FMODB ID: QY69Y
Calculation Name: 1TR2-A-Xray372
Preferred Name: Vinculin
Target Type: SINGLE PROTEIN
Ligand Name:
ligand 3-letter code:
PDB ID: 1TR2
Chain ID: A
ChEMBL ID: CHEMBL4295723
UniProt ID: P18206
Base Structure: X-ray
Registration Date: 2023-09-20
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 | 1028 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -29497959.176339 |
---|---|
FMO2-HF: Nuclear repulsion | 29098103.085817 |
FMO2-HF: Total energy | -399856.090522 |
FMO2-MP2: Total energy | -401007.346808 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(A:1:MET)
Summations of interaction energy for
fragment #1(A:1:MET)
IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
-12.083 | -5.299 | 16.467 | -8.596 | -14.655 | -0.051 |
Interaction energy analysis for fragmet #1(A:1:MET)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | 3 | VAL | 0 | 0.022 | 0.003 | 2.429 | -1.445 | 1.158 | 4.899 | -2.511 | -4.991 | -0.007 |
4 | A | 4 | PHE | 0 | 0.019 | -0.027 | 3.693 | -0.676 | -0.439 | 0.013 | -0.035 | -0.216 | 0.000 |
5 | A | 5 | HIS | 0 | 0.012 | 0.024 | 6.925 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 6 | THR | 0 | -0.016 | -0.002 | 8.831 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 7 | ARG | 1 | 0.942 | 0.986 | 11.557 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 8 | THR | 0 | 0.032 | 0.009 | 13.528 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 9 | ILE | 0 | 0.004 | 0.005 | 7.572 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 10 | GLU | -1 | -0.807 | -0.919 | 11.223 | -0.273 | -0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 11 | SER | 0 | -0.041 | -0.022 | 11.924 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 12 | ILE | 0 | -0.052 | -0.027 | 13.570 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 13 | LEU | 0 | -0.022 | -0.019 | 8.877 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 14 | GLU | -1 | -0.782 | -0.869 | 12.278 | -0.510 | -0.510 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 15 | PRO | 0 | -0.002 | -0.001 | 14.478 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 16 | VAL | 0 | 0.009 | 0.008 | 13.673 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 17 | ALA | 0 | 0.004 | -0.009 | 12.201 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 18 | GLN | 0 | 0.006 | 0.009 | 14.103 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 19 | GLN | 0 | 0.017 | 0.028 | 17.587 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 20 | ILE | 0 | 0.024 | 0.003 | 13.405 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 21 | SER | 0 | -0.042 | -0.035 | 16.584 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 22 | HIS | 0 | 0.043 | -0.003 | 17.361 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 23 | LEU | 0 | -0.062 | -0.035 | 18.339 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 24 | VAL | 0 | 0.002 | 0.002 | 15.347 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 25 | ILE | 0 | 0.015 | 0.007 | 18.784 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 26 | MET | 0 | 0.034 | 0.017 | 21.754 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 27 | HIS | 1 | 0.879 | 0.941 | 19.139 | 0.460 | 0.460 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 28 | GLU | -1 | -0.793 | -0.903 | 20.266 | -0.301 | -0.301 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 29 | GLU | -1 | -0.883 | -0.932 | 22.219 | -0.210 | -0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 30 | GLY | 0 | -0.040 | -0.018 | 24.960 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 31 | GLU | -1 | -0.940 | -0.953 | 20.546 | -0.331 | -0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 32 | VAL | 0 | -0.042 | -0.025 | 24.049 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 33 | ASP | -1 | -0.829 | -0.863 | 26.521 | -0.185 | -0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 34 | GLY | 0 | 0.022 | 0.014 | 29.012 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 35 | LYS | 1 | 0.799 | 0.887 | 29.556 | 0.198 | 0.198 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 36 | ALA | 0 | -0.009 | -0.002 | 28.744 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 37 | ILE | 0 | -0.025 | -0.001 | 24.477 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 38 | PRO | 0 | 0.013 | 0.020 | 27.322 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 39 | ASP | -1 | -0.841 | -0.927 | 29.092 | -0.229 | -0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 40 | LEU | 0 | -0.048 | -0.042 | 23.585 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 41 | THR | 0 | 0.018 | -0.003 | 26.443 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 42 | ALA | 0 | 0.034 | 0.013 | 27.862 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 43 | PRO | 0 | 0.042 | 0.026 | 24.305 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 44 | VAL | 0 | 0.011 | 0.002 | 21.323 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 45 | ALA | 0 | 0.030 | 0.024 | 22.815 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 46 | ALA | 0 | -0.064 | -0.028 | 23.069 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 47 | VAL | 0 | -0.005 | -0.008 | 17.875 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 48 | GLN | 0 | -0.001 | 0.007 | 19.268 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 49 | ALA | 0 | 0.038 | 0.008 | 21.366 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 50 | ALA | 0 | -0.010 | 0.000 | 18.564 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 51 | VAL | 0 | 0.043 | 0.008 | 15.302 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 52 | SER | 0 | -0.051 | 0.008 | 17.851 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 53 | ASN | 0 | 0.041 | 0.006 | 21.063 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 54 | LEU | 0 | 0.007 | 0.028 | 13.615 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 55 | VAL | 0 | 0.037 | 0.004 | 16.920 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 56 | ARG | 1 | 0.881 | 0.941 | 18.374 | 0.357 | 0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 57 | VAL | 0 | 0.039 | 0.015 | 18.196 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 58 | GLY | 0 | -0.004 | -0.006 | 17.397 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 59 | LYS | 1 | 0.833 | 0.893 | 18.062 | 0.495 | 0.495 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 60 | GLU | -1 | -0.880 | -0.949 | 21.137 | -0.263 | -0.263 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 61 | THR | 0 | -0.007 | 0.005 | 17.922 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 62 | VAL | 0 | -0.046 | -0.030 | 17.688 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 63 | GLN | 0 | -0.052 | -0.026 | 20.167 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 64 | THR | 0 | -0.054 | -0.025 | 23.953 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 65 | THR | 0 | -0.014 | -0.005 | 19.414 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 66 | GLU | -1 | -0.894 | -0.946 | 22.681 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 67 | ASP | -1 | -0.870 | -0.940 | 16.585 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 68 | GLN | 0 | 0.107 | 0.038 | 19.090 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 69 | ILE | 0 | 0.001 | 0.000 | 13.067 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 70 | LEU | 0 | 0.016 | 0.020 | 14.355 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 71 | LYS | 1 | 0.872 | 0.938 | 15.672 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 72 | ARG | 1 | 0.781 | 0.879 | 12.181 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 73 | ASP | -1 | -0.764 | -0.859 | 11.057 | -0.384 | -0.384 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 74 | MET | 0 | 0.007 | 0.030 | 12.333 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 75 | PRO | 0 | -0.026 | -0.015 | 13.986 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 76 | PRO | 0 | -0.074 | -0.041 | 12.779 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 77 | ALA | 0 | 0.044 | 0.029 | 11.391 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 78 | PHE | 0 | 0.025 | 0.020 | 12.821 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 79 | ILE | 0 | 0.001 | -0.006 | 15.146 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 80 | LYS | 1 | 0.827 | 0.921 | 6.672 | 2.595 | 2.595 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 81 | VAL | 0 | 0.030 | 0.013 | 12.316 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 82 | GLU | -1 | -0.813 | -0.884 | 14.288 | -0.453 | -0.453 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 83 | ASN | 0 | 0.018 | 0.015 | 15.590 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 84 | ALA | 0 | -0.017 | -0.001 | 13.364 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 85 | CYS | 0 | -0.043 | -0.015 | 15.430 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 86 | THR | 0 | -0.019 | -0.027 | 18.427 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 87 | LYS | 1 | 0.858 | 0.944 | 16.078 | 0.689 | 0.689 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 88 | LEU | 0 | -0.035 | -0.025 | 17.216 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 89 | VAL | 0 | -0.013 | -0.001 | 20.612 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 90 | GLN | 0 | -0.019 | -0.014 | 23.208 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 91 | ALA | 0 | 0.016 | 0.009 | 21.572 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 92 | ALA | 0 | 0.033 | 0.006 | 23.735 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 93 | GLN | 0 | 0.019 | 0.013 | 25.880 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 94 | MET | 0 | -0.020 | -0.009 | 26.817 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 95 | LEU | 0 | -0.015 | 0.003 | 25.146 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 96 | GLN | 0 | -0.017 | 0.000 | 28.461 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 97 | SER | 0 | -0.089 | -0.037 | 31.314 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 98 | ASP | -1 | -0.892 | -0.957 | 31.927 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 99 | PRO | 0 | 0.070 | 0.045 | 29.763 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 100 | TYR | 0 | -0.055 | -0.047 | 28.661 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 101 | SER | 0 | 0.038 | 0.024 | 28.203 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 102 | VAL | 0 | 0.009 | -0.014 | 25.046 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 103 | PRO | 0 | -0.007 | -0.003 | 24.294 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 104 | ALA | 0 | 0.047 | 0.037 | 23.649 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 105 | ARG | 1 | 0.847 | 0.917 | 22.504 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 106 | ASP | -1 | -0.823 | -0.925 | 19.290 | -0.409 | -0.409 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 107 | TYR | 0 | -0.089 | -0.045 | 18.538 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 108 | LEU | 0 | 0.067 | 0.036 | 18.327 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 109 | ILE | 0 | 0.070 | 0.072 | 14.450 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 110 | ASP | -1 | -0.853 | -0.945 | 13.271 | -0.838 | -0.838 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 111 | GLY | 0 | -0.093 | -0.059 | 13.447 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 112 | SER | 0 | -0.070 | -0.051 | 14.235 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 113 | ARG | 1 | 0.890 | 0.928 | 5.444 | 2.416 | 2.416 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 114 | GLY | 0 | -0.015 | -0.013 | 9.251 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 115 | ILE | 0 | 0.015 | 0.014 | 10.494 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 116 | LEU | 0 | 0.018 | 0.025 | 8.843 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 117 | SER | 0 | 0.070 | 0.015 | 4.780 | 0.344 | 0.388 | -0.001 | -0.008 | -0.035 | 0.000 |
118 | A | 118 | GLY | 0 | 0.006 | 0.008 | 6.617 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 119 | THR | 0 | -0.020 | -0.029 | 9.451 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 120 | SER | 0 | 0.007 | 0.010 | 4.991 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 121 | ASP | -1 | -0.796 | -0.895 | 5.230 | -4.205 | -4.205 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 122 | LEU | 0 | -0.029 | -0.005 | 7.058 | 0.462 | 0.462 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 123 | LEU | 0 | -0.007 | -0.006 | 9.204 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 124 | LEU | 0 | -0.001 | 0.007 | 3.052 | -0.124 | 0.267 | 0.062 | -0.070 | -0.383 | 0.000 |
125 | A | 125 | THR | 0 | -0.027 | -0.030 | 7.095 | 0.312 | 0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 126 | PHE | 0 | 0.012 | 0.000 | 9.947 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 127 | ASP | -1 | -0.765 | -0.848 | 9.051 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 128 | GLU | -1 | -0.867 | -0.932 | 6.831 | -0.378 | -0.378 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 129 | ALA | 0 | -0.040 | -0.020 | 10.474 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 130 | GLU | -1 | -0.938 | -0.967 | 13.967 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 131 | VAL | 0 | 0.044 | 0.008 | 11.080 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 132 | ARG | 1 | 0.865 | 0.942 | 11.537 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 133 | LYS | 1 | 0.872 | 0.934 | 15.538 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 134 | ILE | 0 | 0.016 | 0.019 | 16.160 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 135 | ILE | 0 | 0.082 | 0.033 | 13.581 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 136 | ARG | 1 | 0.865 | 0.939 | 17.920 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 137 | VAL | 0 | -0.004 | -0.010 | 20.807 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 138 | CYS | 0 | -0.042 | -0.014 | 20.109 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 139 | LYS | 1 | 0.911 | 0.938 | 17.671 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 140 | GLY | 0 | -0.006 | 0.021 | 23.074 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 141 | ILE | 0 | -0.009 | -0.005 | 25.834 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 142 | LEU | 0 | -0.025 | -0.011 | 22.614 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 143 | GLU | -1 | -0.844 | -0.906 | 26.634 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 144 | TYR | 0 | -0.035 | -0.027 | 28.731 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 145 | LEU | 0 | -0.002 | 0.001 | 28.512 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 146 | THR | 0 | -0.026 | -0.022 | 30.375 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 147 | VAL | 0 | -0.049 | -0.030 | 32.642 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 148 | ALA | 0 | 0.007 | 0.017 | 35.100 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 149 | GLU | -1 | -0.885 | -0.963 | 36.948 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 150 | VAL | 0 | -0.065 | -0.012 | 38.345 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 151 | VAL | 0 | -0.017 | -0.006 | 39.817 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 152 | GLU | -1 | -0.872 | -0.947 | 42.495 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 153 | THR | 0 | -0.016 | -0.040 | 45.976 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 154 | MET | 0 | 0.003 | -0.017 | 46.594 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 155 | GLU | -1 | -0.866 | -0.944 | 46.067 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 156 | ASP | -1 | -0.798 | -0.858 | 43.678 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 157 | LEU | 0 | -0.017 | -0.005 | 42.176 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 158 | VAL | 0 | -0.014 | -0.006 | 41.633 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 159 | THR | 0 | -0.005 | -0.015 | 40.341 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 160 | TYR | 0 | 0.018 | -0.005 | 33.986 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 161 | THR | 0 | -0.037 | -0.038 | 37.467 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 162 | LYS | 1 | 0.865 | 0.939 | 37.942 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 163 | ASN | 0 | -0.035 | -0.010 | 35.463 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 164 | LEU | 0 | -0.005 | -0.001 | 31.190 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 165 | GLY | 0 | 0.031 | 0.025 | 32.411 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 166 | PRO | 0 | 0.022 | 0.021 | 32.853 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 167 | GLY | 0 | 0.042 | 0.030 | 29.469 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 168 | MET | 0 | 0.023 | -0.004 | 28.044 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 169 | THR | 0 | -0.030 | -0.017 | 28.468 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 170 | LYS | 1 | 0.837 | 0.916 | 25.465 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 171 | MET | 0 | -0.015 | -0.012 | 21.936 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 172 | ALA | 0 | 0.044 | 0.007 | 23.791 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 173 | LYS | 1 | 0.812 | 0.899 | 24.811 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 174 | MET | 0 | 0.001 | 0.001 | 21.161 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 175 | ILE | 0 | -0.011 | 0.000 | 19.133 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 176 | ASP | -1 | -0.859 | -0.930 | 20.463 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 177 | GLU | -1 | -0.799 | -0.897 | 21.782 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 178 | ARG | 1 | 0.835 | 0.882 | 11.195 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 179 | GLN | 0 | 0.015 | 0.002 | 17.090 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 180 | GLN | 0 | -0.107 | -0.039 | 18.240 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 181 | GLU | -1 | -0.888 | -0.947 | 15.830 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 182 | LEU | 0 | -0.077 | -0.038 | 12.780 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 183 | THR | 0 | -0.036 | -0.022 | 11.086 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 184 | HIS | 0 | -0.012 | -0.003 | 8.969 | 0.247 | 0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 185 | GLN | 0 | 0.058 | 0.004 | 13.755 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 186 | GLU | -1 | -0.930 | -0.957 | 15.226 | 0.498 | 0.498 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 187 | HIS | 0 | 0.006 | -0.015 | 9.884 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 188 | ARG | 1 | 0.841 | 0.919 | 15.382 | -0.245 | -0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 189 | VAL | 0 | -0.041 | -0.008 | 18.222 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 190 | MET | 0 | -0.033 | -0.010 | 17.848 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 191 | LEU | 0 | 0.031 | 0.020 | 15.625 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 192 | VAL | 0 | 0.018 | 0.005 | 19.644 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 193 | ASN | 0 | -0.063 | -0.040 | 22.916 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 194 | SER | 0 | 0.008 | -0.009 | 21.705 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 195 | MET | 0 | -0.010 | 0.003 | 23.171 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 196 | ASN | 0 | -0.026 | -0.006 | 24.910 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 197 | THR | 0 | 0.029 | 0.015 | 27.155 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 198 | VAL | 0 | 0.006 | -0.008 | 25.393 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 199 | LYS | 1 | 0.787 | 0.900 | 28.481 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 200 | GLU | -1 | -0.844 | -0.935 | 30.818 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 201 | LEU | 0 | -0.021 | -0.007 | 30.257 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 202 | LEU | 0 | 0.038 | 0.019 | 32.603 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 203 | PRO | 0 | -0.023 | -0.019 | 34.248 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 204 | VAL | 0 | 0.023 | 0.019 | 36.697 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 205 | LEU | 0 | -0.025 | 0.007 | 34.361 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 206 | ILE | 0 | 0.014 | -0.006 | 37.065 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 207 | SER | 0 | -0.004 | -0.018 | 39.952 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 208 | ALA | 0 | 0.015 | 0.009 | 40.418 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 209 | MET | 0 | 0.004 | -0.013 | 38.939 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 210 | LYS | 1 | 0.949 | 0.981 | 42.535 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 211 | ILE | 0 | -0.015 | 0.012 | 45.290 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 212 | PHE | 0 | 0.005 | 0.003 | 44.348 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 213 | VAL | 0 | -0.060 | -0.007 | 45.612 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 214 | THR | 0 | -0.097 | -0.073 | 48.221 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 215 | THR | 0 | 0.000 | 0.004 | 50.193 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 216 | LYS | 1 | 0.873 | 0.948 | 47.713 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 217 | ASN | 0 | -0.012 | -0.008 | 50.115 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 218 | SER | 0 | -0.025 | -0.010 | 52.613 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 219 | LYS | 1 | 0.834 | 0.923 | 53.835 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 220 | ASN | 0 | 0.016 | -0.002 | 54.269 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 221 | GLN | 0 | -0.029 | -0.007 | 53.985 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 222 | GLY | 0 | 0.088 | 0.024 | 51.389 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 223 | ILE | 0 | -0.013 | -0.009 | 47.229 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 224 | GLU | -1 | -0.833 | -0.911 | 46.882 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 225 | GLU | -1 | -0.853 | -0.942 | 45.287 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 226 | ALA | 0 | -0.017 | 0.002 | 44.200 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 227 | LEU | 0 | -0.018 | -0.012 | 41.007 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 228 | LYS | 1 | 0.856 | 0.934 | 40.850 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 229 | ASN | 0 | 0.065 | 0.042 | 39.462 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 230 | ARG | 1 | 0.895 | 0.969 | 38.026 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 231 | ASN | 0 | 0.057 | 0.031 | 36.664 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 232 | PHE | 0 | 0.027 | 0.016 | 34.735 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 233 | THR | 0 | -0.003 | -0.034 | 33.659 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 234 | VAL | 0 | 0.045 | 0.036 | 31.809 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 235 | GLU | -1 | -0.867 | -0.902 | 30.426 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 236 | LYS | 1 | 0.753 | 0.877 | 28.931 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 237 | MET | 0 | 0.042 | 0.025 | 27.712 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 238 | SER | 0 | -0.004 | -0.014 | 26.332 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 239 | ALA | 0 | -0.008 | -0.003 | 24.531 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 240 | GLU | -1 | -0.812 | -0.881 | 22.924 | 0.306 | 0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 241 | ILE | 0 | 0.006 | 0.009 | 21.787 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 242 | ASN | 0 | -0.069 | -0.043 | 20.275 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 243 | GLU | -1 | -0.794 | -0.883 | 18.431 | 0.570 | 0.570 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 244 | ILE | 0 | -0.024 | -0.019 | 17.359 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 245 | ILE | 0 | -0.041 | -0.036 | 15.906 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 246 | ARG | 1 | 0.787 | 0.884 | 13.783 | -0.745 | -0.745 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 247 | VAL | 0 | -0.004 | -0.020 | 12.692 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 248 | LEU | 0 | -0.039 | -0.019 | 12.322 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 249 | GLN | 0 | -0.061 | -0.026 | 9.564 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 250 | LEU | 0 | -0.060 | -0.005 | 7.825 | 0.162 | 0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 251 | THR | 0 | 0.004 | -0.019 | 3.687 | -1.531 | -1.056 | 0.039 | -0.177 | -0.337 | 0.001 |
252 | A | 252 | SER | 0 | 0.031 | 0.003 | 4.507 | 0.351 | 0.656 | 0.005 | -0.065 | -0.245 | 0.000 |
253 | A | 253 | TRP | 0 | -0.033 | -0.013 | 6.165 | -0.519 | -0.519 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 254 | ASP | -1 | -0.766 | -0.895 | 9.006 | 1.309 | 1.309 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 255 | GLU | -1 | -0.828 | -0.880 | 9.020 | 2.172 | 2.172 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 256 | ASP | -1 | -0.805 | -0.893 | 11.650 | 0.573 | 0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 257 | ALA | 0 | 0.025 | 0.019 | 15.213 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 258 | TRP | 0 | -0.072 | -0.070 | 16.546 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 259 | ALA | 0 | 0.075 | 0.058 | 17.896 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 260 | SER | 0 | 0.022 | 0.013 | 19.894 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 261 | LYS | 1 | 0.932 | 0.956 | 19.830 | -0.530 | -0.530 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 262 | ASP | -1 | -0.718 | -0.832 | 22.686 | 0.423 | 0.423 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 263 | THR | 0 | 0.012 | 0.001 | 23.894 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 264 | GLU | -1 | -0.856 | -0.915 | 26.163 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 265 | ALA | 0 | -0.002 | 0.003 | 27.728 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 266 | MET | 0 | -0.027 | -0.006 | 28.753 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 267 | LYS | 1 | 0.852 | 0.915 | 28.809 | -0.275 | -0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 268 | ARG | 1 | 0.867 | 0.924 | 30.590 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 269 | ALA | 0 | 0.041 | 0.023 | 33.903 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 270 | LEU | 0 | -0.004 | 0.001 | 34.531 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 271 | ALA | 0 | 0.059 | 0.036 | 36.714 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 272 | SER | 0 | -0.060 | -0.042 | 38.168 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 273 | ILE | 0 | -0.026 | -0.022 | 38.306 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 274 | ASP | -1 | -0.921 | -0.973 | 40.861 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 275 | SER | 0 | -0.022 | -0.003 | 42.501 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 276 | LYS | 1 | 0.781 | 0.879 | 41.712 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 277 | LEU | 0 | 0.040 | 0.026 | 44.491 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 278 | ASN | 0 | 0.010 | -0.006 | 47.092 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 279 | GLN | 0 | 0.008 | 0.000 | 49.578 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 280 | ALA | 0 | 0.060 | 0.050 | 48.650 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 281 | LYS | 1 | 0.769 | 0.867 | 48.548 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 282 | GLY | 0 | -0.049 | -0.042 | 52.598 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 283 | TRP | 0 | 0.026 | 0.014 | 53.956 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 284 | LEU | 0 | -0.038 | -0.016 | 51.512 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 285 | ARG | 1 | 0.836 | 0.930 | 53.533 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 286 | ASP | -1 | -0.725 | -0.855 | 58.400 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 287 | PRO | 0 | -0.064 | -0.018 | 60.137 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 288 | SER | 0 | -0.111 | -0.069 | 62.423 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 289 | ALA | 0 | 0.043 | 0.028 | 58.451 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 290 | SER | 0 | 0.019 | -0.001 | 59.355 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 291 | PRO | 0 | 0.011 | 0.000 | 56.847 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 292 | GLY | 0 | -0.008 | 0.000 | 54.244 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 293 | ASP | -1 | -0.881 | -0.949 | 54.351 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 294 | ALA | 0 | 0.036 | 0.011 | 51.965 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 295 | GLY | 0 | 0.013 | 0.006 | 51.096 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 296 | GLU | -1 | -0.822 | -0.890 | 51.398 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 297 | GLN | 0 | 0.048 | 0.019 | 48.179 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 298 | ALA | 0 | -0.030 | 0.003 | 46.935 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 299 | ILE | 0 | -0.001 | -0.001 | 46.139 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 300 | ARG | 1 | 0.747 | 0.824 | 45.538 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 301 | GLN | 0 | -0.038 | -0.041 | 39.974 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 302 | ILE | 0 | 0.004 | 0.018 | 41.313 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 303 | LEU | 0 | -0.011 | -0.019 | 40.757 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 304 | ASP | -1 | -0.778 | -0.863 | 37.949 | 0.180 | 0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 305 | GLU | -1 | -0.776 | -0.851 | 36.597 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 306 | ALA | 0 | -0.007 | 0.001 | 35.860 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 307 | GLY | 0 | 0.047 | 0.008 | 35.858 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 308 | LYS | 1 | 0.764 | 0.886 | 32.773 | -0.172 | -0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 309 | VAL | 0 | 0.009 | 0.007 | 31.318 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 310 | GLY | 0 | 0.008 | -0.001 | 31.139 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 311 | GLU | -1 | -0.788 | -0.873 | 29.494 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 312 | LEU | 0 | -0.050 | -0.019 | 25.679 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 313 | CYS | 0 | -0.058 | -0.020 | 26.797 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 314 | ALA | 0 | 0.114 | 0.042 | 26.553 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 315 | GLY | 0 | 0.000 | -0.017 | 28.598 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 316 | LYS | 1 | 0.816 | 0.901 | 31.440 | -0.219 | -0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 317 | GLU | -1 | -0.738 | -0.862 | 31.679 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 318 | ARG | 1 | 0.877 | 0.963 | 28.113 | -0.295 | -0.295 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 319 | ARG | 1 | 0.933 | 0.939 | 33.121 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 320 | GLU | -1 | -0.882 | -0.924 | 36.163 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 321 | ILE | 0 | -0.034 | 0.001 | 34.206 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 322 | LEU | 0 | 0.031 | 0.031 | 34.166 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 323 | GLY | 0 | 0.013 | 0.011 | 38.293 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 324 | THR | 0 | -0.046 | -0.053 | 41.080 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 325 | CYS | 0 | -0.027 | -0.014 | 39.891 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 326 | LYS | 1 | 0.859 | 0.924 | 42.234 | -0.138 | -0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 327 | MET | 0 | 0.017 | 0.018 | 44.221 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 328 | LEU | 0 | -0.012 | -0.014 | 44.577 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 329 | GLY | 0 | 0.045 | 0.025 | 46.488 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 330 | GLN | 0 | 0.044 | 0.037 | 47.781 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 331 | MET | 0 | -0.101 | -0.070 | 49.857 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 332 | THR | 0 | -0.015 | -0.014 | 50.240 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 333 | ASP | -1 | -0.808 | -0.886 | 50.713 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 334 | GLN | 0 | -0.032 | -0.025 | 53.208 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 335 | VAL | 0 | -0.015 | -0.007 | 55.499 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 336 | ALA | 0 | 0.035 | 0.019 | 55.431 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 337 | ASP | -1 | -0.808 | -0.884 | 57.422 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 338 | LEU | 0 | -0.024 | 0.004 | 59.093 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 339 | ARG | 1 | 0.826 | 0.919 | 58.643 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 340 | ALA | 0 | -0.041 | -0.015 | 61.306 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 341 | ARG | 1 | 0.820 | 0.872 | 61.679 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 342 | GLY | 0 | 0.017 | 0.031 | 66.054 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 343 | GLN | 0 | -0.038 | -0.005 | 65.360 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 344 | GLY | 0 | 0.093 | 0.039 | 63.382 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 345 | SER | 0 | 0.030 | -0.004 | 63.686 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 346 | SER | 0 | -0.031 | -0.019 | 64.811 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 347 | PRO | 0 | 0.035 | 0.006 | 64.938 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 348 | VAL | 0 | 0.008 | -0.016 | 60.717 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 349 | ALA | 0 | 0.011 | 0.014 | 60.610 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 350 | MET | 0 | 0.022 | 0.040 | 60.209 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 351 | GLN | 0 | -0.030 | -0.025 | 59.178 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 352 | LYS | 1 | 0.893 | 0.956 | 55.824 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 353 | ALA | 0 | 0.045 | 0.027 | 55.062 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 354 | GLN | 0 | 0.004 | -0.001 | 55.042 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 355 | GLN | 0 | -0.003 | -0.002 | 52.952 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 356 | VAL | 0 | 0.019 | 0.010 | 49.768 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 357 | SER | 0 | 0.028 | 0.018 | 49.920 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 358 | GLN | 0 | -0.004 | -0.006 | 50.179 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 359 | GLY | 0 | 0.042 | 0.027 | 47.868 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 360 | LEU | 0 | 0.003 | -0.004 | 45.669 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 361 | ASP | -1 | -0.816 | -0.889 | 44.700 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 362 | VAL | 0 | -0.039 | -0.008 | 43.481 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 363 | LEU | 0 | -0.020 | -0.018 | 39.831 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 364 | THR | 0 | 0.045 | 0.001 | 40.113 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 365 | ALA | 0 | 0.030 | 0.028 | 39.535 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 366 | LYS | 1 | 0.852 | 0.928 | 37.087 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 367 | VAL | 0 | 0.024 | 0.003 | 35.375 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 368 | GLU | -1 | -0.813 | -0.878 | 34.468 | 0.180 | 0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 369 | ASN | 0 | -0.077 | -0.054 | 34.483 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 370 | ALA | 0 | -0.008 | -0.006 | 31.615 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 371 | ALA | 0 | 0.015 | -0.010 | 30.295 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 372 | ARG | 1 | 0.895 | 0.935 | 29.673 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 373 | LYS | 1 | 0.900 | 0.953 | 28.670 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 374 | LEU | 0 | 0.043 | 0.022 | 23.284 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 375 | GLU | -1 | -0.803 | -0.905 | 24.922 | 0.298 | 0.298 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 376 | ALA | 0 | -0.053 | -0.024 | 25.631 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 377 | MET | 0 | 0.027 | 0.030 | 21.648 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 378 | THR | 0 | 0.001 | -0.001 | 21.139 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 379 | ASN | 0 | 0.011 | 0.008 | 21.171 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 380 | SER | 0 | -0.009 | -0.015 | 21.605 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 381 | LYS | 1 | 0.876 | 0.946 | 14.374 | -0.893 | -0.893 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 382 | GLN | 0 | -0.003 | -0.002 | 17.213 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 383 | SER | 0 | -0.105 | -0.079 | 18.930 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 384 | ILE | 0 | 0.007 | -0.009 | 15.139 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 385 | ALA | 0 | 0.036 | 0.029 | 14.771 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 386 | LYS | 1 | 0.936 | 0.965 | 15.607 | -0.297 | -0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 387 | LYS | 1 | 0.855 | 0.931 | 18.352 | -0.309 | -0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 388 | ILE | 0 | 0.024 | 0.010 | 12.287 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 389 | ASP | -1 | -0.881 | -0.926 | 14.860 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 390 | ALA | 0 | -0.030 | -0.015 | 15.823 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 391 | ALA | 0 | -0.012 | -0.016 | 17.319 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 392 | GLN | 0 | 0.054 | 0.033 | 11.721 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 393 | ASN | 0 | -0.012 | -0.022 | 15.834 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 394 | TRP | 0 | 0.004 | 0.049 | 18.947 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 395 | LEU | 0 | -0.006 | 0.002 | 15.722 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 396 | ALA | 0 | -0.102 | -0.050 | 17.884 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 397 | ASP | -1 | -0.812 | -0.907 | 19.197 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 398 | PRO | 0 | -0.112 | -0.054 | 22.980 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 399 | ASN | 0 | -0.052 | -0.034 | 24.746 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 400 | GLY | 0 | 0.036 | 0.028 | 25.122 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 401 | GLY | 0 | 0.064 | 0.021 | 25.991 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 402 | PRO | 0 | -0.002 | -0.016 | 26.743 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 403 | GLU | -1 | -0.803 | -0.905 | 27.060 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 404 | GLY | 0 | -0.017 | -0.018 | 23.255 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 405 | GLU | -1 | -0.908 | -0.964 | 22.242 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 406 | GLU | -1 | -0.840 | -0.905 | 24.061 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 407 | GLN | 0 | -0.070 | -0.038 | 20.929 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 408 | ILE | 0 | 0.001 | 0.001 | 18.564 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 409 | ARG | 1 | 0.840 | 0.903 | 20.552 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 410 | GLY | 0 | 0.007 | -0.010 | 23.455 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 411 | ALA | 0 | 0.000 | 0.002 | 17.738 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 412 | LEU | 0 | 0.027 | 0.010 | 18.381 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 413 | ALA | 0 | -0.052 | -0.025 | 20.795 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 414 | GLU | -1 | -0.828 | -0.853 | 20.714 | 0.321 | 0.321 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 415 | ALA | 0 | 0.038 | 0.004 | 18.268 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 416 | ARG | 1 | 0.936 | 0.974 | 20.031 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 417 | LYS | 1 | 0.872 | 0.942 | 23.436 | -0.283 | -0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 418 | ILE | 0 | 0.010 | -0.008 | 18.487 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 419 | ALA | 0 | 0.048 | 0.027 | 22.079 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 420 | GLU | -1 | -0.910 | -0.937 | 23.058 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 421 | LEU | 0 | -0.069 | -0.053 | 24.846 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 422 | CYS | 0 | -0.036 | 0.001 | 21.819 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 423 | ASP | -1 | -0.951 | -0.986 | 24.459 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 424 | ASP | -1 | -0.750 | -0.871 | 20.859 | 0.481 | 0.481 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 425 | PRO | 0 | -0.052 | -0.046 | 22.674 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 426 | LYS | 1 | 0.853 | 0.910 | 18.339 | -0.574 | -0.574 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 427 | GLU | -1 | -0.779 | -0.856 | 16.768 | 0.780 | 0.780 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 428 | ARG | 1 | 0.844 | 0.924 | 18.933 | -0.295 | -0.295 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 429 | ASP | -1 | -0.837 | -0.910 | 21.429 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 430 | ASP | -1 | -0.823 | -0.901 | 14.803 | 0.750 | 0.750 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 431 | ILE | 0 | 0.023 | 0.025 | 16.808 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 432 | LEU | 0 | -0.036 | -0.032 | 18.371 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 433 | ARG | 1 | 0.766 | 0.885 | 18.762 | -0.337 | -0.337 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 434 | SER | 0 | 0.084 | 0.036 | 15.956 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 435 | LEU | 0 | -0.055 | -0.028 | 17.917 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 436 | GLY | 0 | -0.002 | 0.005 | 20.248 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 437 | GLU | -1 | -0.873 | -0.940 | 17.167 | 0.289 | 0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 438 | ILE | 0 | 0.001 | -0.012 | 15.295 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 439 | SER | 0 | 0.009 | 0.006 | 18.753 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 440 | ALA | 0 | -0.006 | 0.014 | 22.201 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 441 | LEU | 0 | 0.032 | 0.002 | 17.104 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 442 | THR | 0 | -0.033 | -0.026 | 20.219 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 443 | SER | 0 | -0.017 | -0.019 | 21.833 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 444 | LYN | 0 | -0.073 | -0.040 | 22.413 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 445 | LEU | 0 | 0.009 | 0.024 | 20.115 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 446 | ALA | 0 | 0.024 | 0.014 | 24.049 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 447 | ASP | -1 | -0.850 | -0.930 | 26.366 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 448 | LEU | 0 | 0.059 | -0.009 | 25.532 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 449 | ARG | 1 | 0.890 | 0.964 | 21.676 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 450 | ARG | 1 | 0.768 | 0.905 | 28.324 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 451 | GLN | 0 | -0.109 | -0.031 | 30.982 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 452 | GLY | 0 | 0.026 | 0.010 | 31.738 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 453 | LYS | 1 | 0.829 | 0.903 | 27.814 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 454 | GLY | 0 | 0.051 | 0.053 | 26.341 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 455 | ASP | -1 | -0.891 | -0.956 | 25.084 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 456 | SER | 0 | -0.096 | -0.050 | 24.838 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 457 | PRO | 0 | 0.030 | -0.031 | 20.819 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 458 | GLU | -1 | -0.902 | -0.899 | 22.391 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 459 | ALA | 0 | 0.104 | 0.044 | 22.243 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 460 | ARG | 1 | 1.055 | 1.055 | 16.875 | 0.396 | 0.396 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 461 | ALA | 0 | -0.069 | -0.038 | 17.042 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 462 | LEU | 0 | -0.027 | -0.023 | 17.918 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 463 | ALA | 0 | 0.050 | 0.014 | 16.951 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 464 | LYS | 1 | 0.862 | 0.918 | 9.626 | 0.576 | 0.576 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 465 | GLN | 0 | -0.009 | 0.006 | 12.682 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 466 | VAL | 0 | 0.041 | 0.014 | 13.507 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 467 | ALA | 0 | 0.003 | 0.013 | 12.185 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 468 | THR | 0 | -0.051 | -0.038 | 7.749 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 469 | ALA | 0 | 0.032 | 0.023 | 9.621 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 470 | LEU | 0 | -0.016 | -0.014 | 12.166 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 471 | GLN | 0 | 0.048 | 0.018 | 6.362 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 472 | ASN | 0 | 0.028 | 0.015 | 7.718 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 473 | LEU | 0 | 0.012 | 0.013 | 9.496 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 474 | GLN | 0 | -0.016 | -0.014 | 10.258 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 475 | THR | 0 | -0.013 | 0.005 | 7.339 | 0.242 | 0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 476 | LYS | 1 | 0.843 | 0.910 | 10.102 | -0.853 | -0.853 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 477 | THR | 0 | -0.022 | -0.036 | 12.876 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 478 | ASN | 0 | -0.041 | -0.025 | 11.199 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 479 | ARG | 1 | 0.866 | 0.926 | 8.380 | -2.282 | -2.282 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 480 | ALA | 0 | 0.069 | 0.049 | 14.232 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 481 | VAL | 0 | -0.018 | -0.015 | 17.154 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 482 | ALA | 0 | 0.013 | 0.035 | 15.055 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 483 | ASN | 0 | -0.101 | -0.077 | 15.502 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 484 | SER | 0 | -0.065 | -0.034 | 18.873 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 485 | ARG | 1 | 0.734 | 0.835 | 18.711 | -0.652 | -0.652 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 486 | PRO | 0 | -0.055 | -0.012 | 21.505 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 487 | ALA | 0 | 0.000 | -0.001 | 21.439 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 488 | LYS | 1 | 0.829 | 0.907 | 21.940 | -0.495 | -0.495 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 489 | ALA | 0 | 0.008 | 0.017 | 23.462 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 490 | ALA | 0 | -0.034 | -0.021 | 24.681 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 491 | VAL | 0 | 0.036 | -0.004 | 24.384 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 492 | HIS | 0 | 0.063 | 0.044 | 25.553 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 493 | LEU | 0 | 0.065 | 0.037 | 29.578 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 494 | GLU | -1 | -0.824 | -0.906 | 30.760 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 495 | GLY | 0 | 0.008 | -0.004 | 27.494 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 496 | LYS | 1 | 0.874 | 0.949 | 28.249 | -0.220 | -0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 497 | ILE | 0 | 0.046 | 0.017 | 30.014 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 498 | GLU | -1 | -0.873 | -0.908 | 26.477 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 499 | GLN | 0 | 0.024 | -0.002 | 23.923 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 500 | ALA | 0 | -0.028 | -0.017 | 28.504 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 501 | GLN | 0 | -0.016 | 0.000 | 31.903 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 502 | ARG | 1 | 0.920 | 0.945 | 24.502 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 503 | TRP | 0 | 0.017 | 0.027 | 29.935 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 504 | ILE | 0 | -0.021 | -0.031 | 31.257 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 505 | ASP | -1 | -0.955 | -0.970 | 32.877 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 506 | ASN | 0 | -0.091 | -0.039 | 30.450 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 507 | PRO | 0 | 0.001 | 0.010 | 31.326 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 508 | THR | 0 | 0.013 | 0.002 | 32.413 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 509 | VAL | 0 | -0.072 | -0.035 | 27.192 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 510 | ASP | -1 | -0.877 | -0.955 | 23.383 | 0.335 | 0.335 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 511 | ASP | -1 | -0.836 | -0.911 | 24.199 | 0.270 | 0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 512 | ARG | 1 | 0.927 | 0.966 | 18.193 | -0.501 | -0.501 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 513 | GLY | 0 | -0.029 | -0.015 | 24.085 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 514 | VAL | 0 | -0.023 | -0.023 | 22.849 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 515 | GLY | 0 | 0.070 | 0.034 | 26.240 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 516 | GLN | 0 | -0.001 | -0.012 | 29.419 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 517 | ALA | 0 | -0.041 | -0.008 | 27.962 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 518 | ALA | 0 | 0.012 | 0.004 | 29.010 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 519 | ILE | 0 | -0.018 | -0.005 | 30.623 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 520 | ARG | 1 | 0.834 | 0.884 | 30.366 | -0.241 | -0.241 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 521 | GLY | 0 | -0.004 | 0.000 | 32.331 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 522 | LEU | 0 | 0.013 | 0.006 | 33.293 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 523 | VAL | 0 | 0.053 | 0.031 | 35.761 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 524 | ALA | 0 | -0.025 | -0.002 | 35.574 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 525 | GLU | -1 | -0.825 | -0.906 | 34.431 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 526 | GLY | 0 | 0.019 | -0.001 | 37.987 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 527 | HIS | 0 | -0.049 | -0.044 | 40.957 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 528 | ARG | 1 | 0.750 | 0.853 | 34.488 | -0.191 | -0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 529 | LEU | 0 | -0.037 | -0.006 | 40.659 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 530 | ALA | 0 | 0.107 | 0.046 | 43.348 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 531 | ASN | 0 | -0.066 | -0.039 | 43.795 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 532 | VAL | 0 | -0.026 | -0.009 | 45.593 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 533 | MET | 0 | -0.071 | -0.006 | 46.514 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 534 | MET | 0 | 0.015 | -0.009 | 50.347 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 535 | GLY | 0 | 0.030 | 0.000 | 53.950 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 536 | PRO | 0 | 0.037 | 0.019 | 54.640 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 537 | TYR | 0 | 0.050 | 0.034 | 51.828 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 538 | ARG | 1 | 0.921 | 0.974 | 49.281 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 539 | GLN | 0 | 0.034 | -0.016 | 49.596 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 540 | ASP | -1 | -0.848 | -0.881 | 50.748 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 541 | LEU | 0 | 0.010 | -0.013 | 44.319 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 542 | LEU | 0 | 0.039 | 0.009 | 45.441 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 543 | ALA | 0 | 0.007 | 0.028 | 47.092 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 544 | LYS | 1 | 0.849 | 0.898 | 45.346 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 545 | CYS | 0 | -0.074 | -0.015 | 42.945 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 546 | ASP | -1 | -0.819 | -0.919 | 43.300 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 547 | ARG | 1 | 0.820 | 0.911 | 45.277 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 548 | VAL | 0 | 0.044 | 0.008 | 39.340 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 549 | ASP | -1 | -0.846 | -0.901 | 39.877 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 550 | GLN | 0 | -0.044 | -0.020 | 41.331 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 551 | LEU | 0 | -0.023 | -0.003 | 42.197 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 552 | THR | 0 | 0.001 | -0.008 | 36.244 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 553 | ALA | 0 | -0.033 | -0.005 | 38.786 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 554 | GLN | 0 | -0.040 | -0.022 | 40.465 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 555 | LEU | 0 | 0.014 | 0.000 | 37.676 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 556 | ALA | 0 | 0.024 | 0.002 | 36.071 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 557 | ASP | -1 | -0.878 | -0.920 | 37.381 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 558 | LEU | 0 | -0.061 | -0.033 | 39.990 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 559 | ALA | 0 | 0.039 | 0.007 | 35.850 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 560 | ALA | 0 | -0.074 | -0.020 | 36.066 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 561 | ARG | 1 | 0.777 | 0.892 | 37.131 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 562 | GLY | 0 | 0.063 | 0.021 | 38.124 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 563 | GLU | -1 | -0.987 | -1.001 | 38.795 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 564 | GLY | 0 | 0.054 | 0.032 | 37.296 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 565 | GLU | -1 | -0.964 | -0.980 | 37.508 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 566 | SER | 0 | -0.022 | -0.003 | 40.647 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 567 | PRO | 0 | 0.019 | 0.004 | 44.142 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 568 | GLN | 0 | 0.102 | 0.033 | 46.249 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 569 | ALA | 0 | -0.003 | 0.025 | 40.998 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 570 | ARG | 1 | 0.904 | 0.932 | 40.139 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 571 | ALA | 0 | 0.012 | 0.002 | 43.391 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 572 | LEU | 0 | -0.041 | -0.021 | 43.181 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 573 | ALA | 0 | 0.055 | 0.026 | 39.646 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 574 | SER | 0 | -0.028 | -0.007 | 41.197 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 575 | GLN | 0 | 0.049 | 0.025 | 43.658 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 576 | LEU | 0 | 0.019 | 0.028 | 38.408 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 577 | GLN | 0 | 0.013 | 0.016 | 38.286 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 578 | ASP | -1 | -0.833 | -0.913 | 40.110 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 579 | SER | 0 | -0.041 | -0.046 | 42.685 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 580 | LEU | 0 | -0.011 | -0.003 | 36.208 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 581 | LYS | 1 | 0.842 | 0.923 | 39.965 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 582 | ASP | -1 | -0.794 | -0.860 | 41.550 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 583 | LEU | 0 | 0.039 | 0.009 | 39.767 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 584 | LYS | 1 | 0.774 | 0.877 | 36.312 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 585 | ALA | 0 | 0.026 | 0.010 | 40.179 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 586 | ARG | 1 | 0.812 | 0.877 | 43.352 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 587 | MET | 0 | -0.042 | -0.034 | 38.176 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 588 | GLN | 0 | 0.003 | -0.001 | 38.138 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 589 | GLU | -1 | -0.936 | -0.947 | 42.056 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 590 | ALA | 0 | 0.000 | -0.010 | 44.375 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 591 | MET | 0 | -0.021 | 0.002 | 39.079 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 592 | THR | 0 | 0.017 | 0.005 | 43.250 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 593 | GLN | 0 | 0.001 | -0.013 | 45.003 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 594 | GLU | -1 | -0.796 | -0.853 | 43.314 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 595 | VAL | 0 | 0.017 | 0.002 | 41.935 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 596 | SER | 0 | -0.029 | -0.013 | 45.006 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 597 | ASP | -1 | -0.891 | -0.952 | 48.512 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 598 | VAL | 0 | -0.062 | -0.016 | 44.561 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 599 | PHE | 0 | 0.015 | -0.018 | 40.374 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 600 | SER | 0 | -0.053 | 0.013 | 46.292 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 601 | ASP | -1 | -0.864 | -0.920 | 49.909 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 602 | THR | 0 | 0.060 | 0.027 | 45.131 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 603 | THR | 0 | 0.035 | 0.009 | 47.499 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 604 | THR | 0 | -0.069 | -0.076 | 49.566 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 605 | PRO | 0 | 0.032 | 0.022 | 48.991 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 606 | ILE | 0 | 0.035 | 0.026 | 45.737 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 607 | LYS | 1 | 0.916 | 0.974 | 49.715 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 608 | LEU | 0 | -0.014 | 0.003 | 53.021 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 609 | LEU | 0 | 0.019 | 0.028 | 48.761 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 610 | ALA | 0 | 0.057 | 0.006 | 51.401 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 611 | VAL | 0 | -0.101 | -0.060 | 52.791 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 612 | ALA | 0 | -0.003 | -0.001 | 55.092 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 613 | ALA | 0 | -0.007 | -0.003 | 52.776 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 614 | THR | 0 | -0.068 | -0.038 | 54.809 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 615 | ALA | 0 | -0.010 | 0.002 | 57.336 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 616 | PRO | 0 | 0.059 | 0.016 | 60.512 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 617 | PRO | 0 | -0.030 | -0.018 | 62.115 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 618 | ASP | -1 | -0.903 | -0.950 | 63.513 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 619 | ALA | 0 | -0.071 | -0.018 | 63.381 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 620 | PRO | 0 | 0.050 | 0.005 | 65.044 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 621 | ASN | 0 | -0.064 | -0.039 | 63.607 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 622 | ARG | 1 | 0.909 | 0.963 | 58.623 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 623 | GLU | -1 | -0.882 | -0.923 | 56.403 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 624 | GLU | -1 | -0.865 | -0.907 | 58.189 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 625 | VAL | 0 | -0.009 | -0.020 | 58.322 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 626 | PHE | 0 | 0.022 | 0.003 | 50.903 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 627 | ASP | -1 | -0.802 | -0.889 | 52.906 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 628 | GLU | -1 | -0.871 | -0.903 | 53.334 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 629 | ARG | 1 | 0.817 | 0.871 | 53.796 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 630 | ALA | 0 | 0.057 | 0.022 | 49.497 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 631 | ALA | 0 | 0.068 | 0.041 | 48.864 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 632 | ASN | 0 | -0.092 | -0.057 | 49.110 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 633 | PHE | 0 | -0.026 | 0.001 | 44.189 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 634 | GLU | -1 | -0.875 | -0.947 | 44.666 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 635 | ASN | 0 | -0.090 | -0.056 | 44.405 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 636 | HIS | 0 | 0.012 | -0.001 | 45.587 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 637 | SER | 0 | 0.033 | -0.001 | 41.640 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 638 | GLY | 0 | -0.010 | 0.005 | 40.886 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 639 | LYS | 1 | 0.859 | 0.926 | 41.071 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 640 | LEU | 0 | -0.005 | 0.023 | 41.748 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 641 | GLY | 0 | 0.049 | 0.011 | 38.025 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 642 | ALA | 0 | -0.038 | -0.030 | 37.538 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 643 | THR | 0 | -0.007 | -0.030 | 38.521 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 644 | ALA | 0 | 0.030 | 0.009 | 36.919 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 645 | GLU | -1 | -0.838 | -0.901 | 33.356 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 646 | LYS | 1 | 0.817 | 0.901 | 34.811 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 647 | ALA | 0 | 0.033 | 0.010 | 36.882 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 648 | ALA | 0 | -0.062 | -0.028 | 31.826 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 649 | ALA | 0 | -0.052 | -0.018 | 32.747 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 650 | VAL | 0 | -0.043 | -0.037 | 33.686 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 651 | GLY | 0 | 0.056 | 0.029 | 35.766 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 652 | THR | 0 | -0.085 | -0.043 | 34.753 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 653 | ALA | 0 | 0.041 | 0.013 | 31.992 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 654 | ASN | 0 | 0.017 | 0.013 | 25.353 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 655 | LYS | 1 | 0.852 | 0.886 | 20.353 | -0.372 | -0.372 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 656 | SER | 0 | 0.015 | 0.013 | 26.011 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 657 | THR | 0 | 0.071 | 0.030 | 27.493 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 658 | VAL | 0 | 0.000 | 0.013 | 27.807 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 659 | GLU | -1 | -0.822 | -0.896 | 23.249 | 0.353 | 0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 660 | GLY | 0 | 0.041 | 0.025 | 27.167 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 661 | ILE | 0 | 0.007 | 0.006 | 29.649 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 662 | GLN | 0 | 0.009 | -0.011 | 27.432 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 663 | ALA | 0 | -0.023 | 0.008 | 28.184 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 664 | SER | 0 | -0.032 | -0.017 | 29.860 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 665 | VAL | 0 | 0.018 | -0.001 | 33.177 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 666 | LYS | 1 | 0.881 | 0.934 | 27.682 | -0.251 | -0.251 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 667 | THR | 0 | 0.033 | 0.005 | 32.214 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 668 | ALA | 0 | 0.005 | 0.025 | 33.806 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 669 | ARG | 1 | 0.791 | 0.887 | 34.471 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 670 | GLU | -1 | -0.882 | -0.921 | 31.138 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 671 | LEU | 0 | -0.031 | -0.039 | 35.477 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 672 | THR | 0 | 0.009 | 0.007 | 38.542 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 673 | PRO | 0 | 0.089 | 0.023 | 39.391 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 674 | GLN | 0 | -0.011 | -0.001 | 37.186 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 675 | VAL | 0 | 0.018 | 0.023 | 41.351 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 676 | VAL | 0 | -0.044 | -0.012 | 43.977 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 677 | SER | 0 | 0.007 | 0.012 | 43.651 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 678 | ALA | 0 | 0.005 | 0.000 | 44.753 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 679 | ALA | 0 | 0.003 | -0.002 | 46.668 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 680 | ARG | 1 | 0.907 | 0.931 | 48.187 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 681 | ILE | 0 | -0.107 | -0.047 | 45.990 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 682 | LEU | 0 | -0.031 | -0.020 | 50.384 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 683 | LEU | 0 | -0.009 | 0.039 | 53.004 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 684 | ARG | 1 | 0.839 | 0.891 | 53.268 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 685 | ASN | 0 | -0.061 | -0.045 | 53.621 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 686 | PRO | 0 | 0.047 | 0.029 | 55.369 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 687 | GLY | 0 | 0.011 | 0.003 | 57.136 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 688 | ASN | 0 | 0.016 | -0.005 | 52.505 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 689 | GLN | 0 | 0.059 | 0.024 | 51.988 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 690 | ALA | 0 | 0.063 | 0.049 | 49.489 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 691 | ALA | 0 | -0.097 | -0.060 | 49.117 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 692 | TYR | 0 | -0.046 | -0.047 | 50.184 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 693 | GLU | -1 | -0.864 | -0.922 | 47.385 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 694 | HIS | 0 | 0.012 | 0.038 | 41.958 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 695 | PHE | 0 | 0.037 | 0.014 | 45.396 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 696 | GLU | -1 | -0.785 | -0.851 | 46.993 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 697 | THR | 0 | -0.027 | -0.021 | 41.856 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 698 | MET | 0 | -0.024 | -0.011 | 39.131 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 699 | LYS | 1 | 0.826 | 0.895 | 42.591 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 700 | ASN | 0 | -0.001 | -0.005 | 44.237 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 701 | GLN | 0 | 0.047 | 0.033 | 36.595 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 702 | TRP | 0 | -0.065 | -0.041 | 39.849 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 703 | ILE | 0 | -0.046 | -0.055 | 41.335 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 704 | ASP | -1 | -0.881 | -0.904 | 39.597 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 705 | ASN | 0 | -0.072 | -0.058 | 35.439 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 706 | VAL | 0 | 0.024 | 0.024 | 38.002 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 707 | GLU | -1 | -0.794 | -0.877 | 40.375 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 708 | LYS | 1 | 0.838 | 0.933 | 33.038 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 709 | MET | 0 | -0.021 | -0.019 | 36.333 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 710 | THR | 0 | -0.046 | -0.051 | 37.838 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 711 | GLY | 0 | -0.005 | 0.003 | 40.010 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 712 | LEU | 0 | -0.016 | -0.020 | 33.384 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 713 | VAL | 0 | -0.001 | 0.004 | 37.107 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 714 | ASP | -1 | -0.761 | -0.859 | 38.783 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 715 | GLU | -1 | -0.939 | -0.959 | 37.218 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 716 | ALA | 0 | -0.051 | -0.016 | 36.614 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 717 | ILE | 0 | -0.035 | -0.017 | 37.652 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 718 | ASP | -1 | -0.749 | -0.840 | 41.051 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 719 | THR | 0 | 0.001 | -0.021 | 42.228 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 720 | LYS | 1 | 0.875 | 0.922 | 44.160 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 721 | SER | 0 | 0.034 | 0.003 | 45.102 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 722 | LEU | 0 | -0.037 | -0.003 | 44.250 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 723 | LEU | 0 | -0.001 | -0.006 | 47.210 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 724 | ASP | -1 | -0.849 | -0.915 | 50.120 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 725 | ALA | 0 | -0.018 | -0.010 | 49.322 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | A | 726 | SER | 0 | -0.057 | -0.051 | 50.133 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | A | 727 | GLU | -1 | -0.844 | -0.901 | 52.548 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | A | 728 | GLU | -1 | -0.803 | -0.892 | 54.690 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | A | 729 | ALA | 0 | -0.023 | -0.009 | 53.735 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | A | 730 | ILE | 0 | 0.007 | -0.006 | 55.676 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | A | 731 | LYS | 1 | 0.812 | 0.885 | 58.131 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | A | 732 | LYS | 1 | 0.880 | 0.937 | 56.757 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | A | 733 | ASP | -1 | -0.757 | -0.852 | 57.679 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | A | 734 | LEU | 0 | 0.017 | 0.001 | 60.721 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | A | 735 | ASP | -1 | -0.866 | -0.919 | 63.354 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | A | 736 | LYN | 0 | -0.017 | 0.016 | 58.377 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | A | 737 | CYS | 0 | -0.068 | -0.019 | 63.829 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | A | 738 | LYS | 1 | 0.898 | 0.931 | 66.541 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | A | 739 | VAL | 0 | 0.009 | -0.001 | 67.559 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | A | 740 | ALA | 0 | 0.002 | 0.019 | 67.563 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | A | 741 | MET | 0 | -0.023 | -0.034 | 69.600 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | A | 742 | ALA | 0 | -0.054 | -0.003 | 72.272 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | A | 743 | ASN | 0 | -0.024 | -0.011 | 70.621 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | A | 744 | ILE | 0 | -0.040 | -0.024 | 73.896 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | A | 745 | GLN | 0 | 0.044 | 0.016 | 69.357 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | A | 746 | PRO | 0 | 0.032 | 0.023 | 69.219 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | A | 747 | GLN | 0 | 0.004 | 0.005 | 66.123 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
748 | A | 748 | MET | 0 | 0.017 | -0.006 | 64.644 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
749 | A | 749 | LEU | 0 | -0.035 | -0.002 | 64.964 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | A | 750 | VAL | 0 | 0.040 | 0.012 | 64.112 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | A | 751 | ALA | 0 | -0.008 | 0.015 | 61.005 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | A | 752 | GLY | 0 | 0.050 | 0.034 | 60.126 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | A | 753 | ALA | 0 | 0.049 | 0.012 | 60.826 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | A | 754 | THR | 0 | -0.102 | -0.070 | 57.981 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | A | 755 | SER | 0 | -0.052 | -0.046 | 56.376 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | A | 756 | ILE | 0 | 0.030 | 0.018 | 56.179 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | A | 757 | ALA | 0 | -0.003 | 0.002 | 57.341 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | A | 758 | ARG | 1 | 0.939 | 0.983 | 53.069 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | A | 759 | ARG | 1 | 0.821 | 0.887 | 52.364 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | A | 760 | ALA | 0 | 0.045 | 0.011 | 52.855 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | A | 761 | ASN | 0 | -0.065 | -0.049 | 52.870 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | A | 762 | ARG | 1 | 0.821 | 0.896 | 44.802 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | A | 763 | ILE | 0 | 0.006 | 0.011 | 49.085 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | A | 764 | LEU | 0 | -0.028 | -0.010 | 50.150 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | A | 765 | LEU | 0 | -0.005 | 0.002 | 46.604 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | A | 766 | VAL | 0 | 0.001 | -0.002 | 45.139 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | A | 767 | ALA | 0 | 0.022 | 0.010 | 45.890 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | A | 768 | LYS | 1 | 0.972 | 0.979 | 47.183 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | A | 769 | ARG | 1 | 0.918 | 0.971 | 40.203 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | A | 770 | GLU | -1 | -0.790 | -0.889 | 41.936 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | A | 771 | VAL | 0 | -0.032 | -0.015 | 44.251 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | A | 772 | GLU | -1 | -0.867 | -0.931 | 42.679 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | A | 773 | ASN | 0 | -0.034 | -0.016 | 38.588 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | A | 774 | SER | 0 | 0.011 | 0.020 | 40.584 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | A | 775 | GLU | -1 | -0.821 | -0.895 | 39.905 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | A | 776 | ASP | -1 | -0.821 | -0.888 | 43.988 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | A | 777 | PRO | 0 | -0.007 | -0.009 | 46.572 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | A | 778 | LYS | 1 | 0.930 | 0.960 | 50.197 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | A | 779 | PHE | 0 | 0.018 | 0.018 | 45.533 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | A | 780 | ARG | 1 | 0.894 | 0.930 | 46.346 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | A | 781 | GLU | -1 | -0.897 | -0.924 | 49.749 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | A | 782 | ALA | 0 | 0.025 | 0.020 | 52.803 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | A | 783 | VAL | 0 | 0.017 | -0.004 | 49.074 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | A | 784 | LYS | 1 | 0.814 | 0.904 | 52.340 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | A | 785 | ALA | 0 | 0.052 | 0.028 | 53.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | A | 786 | ALA | 0 | -0.004 | 0.013 | 55.230 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | A | 787 | SER | 0 | 0.019 | -0.001 | 53.127 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | A | 788 | ASP | -1 | -0.926 | -0.973 | 55.252 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | A | 789 | GLU | -1 | -0.890 | -0.919 | 57.960 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | A | 790 | LEU | 0 | 0.011 | -0.010 | 54.984 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | A | 791 | SER | 0 | -0.001 | -0.004 | 57.303 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | A | 792 | LYS | 1 | 0.851 | 0.931 | 58.993 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | A | 793 | THR | 0 | -0.022 | 0.002 | 60.854 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | A | 794 | ILE | 0 | -0.034 | -0.004 | 57.657 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | A | 795 | SER | 0 | 0.022 | -0.003 | 61.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | A | 796 | PRO | 0 | 0.031 | 0.010 | 63.838 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | A | 797 | MET | 0 | 0.056 | 0.051 | 61.863 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | A | 798 | VAL | 0 | 0.013 | -0.005 | 61.682 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | A | 799 | MET | 0 | -0.119 | -0.059 | 65.035 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | A | 800 | ASP | -1 | -0.812 | -0.910 | 68.437 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | A | 801 | ALA | 0 | -0.048 | -0.034 | 66.214 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | A | 802 | LYS | 1 | 0.893 | 0.948 | 65.715 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | A | 803 | ALA | 0 | 0.009 | 0.017 | 69.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | A | 804 | VAL | 0 | -0.048 | -0.024 | 71.402 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | A | 805 | ALA | 0 | -0.006 | 0.000 | 70.305 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | A | 806 | GLY | 0 | -0.003 | -0.004 | 71.924 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | A | 807 | ASN | 0 | -0.032 | -0.028 | 75.531 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | A | 808 | ILE | 0 | -0.009 | 0.021 | 71.240 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | A | 809 | SER | 0 | 0.028 | 0.012 | 75.207 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | A | 810 | ASP | -1 | -0.883 | -0.926 | 78.234 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | A | 811 | PRO | 0 | 0.044 | 0.018 | 77.988 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | A | 812 | GLY | 0 | 0.009 | 0.014 | 78.819 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | A | 813 | LEU | 0 | -0.006 | -0.014 | 75.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | A | 814 | GLN | 0 | 0.055 | 0.003 | 73.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | A | 815 | LYS | 1 | 0.810 | 0.905 | 72.833 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | A | 816 | SER | 0 | 0.066 | 0.030 | 73.264 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | A | 817 | PHE | 0 | 0.019 | 0.026 | 65.794 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | A | 818 | LEU | 0 | -0.028 | -0.032 | 68.574 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | A | 819 | ASP | -1 | -0.854 | -0.869 | 68.958 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | A | 820 | SER | 0 | 0.013 | 0.001 | 67.291 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | A | 821 | GLY | 0 | 0.007 | 0.003 | 64.980 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | A | 822 | TYR | 0 | 0.004 | -0.013 | 64.298 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | A | 823 | ARG | 1 | 0.851 | 0.902 | 64.958 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | A | 824 | ILE | 0 | 0.007 | -0.018 | 59.615 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | A | 825 | LEU | 0 | -0.026 | -0.020 | 59.383 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | A | 826 | GLY | 0 | 0.029 | 0.033 | 60.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | A | 827 | ALA | 0 | -0.014 | -0.012 | 59.973 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | A | 828 | VAL | 0 | -0.019 | -0.022 | 55.958 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | A | 829 | ALA | 0 | 0.053 | 0.045 | 55.956 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | A | 830 | LYS | 1 | 0.832 | 0.900 | 57.082 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | A | 831 | VAL | 0 | -0.030 | -0.032 | 52.504 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | A | 832 | ARG | 1 | 0.807 | 0.893 | 52.389 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | A | 833 | GLU | -1 | -0.731 | -0.886 | 52.519 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | A | 834 | ALA | 0 | -0.069 | -0.005 | 52.612 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | A | 835 | PHE | 0 | -0.058 | -0.042 | 47.077 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | A | 836 | GLN | 0 | -0.087 | -0.040 | 48.874 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | A | 837 | PRO | 0 | -0.057 | -0.010 | 47.481 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | A | 838 | GLN | 0 | -0.023 | -0.025 | 49.142 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | A | 839 | GLU | -1 | -0.893 | -0.949 | 50.983 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
840 | A | 840 | PRO | 0 | -0.055 | -0.024 | 51.011 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
841 | A | 841 | ASP | -1 | -0.848 | -0.910 | 52.704 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
842 | A | 842 | PHE | 0 | -0.063 | -0.042 | 54.628 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
843 | A | 843 | PRO | 0 | -0.068 | -0.020 | 53.219 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
844 | A | 877 | PRO | 0 | 0.015 | -0.013 | 47.958 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
845 | A | 878 | PRO | 0 | -0.041 | -0.020 | 49.651 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
846 | A | 879 | GLU | -1 | -0.859 | -0.925 | 45.338 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
847 | A | 880 | GLU | -1 | -0.833 | -0.915 | 39.945 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
848 | A | 881 | LYS | 1 | 0.816 | 0.905 | 41.068 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
849 | A | 882 | ASP | -1 | -0.802 | -0.855 | 35.546 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
850 | A | 883 | GLU | -1 | -0.906 | -0.961 | 33.795 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
851 | A | 884 | GLU | -1 | -0.861 | -0.902 | 33.937 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
852 | A | 885 | PHE | 0 | 0.018 | 0.003 | 25.657 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
853 | A | 886 | PRO | 0 | -0.015 | 0.004 | 28.458 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
854 | A | 887 | GLU | -1 | -0.807 | -0.904 | 28.310 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
855 | A | 888 | GLN | 0 | -0.008 | -0.015 | 29.154 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
856 | A | 889 | LYS | 1 | 0.827 | 0.895 | 27.588 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
857 | A | 890 | ALA | 0 | 0.033 | 0.028 | 29.528 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
858 | A | 891 | GLY | 0 | 0.029 | 0.036 | 27.736 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
859 | A | 892 | GLU | -1 | -0.835 | -0.908 | 25.678 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
860 | A | 893 | VAL | 0 | -0.049 | -0.042 | 20.147 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
861 | A | 894 | ILE | 0 | -0.006 | 0.000 | 21.293 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
862 | A | 895 | ASN | 0 | 0.016 | 0.001 | 14.309 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
863 | A | 896 | GLN | 0 | 0.057 | 0.015 | 18.184 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
864 | A | 897 | PRO | 0 | 0.034 | 0.025 | 16.280 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
865 | A | 898 | MET | 0 | 0.016 | 0.010 | 15.052 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
866 | A | 899 | MET | 0 | -0.038 | -0.001 | 18.171 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
867 | A | 900 | MET | 0 | 0.014 | 0.014 | 21.537 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
868 | A | 901 | ALA | 0 | 0.003 | 0.012 | 19.053 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
869 | A | 902 | ALA | 0 | 0.017 | 0.008 | 21.133 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
870 | A | 903 | ARG | 1 | 0.842 | 0.905 | 23.065 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
871 | A | 904 | GLN | 0 | 0.009 | 0.008 | 23.719 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
872 | A | 905 | LEU | 0 | -0.053 | -0.026 | 22.702 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
873 | A | 906 | HIS | 0 | 0.052 | -0.001 | 25.548 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
874 | A | 907 | ASP | -1 | -0.849 | -0.934 | 28.349 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
875 | A | 908 | GLU | -1 | -0.885 | -0.917 | 28.603 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
876 | A | 909 | ALA | 0 | 0.024 | -0.006 | 29.581 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
877 | A | 910 | ARG | 1 | 0.831 | 0.905 | 31.384 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
878 | A | 911 | LYS | 1 | 0.806 | 0.902 | 32.437 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
879 | A | 912 | TRP | 0 | -0.025 | -0.007 | 33.824 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
880 | A | 913 | SER | 0 | 0.069 | 0.051 | 36.935 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
881 | A | 914 | SER | 0 | -0.008 | -0.038 | 34.994 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
882 | A | 915 | LYN | 0 | -0.014 | 0.007 | 36.768 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
883 | A | 916 | GLY | 0 | 0.042 | 0.032 | 40.151 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
884 | A | 917 | ASN | 0 | 0.002 | -0.003 | 34.815 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
885 | A | 918 | ASP | -1 | -0.812 | -0.913 | 33.455 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
886 | A | 919 | ILE | 0 | -0.001 | 0.011 | 29.495 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
887 | A | 920 | ILE | 0 | -0.018 | 0.005 | 30.147 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
888 | A | 921 | ALA | 0 | 0.010 | 0.009 | 31.345 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
889 | A | 922 | ALA | 0 | -0.014 | -0.012 | 27.550 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
890 | A | 923 | ALA | 0 | -0.012 | 0.001 | 26.804 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
891 | A | 924 | LYS | 1 | 0.842 | 0.880 | 27.168 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
892 | A | 925 | ARG | 1 | 0.820 | 0.902 | 28.188 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
893 | A | 926 | MET | 0 | 0.005 | 0.007 | 23.094 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
894 | A | 927 | ALA | 0 | -0.004 | 0.011 | 23.381 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
895 | A | 928 | LEU | 0 | 0.013 | 0.004 | 24.375 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
896 | A | 929 | LEU | 0 | -0.032 | -0.015 | 22.620 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
897 | A | 930 | MET | 0 | 0.035 | 0.014 | 16.274 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
898 | A | 931 | ALA | 0 | -0.018 | -0.010 | 20.420 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
899 | A | 932 | GLU | -1 | -0.919 | -0.941 | 22.543 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
900 | A | 933 | MET | 0 | 0.047 | 0.022 | 13.959 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
901 | A | 934 | SER | 0 | -0.078 | -0.047 | 17.619 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
902 | A | 935 | ARG | 1 | 0.915 | 0.950 | 19.339 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
903 | A | 936 | LEU | 0 | -0.002 | 0.007 | 17.988 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
904 | A | 937 | VAL | 0 | 0.014 | 0.013 | 12.758 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
905 | A | 938 | ARG | 1 | 0.882 | 0.945 | 14.238 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
906 | A | 939 | GLY | 0 | 0.043 | -0.001 | 15.885 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
907 | A | 940 | GLY | 0 | -0.002 | -0.002 | 16.959 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
908 | A | 941 | SER | 0 | 0.002 | 0.004 | 20.415 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
909 | A | 942 | GLY | 0 | 0.040 | 0.032 | 22.155 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
910 | A | 943 | THR | 0 | 0.022 | 0.000 | 17.582 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
911 | A | 944 | LYS | 1 | 0.808 | 0.909 | 16.269 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
912 | A | 945 | ARG | 1 | 0.807 | 0.908 | 17.755 | 0.205 | 0.205 | 0.000 | 0.000 | 0.000 | 0.000 |
913 | A | 946 | ALA | 0 | 0.021 | -0.001 | 20.460 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
914 | A | 947 | LEU | 0 | -0.020 | -0.007 | 13.740 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
915 | A | 948 | ILE | 0 | 0.017 | 0.000 | 15.836 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
916 | A | 949 | GLN | 0 | -0.025 | -0.008 | 17.781 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
917 | A | 950 | CYS | 0 | -0.009 | -0.002 | 18.752 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
918 | A | 951 | ALA | 0 | 0.028 | 0.018 | 15.919 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
919 | A | 952 | LYS | 1 | 0.820 | 0.903 | 17.907 | 0.227 | 0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
920 | A | 953 | ASP | -1 | -0.784 | -0.881 | 20.346 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
921 | A | 954 | ILE | 0 | -0.003 | 0.003 | 18.771 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
922 | A | 955 | ALA | 0 | -0.024 | -0.024 | 18.632 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
923 | A | 956 | LYS | 1 | 0.979 | 0.997 | 20.514 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
924 | A | 957 | ALA | 0 | -0.018 | -0.012 | 24.063 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
925 | A | 958 | SER | 0 | 0.004 | -0.024 | 19.684 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
926 | A | 959 | ASP | -1 | -0.915 | -0.962 | 22.598 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
927 | A | 960 | GLU | -1 | -0.904 | -0.932 | 24.544 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
928 | A | 961 | VAL | 0 | 0.037 | 0.010 | 24.882 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
929 | A | 962 | THR | 0 | 0.002 | 0.001 | 23.460 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
930 | A | 963 | ARG | 1 | 0.890 | 0.949 | 25.876 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
931 | A | 964 | LEU | 0 | -0.008 | -0.006 | 28.994 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
932 | A | 965 | ALA | 0 | 0.022 | 0.012 | 28.014 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
933 | A | 966 | LYS | 1 | 0.951 | 0.965 | 25.333 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
934 | A | 967 | GLU | -1 | -0.900 | -0.938 | 30.582 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
935 | A | 968 | VAL | 0 | 0.014 | 0.009 | 33.376 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
936 | A | 969 | ALA | 0 | -0.004 | 0.000 | 31.658 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
937 | A | 970 | LYS | 1 | 0.908 | 0.945 | 33.813 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
938 | A | 971 | GLN | 0 | -0.067 | -0.024 | 36.324 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
939 | A | 972 | CYS | 0 | -0.033 | 0.021 | 36.729 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
940 | A | 973 | THR | 0 | -0.038 | -0.030 | 38.643 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
941 | A | 974 | ASP | -1 | -0.778 | -0.894 | 38.224 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
942 | A | 975 | LYS | 1 | 0.879 | 0.922 | 36.865 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
943 | A | 976 | ARG | 1 | 0.800 | 0.919 | 34.297 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
944 | A | 977 | ILE | 0 | 0.035 | 0.020 | 33.077 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
945 | A | 978 | ARG | 1 | 0.805 | 0.880 | 32.150 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
946 | A | 979 | THR | 0 | -0.052 | -0.040 | 30.212 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
947 | A | 980 | ASN | 0 | -0.066 | -0.039 | 28.673 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
948 | A | 981 | LEU | 0 | -0.024 | -0.029 | 27.555 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
949 | A | 982 | LEU | 0 | -0.005 | -0.010 | 27.121 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
950 | A | 983 | GLN | 0 | -0.020 | 0.002 | 23.847 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
951 | A | 984 | VAL | 0 | -0.043 | -0.019 | 22.784 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
952 | A | 985 | CYS | 0 | -0.066 | -0.030 | 22.330 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
953 | A | 986 | GLU | -1 | -0.891 | -0.952 | 20.457 | 0.166 | 0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
954 | A | 987 | ARG | 1 | 0.920 | 0.967 | 17.982 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
955 | A | 988 | ILE | 0 | -0.036 | -0.008 | 17.337 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
956 | A | 989 | PRO | 0 | 0.009 | 0.014 | 17.754 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
957 | A | 990 | THR | 0 | 0.034 | 0.020 | 13.289 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
958 | A | 991 | ILE | 0 | -0.003 | -0.002 | 13.380 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
959 | A | 992 | SER | 0 | -0.011 | -0.009 | 13.685 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
960 | A | 993 | THR | 0 | -0.009 | -0.005 | 12.916 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
961 | A | 994 | GLN | 0 | 0.064 | 0.053 | 9.263 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
962 | A | 995 | LEU | 0 | -0.014 | 0.008 | 10.672 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
963 | A | 996 | LYS | 1 | 0.837 | 0.904 | 12.677 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
964 | A | 997 | ILE | 0 | 0.039 | 0.019 | 8.779 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
965 | A | 998 | LEU | 0 | -0.021 | -0.002 | 5.776 | -0.287 | -0.287 | 0.000 | 0.000 | 0.000 | 0.000 |
966 | A | 999 | SER | 0 | -0.066 | -0.035 | 8.819 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
967 | A | 1000 | THR | 0 | -0.030 | -0.033 | 11.664 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
968 | A | 1001 | VAL | 0 | 0.012 | 0.009 | 5.568 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
969 | A | 1002 | LYS | 1 | 0.879 | 0.934 | 9.075 | 0.382 | 0.382 | 0.000 | 0.000 | 0.000 | 0.000 |
970 | A | 1003 | ALA | 0 | -0.014 | -0.008 | 10.119 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
971 | A | 1004 | THR | 0 | -0.014 | -0.006 | 9.135 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
972 | A | 1005 | MET | 0 | -0.057 | -0.014 | 4.813 | 0.245 | 0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
973 | A | 1006 | LEU | 0 | -0.060 | -0.011 | 10.929 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
974 | A | 1007 | GLY | 0 | 0.031 | -0.018 | 13.815 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
975 | A | 1008 | ARG | 1 | 0.955 | 0.995 | 13.250 | 0.495 | 0.495 | 0.000 | 0.000 | 0.000 | 0.000 |
976 | A | 1009 | THR | 0 | 0.003 | 0.020 | 15.385 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
977 | A | 1010 | ASN | 0 | -0.093 | -0.061 | 16.135 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
978 | A | 1011 | ILE | 0 | 0.020 | 0.002 | 14.692 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
979 | A | 1012 | SER | 0 | -0.003 | 0.001 | 11.953 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
980 | A | 1013 | ASP | -1 | -0.878 | -0.919 | 8.554 | -0.472 | -0.472 | 0.000 | 0.000 | 0.000 | 0.000 |
981 | A | 1014 | GLU | -1 | -0.836 | -0.935 | 6.945 | 1.202 | 1.202 | 0.000 | 0.000 | 0.000 | 0.000 |
982 | A | 1015 | GLU | -1 | -0.848 | -0.897 | 2.364 | -6.568 | -5.343 | 2.156 | -1.489 | -1.892 | -0.019 |
983 | A | 1016 | SER | 0 | -0.037 | -0.053 | 4.842 | -0.159 | -0.095 | -0.001 | -0.001 | -0.061 | 0.000 |
984 | A | 1017 | GLU | -1 | -0.953 | -0.952 | 7.397 | 0.895 | 0.895 | 0.000 | 0.000 | 0.000 | 0.000 |
985 | A | 1018 | GLN | 0 | 0.104 | 0.029 | 2.161 | -4.634 | -4.083 | 7.214 | -3.458 | -4.307 | -0.026 |
986 | A | 1019 | ALA | 0 | 0.036 | 0.027 | 4.265 | -0.203 | -0.070 | -0.001 | -0.017 | -0.114 | 0.000 |
987 | A | 1020 | THR | 0 | -0.083 | -0.059 | 4.944 | -0.006 | -0.001 | -0.001 | -0.002 | -0.002 | 0.000 |
988 | A | 1021 | GLU | -1 | -0.906 | -0.949 | 7.327 | 1.785 | 1.785 | 0.000 | 0.000 | 0.000 | 0.000 |
989 | A | 1022 | MET | 0 | -0.061 | -0.039 | 2.783 | -1.534 | -0.783 | 2.083 | -0.763 | -2.072 | 0.000 |
990 | A | 1023 | LEU | 0 | -0.035 | -0.011 | 7.003 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
991 | A | 1024 | VAL | 0 | -0.003 | -0.007 | 9.584 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
992 | A | 1025 | HIS | 1 | 0.922 | 0.974 | 9.416 | -1.011 | -1.011 | 0.000 | 0.000 | 0.000 | 0.000 |
993 | A | 1026 | ASN | 0 | 0.035 | -0.002 | 8.837 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
994 | A | 1027 | ALA | 0 | 0.009 | 0.007 | 11.836 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
995 | A | 1028 | GLN | 0 | -0.025 | -0.013 | 14.225 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
996 | A | 1029 | ASN | 0 | 0.010 | -0.006 | 11.713 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
997 | A | 1030 | LEU | 0 | -0.003 | 0.017 | 15.835 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
998 | A | 1031 | MET | 0 | 0.015 | 0.015 | 17.641 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
999 | A | 1032 | GLN | 0 | -0.009 | 0.019 | 19.324 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1000 | A | 1033 | SER | 0 | 0.012 | -0.013 | 18.669 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1001 | A | 1034 | VAL | 0 | 0.040 | 0.026 | 21.388 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
1002 | A | 1035 | LYS | 1 | 0.856 | 0.917 | 22.678 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
1003 | A | 1036 | GLU | -1 | -0.858 | -0.925 | 23.001 | 0.231 | 0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
1004 | A | 1037 | THR | 0 | 0.001 | -0.009 | 24.543 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1005 | A | 1038 | VAL | 0 | -0.015 | -0.011 | 27.153 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
1006 | A | 1039 | ARG | 1 | 0.893 | 0.941 | 29.048 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
1007 | A | 1040 | GLU | -1 | -0.815 | -0.914 | 29.548 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
1008 | A | 1041 | ALA | 0 | -0.040 | -0.015 | 31.156 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
1009 | A | 1042 | GLU | -1 | -0.837 | -0.932 | 32.710 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
1010 | A | 1043 | ALA | 0 | 0.019 | 0.038 | 34.279 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1011 | A | 1044 | ALA | 0 | -0.013 | -0.022 | 34.842 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1012 | A | 1045 | SER | 0 | -0.068 | -0.050 | 36.717 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
1013 | A | 1046 | ILE | 0 | 0.033 | 0.017 | 38.949 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
1014 | A | 1047 | LYS | 1 | 0.844 | 0.916 | 39.849 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
1015 | A | 1048 | ILE | 0 | 0.015 | 0.040 | 39.602 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1016 | A | 1049 | ARG | 1 | 0.845 | 0.867 | 42.323 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
1017 | A | 1050 | THR | 0 | -0.043 | -0.011 | 45.835 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1018 | A | 1051 | ASP | -1 | -0.972 | -0.988 | 45.549 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
1019 | A | 1052 | ALA | 0 | 0.034 | 0.033 | 43.312 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1020 | A | 1053 | GLY | 0 | 0.034 | 0.015 | 41.807 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1021 | A | 1054 | PHE | 0 | -0.040 | -0.031 | 42.142 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1022 | A | 1055 | THR | 0 | 0.063 | 0.037 | 39.643 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1023 | A | 1056 | LEU | 0 | -0.046 | -0.003 | 34.424 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
1024 | A | 1057 | ARG | 1 | 0.905 | 0.916 | 38.787 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1025 | A | 1058 | TRP | 0 | 0.039 | 0.022 | 32.961 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1026 | A | 1059 | VAL | 0 | 0.018 | 0.006 | 39.747 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1027 | A | 1060 | ARG | 1 | 0.866 | 0.942 | 37.244 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
1028 | A | 1061 | LYS | 1 | 0.773 | 0.872 | 37.779 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |