
95 | A | 95 | ASN | 0 | -0.007 | 33.542 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
96 | A | 96 | PRO | 0 | 0.043 | 36.175 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 | |
97 | A | 97 | LYS | 1 | 0.883 | 31.094 | 9.688 | 9.688 | 0.000 | 0.000 | 0.000 | 0.000 | |
98 | A | 98 | THR | 0 | -0.005 | 31.079 | -0.370 | -0.370 | 0.000 | 0.000 | 0.000 | 0.000 | |
99 | A | 99 | PRO | 0 | 0.014 | 27.747 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
100 | A | 100 | LYS | 1 | 0.890 | 27.825 | 11.536 | 11.536 | 0.000 | 0.000 | 0.000 | 0.000 | |
101 | A | 101 | TYR | 0 | -0.052 | 28.383 | -0.452 | -0.452 | 0.000 | 0.000 | 0.000 | 0.000 | |
102 | A | 102 | LYS | 1 | 0.921 | 27.802 | 11.516 | 11.516 | 0.000 | 0.000 | 0.000 | 0.000 | |
103 | A | 103 | PHE | 0 | -0.036 | 30.354 | -0.292 | -0.292 | 0.000 | 0.000 | 0.000 | 0.000 | |
104 | A | 104 | VAL | 0 | 0.012 | 27.432 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 | |
105 | A | 105 | ARG | 1 | 0.855 | 30.898 | 9.064 | 9.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
106 | A | 106 | ILE | 0 | -0.048 | 25.805 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 | |
107 | A | 107 | GLN | 0 | 0.063 | 27.412 | 0.524 | 0.524 | 0.000 | 0.000 | 0.000 | 0.000 | |
108 | A | 108 | PRO | 0 | 0.001 | 26.787 | -0.490 | -0.490 | 0.000 | 0.000 | 0.000 | 0.000 | |
109 | A | 109 | GLY | 0 | 0.038 | 23.879 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
110 | A | 110 | GLN | 0 | -0.088 | 20.427 | -0.687 | -0.687 | 0.000 | 0.000 | 0.000 | 0.000 | |
111 | A | 111 | THR | 0 | 0.001 | 17.858 | 0.490 | 0.490 | 0.000 | 0.000 | 0.000 | 0.000 | |
112 | A | 112 | PHE | 0 | 0.002 | 20.908 | 0.295 | 0.295 | 0.000 | 0.000 | 0.000 | 0.000 | |
113 | A | 113 | SER | 0 | 0.017 | 19.108 | -0.556 | -0.556 | 0.000 | 0.000 | 0.000 | 0.000 | |
114 | A | 114 | VAL | 0 | 0.005 | 21.351 | 0.679 | 0.679 | 0.000 | 0.000 | 0.000 | 0.000 | |
115 | A | 115 | LEU | 0 | 0.004 | 23.495 | -0.493 | -0.493 | 0.000 | 0.000 | 0.000 | 0.000 | |
116 | A | 116 | ALA | 0 | 0.035 | 25.432 | 0.563 | 0.563 | 0.000 | 0.000 | 0.000 | 0.000 | |
117 | A | 117 | CYS | 0 | -0.045 | 27.820 | -0.224 | -0.224 | 0.000 | 0.000 | 0.000 | 0.000 | |
118 | A | 118 | TYR | 0 | 0.021 | 30.306 | 0.249 | 0.249 | 0.000 | 0.000 | 0.000 | 0.000 | |
119 | A | 119 | ASN | 0 | -0.010 | 34.104 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 | |
120 | A | 120 | GLY | 0 | 0.049 | 34.789 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 | |
121 | A | 121 | SER | 0 | -0.047 | 32.334 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
122 | A | 122 | PRO | 0 | 0.027 | 27.043 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
123 | A | 123 | SER | 0 | -0.067 | 27.788 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
124 | A | 124 | GLY | 0 | 0.031 | 23.699 | -0.292 | -0.292 | 0.000 | 0.000 | 0.000 | 0.000 | |
125 | A | 125 | VAL | 0 | -0.009 | 19.109 | 0.360 | 0.360 | 0.000 | 0.000 | 0.000 | 0.000 | |
126 | A | 126 | TYR | 0 | 0.033 | 19.378 | -0.648 | -0.648 | 0.000 | 0.000 | 0.000 | 0.000 | |
127 | A | 127 | GLN | 0 | 0.047 | 16.243 | 1.005 | 1.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
128 | A | 128 | CYS | 0 | -0.060 | 19.185 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
129 | A | 129 | ALA | 0 | 0.027 | 20.951 | -0.460 | -0.460 | 0.000 | 0.000 | 0.000 | 0.000 | |
130 | A | 130 | MET | 0 | -0.002 | 22.888 | 0.544 | 0.544 | 0.000 | 0.000 | 0.000 | 0.000 | |
131 | A | 131 | ARG | 1 | 0.739 | 22.739 | 12.607 | 12.607 | 0.000 | 0.000 | 0.000 | 0.000 | |
132 | A | 132 | PRO | 0 | -0.017 | 26.366 | 0.349 | 0.349 | 0.000 | 0.000 | 0.000 | 0.000 | |
133 | A | 133 | ASN | 0 | -0.030 | 29.452 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 | |
134 | A | 134 | PHE | 0 | -0.008 | 30.952 | 0.356 | 0.356 | 0.000 | 0.000 | 0.000 | 0.000 | |
135 | A | 135 | THR | 0 | -0.001 | 30.850 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 | |
136 | A | 136 | ILE | 0 | -0.004 | 26.591 | -0.356 | -0.356 | 0.000 | 0.000 | 0.000 | 0.000 | |
137 | A | 137 | LYS | 1 | 0.883 | 25.439 | 11.926 | 11.926 | 0.000 | 0.000 | 0.000 | 0.000 | |
138 | A | 138 | GLY | 0 | 0.019 | 25.215 | -0.582 | -0.582 | 0.000 | 0.000 | 0.000 | 0.000 | |
139 | A | 139 | SER | 0 | -0.038 | 26.260 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 | |
140 | A | 140 | PHE | 0 | -0.001 | 28.034 | -0.215 | -0.215 | 0.000 | 0.000 | 0.000 | 0.000 | |
141 | A | 141 | LEU | 0 | 0.065 | 31.327 | 0.234 | 0.234 | 0.000 | 0.000 | 0.000 | 0.000 | |
142 | A | 142 | ASN | 0 | 0.001 | 34.262 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 | |
143 | A | 143 | GLY | 0 | 0.015 | 36.926 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
144 | A | 144 | SER | 0 | -0.005 | 31.978 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 | |
145 | A | 145 | CYS | 0 | -0.048 | 33.314 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 | |
146 | A | 146 | GLY | 0 | 0.065 | 34.947 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 | |
147 | A | 147 | SER | 0 | -0.054 | 29.465 | -0.180 | -0.180 | 0.000 | 0.000 | 0.000 | 0.000 | |
148 | A | 148 | VAL | 0 | -0.004 | 27.998 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
149 | A | 149 | GLY | 0 | -0.030 | 25.729 | -0.463 | -0.463 | 0.000 | 0.000 | 0.000 | 0.000 | |
150 | A | 150 | PHE | 0 | -0.023 | 21.502 | 0.450 | 0.450 | 0.000 | 0.000 | 0.000 | 0.000 | |
151 | A | 151 | ASN | 0 | 0.012 | 20.745 | -1.358 | -1.358 | 0.000 | 0.000 | 0.000 | 0.000 | |
152 | A | 152 | ILE | 0 | -0.026 | 19.858 | 0.723 | 0.723 | 0.000 | 0.000 | 0.000 | 0.000 | |
153 | A | 153 | ASP | -1 | -0.878 | 19.928 | -14.828 | -14.828 | 0.000 | 0.000 | 0.000 | 0.000 | |
154 | A | 154 | TYR | 0 | 0.035 | 19.587 | 0.835 | 0.835 | 0.000 | 0.000 | 0.000 | 0.000 | |
155 | A | 155 | ASP | -1 | -0.769 | 20.858 | -12.286 | -12.286 | 0.000 | 0.000 | 0.000 | 0.000 | |
156 | A | 156 | CYS | 0 | -0.012 | 23.961 | 0.736 | 0.736 | 0.000 | 0.000 | 0.000 | 0.000 | |
157 | A | 157 | VAL | 0 | 0.000 | 24.397 | -0.593 | -0.593 | 0.000 | 0.000 | 0.000 | 0.000 | |
158 | A | 158 | SER | 0 | -0.007 | 25.094 | 0.770 | 0.770 | 0.000 | 0.000 | 0.000 | 0.000 | |
159 | A | 159 | PHE | 0 | 0.029 | 26.201 | -0.469 | -0.469 | 0.000 | 0.000 | 0.000 | 0.000 | |
160 | A | 160 | CYS | 0 | -0.009 | 26.405 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 | |
161 | A | 161 | TYR | 0 | -0.029 | 28.313 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 | |
162 | A | 162 | MET | 0 | 0.044 | 30.169 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
163 | A | 163 | HIS | 0 | 0.020 | 31.452 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 | |
164 | A | 164 | HIS | 0 | 0.003 | 33.230 | 0.426 | 0.426 | 0.000 | 0.000 | 0.000 | 0.000 | |
165 | A | 165 | MET | 0 | 0.020 | 35.837 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 | |
166 | A | 166 | GLU | -1 | -0.744 | 34.005 | -9.646 | -9.646 | 0.000 | 0.000 | 0.000 | 0.000 | |
167 | A | 167 | LEU | 0 | -0.002 | 35.784 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 | |
168 | A | 168 | PRO | 0 | 0.014 | 37.240 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 | |
169 | A | 169 | THR | 0 | -0.007 | 35.379 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 | |
170 | A | 170 | GLY | 0 | 0.049 | 33.840 | -0.248 | -0.248 | 0.000 | 0.000 | 0.000 | 0.000 | |
171 | A | 171 | VAL | 0 | -0.011 | 30.680 | -0.382 | -0.382 | 0.000 | 0.000 | 0.000 | 0.000 | |
172 | A | 172 | HIS | 0 | -0.039 | 30.205 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 | |
173 | A | 173 | ALA | 0 | 0.036 | 32.060 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 | |
174 | A | 174 | GLY | 0 | 0.034 | 33.599 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
175 | A | 175 | THR | 0 | -0.032 | 34.398 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 | |
176 | A | 176 | ASP | -1 | -0.708 | 32.728 | -9.320 | -9.320 | 0.000 | 0.000 | 0.000 | 0.000 | |
177 | A | 177 | LEU | 0 | -0.010 | 31.690 | 0.223 | 0.223 | 0.000 | 0.000 | 0.000 | 0.000 | |
178 | A | 178 | GLU | -1 | -0.778 | 35.072 | -8.363 | -8.363 | 0.000 | 0.000 | 0.000 | 0.000 | |
179 | A | 179 | GLY | 0 | 0.020 | 37.368 | 0.277 | 0.277 | 0.000 | 0.000 | 0.000 | 0.000 | |
180 | A | 180 | ASN | 0 | 0.014 | 37.925 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 | |
181 | A | 181 | PHE | 0 | 0.048 | 36.488 | -0.311 | -0.311 | 0.000 | 0.000 | 0.000 | 0.000 | |
182 | A | 182 | TYR | 0 | -0.045 | 30.630 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
183 | A | 183 | GLY | 0 | 0.045 | 34.535 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
184 | A | 184 | PRO | 0 | -0.009 | 36.269 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 | |
185 | A | 185 | PHE | 0 | -0.021 | 34.759 | 0.293 | 0.293 | 0.000 | 0.000 | 0.000 | 0.000 | |
186 | A | 186 | VAL | 0 | 0.034 | 39.557 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 | |
187 | A | 187 | ASP | -1 | -0.704 | 41.371 | -7.554 | -7.554 | 0.000 | 0.000 | 0.000 | 0.000 | |
188 | A | 188 | ARG | 1 | 0.869 | 42.623 | 6.704 | 6.704 | 0.000 | 0.000 | 0.000 | 0.000 | |
189 | A | 189 | GLN | 0 | 0.016 | 43.879 | -0.188 | -0.188 | 0.000 | 0.000 | 0.000 | 0.000 | |
190 | A | 190 | THR | 0 | 0.013 | 44.480 | 0.265 | 0.265 | 0.000 | 0.000 | 0.000 | 0.000 | |
191 | A | 191 | ALA | 0 | -0.028 | 44.022 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 | |
192 | A | 192 | GLN | 0 | 0.065 | 40.687 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
193 | A | 193 | ALA | 0 | -0.015 | 39.449 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 | |
194 | A | 194 | ALA | 0 | 0.016 | 34.488 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
195 | A | 195 | GLY | 0 | 0.048 | 36.009 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 | |
196 | A | 196 | THR | 0 | 0.020 | 32.340 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 | |
197 | A | 197 | ASP | -1 | -0.774 | 28.098 | -11.536 | -11.536 | 0.000 | 0.000 | 0.000 | 0.000 | |
198 | A | 198 | THR | 0 | 0.000 | 28.971 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 | |
199 | A | 199 | THR | 0 | 0.002 | 22.928 | -0.385 | -0.385 | 0.000 | 0.000 | 0.000 | 0.000 | |
200 | A | 200 | ILE | 0 | -0.038 | 22.026 | 0.332 | 0.332 | 0.000 | 0.000 | 0.000 | 0.000 | |
201 | A | 201 | THR | 0 | 0.013 | 21.499 | -0.873 | -0.873 | 0.000 | 0.000 | 0.000 | 0.000 | |
202 | A | 202 | VAL | 0 | 0.000 | 20.203 | -0.695 | -0.695 | 0.000 | 0.000 | 0.000 | 0.000 | |
203 | A | 203 | ASN | 0 | 0.022 | 17.948 | -0.778 | -0.778 | 0.000 | 0.000 | 0.000 | 0.000 | |
204 | A | 204 | VAL | 0 | -0.021 | 16.620 | -1.243 | -1.243 | 0.000 | 0.000 | 0.000 | 0.000 | |
205 | A | 205 | LEU | 0 | 0.003 | 16.484 | -1.029 | -1.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
206 | A | 206 | ALA | 0 | 0.025 | 14.655 | -1.033 | -1.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
207 | A | 207 | TRP | 0 | -0.035 | 12.063 | -1.500 | -1.500 | 0.000 | 0.000 | 0.000 | 0.000 | |
208 | A | 208 | LEU | 0 | -0.001 | 11.678 | -1.811 | -1.811 | 0.000 | 0.000 | 0.000 | 0.000 | |
209 | A | 209 | TYR | 0 | 0.001 | 11.913 | -0.966 | -0.966 | 0.000 | 0.000 | 0.000 | 0.000 | |
210 | A | 210 | ALA | 0 | 0.029 | 8.314 | -2.053 | -2.053 | 0.000 | 0.000 | 0.000 | 0.000 | |
211 | A | 211 | ALA | 0 | -0.006 | 7.229 | -5.033 | -5.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
212 | A | 212 | VAL | 0 | -0.011 | 7.573 | -2.324 | -2.324 | 0.000 | 0.000 | 0.000 | 0.000 | |
213 | A | 213 | ILE | 0 | -0.009 | 5.206 | -1.490 | -1.490 | 0.000 | 0.000 | 0.000 | 0.000 | |
214 | A | 214 | ASN | 0 | -0.027 | 2.615 | -24.140 | -21.770 | 0.946 | -1.464 | -1.852 | -0.015 | |
215 | A | 215 | GLY | 0 | 0.052 | 4.053 | -2.696 | -2.654 | -0.001 | -0.026 | -0.015 | 0.000 | |
216 | A | 216 | ASP | -1 | -0.756 | 6.368 | -23.954 | -23.954 | 0.000 | 0.000 | 0.000 | 0.000 | |
217 | A | 217 | ARG | 1 | 0.936 | 9.153 | 23.358 | 23.358 | 0.000 | 0.000 | 0.000 | 0.000 | |
218 | A | 218 | TRP | 0 | -0.040 | 12.093 | 2.007 | 2.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
219 | A | 219 | PHE | 0 | 0.052 | 11.973 | 1.342 | 1.342 | 0.000 | 0.000 | 0.000 | 0.000 | |
220 | A | 220 | LEU | 0 | -0.001 | 13.665 | 0.764 | 0.764 | 0.000 | 0.000 | 0.000 | 0.000 | |
221 | A | 221 | ASN | 0 | 0.017 | 17.355 | 0.542 | 0.542 | 0.000 | 0.000 | 0.000 | 0.000 | |
222 | A | 222 | ARG | 1 | 0.962 | 21.049 | 11.868 | 11.868 | 0.000 | 0.000 | 0.000 | 0.000 | |
223 | A | 223 | PHE | 0 | -0.036 | 23.623 | 0.505 | 0.505 | 0.000 | 0.000 | 0.000 | 0.000 | |
224 | A | 224 | THR | 0 | 0.092 | 23.889 | -0.436 | -0.436 | 0.000 | 0.000 | 0.000 | 0.000 | |
225 | A | 225 | THR | 0 | -0.031 | 25.635 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 | |
226 | A | 226 | THR | 0 | 0.003 | 28.167 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 | |
227 | A | 227 | LEU | 0 | 0.028 | 27.076 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 | |
228 | A | 228 | ASN | 0 | 0.005 | 29.936 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 | |
229 | A | 229 | ASP | -1 | -0.736 | 30.605 | -9.829 | -9.829 | 0.000 | 0.000 | 0.000 | 0.000 | |
230 | A | 230 | PHE | 0 | 0.016 | 24.256 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
231 | A | 231 | ASN | 0 | 0.007 | 28.885 | -0.376 | -0.376 | 0.000 | 0.000 | 0.000 | 0.000 | |
232 | A | 232 | LEU | 0 | 0.001 | 30.840 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 | |
233 | A | 233 | VAL | 0 | 0.011 | 28.077 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 | |
234 | A | 234 | ALA | 0 | 0.004 | 27.982 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 | |
235 | A | 235 | MET | 0 | 0.010 | 29.060 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
236 | A | 236 | LYS | 1 | 0.931 | 32.160 | 9.327 | 9.327 | 0.000 | 0.000 | 0.000 | 0.000 | |
237 | A | 237 | TYR | 0 | -0.008 | 27.856 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 | |
238 | A | 238 | ASN | 0 | 0.029 | 28.835 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
239 | A | 239 | TYR | 0 | 0.042 | 21.629 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 | |
240 | A | 240 | GLU | -1 | -0.778 | 26.617 | -10.030 | -10.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
241 | A | 241 | PRO | 0 | 0.012 | 27.603 | -0.347 | -0.347 | 0.000 | 0.000 | 0.000 | 0.000 | |
242 | A | 242 | LEU | 0 | -0.009 | 23.323 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 | |
243 | A | 243 | THR | 0 | 0.042 | 27.254 | 0.427 | 0.427 | 0.000 | 0.000 | 0.000 | 0.000 | |
244 | A | 244 | GLN | 0 | 0.000 | 27.046 | -0.335 | -0.335 | 0.000 | 0.000 | 0.000 | 0.000 | |
245 | A | 245 | ASP | -1 | -0.809 | 27.028 | -10.804 | -10.804 | 0.000 | 0.000 | 0.000 | 0.000 | |
246 | A | 246 | HIS | 0 | 0.002 | 23.529 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 | |
247 | A | 247 | VAL | 0 | -0.011 | 22.484 | -0.724 | -0.724 | 0.000 | 0.000 | 0.000 | 0.000 | |
248 | A | 248 | ASP | -1 | -0.756 | 22.560 | -12.041 | -12.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
249 | A | 249 | ILE | 0 | -0.007 | 19.874 | -0.533 | -0.533 | 0.000 | 0.000 | 0.000 | 0.000 | |
250 | A | 250 | LEU | 0 | -0.016 | 17.360 | -0.990 | -0.990 | 0.000 | 0.000 | 0.000 | 0.000 | |
251 | A | 251 | GLY | 0 | 0.015 | 18.053 | -0.687 | -0.687 | 0.000 | 0.000 | 0.000 | 0.000 | |
252 | A | 252 | PRO | 0 | 0.003 | 16.461 | -0.478 | -0.478 | 0.000 | 0.000 | 0.000 | 0.000 | |
253 | A | 253 | LEU | 0 | 0.033 | 11.759 | -1.127 | -1.127 | 0.000 | 0.000 | 0.000 | 0.000 | |
254 | A | 254 | SER | 0 | -0.044 | 14.497 | -0.588 | -0.588 | 0.000 | 0.000 | 0.000 | 0.000 | |
255 | A | 255 | ALA | 0 | 0.008 | 17.164 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 | |
256 | A | 256 | GLN | 0 | 0.004 | 9.042 | 1.452 | 1.452 | 0.000 | 0.000 | 0.000 | 0.000 | |
257 | A | 257 | THR | 0 | -0.029 | 11.254 | -0.565 | -0.565 | 0.000 | 0.000 | 0.000 | 0.000 | |
258 | A | 258 | GLY | 0 | 0.055 | 13.739 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 | |
259 | A | 259 | ILE | 0 | -0.048 | 14.163 | 0.962 | 0.962 | 0.000 | 0.000 | 0.000 | 0.000 | |
260 | A | 260 | ALA | 0 | 0.034 | 17.782 | -0.284 | -0.284 | 0.000 | 0.000 | 0.000 | 0.000 | |
261 | A | 261 | VAL | 0 | 0.040 | 19.937 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 | |
262 | A | 262 | LEU | 0 | -0.024 | 21.290 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 | |
263 | A | 263 | ASP | -1 | -0.763 | 20.751 | -12.953 | -12.953 | 0.000 | 0.000 | 0.000 | 0.000 | |
264 | A | 264 | MET | 0 | -0.029 | 14.298 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
265 | A | 265 | CYS | 0 | -0.055 | 19.402 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
266 | A | 266 | ALA | 0 | 0.032 | 22.518 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 | |
267 | A | 267 | SER | 0 | 0.018 | 18.545 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 | |
268 | A | 268 | LEU | 0 | -0.014 | 19.951 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
269 | A | 269 | LYS | 1 | 0.820 | 21.186 | 10.699 | 10.699 | 0.000 | 0.000 | 0.000 | 0.000 | |
270 | A | 270 | GLU | -1 | -0.721 | 22.822 | -10.899 | -10.899 | 0.000 | 0.000 | 0.000 | 0.000 | |
271 | A | 271 | LEU | 0 | -0.004 | 17.579 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 | |
272 | A | 272 | LEU | 0 | -0.030 | 22.164 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 | |
273 | A | 273 | GLN | 0 | 0.008 | 25.018 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 | |
274 | A | 274 | ASN | 0 | -0.019 | 24.855 | 0.745 | 0.745 | 0.000 | 0.000 | 0.000 | 0.000 | |
275 | A | 275 | GLY | 0 | 0.045 | 24.016 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 | |
276 | A | 276 | MET | 0 | -0.043 | 16.462 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 | |
277 | A | 277 | ASN | 0 | 0.006 | 20.611 | -0.548 | -0.548 | 0.000 | 0.000 | 0.000 | 0.000 | |
278 | A | 278 | GLY | 0 | 0.053 | 21.564 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
279 | A | 279 | ARG | 1 | 0.831 | 16.853 | 13.965 | 13.965 | 0.000 | 0.000 | 0.000 | 0.000 | |
280 | A | 280 | THR | 0 | 0.009 | 13.699 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 | |
281 | A | 281 | ILE | 0 | 0.000 | 11.799 | -0.671 | -0.671 | 0.000 | 0.000 | 0.000 | 0.000 | |
282 | A | 282 | LEU | 0 | -0.022 | 6.703 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
283 | A | 283 | GLY | 0 | 0.027 | 9.882 | 0.295 | 0.295 | 0.000 | 0.000 | 0.000 | 0.000 | |
284 | A | 284 | SER | 0 | -0.006 | 12.029 | 1.627 | 1.627 | 0.000 | 0.000 | 0.000 | 0.000 | |
285 | A | 285 | ALA | 0 | 0.043 | 15.268 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 | |
286 | A | 286 | LEU | 0 | -0.033 | 18.086 | 0.926 | 0.926 | 0.000 | 0.000 | 0.000 | 0.000 | |
287 | A | 287 | LEU | 0 | -0.013 | 17.418 | -1.295 | -1.295 | 0.000 | 0.000 | 0.000 | 0.000 | |
288 | A | 288 | GLU | -1 | -0.720 | 14.657 | -17.662 | -17.662 | 0.000 | 0.000 | 0.000 | 0.000 | |
289 | A | 289 | ASP | -1 | -0.725 | 17.175 | -14.657 | -14.657 | 0.000 | 0.000 | 0.000 | 0.000 | |
290 | A | 290 | GLU | -1 | -0.727 | 17.833 | -13.883 | -13.883 | 0.000 | 0.000 | 0.000 | 0.000 | |
291 | A | 291 | PHE | 0 | -0.040 | 11.861 | -0.731 | -0.731 | 0.000 | 0.000 | 0.000 | 0.000 | |
292 | A | 292 | THR | 0 | 0.000 | 15.569 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 | |
293 | A | 293 | PRO | 0 | 0.041 | 15.125 | -1.421 | -1.421 | 0.000 | 0.000 | 0.000 | 0.000 | |
294 | A | 294 | PHE | 0 | 0.010 | 14.648 | -1.201 | -1.201 | 0.000 | 0.000 | 0.000 | 0.000 | |
295 | A | 295 | ASP | -1 | -0.710 | 13.686 | -19.684 | -19.684 | 0.000 | 0.000 | 0.000 | 0.000 | |
296 | A | 296 | VAL | 0 | -0.001 | 9.673 | -2.218 | -2.218 | 0.000 | 0.000 | 0.000 | 0.000 | |
297 | A | 297 | VAL | 0 | 0.054 | 9.751 | -2.800 | -2.800 | 0.000 | 0.000 | 0.000 | 0.000 | |
298 | A | 298 | ARG | 1 | 0.859 | 10.834 | 17.884 | 17.884 | 0.000 | 0.000 | 0.000 | 0.000 | |
299 | A | 299 | GLN | 0 | -0.005 | 6.983 | -5.002 | -5.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
300 | A | 300 | CYS | 0 | -0.043 | 5.874 | -5.805 | -5.805 | 0.000 | 0.000 | 0.000 | 0.000 | |
301 | A | 301 | SER | 0 | -0.042 | 6.921 | -1.993 | -1.993 | 0.000 | 0.000 | 0.000 | 0.000 | |
302 | A | 302 | GLY | 0 | -0.010 | 8.781 | 0.491 | 0.491 | 0.000 | 0.000 | 0.000 | 0.000 | |
303 | A | 303 | VAL | 0 | -0.033 | 9.217 | 1.995 | 1.995 | 0.000 | 0.000 | 0.000 | 0.000 | |
304 | A | 304 | THR | 0 | -0.042 | 12.880 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
305 | A | 305 | PHE | 0 | -0.049 | 14.578 | 0.749 | 0.749 | 0.000 | 0.000 | 0.000 | 0.000 | |
306 | A | 306 | GLN | -1 | -0.815 | 18.287 | -13.526 | -13.526 | 0.000 | 0.000 | 0.000 | 0.000 | |
307 | A | 502 | HOH | 0 | -0.025 | 32.094 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
308 | A | 503 | HOH | 0 | -0.035 | 15.241 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 | |
309 | A | 504 | HOH | 0 | 0.003 | 29.598 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 | |
310 | A | 505 | HOH | 0 | 0.001 | 50.602 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 | |
311 | A | 506 | HOH | 0 | 0.006 | 2.698 | -11.949 | -10.475 | 0.966 | -1.217 | -1.223 | -0.015 | |
312 | A | 507 | HOH | 0 | -0.012 | 51.327 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
313 | A | 508 | HOH | 0 | -0.039 | 19.109 | -0.404 | -0.404 | 0.000 | 0.000 | 0.000 | 0.000 | |
314 | A | 509 | HOH | 0 | -0.024 | 3.981 | -3.197 | -3.073 | 0.000 | -0.068 | -0.055 | 0.000 | |
315 | A | 510 | HOH | 0 | -0.062 | 36.888 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
316 | A | 511 | HOH | 0 | -0.037 | 35.517 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
317 | A | 512 | HOH | 0 | -0.007 | 26.750 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 | |
318 | A | 513 | HOH | 0 | 0.003 | 21.580 | -0.237 | -0.237 | 0.000 | 0.000 | 0.000 | 0.000 | |
319 | A | 514 | HOH | 0 | -0.024 | 30.251 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 | |
320 | A | 515 | HOH | 0 | -0.005 | 37.736 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
321 | A | 516 | HOH | 0 | 0.003 | 44.828 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
322 | A | 517 | HOH | 0 | -0.025 | 32.353 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
323 | A | 518 | HOH | 0 | -0.029 | 22.073 | -0.220 | -0.220 | 0.000 | 0.000 | 0.000 | 0.000 | |
324 | A | 519 | HOH | 0 | -0.016 | 57.626 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
325 | A | 520 | HOH | 0 | -0.020 | 38.436 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 | |
326 | A | 521 | HOH | 0 | -0.011 | 48.360 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
327 | A | 522 | HOH | 0 | -0.016 | 51.260 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
328 | A | 523 | HOH | 0 | -0.020 | 42.810 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
329 | A | 524 | HOH | 0 | -0.011 | 52.800 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
330 | A | 525 | HOH | 0 | -0.032 | 28.867 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
331 | A | 526 | HOH | 0 | -0.010 | 28.900 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
332 | A | 527 | HOH | 0 | -0.012 | 28.678 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
333 | A | 528 | HOH | 0 | 0.010 | 24.320 | 0.266 | 0.266 | 0.000 | 0.000 | 0.000 | 0.000 | |
334 | A | 529 | HOH | 0 | -0.032 | 34.599 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 | |
335 | A | 531 | HOH | 0 | 0.023 | 21.380 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
336 | A | 532 | HOH | 0 | -0.045 | 27.880 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 | |
337 | A | 533 | HOH | 0 | -0.026 | 19.839 | 0.294 | 0.294 | 0.000 | 0.000 | 0.000 | 0.000 | |
338 | A | 534 | HOH | 0 | -0.017 | 44.336 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
339 | A | 535 | HOH | 0 | -0.005 | 28.611 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
340 | A | 536 | HOH | 0 | 0.007 | 28.938 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 | |
341 | A | 537 | HOH | 0 | 0.004 | 32.028 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 | |
342 | A | 538 | HOH | 0 | -0.031 | 39.362 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 | |
343 | A | 539 | HOH | 0 | -0.010 | 9.263 | 1.034 | 1.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
344 | A | 540 | HOH | 0 | -0.036 | 25.500 | -0.198 | -0.198 | 0.000 | 0.000 | 0.000 | 0.000 | |
345 | A | 541 | HOH | 0 | 0.003 | 17.954 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
346 | A | 542 | HOH | 0 | 0.017 | 46.544 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
347 | A | 543 | HOH | 0 | 0.003 | 17.897 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 | |
348 | A | 544 | HOH | 0 | -0.011 | 17.718 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
349 | A | 545 | HOH | 0 | 0.006 | 46.712 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 | |
350 | A | 546 | HOH | 0 | -0.041 | 39.071 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
351 | A | 547 | HOH | 0 | -0.029 | 48.200 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 | |
352 | A | 548 | HOH | 0 | 0.003 | 28.570 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 | |
353 | A | 549 | HOH | 0 | 0.026 | 23.166 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
354 | A | 550 | HOH | 0 | 0.018 | 48.222 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
355 | A | 551 | HOH | 0 | -0.057 | 29.293 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 | |
356 | A | 552 | HOH | 0 | -0.055 | 33.118 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
357 | A | 553 | HOH | 0 | 0.001 | 35.853 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 | |
358 | A | 554 | HOH | 0 | -0.016 | 32.644 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 | |
359 | A | 555 | HOH | 0 | -0.054 | 28.593 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 | |
360 | A | 556 | HOH | 0 | -0.036 | 29.130 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
361 | A | 558 | HOH | 0 | 0.025 | 7.303 | -1.867 | -1.867 | 0.000 | 0.000 | 0.000 | 0.000 | |
362 | A | 559 | HOH | 0 | -0.038 | 34.687 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
363 | A | 560 | HOH | 0 | 0.001 | 50.190 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 | |
364 | A | 561 | HOH | 0 | -0.044 | 52.864 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
365 | A | 562 | HOH | 0 | -0.007 | 20.821 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
366 | A | 563 | HOH | 0 | 0.010 | 53.980 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
367 | A | 564 | HOH | 0 | -0.023 | 26.918 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 | |
368 | A | 565 | HOH | 0 | -0.056 | 13.301 | -0.393 | -0.393 | 0.000 | 0.000 | 0.000 | 0.000 | |
369 | A | 566 | HOH | 0 | -0.035 | 27.034 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
370 | A | 567 | HOH | 0 | -0.019 | 23.885 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 | |
371 | A | 568 | HOH | 0 | -0.024 | 18.069 | -0.195 | -0.195 | 0.000 | 0.000 | 0.000 | 0.000 | |
372 | A | 569 | HOH | 0 | -0.018 | 57.595 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
373 | A | 570 | HOH | 0 | -0.035 | 53.299 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
374 | A | 571 | HOH | 0 | 0.010 | 21.172 | -0.292 | -0.292 | 0.000 | 0.000 | 0.000 | 0.000 | |
375 | A | 572 | HOH | 0 | -0.024 | 34.200 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 | |
376 | A | 573 | HOH | 0 | -0.022 | 26.955 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 | |
377 | A | 574 | HOH | 0 | -0.012 | 57.734 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
378 | A | 575 | HOH | 0 | 0.003 | 28.042 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 | |
379 | A | 576 | HOH | 0 | -0.011 | 52.942 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
380 | A | 577 | HOH | 0 | 0.008 | 33.989 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 | |
381 | A | 578 | HOH | 0 | -0.025 | 18.574 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 | |
382 | A | 579 | HOH | 0 | -0.020 | 2.787 | 4.854 | 5.597 | 0.102 | -0.478 | -0.366 | -0.004 | |
383 | A | 580 | HOH | 0 | -0.015 | 57.444 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
384 | A | 581 | HOH | 0 | -0.058 | 54.068 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
385 | A | 582 | HOH | 0 | -0.010 | 26.246 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 | |
386 | A | 583 | HOH | 0 | 0.002 | 21.186 | 0.334 | 0.334 | 0.000 | 0.000 | 0.000 | 0.000 | |
387 | A | 585 | HOH | 0 | -0.032 | 18.076 | 0.334 | 0.334 | 0.000 | 0.000 | 0.000 | 0.000 | |
388 | A | 586 | HOH | 0 | -0.058 | 30.966 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 | |
389 | A | 587 | HOH | 0 | -0.027 | 25.357 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 | |
390 | A | 588 | HOH | 0 | -0.004 | 33.509 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 | |
391 | A | 589 | HOH | 0 | -0.034 | 21.189 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
392 | A | 590 | HOH | 0 | -0.025 | 50.147 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
393 | A | 591 | HOH | 0 | 0.009 | 19.209 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 | |
394 | A | 592 | HOH | 0 | -0.012 | 45.773 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 | |
395 | A | 593 | HOH | 0 | 0.016 | 22.039 | -0.203 | -0.203 | 0.000 | 0.000 | 0.000 | 0.000 | |
396 | A | 595 | HOH | 0 | -0.043 | 3.987 | -3.009 | -2.944 | 0.000 | -0.016 | -0.048 | 0.000 | |
397 | A | 596 | HOH | 0 | 0.010 | 40.388 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 | |
398 | A | 597 | HOH | 0 | -0.006 | 28.859 | 0.169 | 0.169 | 0.000 | 0.000 | 0.000 | 0.000 | |
399 | A | 598 | HOH | 0 | 0.029 | 14.021 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 | |
400 | A | 599 | HOH | 0 | -0.027 | 27.616 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 | |
401 | A | 600 | HOH | 0 | -0.001 | 25.287 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
402 | A | 601 | HOH | 0 | -0.035 | 51.423 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
403 | A | 602 | HOH | 0 | -0.046 | 50.861 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
404 | A | 603 | HOH | 0 | 0.005 | 31.763 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 | |
405 | A | 604 | HOH | 0 | 0.035 | 24.139 | -0.221 | -0.221 | 0.000 | 0.000 | 0.000 | 0.000 | |
406 | A | 605 | HOH | 0 | -0.033 | 27.067 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 | |
407 | A | 606 | HOH | 0 | -0.004 | 35.323 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
408 | A | 607 | HOH | 0 | 0.027 | 35.036 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
409 | A | 608 | HOH | 0 | -0.057 | 45.630 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
410 | A | 609 | HOH | 0 | -0.005 | 46.283 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 | |
411 | A | 611 | HOH | 0 | -0.018 | 29.446 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 | |
412 | A | 612 | HOH | 0 | -0.018 | 37.038 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
413 | A | 613 | HOH | 0 | 0.007 | 19.262 | -0.278 | -0.278 | 0.000 | 0.000 | 0.000 | 0.000 | |
414 | A | 614 | HOH | 0 | -0.018 | 16.409 | -0.221 | -0.221 | 0.000 | 0.000 | 0.000 | 0.000 | |
415 | A | 615 | HOH | 0 | 0.006 | 40.372 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
416 | A | 616 | HOH | 0 | -0.008 | 33.533 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
417 | A | 617 | HOH | 0 | 0.001 | 29.760 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
418 | A | 618 | HOH | 0 | -0.022 | 38.617 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 | |
419 | A | 619 | HOH | 0 | 0.039 | 14.398 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 | |
420 | A | 620 | HOH | 0 | -0.040 | 36.149 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 | |
421 | A | 621 | HOH | 0 | -0.014 | 15.854 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 | |
422 | A | 622 | HOH | 0 | 0.003 | 25.603 | -0.251 | -0.251 | 0.000 | 0.000 | 0.000 | 0.000 | |
423 | A | 623 | HOH | 0 | -0.008 | 29.293 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
424 | A | 624 | HOH | 0 | -0.031 | 32.619 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
425 | A | 625 | HOH | 0 | -0.041 | 11.676 | 0.549 | 0.549 | 0.000 | 0.000 | 0.000 | 0.000 | |
426 | A | 626 | HOH | 0 | -0.048 | 40.100 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 | |
427 | A | 627 | HOH | 0 | -0.019 | 19.985 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
428 | A | 628 | HOH | 0 | -0.008 | 49.425 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
429 | A | 629 | HOH | 0 | 0.012 | 31.528 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
430 | A | 630 | HOH | 0 | 0.001 | 38.375 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 | |
431 | A | 631 | HOH | 0 | 0.005 | 54.905 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
432 | A | 632 | HOH | 0 | -0.016 | 39.712 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 | |
433 | A | 633 | HOH | 0 | -0.008 | 36.694 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
434 | A | 634 | HOH | 0 | -0.018 | 47.592 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
435 | A | 635 | HOH | 0 | -0.001 | 43.915 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
436 | A | 636 | HOH | 0 | -0.024 | 19.493 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 | |
437 | A | 637 | HOH | 0 | -0.017 | 34.547 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
438 | A | 638 | HOH | 0 | -0.009 | 43.739 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
439 | A | 639 | HOH | 0 | -0.020 | 43.109 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
440 | A | 640 | HOH | 0 | 0.017 | 49.638 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 | |
441 | A | 641 | HOH | 0 | -0.014 | 56.014 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 | |
442 | A | 642 | HOH | 0 | -0.005 | 55.416 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
443 | A | 643 | HOH | 0 | -0.004 | 31.017 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
444 | A | 644 | HOH | 0 | -0.040 | 40.799 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 | |
445 | A | 645 | HOH | 0 | -0.014 | 46.302 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
446 | A | 646 | HOH | 0 | -0.024 | 34.110 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
447 | A | 647 | HOH | 0 | -0.010 | 27.490 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 | |
448 | A | 648 | HOH | 0 | -0.017 | 30.956 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
449 | A | 649 | HOH | 0 | 0.006 | 25.223 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
450 | A | 650 | HOH | 0 | -0.043 | 29.168 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 | |
451 | A | 651 | HOH | 0 | -0.007 | 41.728 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 | |
452 | A | 652 | HOH | 0 | -0.017 | 53.511 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
453 | A | 653 | HOH | 0 | -0.014 | 27.274 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 | |
454 | A | 654 | HOH | 0 | 0.007 | 45.113 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
455 | A | 655 | HOH | 0 | -0.033 | 23.465 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 | |
456 | A | 656 | HOH | 0 | -0.002 | 20.502 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
457 | A | 657 | HOH | 0 | -0.037 | 32.547 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
458 | A | 658 | HOH | 0 | -0.028 | 41.971 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
459 | A | 659 | HOH | 0 | -0.033 | 37.662 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
460 | A | 660 | HOH | 0 | -0.022 | 15.218 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 | |
461 | A | 661 | HOH | 0 | -0.020 | 16.084 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 | |
462 | A | 662 | HOH | 0 | -0.017 | 43.262 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 | |
463 | A | 663 | HOH | 0 | -0.004 | 37.603 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
464 | A | 664 | HOH | 0 | 0.001 | 15.410 | 0.494 | 0.494 | 0.000 | 0.000 | 0.000 | 0.000 | |
465 | A | 665 | HOH | 0 | -0.004 | 26.853 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 | |
466 | A | 666 | HOH | 0 | -0.026 | 38.463 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
467 | A | 667 | HOH | 0 | -0.020 | 13.857 | -0.568 | -0.568 | 0.000 | 0.000 | 0.000 | 0.000 | |
468 | A | 668 | HOH | 0 | 0.011 | 33.708 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 | |
469 | A | 669 | HOH | 0 | -0.040 | 20.671 | -0.284 | -0.284 | 0.000 | 0.000 | 0.000 | 0.000 | |
470 | A | 670 | HOH | 0 | -0.033 | 14.108 | 0.411 | 0.411 | 0.000 | 0.000 | 0.000 | 0.000 | |
471 | A | 671 | HOH | 0 | 0.015 | 42.118 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
472 | A | 672 | HOH | 0 | 0.007 | 39.069 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 | |
473 | A | 673 | HOH | 0 | 0.000 | 13.797 | -0.855 | -0.855 | 0.000 | 0.000 | 0.000 | 0.000 | |
474 | A | 674 | HOH | 0 | 0.002 | 30.870 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 | |
475 | A | 675 | HOH | 0 | 0.021 | 11.800 | -0.419 | -0.419 | 0.000 | 0.000 | 0.000 | 0.000 | |
476 | A | 676 | HOH | 0 | -0.017 | 33.243 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
477 | A | 677 | HOH | 0 | -0.010 | 22.986 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
478 | A | 678 | HOH | 0 | -0.028 | 27.850 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 | |
479 | A | 679 | HOH | 0 | -0.012 | 22.703 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 | |
480 | A | 680 | HOH | 0 | -0.029 | 30.745 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 | |
481 | A | 681 | HOH | 0 | 0.020 | 25.441 | -0.221 | -0.221 | 0.000 | 0.000 | 0.000 | 0.000 | |
482 | A | 682 | HOH | 0 | 0.013 | 31.765 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 | |
483 | A | 683 | HOH | 0 | 0.020 | 34.414 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 | |
484 | A | 684 | HOH | 0 | -0.026 | 18.153 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
485 | A | 685 | HOH | 0 | 0.001 | 14.055 | -0.403 | -0.403 | 0.000 | 0.000 | 0.000 | 0.000 | |
486 | A | 686 | HOH | 0 | -0.008 | 37.144 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
487 | A | 687 | HOH | 0 | -0.022 | 6.310 | 2.388 | 2.388 | 0.000 | 0.000 | 0.000 | 0.000 | |
488 | A | 688 | HOH | 0 | 0.022 | 48.890 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 | |
489 | A | 689 | HOH | 0 | -0.056 | 48.926 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 | |
490 | A | 690 | HOH | 0 | 0.018 | 27.452 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 | |
491 | A | 691 | HOH | 0 | -0.027 | 10.362 | -0.291 | -0.291 | 0.000 | 0.000 | 0.000 | 0.000 | |
492 | A | 692 | HOH | 0 | 0.005 | 45.381 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
493 | A | 693 | HOH | 0 | -0.041 | 8.061 | 1.503 | 1.503 | 0.000 | 0.000 | 0.000 | 0.000 | |
494 | A | 694 | HOH | 0 | 0.020 | 39.413 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 | |
495 | A | 695 | HOH | 0 | 0.027 | 64.274 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
496 | A | 696 | HOH | 0 | -0.016 | 42.440 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
497 | A | 697 | HOH | 0 | 0.024 | 57.018 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 | |
498 | A | 698 | HOH | 0 | 0.005 | 26.040 | -0.236 | -0.236 | 0.000 | 0.000 | 0.000 | 0.000 | |
499 | A | 699 | HOH | 0 | -0.019 | 35.538 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
500 | A | 700 | HOH | 0 | 0.036 | 33.799 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 | |
501 | A | 701 | HOH | 0 | 0.011 | 32.772 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 | |
502 | A | 702 | HOH | 0 | -0.026 | 5.489 | -0.648 | -0.648 | 0.000 | 0.000 | 0.000 | 0.000 | |
503 | A | 704 | HOH | 0 | -0.015 | 18.904 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
504 | A | 705 | HOH | 0 | 0.019 | 51.095 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 | |
505 | A | 706 | HOH | 0 | -0.006 | 40.021 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 | |
506 | A | 707 | HOH | 0 | 0.002 | 30.987 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
507 | A | 708 | HOH | 0 | -0.006 | 11.930 | -0.917 | -0.917 | 0.000 | 0.000 | 0.000 | 0.000 | |
508 | A | 709 | HOH | 0 | -0.025 | 23.469 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 | |
509 | A | 710 | HOH | 0 | 0.004 | 35.150 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 | |
510 | A | 711 | HOH | 0 | -0.006 | 51.832 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
511 | A | 712 | HOH | 0 | 0.002 | 42.989 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 | |
512 | A | 713 | HOH | 0 | -0.016 | 28.073 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 | |
513 | A | 714 | HOH | 0 | 0.034 | 32.035 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 | |
514 | A | 715 | HOH | 0 | 0.035 | 54.619 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
515 | A | 716 | HOH | 0 | -0.002 | 45.925 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
516 | A | 717 | HOH | 0 | 0.001 | 43.944 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 | |
517 | A | 718 | HOH | 0 | 0.006 | 1.989 | -22.665 | -23.280 | 5.223 | -2.425 | -2.183 | -0.035 | |
518 | A | 719 | HOH | 0 | 0.029 | 41.565 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
519 | A | 720 | HOH | 0 | -0.021 | 10.042 | 0.834 | 0.834 | 0.000 | 0.000 | 0.000 | 0.000 | |
520 | A | 721 | HOH | 0 | -0.018 | 54.356 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
521 | A | 722 | HOH | 0 | 0.004 | 47.016 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 | |
522 | A | 723 | HOH | 0 | 0.016 | 42.781 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
523 | A | 724 | HOH | 0 | 0.022 | 34.059 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 | |
524 | A | 725 | HOH | 0 | -0.019 | 22.066 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 | |
525 | A | 726 | HOH | 0 | -0.026 | 36.992 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 | |
526 | A | 727 | HOH | 0 | -0.011 | 25.372 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 | |
527 | A | 728 | HOH | 0 | -0.024 | 26.330 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
528 | A | 729 | HOH | 0 | 0.005 | 50.148 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 | |
529 | A | 730 | HOH | 0 | 0.016 | 12.043 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
530 | A | 731 | HOH | 0 | -0.008 | 40.664 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 | |
531 | A | 732 | HOH | 0 | -0.009 | 41.031 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
532 | A | 733 | HOH | 0 | 0.019 | 23.530 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
533 | A | 734 | HOH | 0 | 0.012 | 38.230 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 | |
534 | A | 735 | HOH | 0 | -0.004 | 24.851 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 | |
535 | A | 736 | HOH | 0 | 0.009 | 54.129 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 | |
536 | A | 737 | HOH | 0 | -0.010 | 31.951 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
537 | A | 739 | HOH | 0 | 0.009 | 36.128 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
538 | A | 740 | HOH | 0 | 0.005 | 41.332 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 | |
539 | A | 741 | HOH | 0 | -0.011 | 35.044 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 | |
540 | A | 742 | HOH | 0 | 0.018 | 11.192 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 | |
541 | A | 743 | HOH | 0 | 0.015 | 44.536 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
542 | A | 744 | HOH | 0 | 0.005 | 42.963 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 | |
543 | A | 745 | HOH | 0 | 0.004 | 46.546 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 | |
544 | A | 746 | HOH | 0 | 0.029 | 51.422 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
545 | A | 747 | HOH | 0 | -0.010 | 1.878 | -17.105 | -18.682 | 6.702 | -2.823 | -2.302 | -0.035 | |
546 | A | 748 | HOH | 0 | 0.024 | 34.368 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 | |
547 | A | 749 | HOH | 0 | 0.002 | 48.631 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
548 | A | 751 | HOH | 0 | 0.015 | 24.120 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
549 | A | 752 | HOH | 0 | 0.012 | 31.802 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 | |
550 | A | 753 | HOH | 0 | 0.000 | 54.789 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
551 | A | 754 | HOH | 0 | -0.005 | 14.640 | -0.278 | -0.278 | 0.000 | 0.000 | 0.000 | 0.000 | |
552 | A | 755 | HOH | 0 | -0.048 | 34.422 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
553 | A | 756 | HOH | 0 | 0.000 | 13.972 | 0.519 | 0.519 | 0.000 | 0.000 | 0.000 | 0.000 | |
554 | A | 757 | HOH | 0 | -0.048 | 50.832 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
555 | A | 758 | HOH | 0 | 0.007 | 43.203 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 | |
556 | A | 759 | HOH | 0 | 0.011 | 22.975 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
557 | A | 760 | HOH | 0 | 0.008 | 15.568 | -0.466 | -0.466 | 0.000 | 0.000 | 0.000 | 0.000 | |
558 | A | 761 | HOH | 0 | -0.008 | 50.221 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
559 | A | 762 | HOH | 0 | 0.005 | 33.008 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 | |
560 | A | 763 | HOH | 0 | -0.013 | 30.253 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
561 | A | 764 | HOH | 0 | 0.030 | 32.269 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 | |
562 | A | 765 | HOH | 0 | 0.010 | 26.067 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
563 | A | 766 | HOH | 0 | -0.022 | 49.765 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | |
564 | A | 767 | HOH | 0 | -0.044 | 38.473 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
565 | A | 768 | HOH | 0 | -0.017 | 17.231 | -0.325 | -0.325 | 0.000 | 0.000 | 0.000 | 0.000 | |
566 | A | 769 | HOH | 0 | -0.012 | 41.288 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
567 | A | 770 | HOH | 0 | -0.005 | 39.625 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
568 | A | 771 | HOH | 0 | 0.024 | 52.830 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
569 | A | 772 | HOH | 0 | -0.005 | 49.497 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 | |
570 | A | 773 | HOH | 0 | -0.004 | 50.831 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
571 | A | 774 | HOH | 0 | 0.028 | 30.236 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 | |
572 | A | 775 | HOH | 0 | 0.033 | 13.561 | -0.383 | -0.383 | 0.000 | 0.000 | 0.000 | 0.000 | |
573 | A | 776 | HOH | 0 | -0.008 | 40.177 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 | |
574 | A | 777 | HOH | 0 | -0.015 | 36.922 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
575 | A | 778 | HOH | 0 | 0.001 | 25.944 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 | |
576 | A | 779 | HOH | 0 | 0.013 | 35.233 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 | |
577 | A | 780 | HOH | 0 | -0.050 | 31.437 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 | |
578 | A | 781 | HOH | 0 | -0.013 | 39.485 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 | |
579 | A | 783 | HOH | 0 | 0.019 | 49.295 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
580 | A | 784 | HOH | 0 | -0.034 | 20.452 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 | |
581 | A | 785 | HOH | 0 | 0.014 | 31.004 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 | |
582 | A | 786 | HOH | 0 | 0.008 | 22.900 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 | |
583 | A | 787 | HOH | 0 | -0.028 | 19.515 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 | |
584 | A | 788 | HOH | 0 | -0.010 | 43.904 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 | |
585 | A | 789 | HOH | 0 | 0.016 | 18.944 | 0.358 | 0.358 | 0.000 | 0.000 | 0.000 | 0.000 | |
586 | A | 790 | HOH | 0 | 0.013 | 18.418 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 | |
587 | A | 791 | HOH | 0 | 0.008 | 52.694 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 | |
588 | A | 792 | HOH | 0 | -0.001 | 34.354 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 | |
589 | A | 793 | HOH | 0 | 0.024 | 45.822 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
590 | A | 794 | HOH | 0 | 0.034 | 23.175 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 | |
591 | A | 795 | HOH | 0 | 0.019 | 8.654 | -0.150 | -0.150 | 0.000 | 0.000 | 0.000 | 0.000 | |
592 | A | 797 | HOH | 0 | 0.027 | 44.415 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
593 | A | 798 | HOH | 0 | -0.017 | 25.955 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
594 | A | 799 | HOH | 0 | 0.001 | 41.171 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 | |
595 | A | 800 | HOH | 0 | -0.016 | 35.869 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
596 | A | 801 | HOH | 0 | 0.030 | 28.240 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 | |
597 | A | 802 | HOH | 0 | -0.016 | 34.448 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
598 | A | 803 | HOH | 0 | 0.010 | 54.595 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 | |
599 | A | 804 | HOH | 0 | -0.026 | 16.197 | 0.378 | 0.378 | 0.000 | 0.000 | 0.000 | 0.000 | |
600 | A | 805 | HOH | 0 | 0.025 | 26.785 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 | |
601 | A | 806 | HOH | 0 | 0.025 | 48.430 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
602 | A | 807 | HOH | 0 | -0.027 | 13.381 | 0.493 | 0.493 | 0.000 | 0.000 | 0.000 | 0.000 | |
603 | A | 808 | HOH | 0 | -0.024 | 49.191 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 | |
604 | A | 809 | HOH | 0 | -0.009 | 13.546 | 0.252 | 0.252 | 0.000 | 0.000 | 0.000 | 0.000 | |
605 | A | 810 | HOH | 0 | -0.041 | 30.440 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
606 | A | 811 | HOH | 0 | -0.025 | 26.594 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 | |
607 | A | 812 | HOH | 0 | -0.003 | 23.046 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 | |
608 | A | 813 | HOH | 0 | -0.026 | 31.506 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 | |
609 | A | 815 | HOH | 0 | -0.001 | 43.471 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
610 | A | 816 | HOH | 0 | -0.023 | 28.146 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 | |
611 | A | 817 | HOH | 0 | 0.013 | 17.240 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
612 | A | 818 | HOH | 0 | 0.003 | 29.311 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 | |
613 | A | 819 | HOH | 0 | 0.021 | 36.903 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 | |
614 | A | 820 | HOH | 0 | -0.032 | 23.373 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 | |
615 | A | 821 | HOH | 0 | 0.016 | 22.162 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 | |
616 | A | 822 | HOH | 0 | -0.032 | 33.465 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
617 | A | 823 | HOH | 0 | 0.033 | 30.034 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 | |
618 | A | 824 | HOH | 0 | -0.039 | 37.013 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
619 | A | 825 | HOH | 0 | -0.009 | 35.417 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 | |
620 | A | 826 | HOH | 0 | -0.008 | 4.506 | -2.911 | -2.888 | -0.001 | -0.005 | -0.018 | 0.000 | |
621 | A | 828 | HOH | 0 | -0.012 | 34.512 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 | |
622 | A | 829 | HOH | 0 | 0.010 | 31.703 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 | |
623 | A | 830 | HOH | 0 | 0.025 | 43.627 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 | |
624 | A | 831 | HOH | 0 | 0.002 | 44.564 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
625 | A | 832 | HOH | 0 | -0.010 | 51.231 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
626 | A | 833 | HOH | 0 | -0.044 | 25.273 | 0.287 | 0.287 | 0.000 | 0.000 | 0.000 | 0.000 | |
627 | A | 834 | HOH | 0 | 0.025 | 52.799 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
628 | A | 836 | HOH | 0 | 0.009 | 30.226 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 | |
629 | A | 837 | HOH | 0 | -0.023 | 34.452 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 | |
630 | A | 838 | HOH | 0 | -0.001 | 19.652 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 | |
631 | A | 839 | HOH | 0 | -0.041 | 35.004 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
632 | A | 840 | HOH | 0 | -0.022 | 56.796 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 | |
633 | A | 841 | HOH | 0 | -0.022 | 28.161 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 | |
634 | A | 843 | HOH | 0 | -0.013 | 28.181 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
635 | A | 844 | HOH | 0 | 0.013 | 25.057 | -0.249 | -0.249 | 0.000 | 0.000 | 0.000 | 0.000 | |
636 | A | 845 | HOH | 0 | 0.001 | 8.347 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 | |
637 | A | 846 | HOH | 0 | 0.005 | 48.493 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
638 | A | 847 | HOH | 0 | -0.009 | 29.271 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 | |
639 | A | 848 | HOH | 0 | 0.013 | 51.150 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
640 | A | 849 | HOH | 0 | -0.020 | 35.028 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
641 | A | 850 | HOH | 0 | -0.008 | 58.163 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
642 | A | 851 | HOH | 0 | -0.009 | 36.443 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 | |
643 | A | 852 | HOH | 0 | -0.024 | 31.898 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 | |
644 | A | 853 | HOH | 0 | -0.022 | 21.805 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 | |
645 | A | 854 | HOH | 0 | -0.037 | 27.788 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 | |
646 | A | 855 | HOH | 0 | -0.002 | 40.229 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 | |
647 | A | 856 | HOH | 0 | -0.029 | 7.581 | -0.641 | -0.641 | 0.000 | 0.000 | 0.000 | 0.000 | |
648 | A | 857 | HOH | 0 | -0.013 | 55.050 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 | |
649 | A | 858 | HOH | 0 | 0.011 | 11.410 | 0.614 | 0.614 | 0.000 | 0.000 | 0.000 | 0.000 | |
650 | A | 859 | HOH | 0 | -0.011 | 32.343 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 | |
651 | A | 860 | HOH | 0 | 0.015 | 22.612 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 | |
652 | A | 861 | HOH | 0 | -0.040 | 29.978 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 | |
653 | A | 862 | HOH | 0 | -0.042 | 34.017 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 | |
654 | A | 863 | HOH | 0 | -0.010 | 47.425 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 | |
655 | A | 864 | HOH | 0 | -0.044 | 44.764 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
656 | A | 865 | HOH | 0 | -0.022 | 42.077 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 | |
657 | A | 866 | HOH | 0 | 0.026 | 53.121 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 | |
658 | A | 867 | HOH | 0 | -0.005 | 39.934 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
659 | A | 868 | HOH | 0 | 0.015 | 52.114 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 | |
660 | A | 869 | HOH | 0 | -0.020 | 22.177 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 | |
661 | A | 870 | HOH | 0 | 0.002 | 29.247 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
662 | A | 871 | HOH | 0 | 0.005 | 13.568 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 | |
663 | A | 872 | HOH | 0 | 0.000 | 39.584 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
664 | A | 873 | HOH | 0 | 0.054 | 26.971 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 | |
665 | A | 874 | HOH | 0 | -0.030 | 25.753 | -0.204 | -0.204 | 0.000 | 0.000 | 0.000 | 0.000 | |
666 | A | 875 | HOH | 0 | -0.017 | 23.491 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 | |
667 | A | 876 | HOH | 0 | 0.002 | 45.859 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 | |
668 | A | 877 | HOH | 0 | 0.009 | 52.977 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 | |
669 | A | 878 | HOH | 0 | -0.057 | 45.304 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 | |
670 | A | 879 | HOH | 0 | -0.011 | 13.572 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 | |
671 | A | 880 | HOH | 0 | 0.009 | 54.204 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 | |
672 | A | 881 | HOH | 0 | -0.011 | 23.908 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
673 | A | 882 | HOH | 0 | 0.003 | 20.185 | 0.302 | 0.302 | 0.000 | 0.000 | 0.000 | 0.000 | |
674 | A | 883 | HOH | 0 | -0.055 | 20.883 | 0.182 | 0.182 | 0.000 | 0.000 | 0.000 | 0.000 | |
675 | A | 884 | HOH | 0 | -0.033 | 25.667 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 | |
676 | A | 885 | HOH | 0 | -0.045 | 18.199 | -0.361 | -0.361 | 0.000 | 0.000 | 0.000 | 0.000 | |
677 | A | 886 | HOH | 0 | -0.010 | 55.277 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 | |
678 | A | 888 | HOH | 0 | 0.001 | 47.524 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 | |
679 | A | 889 | HOH | 0 | 0.056 | 29.555 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 | |
680 | A | 891 | HOH | 0 | -0.012 | 25.103 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
681 | A | 892 | HOH | 0 | -0.039 | 20.860 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 | |
682 | A | 893 | HOH | 0 | 0.005 | 26.241 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 | |
683 | A | 894 | HOH | 0 | -0.039 | 9.171 | -0.254 | -0.254 | 0.000 | 0.000 | 0.000 | 0.000 | |
684 | A | 895 | HOH | 0 | -0.010 | 38.513 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 | |
685 | A | 896 | HOH | 0 | -0.021 | 53.553 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
686 | A | 897 | HOH | 0 | 0.036 | 21.910 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 | |
687 | A | 898 | HOH | 0 | -0.011 | 55.994 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 | |
688 | A | 899 | HOH | 0 | -0.043 | 55.256 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 | |
689 | A | 901 | HOH | 0 | -0.033 | 45.383 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
690 | A | 902 | HOH | 0 | 0.008 | 48.016 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 | |
691 | A | 903 | HOH | 0 | 0.011 | 21.283 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
692 | A | 904 | HOH | 0 | 0.009 | 56.271 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 | |
693 | A | 905 | HOH | 0 | 0.005 | 42.070 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
694 | A | 906 | HOH | 0 | -0.023 | 53.118 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 | |
695 | A | 907 | HOH | 0 | -0.007 | 42.943 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | |
696 | A | 908 | HOH | 0 | -0.010 | 46.097 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 | |
697 | A | 909 | HOH | 0 | 0.013 | 37.099 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 | |
698 | A | 910 | HOH | 0 | -0.002 | 11.147 | -0.575 | -0.575 | 0.000 | 0.000 | 0.000 | 0.000 | |
699 | A | 911 | HOH | 0 | 0.003 | 39.181 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 | |
700 | A | 912 | HOH | 0 | 0.020 | 36.030 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 | |
701 | A | 913 | HOH | 0 | -0.009 | 38.027 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
702 | A | 914 | HOH | 0 | -0.001 | 36.299 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 | |
703 | A | 915 | HOH | 0 | -0.022 | 41.443 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 | |
704 | A | 916 | HOH | 0 | -0.022 | 55.397 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 | |
705 | A | 917 | HOH | 0 | -0.016 | 33.550 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 | |
706 | A | 918 | HOH | 0 | -0.004 | 30.374 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 | |
707 | A | 919 | HOH | 0 | -0.013 | 54.201 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 | |
708 | A | 920 | HOH | 0 | -0.029 | 44.526 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 | |
709 | A | 921 | HOH | 0 | -0.021 | 28.326 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 | |
710 | A | 922 | HOH | 0 | -0.014 | 56.060 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 | |
711 | A | 923 | HOH | 0 | 0.016 | 43.791 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 | |
712 | A | 924 | HOH | 0 | -0.044 | 19.301 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 | |
713 | A | 925 | HOH | 0 | -0.033 | 31.681 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 | |
714 | A | 926 | HOH | 0 | 0.017 | 46.634 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 | |
715 | A | 927 | HOH | 0 | -0.025 | 24.940 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 | |
716 | A | 928 | HOH | 0 | -0.014 | 42.997 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
717 | A | 929 | HOH | 0 | -0.022 | 15.645 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 | |
718 | A | 930 | HOH | 0 | -0.014 | 23.408 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 | |
719 | A | 931 | HOH | 0 | -0.010 | 47.008 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
720 | A | 932 | HOH | 0 | -0.025 | 50.311 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 | |
721 | A | 933 | HOH | 0 | 0.002 | 40.478 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 | |
722 | A | 935 | HOH | 0 | 0.016 | 41.840 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 | |
723 | A | 936 | HOH | 0 | -0.001 | 55.620 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 | |
724 | A | 937 | HOH | 0 | 0.007 | 14.070 | -0.273 | -0.273 | 0.000 | 0.000 | 0.000 | 0.000 | |
725 | A | 938 | HOH | 0 | 0.019 | 26.070 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 | |
726 | A | 939 | HOH | 0 | -0.002 | 53.370 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 | |
727 | A | 940 | HOH | 0 | 0.007 | 33.288 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 | |
728 | A | 941 | HOH | 0 | 0.000 | 34.679 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 | |
729 | A | 942 | HOH | 0 | 0.000 | 51.014 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 | |
730 | A | 943 | HOH | 0 | 0.027 | 28.518 | -0.150 | -0.150 | 0.000 | 0.000 | 0.000 | 0.000 |