![FMODB](./images/FMODB-Logo_20190201-0_300ppi.png)
FMODB ID: VRM91
Calculation Name: 1Y7E-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 1Y7E
Chain ID: A
UniProt ID: P0C925
Base Structure: X-ray
Registration Date: 2023-06-20
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptHSide |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Auto-FMO protocol ver. 2.20220422 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 409 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -7302100.438358 |
---|---|
FMO2-HF: Nuclear repulsion | 7140503.308406 |
FMO2-HF: Total energy | -161597.129952 |
FMO2-MP2: Total energy | -162072.579954 |
3D Structure
Ligand structure
![ligand structure](./Kdata/F022649/ligand_interaction/ligand_F022649.png)
Ligand Interaction
![ligand interaction](./Kdata/F022649/ligand_interaction/ligand_interaction_F022649.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:4:GLN)
Summations of interaction energy for
fragment #1(A:4:GLN)
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. |
-15.803 | -6.316 | 5.443 | -4.743 | -10.182 | 0.025 |
Interaction energy analysis for fragmet #1(A:4:GLN)
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 | 6 | PRO | 0 | 0.070 | 0.022 | 2.398 | -3.801 | -0.241 | 1.650 | -1.536 | -3.674 | 0.014 |
4 | A | 7 | TRP | 0 | 0.017 | 0.019 | 3.679 | -2.361 | -2.245 | 0.039 | 0.070 | -0.225 | 0.001 |
5 | A | 8 | ILE | 0 | -0.018 | -0.017 | 4.600 | -0.920 | -0.741 | -0.001 | -0.012 | -0.166 | 0.000 |
6 | A | 9 | TYR | 0 | -0.055 | -0.024 | 2.597 | -5.339 | -2.720 | 2.039 | -1.428 | -3.229 | 0.000 |
7 | A | 10 | LEU | 0 | -0.009 | 0.031 | 7.365 | -0.408 | -0.408 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 11 | ASN | 0 | -0.024 | -0.044 | 10.020 | -0.313 | -0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 12 | GLU | -1 | -0.821 | -0.920 | 13.751 | 0.649 | 0.649 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 13 | GLU | -1 | -0.895 | -0.917 | 16.689 | 0.410 | 0.410 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 14 | GLU | -1 | -0.817 | -0.904 | 12.141 | 1.158 | 1.158 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 15 | LYS | 1 | 0.825 | 0.900 | 11.390 | -0.901 | -0.901 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 16 | ASN | 0 | -0.030 | -0.032 | 14.566 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 17 | GLN | 0 | -0.005 | 0.017 | 16.566 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 18 | ILE | 0 | -0.009 | 0.001 | 11.779 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 19 | LEU | 0 | -0.005 | -0.004 | 16.152 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 20 | ASN | 0 | -0.047 | -0.029 | 18.540 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 21 | PHE | 0 | 0.020 | 0.011 | 17.636 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 22 | SER | 0 | 0.055 | 0.012 | 18.131 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 23 | GLU | -1 | -0.850 | -0.909 | 20.133 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 24 | SER | 0 | -0.096 | -0.043 | 23.476 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 25 | TYR | 0 | 0.009 | -0.016 | 20.184 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 26 | LYS | 1 | 0.816 | 0.890 | 22.716 | -0.330 | -0.330 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 27 | LYS | 1 | 0.933 | 0.970 | 24.876 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 28 | PHE | 0 | -0.015 | 0.001 | 24.931 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 29 | ILE | 0 | 0.038 | 0.022 | 23.839 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 30 | SER | 0 | -0.084 | -0.052 | 27.047 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 31 | LYS | 1 | 0.894 | 0.961 | 29.324 | -0.150 | -0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 32 | PHE | 0 | -0.046 | -0.020 | 30.289 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 33 | LYS | 1 | 0.802 | 0.889 | 29.936 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 34 | THR | 0 | 0.035 | 0.013 | 31.426 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 35 | GLU | -1 | -0.754 | -0.858 | 32.543 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 36 | ARG | 1 | 0.760 | 0.837 | 33.581 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 37 | GLU | -1 | -0.802 | -0.864 | 34.138 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 38 | VAL | 0 | 0.005 | -0.013 | 28.872 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 39 | THR | 0 | -0.014 | 0.006 | 31.853 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 40 | ALA | 0 | -0.009 | -0.002 | 33.863 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 41 | TYR | 0 | -0.026 | -0.007 | 27.145 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 42 | ALA | 0 | 0.008 | 0.003 | 30.500 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 43 | LEU | 0 | 0.033 | -0.001 | 31.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 44 | ASP | -1 | -0.856 | -0.927 | 35.201 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 45 | LYS | 1 | 0.761 | 0.867 | 27.138 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 46 | ALA | 0 | 0.035 | 0.019 | 32.922 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 47 | LYS | 1 | 0.883 | 0.971 | 33.939 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 48 | LYS | 1 | 0.852 | 0.940 | 35.315 | -0.123 | -0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 49 | LEU | 0 | -0.006 | -0.007 | 30.465 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 50 | GLY | 0 | -0.034 | -0.041 | 34.602 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 51 | PHE | 0 | -0.039 | -0.011 | 30.592 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 52 | ILE | 0 | -0.039 | -0.026 | 36.756 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 53 | ASN | 0 | -0.004 | -0.013 | 39.370 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 54 | ALA | 0 | 0.023 | 0.017 | 40.572 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 55 | GLU | -1 | -0.924 | -0.962 | 41.905 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 56 | GLU | -1 | -0.943 | -0.963 | 44.959 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 57 | LYS | 1 | 0.837 | 0.926 | 41.434 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 58 | LYS | 1 | 0.944 | 0.970 | 45.292 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 59 | ASN | 0 | -0.034 | -0.038 | 45.045 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 60 | LEU | 0 | 0.033 | 0.006 | 39.397 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 61 | MET | 0 | -0.034 | 0.000 | 40.744 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 62 | PRO | 0 | 0.018 | -0.006 | 36.307 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 63 | GLY | 0 | -0.017 | -0.014 | 34.574 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 64 | ASP | -1 | -0.826 | -0.889 | 35.644 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 65 | LYS | 1 | 0.791 | 0.906 | 32.711 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 66 | ILE | 0 | -0.006 | -0.009 | 35.511 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 67 | PHE | 0 | 0.018 | -0.008 | 35.139 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 68 | TYR | 0 | -0.016 | -0.045 | 36.171 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 69 | THR | 0 | 0.054 | 0.029 | 36.810 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 70 | CYS | 0 | -0.028 | 0.020 | 37.601 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 71 | ARG | 1 | 0.978 | 0.962 | 39.104 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 72 | GLU | -1 | -0.849 | -0.908 | 39.001 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 73 | LYS | 1 | 0.866 | 0.930 | 36.128 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 74 | SER | 0 | -0.017 | -0.041 | 33.769 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 75 | VAL | 0 | -0.026 | -0.025 | 32.458 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 76 | ALA | 0 | -0.038 | 0.006 | 32.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 77 | PHE | 0 | -0.002 | 0.004 | 30.421 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 78 | ALA | 0 | 0.011 | -0.011 | 31.158 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 79 | ILE | 0 | 0.027 | 0.027 | 29.392 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 80 | ILE | 0 | -0.030 | -0.021 | 32.181 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 81 | GLY | 0 | 0.059 | 0.029 | 32.475 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 82 | LYS | 1 | 0.772 | 0.874 | 31.189 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 83 | ASN | 0 | -0.004 | -0.001 | 31.674 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 84 | PRO | 0 | 0.054 | 0.028 | 35.119 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 85 | ILE | 0 | 0.050 | 0.031 | 34.921 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 86 | GLU | -1 | -0.800 | -0.912 | 36.085 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 87 | ASP | -1 | -0.934 | -0.976 | 34.231 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 88 | GLY | 0 | -0.010 | 0.007 | 31.750 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 89 | MET | 0 | -0.070 | -0.037 | 30.599 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 90 | ASN | 0 | 0.031 | 0.007 | 24.808 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 91 | PHE | 0 | 0.016 | 0.001 | 26.666 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 92 | ILE | 0 | -0.039 | -0.017 | 20.785 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 93 | VAL | 0 | -0.028 | -0.014 | 23.930 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 94 | SER | 0 | 0.083 | 0.049 | 23.611 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 95 | HIS | 1 | 0.744 | 0.873 | 24.762 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 96 | THR | 0 | 0.018 | 0.005 | 27.116 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 97 | ASP | -1 | -0.776 | -0.874 | 29.596 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 98 | SER | 0 | 0.001 | 0.005 | 27.090 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 99 | PRO | 0 | 0.006 | 0.008 | 28.317 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 100 | ARG | 1 | 0.776 | 0.885 | 31.232 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 101 | LEU | 0 | -0.054 | -0.040 | 34.420 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 102 | ASP | -1 | -0.712 | -0.836 | 38.053 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 103 | ALA | 0 | 0.021 | 0.006 | 40.595 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 104 | LYS | 1 | 0.853 | 0.919 | 44.138 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 105 | PRO | 0 | 0.075 | 0.022 | 46.815 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 106 | SER | 0 | 0.018 | 0.024 | 49.448 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 107 | PRO | 0 | -0.077 | -0.037 | 47.784 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 108 | ILE | 0 | 0.047 | 0.032 | 49.738 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 109 | SER | 0 | -0.013 | -0.003 | 51.792 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 110 | GLU | -1 | -0.769 | -0.885 | 52.781 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 111 | GLU | -1 | -0.828 | -0.904 | 51.818 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 112 | ASN | 0 | -0.032 | -0.025 | 54.246 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 113 | GLU | -1 | -0.900 | -0.946 | 55.846 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 114 | LEU | 0 | 0.001 | 0.008 | 50.853 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 115 | THR | 0 | 0.024 | 0.025 | 51.649 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 116 | PHE | 0 | -0.012 | -0.019 | 47.081 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 117 | ILE | 0 | 0.025 | 0.027 | 44.317 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 118 | LYS | 1 | 0.793 | 0.872 | 45.989 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 119 | THR | 0 | 0.034 | 0.014 | 40.736 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 120 | ASN | 0 | -0.111 | -0.053 | 41.516 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 121 | TYR | 0 | -0.007 | 0.012 | 37.030 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 122 | TYR | 0 | 0.005 | 0.009 | 32.763 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 123 | GLY | 0 | 0.079 | 0.030 | 31.877 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 124 | GLY | 0 | -0.037 | -0.016 | 29.840 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 125 | ILE | 0 | -0.003 | 0.006 | 29.776 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 126 | LYS | 1 | 0.873 | 0.915 | 26.385 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 127 | LYS | 1 | 0.950 | 0.955 | 31.790 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 128 | TYR | 0 | 0.074 | 0.043 | 29.109 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 129 | GLN | 0 | -0.026 | -0.030 | 27.208 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 130 | TRP | 0 | 0.002 | -0.014 | 31.483 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 131 | LEU | 0 | -0.031 | 0.005 | 35.338 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 132 | SER | 0 | -0.054 | -0.029 | 36.704 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 133 | THR | 0 | -0.003 | 0.004 | 33.498 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 134 | PRO | 0 | -0.021 | -0.013 | 35.286 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 135 | LEU | 0 | 0.004 | 0.012 | 35.641 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 136 | SER | 0 | -0.016 | -0.026 | 36.560 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 137 | ILE | 0 | -0.046 | -0.010 | 38.334 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 138 | ARG | 1 | 0.807 | 0.863 | 34.419 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 139 | GLY | 0 | 0.039 | 0.009 | 40.316 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 140 | VAL | 0 | -0.005 | 0.021 | 42.236 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 141 | VAL | 0 | -0.006 | -0.018 | 44.828 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 142 | PHE | 0 | 0.001 | -0.001 | 46.929 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 143 | LEU | 0 | -0.015 | 0.014 | 51.402 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 144 | LYS | 1 | 0.945 | 0.958 | 54.860 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 145 | ASN | 0 | -0.114 | -0.071 | 57.828 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 146 | GLY | 0 | 0.003 | 0.002 | 54.307 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 147 | GLU | -1 | -0.917 | -0.946 | 53.612 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 148 | LYS | 1 | 0.823 | 0.913 | 43.726 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 149 | VAL | 0 | -0.006 | 0.005 | 48.947 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 150 | GLU | -1 | -0.894 | -0.950 | 42.854 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 151 | ILE | 0 | -0.042 | -0.018 | 43.797 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 152 | ASN | 0 | -0.021 | -0.036 | 37.913 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 153 | ILE | 0 | -0.017 | 0.010 | 41.573 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 154 | GLY | 0 | 0.007 | 0.011 | 39.272 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 155 | ASP | -1 | -0.794 | -0.854 | 34.992 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 156 | ASN | 0 | -0.028 | -0.040 | 37.775 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 157 | GLU | -1 | -0.917 | -0.961 | 39.871 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 158 | ASN | 0 | -0.104 | -0.060 | 41.794 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 159 | ASP | -1 | -0.781 | -0.882 | 41.877 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 160 | PRO | 0 | -0.077 | -0.007 | 42.851 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 161 | VAL | 0 | 0.008 | -0.007 | 39.150 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 162 | PHE | 0 | -0.016 | -0.008 | 41.110 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 163 | VAL | 0 | 0.031 | 0.009 | 40.198 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 164 | ILE | 0 | 0.004 | 0.011 | 39.180 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 165 | PRO | 0 | -0.019 | -0.015 | 41.263 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 166 | ASP | -1 | -0.834 | -0.908 | 39.390 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 167 | ILE | 0 | -0.062 | -0.036 | 42.596 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 168 | LEU | 0 | -0.023 | -0.004 | 41.224 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 189 | ASN | 0 | -0.039 | -0.032 | 43.572 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 190 | LEU | 0 | 0.008 | -0.004 | 38.687 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 191 | LYS | 1 | 0.845 | 0.920 | 42.913 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 192 | ILE | 0 | 0.022 | 0.014 | 41.179 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 193 | LEU | 0 | -0.015 | -0.005 | 44.295 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 194 | ILE | 0 | -0.019 | -0.032 | 46.069 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 195 | GLY | 0 | 0.007 | 0.007 | 48.466 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 196 | SER | 0 | -0.006 | -0.015 | 51.457 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 197 | LEU | 0 | 0.000 | -0.007 | 54.323 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 198 | PRO | 0 | 0.017 | 0.014 | 57.756 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 199 | ILE | 0 | 0.030 | 0.032 | 60.414 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 200 | GLU | -1 | -0.940 | -0.973 | 62.898 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 201 | THR | 0 | 0.043 | 0.025 | 64.873 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 202 | LYS | 1 | 0.896 | 0.946 | 67.677 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 203 | GLU | -1 | -0.846 | -0.910 | 64.552 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 204 | LYS | 1 | 0.907 | 0.928 | 63.858 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 205 | ASN | 0 | -0.062 | -0.028 | 59.273 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 206 | LYS | 1 | 0.898 | 0.936 | 60.821 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 207 | VAL | 0 | 0.017 | 0.025 | 55.289 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 208 | LYS | 1 | 0.818 | 0.906 | 55.422 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 209 | LEU | 0 | 0.012 | 0.004 | 56.873 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 210 | ALA | 0 | -0.001 | 0.009 | 58.040 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 211 | THR | 0 | -0.001 | -0.021 | 52.171 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 212 | LEU | 0 | -0.015 | -0.017 | 54.389 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 213 | GLN | 0 | -0.049 | -0.026 | 56.140 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 214 | LEU | 0 | 0.022 | 0.030 | 52.809 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 215 | ILE | 0 | 0.014 | 0.001 | 50.822 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 216 | LYS | 1 | 0.912 | 0.969 | 53.270 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 217 | GLU | -1 | -0.917 | -0.966 | 56.265 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 218 | LYS | 1 | 0.899 | 0.966 | 48.964 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 219 | TYR | 0 | -0.015 | -0.031 | 46.932 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 220 | LYS | 1 | 0.811 | 0.899 | 52.522 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 221 | ILE | 0 | 0.000 | 0.013 | 50.060 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 222 | GLU | -1 | -0.834 | -0.899 | 54.374 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 223 | GLU | -1 | -0.783 | -0.895 | 54.799 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 224 | GLU | -1 | -0.961 | -0.980 | 54.534 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 225 | ASP | -1 | -0.776 | -0.892 | 52.985 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 226 | PHE | 0 | -0.050 | -0.046 | 48.944 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 227 | VAL | 0 | -0.021 | 0.015 | 49.673 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 228 | SER | 0 | -0.049 | -0.030 | 49.593 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 229 | SER | 0 | -0.027 | -0.024 | 47.540 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 230 | GLU | -1 | -0.764 | -0.846 | 41.481 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 231 | ILE | 0 | -0.014 | 0.002 | 42.368 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 232 | GLU | -1 | -0.799 | -0.891 | 35.785 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 233 | ILE | 0 | -0.082 | -0.040 | 38.229 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 234 | VAL | 0 | 0.063 | 0.018 | 32.711 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 235 | PRO | 0 | -0.005 | 0.010 | 30.904 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 236 | ALA | 0 | 0.013 | 0.007 | 32.834 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 237 | GLY | 0 | -0.019 | -0.006 | 32.430 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 238 | THR | 0 | -0.008 | -0.012 | 29.395 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 239 | ALA | 0 | 0.006 | 0.017 | 24.643 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 240 | LYS | 1 | 0.925 | 0.946 | 24.907 | -0.170 | -0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 241 | ASP | -1 | -0.782 | -0.848 | 21.329 | 0.344 | 0.344 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 242 | VAL | 0 | -0.031 | -0.038 | 18.766 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 243 | GLY | 0 | 0.054 | 0.027 | 18.344 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 244 | PHE | 0 | -0.017 | -0.023 | 19.077 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 245 | ASP | -1 | -0.877 | -0.934 | 14.851 | 0.415 | 0.415 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 246 | LYS | 1 | 0.833 | 0.912 | 17.366 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 247 | ALA | 0 | 0.050 | 0.029 | 13.410 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 248 | LEU | 0 | -0.030 | -0.013 | 13.799 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 249 | ILE | 0 | 0.019 | 0.017 | 16.997 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 250 | GLY | 0 | 0.021 | 0.019 | 19.608 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 251 | ALA | 0 | -0.047 | -0.042 | 22.160 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 252 | TYR | 0 | 0.041 | -0.007 | 24.334 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 253 | GLY | 0 | 0.033 | 0.020 | 26.219 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 254 | GLN | 0 | -0.020 | -0.015 | 19.479 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 255 | ASP | -1 | -0.868 | -0.957 | 21.646 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 256 | ASP | -1 | -0.652 | -0.851 | 21.589 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 257 | LYS | 1 | 0.863 | 0.964 | 22.671 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 258 | ILE | 0 | -0.008 | -0.004 | 16.589 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 259 | CYS | 0 | -0.032 | 0.004 | 19.462 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 260 | VAL | 0 | -0.029 | 0.024 | 20.778 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 261 | PHE | 0 | -0.017 | -0.017 | 20.976 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 262 | THR | 0 | -0.002 | -0.034 | 17.351 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 263 | SER | 0 | -0.022 | -0.024 | 20.419 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 264 | LEU | 0 | 0.045 | 0.031 | 22.158 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 265 | GLU | -1 | -0.862 | -0.910 | 21.976 | 0.224 | 0.224 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 266 | SER | 0 | -0.081 | -0.055 | 20.313 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 267 | ILE | 0 | 0.001 | -0.008 | 22.259 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 268 | PHE | 0 | -0.021 | -0.020 | 25.715 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 269 | ASP | -1 | -0.792 | -0.904 | 26.646 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 270 | LEU | 0 | -0.055 | 0.004 | 23.364 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 271 | GLU | -1 | -0.961 | -1.019 | 24.700 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 272 | GLU | -1 | -0.903 | -0.941 | 27.051 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 273 | THR | 0 | 0.025 | 0.012 | 29.251 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 274 | PRO | 0 | 0.079 | 0.062 | 27.666 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 275 | ASN | 0 | -0.029 | -0.024 | 28.027 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 276 | LYS | 1 | 0.776 | 0.872 | 26.472 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 277 | THR | 0 | 0.020 | 0.009 | 29.460 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 278 | ALA | 0 | 0.019 | 0.036 | 27.407 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 279 | ILE | 0 | 0.010 | -0.014 | 28.213 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 280 | CYS | 0 | 0.003 | 0.010 | 26.555 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 281 | PHE | 0 | -0.042 | -0.029 | 27.795 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 282 | LEU | 0 | 0.027 | 0.030 | 26.843 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 283 | VAL | 0 | -0.002 | -0.009 | 29.056 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 284 | ASP | -1 | -0.762 | -0.890 | 30.541 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 285 | LYS | 1 | 0.815 | 0.914 | 26.606 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 286 | GLU | -1 | -0.943 | -0.941 | 32.601 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 287 | GLU | -1 | -0.926 | -0.956 | 35.822 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 288 | ILE | 0 | -0.153 | -0.095 | 33.377 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 297 | ASP | -1 | -0.706 | -0.850 | 34.381 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 298 | SER | 0 | -0.006 | -0.006 | 35.858 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 299 | ARG | 1 | 0.874 | 0.908 | 37.009 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 300 | TYR | 0 | -0.001 | -0.020 | 36.203 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 301 | LEU | 0 | 0.028 | 0.032 | 31.942 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 302 | GLU | -1 | -0.823 | -0.902 | 36.082 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 303 | TYR | 0 | -0.018 | 0.006 | 38.872 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 304 | PHE | 0 | 0.053 | 0.020 | 33.045 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 305 | VAL | 0 | 0.018 | 0.007 | 34.827 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 306 | SER | 0 | -0.072 | -0.054 | 37.890 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 307 | ASP | -1 | -0.775 | -0.841 | 41.244 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 308 | MET | 0 | 0.000 | 0.003 | 35.021 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 309 | ILE | 0 | 0.006 | 0.002 | 38.054 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 310 | PHE | 0 | -0.013 | -0.003 | 41.743 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 311 | LYS | 1 | 0.790 | 0.881 | 42.520 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 312 | ILE | 0 | -0.003 | 0.014 | 39.433 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 313 | LYS | 1 | 0.756 | 0.894 | 43.922 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 314 | LYS | 1 | 0.918 | 0.931 | 46.818 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 315 | SER | 0 | -0.016 | 0.001 | 49.880 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 316 | GLU | -1 | -0.883 | -0.943 | 48.355 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 317 | TYR | 0 | -0.005 | 0.018 | 44.211 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 318 | ASN | 0 | 0.019 | -0.023 | 46.689 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 319 | ASN | 0 | 0.006 | 0.017 | 45.459 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 320 | LEU | 0 | 0.013 | 0.008 | 43.847 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 321 | HIS | 0 | -0.040 | -0.007 | 42.085 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 322 | VAL | 0 | 0.057 | 0.011 | 39.116 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 323 | GLN | 0 | 0.002 | 0.004 | 38.044 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 324 | LYS | 1 | 0.860 | 0.941 | 37.488 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 325 | ALA | 0 | 0.014 | 0.006 | 36.277 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 326 | LEU | 0 | -0.038 | -0.038 | 33.970 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 327 | TRP | 0 | -0.017 | -0.005 | 32.794 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 328 | ASN | 0 | -0.103 | -0.021 | 32.278 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 329 | SER | 0 | -0.018 | -0.025 | 29.746 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 330 | LYS | 1 | 0.909 | 0.991 | 23.926 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 331 | SER | 0 | 0.000 | -0.026 | 24.906 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 332 | ILE | 0 | -0.049 | -0.018 | 18.517 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 333 | SER | 0 | -0.023 | 0.002 | 21.234 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 334 | ALA | 0 | -0.010 | -0.020 | 19.908 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 335 | ASP | -1 | -0.737 | -0.871 | 19.401 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 336 | VAL | 0 | -0.001 | 0.013 | 16.757 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 337 | CYS | 0 | -0.033 | 0.007 | 15.448 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 338 | ALA | 0 | 0.077 | 0.044 | 16.919 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 339 | ALA | 0 | -0.008 | -0.006 | 13.696 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 340 | ILE | 0 | 0.000 | 0.003 | 11.354 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 341 | ASN | 0 | -0.061 | -0.051 | 14.825 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 342 | PRO | 0 | 0.025 | 0.036 | 15.165 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 350 | GLU | -1 | -0.870 | -0.947 | 13.518 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 351 | GLN | 0 | -0.040 | -0.013 | 11.013 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 352 | ASN | 0 | -0.067 | -0.049 | 11.360 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 353 | ALA | 0 | 0.005 | 0.020 | 12.537 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 354 | PRO | 0 | 0.032 | 0.024 | 10.076 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 355 | GLN | 0 | -0.036 | -0.035 | 6.769 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 356 | LEU | 0 | 0.005 | 0.002 | 8.740 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 357 | GLY | 0 | -0.059 | -0.044 | 8.452 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 358 | TYR | 0 | -0.025 | -0.019 | 2.165 | -3.005 | -0.169 | 1.718 | -1.825 | -2.728 | 0.010 |
321 | A | 359 | GLY | 0 | -0.004 | 0.003 | 4.529 | -1.101 | -1.011 | -0.001 | -0.009 | -0.079 | 0.000 |
322 | A | 360 | ILE | 0 | -0.002 | 0.021 | 6.920 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 361 | PRO | 0 | -0.027 | -0.011 | 10.030 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 362 | ILE | 0 | -0.039 | -0.033 | 11.348 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 363 | MET | 0 | -0.018 | -0.005 | 13.985 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 364 | LYS | 1 | 0.937 | 0.974 | 16.586 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 365 | TYR | 0 | -0.029 | -0.021 | 19.438 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 366 | THR | 0 | -0.066 | -0.028 | 22.231 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 378 | ASP | -1 | -0.767 | -0.886 | 23.399 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 379 | ALA | 0 | 0.032 | 0.001 | 20.904 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 380 | GLU | -1 | -0.879 | -0.919 | 20.805 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 381 | LEU | 0 | 0.014 | 0.018 | 20.613 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 382 | VAL | 0 | 0.035 | 0.010 | 16.376 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 383 | SER | 0 | -0.055 | -0.027 | 17.008 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 384 | TYR | 0 | -0.051 | -0.060 | 17.958 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 385 | ILE | 0 | 0.083 | 0.035 | 14.524 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 386 | ARG | 1 | 0.956 | 0.991 | 12.368 | 0.367 | 0.367 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 387 | GLN | 0 | -0.068 | -0.026 | 13.512 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 388 | LEU | 0 | -0.016 | 0.018 | 15.515 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 389 | LEU | 0 | 0.057 | 0.019 | 11.093 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 390 | ASN | 0 | -0.018 | -0.023 | 9.891 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 391 | LYS | 1 | 0.912 | 0.972 | 11.909 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 392 | ASN | 0 | -0.065 | -0.048 | 14.187 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 393 | ASN | 0 | -0.071 | -0.019 | 10.117 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 394 | ILE | 0 | 0.017 | 0.020 | 9.542 | 0.274 | 0.274 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 395 | ALA | 0 | -0.012 | -0.009 | 4.482 | -0.228 | -0.141 | -0.001 | -0.003 | -0.081 | 0.000 |
347 | A | 396 | TRP | 0 | -0.023 | -0.011 | 6.372 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 397 | GLN | 0 | -0.025 | -0.030 | 6.163 | -0.464 | -0.464 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 398 | VAL | 0 | 0.016 | 0.022 | 8.439 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 399 | ALA | 0 | 0.030 | 0.007 | 11.621 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 400 | THR | 0 | -0.022 | -0.008 | 14.371 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 401 | LEU | 0 | -0.017 | 0.001 | 17.773 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 402 | GLY | 0 | -0.031 | -0.015 | 20.614 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 403 | LYS | 1 | 0.914 | 0.911 | 23.953 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 404 | VAL | 0 | -0.025 | 0.009 | 24.707 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 405 | GLU | -1 | -0.845 | -0.902 | 22.930 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 406 | GLU | -1 | -0.825 | -0.927 | 20.123 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 407 | GLY | 0 | 0.090 | 0.061 | 22.048 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 408 | GLY | 0 | -0.120 | -0.072 | 23.163 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 409 | GLY | 0 | 0.073 | 0.032 | 24.105 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 410 | GLY | 0 | 0.028 | 0.010 | 24.711 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 411 | THR | 0 | -0.059 | -0.042 | 26.256 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 412 | VAL | 0 | 0.027 | 0.010 | 26.147 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 413 | ALA | 0 | 0.064 | 0.050 | 24.308 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 414 | LYS | 1 | 0.891 | 0.932 | 26.096 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 415 | PHE | 0 | 0.055 | 0.036 | 29.586 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 416 | LEU | 0 | 0.002 | 0.000 | 26.600 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 417 | ALA | 0 | -0.006 | -0.006 | 28.182 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 418 | GLY | 0 | -0.079 | -0.036 | 30.049 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 419 | TYR | 0 | -0.033 | -0.022 | 33.096 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 420 | GLY | 0 | -0.010 | 0.000 | 32.889 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 421 | ILE | 0 | -0.049 | -0.007 | 27.912 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 422 | ARG | 1 | 0.804 | 0.878 | 25.944 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 423 | THR | 0 | 0.007 | 0.010 | 24.424 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 424 | ILE | 0 | -0.038 | -0.022 | 18.064 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 425 | ASP | -1 | -0.791 | -0.895 | 19.400 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 426 | MET | 0 | -0.033 | -0.007 | 14.955 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 427 | GLY | 0 | 0.142 | 0.091 | 15.495 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 428 | PRO | 0 | -0.052 | -0.036 | 13.102 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 429 | ALA | 0 | 0.051 | 0.017 | 12.359 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 430 | VAL | 0 | -0.022 | -0.023 | 14.218 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 431 | ILE | 0 | -0.021 | -0.009 | 14.745 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 432 | SER | 0 | -0.017 | -0.005 | 18.686 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 433 | MET | 0 | 0.011 | 0.038 | 20.737 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 434 | HIS | 0 | -0.035 | -0.018 | 22.729 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 435 | SER | 0 | -0.054 | -0.032 | 24.803 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 436 | PRO | 0 | 0.004 | -0.017 | 26.608 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 437 | MET | 0 | -0.078 | -0.043 | 24.808 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 438 | GLU | -1 | -0.755 | -0.861 | 21.463 | 0.163 | 0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 439 | ILE | 0 | -0.027 | -0.020 | 17.402 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 440 | THR | 0 | 0.026 | 0.016 | 15.614 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 441 | SER | 0 | 0.055 | 0.019 | 10.949 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 442 | LYS | 1 | 0.840 | 0.911 | 13.541 | -0.482 | -0.482 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 443 | PHE | 0 | 0.021 | 0.011 | 6.648 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 444 | ASP | -1 | -0.741 | -0.889 | 9.195 | 0.911 | 0.911 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 445 | LEU | 0 | -0.033 | 0.003 | 11.287 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 446 | TYR | 0 | 0.018 | -0.020 | 13.351 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 447 | ASN | 0 | -0.031 | -0.015 | 8.206 | -0.214 | -0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 448 | ALA | 0 | 0.054 | 0.018 | 11.710 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 449 | TYR | 0 | -0.023 | 0.007 | 14.233 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 450 | LEU | 0 | -0.030 | -0.011 | 12.556 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 451 | ALA | 0 | -0.003 | 0.004 | 12.826 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 452 | TYR | 0 | -0.013 | -0.042 | 14.627 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 453 | LYS | 1 | 0.900 | 0.972 | 17.829 | -0.271 | -0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 454 | ALA | 0 | -0.037 | -0.016 | 16.419 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 455 | PHE | 0 | -0.066 | -0.035 | 18.449 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 456 | TYR | 0 | -0.006 | -0.041 | 19.957 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 457 | ARG | 1 | 0.856 | 0.949 | 22.016 | -0.212 | -0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 458 | GLU | -1 | -0.794 | -0.834 | 22.209 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |