FMODB ID: 1JL3Z
Calculation Name: 7BV2-ABCPT-EM123
Preferred Name:
Target Type:
Ligand Name: [(2~{r},3~{s},4~{r},5~{r})-5-(4-azanylpyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
ligand 3-letter code: F86
PDB ID: 7BV2
Chain ID: ABCPT
UniProt ID: P0DTD1
Base Structure: ElectronMicroscopy
Registration Date: 2020-05-27
Reference: Kato, Koichiro; Honma, Teruki; Fukuzawa, Kaori (2020): Intermolecular interaction among Remdesivir, RNA and RNA-Dependent RNA polymerase of SARS-CoV-2 analyzed by fragment molecular orbital calculation. J. Mol. Graph. Model. 100 (2020) 107695-107699.
DOI: 10.1016/j.jmgm.2020.107695
Modeling method
Optimization | MOE:Amber14:EHT |
---|---|
Restraint | OptHLMainSide |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Manual calculation |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Manual |
Number of fragment | 1057 |
LigandCharge | |
Software | ABINIT-MP - Open Ver.1 Rev. 15 / 20190524 |
Total energy (hartree)
FMO2-HF: Electronic energy | -36009241.971836 |
---|---|
FMO2-HF: Nuclear repulsion | 35564750.500303 |
FMO2-HF: Total energy | -444491.471534 |
FMO2-MP2: Total energy | -445740.905009 |
3D Structure
Ligand structure
F86
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. |
-102.993 | -89.141 | 52.515 | -22.015 | -44.353 | -0.002 |
Interactive mode: IFIE and PIEDA for fragment #1057(P:101:F86 )
Summations of interaction energy for
fragment #1057(P:101:F86 )
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. |
-102.993 | -89.141 | 52.515 | -22.015 | -44.353 | 0.002 |
Interaction energy analysis for fragmet #1057(P:101:F86 )
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]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1 | A | 31 | VAL | 0 | 0.024 | 0.011 | 41.474 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
2 | A | 32 | TYR | 0 | -0.022 | -0.033 | 37.740 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
3 | A | 33 | ARG | 1 | 0.824 | 0.912 | 37.764 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
4 | A | 34 | ALA | 0 | 0.004 | 0.016 | 33.810 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | 35 | PHE | 0 | -0.025 | -0.024 | 35.622 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 36 | ASP | -1 | -0.821 | -0.855 | 34.311 | 0.140 | 0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 37 | ILE | 0 | -0.044 | -0.021 | 35.823 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 38 | TYR | 0 | 0.031 | 0.003 | 36.855 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 39 | ASN | 0 | 0.027 | 0.024 | 39.134 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 40 | ASP | -1 | -0.865 | -0.932 | 41.477 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 41 | LYS | 1 | 0.785 | 0.873 | 42.553 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 42 | VAL | 0 | -0.009 | -0.007 | 38.053 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 43 | ALA | 0 | 0.042 | 0.036 | 35.867 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 44 | GLY | 0 | 0.031 | 0.026 | 32.577 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 45 | PHE | 0 | -0.012 | -0.005 | 29.028 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 46 | ALA | 0 | 0.044 | 0.026 | 30.908 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 47 | LYS | 1 | 0.928 | 0.977 | 32.493 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 48 | PHE | 0 | 0.003 | 0.006 | 35.422 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 49 | LEU | 0 | -0.027 | -0.012 | 39.108 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 50 | LYS | 1 | 0.932 | 0.979 | 42.275 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 84 | GLU | -1 | -0.727 | -0.845 | 53.632 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 85 | THR | 0 | -0.144 | -0.116 | 55.593 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 86 | ILE | 0 | 0.015 | 0.014 | 51.373 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 87 | TYR | 0 | 0.007 | 0.011 | 52.267 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 88 | ASN | 0 | -0.071 | -0.055 | 54.385 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 89 | LEU | 0 | -0.047 | -0.017 | 54.894 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 90 | LEU | 0 | 0.067 | 0.049 | 49.272 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 91 | LYS | 1 | 0.835 | 0.927 | 51.838 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 92 | ASP | -1 | -0.904 | -0.954 | 53.418 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 93 | CYS | 0 | 0.019 | 0.027 | 47.863 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 94 | PRO | 0 | -0.049 | -0.025 | 48.538 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 95 | ALA | 0 | 0.010 | 0.000 | 44.420 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 96 | VAL | 0 | 0.000 | 0.019 | 45.635 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 97 | ALA | 0 | -0.010 | 0.002 | 47.426 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 98 | LYS | 1 | 0.822 | 0.889 | 49.210 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 99 | HIS | 0 | 0.016 | 0.006 | 49.553 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 100 | ASP | -1 | -0.851 | -0.909 | 54.396 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 118 | ARG | 1 | 0.888 | 0.927 | 49.242 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 119 | LEU | 0 | -0.027 | -0.008 | 45.322 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 120 | THR | 0 | -0.031 | -0.028 | 41.345 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 121 | LYS | 1 | 0.804 | 0.881 | 40.737 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 122 | TYR | 0 | -0.064 | -0.062 | 37.049 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 123 | THR | 0 | 0.030 | 0.023 | 37.723 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 124 | MET | 0 | 0.022 | 0.003 | 33.297 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 125 | ALA | 0 | 0.034 | 0.029 | 33.178 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 126 | ASP | -1 | -0.819 | -0.929 | 32.671 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 127 | LEU | 0 | -0.015 | -0.001 | 30.018 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 128 | VAL | 0 | 0.023 | 0.008 | 28.195 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 129 | TYR | 0 | -0.001 | -0.010 | 27.787 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 130 | ALA | 0 | -0.052 | -0.033 | 27.905 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 131 | LEU | 0 | -0.013 | -0.004 | 24.810 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 132 | ARG | 1 | 0.780 | 0.889 | 23.331 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 133 | HIS | 0 | -0.052 | -0.021 | 23.697 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 134 | PHE | 0 | -0.019 | 0.006 | 21.901 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 135 | ASP | -1 | -0.780 | -0.898 | 23.338 | -0.357 | -0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 136 | GLU | -1 | -0.812 | -0.897 | 22.721 | -0.455 | -0.455 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 137 | GLY | 0 | -0.055 | -0.033 | 25.775 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 138 | ASN | 0 | -0.096 | -0.045 | 28.550 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 139 | CYS | 0 | 0.027 | 0.028 | 27.485 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 140 | ASP | -1 | -0.817 | -0.908 | 30.069 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 141 | THR | 0 | -0.035 | -0.023 | 32.944 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 142 | LEU | 0 | 0.034 | 0.021 | 26.764 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 143 | LYS | 1 | 0.870 | 0.932 | 30.962 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 144 | GLU | -1 | -0.753 | -0.827 | 32.828 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 145 | ILE | 0 | -0.030 | -0.005 | 33.301 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 146 | LEU | 0 | 0.002 | -0.001 | 28.787 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 147 | VAL | 0 | 0.022 | 0.018 | 33.400 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 148 | THR | 0 | -0.101 | -0.062 | 36.635 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 149 | TYR | 0 | -0.071 | -0.048 | 36.072 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 150 | ASN | 0 | -0.055 | -0.020 | 36.808 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 151 | CYS | 0 | -0.033 | -0.003 | 31.690 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 152 | CYS | 0 | -0.057 | -0.030 | 31.682 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 153 | ASP | -1 | -0.861 | -0.926 | 33.812 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 154 | ASP | -1 | -0.913 | -0.975 | 34.561 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 155 | ASP | -1 | -0.934 | -0.959 | 34.835 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 156 | TYR | 0 | -0.027 | -0.046 | 27.233 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 157 | PHE | 0 | -0.015 | -0.027 | 29.891 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 158 | ASN | 0 | -0.064 | -0.033 | 31.021 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 159 | LYS | 1 | 0.798 | 0.913 | 26.695 | 0.186 | 0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 160 | LYS | 1 | 0.883 | 0.925 | 23.229 | 0.535 | 0.535 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 161 | ASP | -1 | -0.817 | -0.920 | 21.465 | -0.533 | -0.533 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 162 | TRP | 0 | -0.026 | 0.001 | 22.837 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 163 | TYR | 0 | 0.047 | 0.021 | 21.441 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 164 | ASP | -1 | -0.871 | -0.921 | 17.738 | -0.607 | -0.607 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 165 | PHE | 0 | 0.003 | 0.000 | 16.135 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 166 | VAL | 0 | -0.031 | -0.017 | 12.951 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 167 | GLU | -1 | -0.868 | -0.944 | 15.921 | -0.745 | -0.745 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 168 | ASN | 0 | 0.016 | 0.009 | 18.860 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 169 | PRO | 0 | 0.113 | 0.051 | 18.750 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 170 | ASP | -1 | -0.815 | -0.852 | 20.707 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 171 | ILE | 0 | 0.047 | 0.041 | 21.737 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 172 | LEU | 0 | 0.052 | 0.025 | 18.830 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 173 | ARG | 1 | 0.756 | 0.864 | 23.404 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 174 | VAL | 0 | 0.022 | 0.014 | 26.895 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 175 | TYR | 0 | 0.016 | -0.026 | 22.625 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 176 | ALA | 0 | 0.003 | 0.005 | 26.674 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 177 | ASN | 0 | -0.073 | -0.026 | 28.245 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 178 | LEU | 0 | 0.032 | 0.009 | 29.367 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 179 | GLY | 0 | 0.041 | 0.029 | 30.443 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 180 | GLU | -1 | -0.825 | -0.904 | 31.073 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 181 | ARG | 1 | 0.854 | 0.910 | 34.632 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 182 | VAL | 0 | 0.016 | 0.007 | 30.353 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 183 | ARG | 1 | 0.836 | 0.907 | 33.507 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 184 | GLN | 0 | -0.046 | -0.044 | 34.635 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 185 | ALA | 0 | -0.010 | 0.000 | 35.889 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 186 | LEU | 0 | 0.025 | 0.026 | 31.819 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 187 | LEU | 0 | 0.002 | 0.005 | 36.438 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 188 | LYS | 1 | 0.864 | 0.923 | 39.523 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 189 | THR | 0 | 0.002 | -0.003 | 37.799 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 190 | VAL | 0 | 0.039 | 0.038 | 38.520 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 191 | GLN | 0 | -0.028 | -0.025 | 41.172 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 192 | PHE | 0 | -0.013 | -0.015 | 43.282 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 193 | CYS | 0 | 0.011 | 0.008 | 41.483 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 194 | ASP | -1 | -0.789 | -0.858 | 44.178 | 0.166 | 0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 195 | ALA | 0 | -0.027 | -0.007 | 46.747 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 196 | MET | 0 | 0.008 | 0.008 | 44.717 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 197 | ARG | 1 | 0.830 | 0.908 | 46.732 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 198 | ASN | 0 | 0.003 | -0.005 | 49.055 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 199 | ALA | 0 | 0.006 | -0.008 | 52.066 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 200 | GLY | 0 | -0.003 | 0.021 | 52.381 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 201 | ILE | 0 | -0.050 | -0.016 | 48.443 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 202 | VAL | 0 | -0.001 | 0.005 | 46.529 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 203 | GLY | 0 | 0.024 | 0.006 | 45.565 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 204 | VAL | 0 | -0.007 | 0.007 | 39.376 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 205 | LEU | 0 | -0.039 | -0.005 | 39.095 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 206 | THR | 0 | 0.039 | 0.012 | 37.349 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 207 | LEU | 0 | 0.031 | 0.006 | 31.863 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 208 | ASP | -1 | -0.833 | -0.924 | 36.259 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 209 | ASN | 0 | -0.010 | 0.002 | 38.628 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 210 | GLN | 0 | 0.025 | 0.022 | 37.832 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 211 | ASP | -1 | -0.766 | -0.875 | 39.289 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 212 | LEU | 0 | 0.044 | 0.031 | 35.115 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 213 | ASN | 0 | -0.071 | -0.016 | 38.794 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 214 | GLY | 0 | 0.040 | 0.014 | 39.721 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 215 | ASN | 0 | -0.058 | -0.015 | 40.584 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 216 | TRP | 0 | 0.062 | 0.032 | 38.874 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 217 | TYR | 0 | -0.109 | -0.093 | 41.820 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 218 | ASP | -1 | -0.886 | -0.928 | 45.468 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 219 | PHE | 0 | -0.009 | -0.003 | 46.614 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 220 | GLY | 0 | 0.021 | 0.000 | 48.381 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 221 | ASP | -1 | -0.918 | -0.964 | 45.662 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 222 | PHE | 0 | -0.046 | -0.017 | 45.062 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 223 | ILE | 0 | 0.015 | 0.017 | 49.329 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 224 | GLN | 0 | 0.004 | 0.000 | 51.779 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 225 | THR | 0 | -0.069 | -0.047 | 52.175 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 226 | THR | 0 | -0.008 | -0.017 | 55.049 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 227 | PRO | 0 | -0.012 | 0.006 | 54.738 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 228 | GLY | 0 | -0.014 | -0.006 | 53.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 229 | SER | 0 | -0.052 | -0.033 | 51.015 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 230 | GLY | 0 | -0.005 | 0.014 | 49.555 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 231 | VAL | 0 | -0.036 | -0.029 | 43.963 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 232 | PRO | 0 | 0.007 | 0.008 | 42.235 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 233 | VAL | 0 | 0.021 | 0.006 | 38.768 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 234 | VAL | 0 | 0.019 | -0.012 | 36.487 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 235 | ASP | -1 | -0.757 | -0.851 | 33.318 | 0.311 | 0.311 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 236 | SER | 0 | -0.014 | -0.036 | 32.279 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 237 | TYR | 0 | -0.038 | -0.029 | 31.970 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 238 | TYR | 0 | -0.004 | -0.033 | 31.458 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 239 | SER | 0 | 0.002 | -0.020 | 27.352 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 240 | LEU | 0 | -0.046 | -0.023 | 27.144 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 241 | LEU | 0 | -0.003 | -0.007 | 27.712 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 242 | MET | 0 | -0.030 | -0.005 | 25.126 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 243 | PRO | 0 | 0.030 | 0.030 | 21.885 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 244 | ILE | 0 | 0.010 | -0.005 | 23.065 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 245 | LEU | 0 | -0.029 | 0.009 | 25.565 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 246 | THR | 0 | 0.033 | 0.020 | 21.485 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 247 | LEU | 0 | -0.015 | 0.007 | 20.719 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 248 | THR | 0 | -0.054 | -0.046 | 23.088 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 249 | ARG | 1 | 0.912 | 0.951 | 23.566 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 250 | ALA | 0 | 0.044 | 0.037 | 26.666 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 251 | LEU | 0 | 0.004 | -0.001 | 29.080 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 252 | THR | 0 | 0.007 | -0.007 | 29.106 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 253 | ALA | 0 | 0.025 | 0.005 | 30.703 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 254 | GLU | -1 | -0.801 | -0.866 | 32.579 | 0.215 | 0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 255 | SER | 0 | -0.013 | 0.009 | 30.977 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 256 | HIS | 0 | -0.055 | -0.030 | 33.438 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 257 | VAL | 0 | -0.016 | -0.012 | 36.902 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 258 | ASP | -1 | -0.867 | -0.925 | 40.467 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 259 | THR | 0 | -0.093 | -0.034 | 37.647 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 260 | ASP | -1 | -0.827 | -0.928 | 38.883 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 261 | LEU | 0 | 0.047 | 0.015 | 34.294 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 262 | THR | 0 | -0.087 | -0.030 | 37.931 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 263 | LYS | 1 | 0.790 | 0.897 | 39.982 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 264 | PRO | 0 | 0.003 | 0.005 | 38.868 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 265 | TYR | 0 | 0.039 | 0.011 | 32.389 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 266 | ILE | 0 | -0.019 | -0.006 | 35.673 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 267 | LYS | 1 | 0.883 | 0.947 | 35.357 | -0.210 | -0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 268 | TRP | 0 | 0.038 | 0.004 | 33.192 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 269 | ASP | -1 | -0.855 | -0.936 | 35.965 | 0.279 | 0.279 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 270 | LEU | 0 | -0.036 | -0.019 | 32.813 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 271 | LEU | 0 | 0.000 | 0.002 | 32.589 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 272 | LYS | 1 | 0.748 | 0.883 | 33.631 | -0.307 | -0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 273 | TYR | 0 | -0.012 | -0.049 | 29.587 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 274 | ASP | -1 | -0.849 | -0.877 | 29.699 | 0.424 | 0.424 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 275 | PHE | 0 | 0.011 | -0.019 | 30.269 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 276 | THR | 0 | 0.041 | 0.022 | 32.380 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 277 | GLU | -1 | -0.825 | -0.928 | 33.298 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 278 | GLU | -1 | -0.871 | -0.926 | 33.467 | 0.299 | 0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 279 | ARG | 1 | 0.825 | 0.914 | 25.607 | -0.555 | -0.555 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 280 | LEU | 0 | 0.029 | 0.020 | 32.258 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 281 | LYS | 1 | 0.793 | 0.900 | 35.249 | -0.284 | -0.284 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 282 | LEU | 0 | -0.011 | -0.002 | 31.018 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 283 | PHE | 0 | 0.044 | 0.024 | 31.651 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 284 | ASP | -1 | -0.861 | -0.931 | 34.253 | 0.231 | 0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 285 | ARG | 1 | 0.824 | 0.917 | 36.910 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 286 | TYR | 0 | -0.068 | -0.072 | 33.867 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 287 | PHE | 0 | 0.012 | 0.006 | 29.971 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 288 | LYS | 1 | 0.857 | 0.945 | 35.333 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 289 | TYR | 0 | -0.026 | -0.059 | 38.351 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 290 | TRP | 0 | -0.078 | -0.044 | 29.928 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 291 | ASP | -1 | -0.853 | -0.913 | 35.843 | 0.294 | 0.294 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 292 | GLN | 0 | 0.016 | 0.035 | 29.677 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 293 | THR | 0 | -0.014 | -0.025 | 33.870 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 294 | TYR | 0 | -0.022 | -0.029 | 27.979 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 295 | HIS | 0 | -0.042 | -0.045 | 29.221 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 296 | PRO | 0 | -0.078 | -0.048 | 28.728 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 297 | ASN | 0 | -0.036 | -0.012 | 27.830 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 298 | CYS | 0 | 0.000 | -0.005 | 24.637 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 299 | VAL | 0 | -0.060 | -0.017 | 26.747 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 300 | ASN | 0 | -0.150 | -0.092 | 28.272 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 301 | CYS | -1 | -0.666 | -0.801 | 27.287 | 0.624 | 0.624 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 302 | LEU | 0 | -0.102 | -0.063 | 29.428 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 303 | ASP | -1 | -0.834 | -0.933 | 27.341 | 0.684 | 0.684 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 304 | ASP | -1 | -0.817 | -0.892 | 22.064 | 0.982 | 0.982 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 305 | ARG | 1 | 0.822 | 0.882 | 23.339 | -0.573 | -0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 306 | CYS | -1 | -0.864 | -0.925 | 25.571 | 0.572 | 0.572 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 307 | ILE | 0 | 0.085 | 0.035 | 21.650 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 308 | LEU | 0 | -0.034 | -0.028 | 18.823 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 309 | HIS | 0 | -0.072 | -0.067 | 22.521 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 310 | CYS | -1 | -0.656 | -0.748 | 25.805 | 0.543 | 0.543 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 311 | ALA | 0 | 0.010 | -0.012 | 20.837 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 312 | ASN | 0 | 0.011 | -0.004 | 22.085 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 313 | PHE | 0 | -0.019 | -0.015 | 23.074 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 314 | ASN | 0 | -0.009 | 0.016 | 24.005 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 315 | VAL | 0 | 0.009 | 0.012 | 19.455 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 316 | LEU | 0 | 0.009 | 0.008 | 22.264 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 317 | PHE | 0 | 0.001 | -0.001 | 25.140 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 318 | SER | 0 | -0.034 | -0.039 | 23.261 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 319 | THR | 0 | -0.096 | -0.057 | 22.940 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 320 | VAL | 0 | -0.015 | 0.008 | 25.286 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 321 | PHE | 0 | 0.013 | -0.001 | 27.633 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 322 | PRO | 0 | 0.022 | 0.018 | 27.120 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 323 | PRO | 0 | 0.026 | -0.011 | 23.364 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 324 | THR | 0 | -0.010 | -0.003 | 24.412 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 325 | SER | 0 | -0.035 | -0.020 | 26.876 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 326 | PHE | 0 | -0.017 | 0.011 | 22.346 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 327 | GLY | 0 | 0.032 | 0.023 | 21.480 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 328 | PRO | 0 | 0.013 | 0.004 | 21.652 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 329 | LEU | 0 | -0.044 | -0.018 | 24.384 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 330 | VAL | 0 | -0.020 | -0.019 | 27.841 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 331 | ARG | 1 | 0.966 | 0.980 | 30.320 | -0.462 | -0.462 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 332 | LYS | 1 | 0.795 | 0.890 | 33.376 | -0.297 | -0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 333 | ILE | 0 | -0.017 | 0.004 | 33.151 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 334 | PHE | 0 | 0.003 | 0.000 | 36.286 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 335 | VAL | 0 | 0.015 | 0.015 | 35.225 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 336 | ASP | -1 | -0.771 | -0.844 | 38.081 | 0.273 | 0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 337 | GLY | 0 | -0.026 | -0.003 | 41.492 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 338 | VAL | 0 | -0.017 | -0.005 | 37.733 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 339 | PRO | 0 | -0.007 | -0.001 | 37.948 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 340 | PHE | 0 | -0.018 | -0.017 | 32.224 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 341 | VAL | 0 | -0.009 | -0.021 | 30.618 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 342 | VAL | 0 | 0.011 | 0.004 | 28.886 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 343 | SER | 0 | 0.047 | 0.012 | 25.769 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 344 | THR | 0 | -0.061 | -0.038 | 27.791 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 345 | GLY | 0 | 0.050 | 0.024 | 27.420 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 346 | TYR | 0 | -0.026 | -0.004 | 18.554 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 347 | HIS | 0 | -0.004 | 0.012 | 24.487 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 348 | PHE | 0 | 0.031 | 0.006 | 18.729 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 349 | ARG | 1 | 0.918 | 0.972 | 19.016 | -0.721 | -0.721 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 350 | GLU | -1 | -0.806 | -0.884 | 17.293 | 0.972 | 0.972 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 351 | LEU | 0 | 0.073 | 0.008 | 19.586 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 352 | GLY | 0 | 0.046 | 0.049 | 23.038 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 353 | VAL | 0 | -0.054 | -0.045 | 25.076 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 354 | VAL | 0 | 0.021 | 0.018 | 24.380 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 355 | HIS | 0 | 0.001 | -0.007 | 27.262 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 356 | ASN | 0 | -0.005 | 0.012 | 26.293 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 357 | GLN | 0 | 0.006 | 0.009 | 29.770 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 358 | ASP | -1 | -0.853 | -0.866 | 30.751 | 0.537 | 0.537 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 359 | VAL | 0 | -0.009 | -0.012 | 31.508 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 360 | ASN | 0 | -0.005 | -0.016 | 33.735 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 361 | LEU | 0 | 0.021 | 0.009 | 36.062 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 362 | HIS | 0 | -0.014 | -0.007 | 38.452 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 363 | SER | 0 | -0.027 | -0.012 | 36.460 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 364 | SER | 0 | -0.034 | -0.067 | 38.357 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 365 | ARG | 1 | 0.780 | 0.864 | 37.649 | -0.274 | -0.274 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 366 | LEU | 0 | 0.019 | 0.026 | 31.149 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 367 | SER | 0 | 0.048 | 0.028 | 31.533 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 368 | PHE | 0 | -0.009 | -0.010 | 24.864 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 369 | LYS | 1 | 0.986 | 0.992 | 26.094 | -0.566 | -0.566 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 370 | GLU | -1 | -0.846 | -0.926 | 26.184 | 0.535 | 0.535 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 371 | LEU | 0 | -0.052 | -0.026 | 27.645 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 372 | LEU | 0 | 0.033 | 0.014 | 20.777 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 373 | VAL | 0 | 0.010 | 0.001 | 22.774 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 374 | TYR | 0 | -0.013 | -0.030 | 23.825 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 375 | ALA | 0 | -0.025 | -0.004 | 23.644 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 376 | ALA | 0 | 0.014 | 0.007 | 19.398 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 377 | ASP | -1 | -0.781 | -0.878 | 20.338 | 0.748 | 0.748 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 378 | PRO | 0 | 0.011 | -0.008 | 20.066 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 379 | ALA | 0 | -0.021 | -0.004 | 22.744 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 380 | MET | 0 | 0.003 | 0.005 | 26.540 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 381 | HIS | 0 | -0.030 | -0.003 | 22.924 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 382 | ALA | 0 | 0.019 | -0.003 | 24.639 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 383 | ALA | 0 | -0.035 | -0.018 | 26.434 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 384 | SER | 0 | -0.087 | -0.058 | 29.032 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 385 | GLY | 0 | 0.041 | 0.039 | 28.263 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 386 | ASN | 0 | -0.114 | -0.069 | 29.095 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 387 | LEU | 0 | 0.033 | 0.030 | 28.765 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 388 | LEU | 0 | 0.004 | 0.001 | 23.496 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 389 | LEU | 0 | -0.035 | -0.016 | 27.167 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 390 | ASP | -1 | -0.721 | -0.826 | 22.464 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 391 | LYS | 1 | 0.902 | 0.950 | 24.882 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 392 | ARG | 1 | 0.848 | 0.899 | 21.773 | -0.218 | -0.218 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 393 | THR | 0 | -0.040 | -0.030 | 17.891 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 394 | THR | 0 | -0.059 | -0.039 | 18.678 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 395 | CYS | 0 | -0.012 | 0.012 | 16.352 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 396 | PHE | 0 | -0.010 | -0.008 | 18.969 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 397 | SER | 0 | 0.011 | 0.000 | 20.228 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 398 | VAL | 0 | -0.039 | -0.015 | 21.292 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 399 | ALA | 0 | -0.001 | -0.017 | 23.815 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 400 | ALA | 0 | 0.004 | 0.020 | 24.173 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 401 | LEU | 0 | 0.010 | -0.003 | 22.449 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 402 | THR | 0 | -0.027 | -0.011 | 25.039 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 403 | ASN | 0 | -0.047 | -0.032 | 27.379 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 404 | ASN | 0 | 0.002 | -0.006 | 28.186 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 405 | VAL | 0 | 0.001 | 0.015 | 23.917 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 406 | ALA | 0 | -0.011 | -0.002 | 21.507 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 407 | PHE | 0 | -0.011 | -0.013 | 21.315 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 408 | GLN | 0 | 0.007 | 0.009 | 14.427 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 409 | THR | 0 | -0.025 | -0.028 | 18.122 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 410 | VAL | 0 | 0.001 | 0.006 | 13.643 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 411 | LYS | 1 | 0.996 | 1.002 | 16.475 | 0.394 | 0.394 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 412 | PRO | 0 | 0.032 | 0.008 | 16.968 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 413 | GLY | 0 | 0.051 | 0.047 | 17.192 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 414 | ASN | 0 | -0.014 | -0.023 | 17.707 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 415 | PHE | 0 | -0.009 | -0.026 | 19.910 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 416 | ASN | 0 | 0.048 | 0.032 | 21.808 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 417 | LYS | 1 | 0.816 | 0.877 | 23.685 | 0.468 | 0.468 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 418 | ASP | -1 | -0.878 | -0.931 | 27.192 | -0.499 | -0.499 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 419 | PHE | 0 | 0.024 | 0.014 | 22.533 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 420 | TYR | 0 | 0.024 | 0.020 | 25.249 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 421 | ASP | -1 | -0.802 | -0.893 | 26.918 | -0.473 | -0.473 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 422 | PHE | 0 | -0.010 | 0.007 | 28.822 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 423 | ALA | 0 | 0.062 | 0.021 | 26.857 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 424 | VAL | 0 | 0.003 | 0.002 | 28.979 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 425 | SER | 0 | -0.122 | -0.067 | 31.351 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 426 | LYS | 1 | 0.831 | 0.921 | 31.089 | 0.496 | 0.496 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 427 | GLY | 0 | -0.091 | -0.037 | 33.056 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 428 | PHE | 0 | 0.079 | 0.035 | 26.514 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 429 | PHE | 0 | 0.013 | -0.004 | 23.785 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 430 | LYS | 1 | 0.858 | 0.953 | 28.874 | 0.529 | 0.529 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 431 | GLU | -1 | -0.881 | -0.961 | 30.943 | -0.592 | -0.592 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 432 | GLY | 0 | -0.045 | -0.023 | 31.764 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 433 | SER | 0 | -0.073 | -0.043 | 28.896 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 434 | SER | 0 | -0.081 | -0.081 | 26.752 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 435 | VAL | 0 | -0.047 | -0.015 | 23.064 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 436 | GLU | -1 | -0.862 | -0.947 | 23.499 | -0.800 | -0.800 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 437 | LEU | 0 | -0.048 | -0.010 | 20.134 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 438 | LYS | 1 | 0.884 | 0.938 | 18.131 | 1.200 | 1.200 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 439 | HIS | 0 | -0.012 | 0.003 | 12.616 | -0.222 | -0.222 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 440 | PHE | 0 | 0.006 | -0.008 | 14.847 | 0.169 | 0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 441 | PHE | 0 | 0.036 | 0.028 | 11.702 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 442 | PHE | 0 | -0.061 | -0.031 | 14.120 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 443 | ALA | 0 | 0.017 | 0.019 | 15.306 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 444 | GLN | 0 | 0.010 | -0.017 | 14.729 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 445 | ASP | -1 | -0.840 | -0.920 | 18.136 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 446 | GLY | 0 | 0.059 | 0.016 | 19.466 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 447 | ASN | 0 | -0.048 | -0.042 | 20.572 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 448 | ALA | 0 | 0.009 | 0.016 | 15.833 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 449 | ALA | 0 | 0.068 | 0.025 | 14.355 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 450 | ILE | 0 | -0.026 | -0.019 | 14.522 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 451 | SER | 0 | -0.003 | -0.005 | 15.820 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 452 | ASP | -1 | -0.786 | -0.861 | 9.344 | 0.219 | 0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 453 | TYR | 0 | 0.009 | 0.009 | 11.143 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 454 | ASP | -1 | -0.721 | -0.833 | 12.718 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 455 | TYR | 0 | -0.048 | -0.010 | 10.029 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 456 | TYR | 0 | 0.023 | 0.001 | 6.945 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 457 | ARG | 1 | 0.826 | 0.907 | 11.851 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 458 | TYR | 0 | -0.059 | -0.030 | 11.124 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 459 | ASN | 0 | -0.051 | -0.016 | 10.172 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 460 | LEU | 0 | -0.007 | -0.007 | 12.896 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 461 | PRO | 0 | -0.027 | 0.003 | 16.106 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 462 | THR | 0 | 0.014 | -0.008 | 16.443 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 463 | MET | 0 | -0.051 | -0.005 | 18.593 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 464 | CYS | 0 | 0.013 | 0.001 | 18.582 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 465 | ASP | -1 | -0.681 | -0.805 | 21.194 | 0.278 | 0.278 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 466 | ILE | 0 | 0.012 | 0.000 | 23.382 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 467 | ARG | 1 | 0.819 | 0.889 | 24.999 | -0.349 | -0.349 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 468 | GLN | 0 | 0.013 | -0.003 | 22.233 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 469 | LEU | 0 | 0.009 | -0.003 | 18.116 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 470 | LEU | 0 | -0.007 | -0.003 | 21.722 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 471 | PHE | 0 | 0.026 | 0.023 | 24.407 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 472 | VAL | 0 | -0.012 | -0.020 | 18.443 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 473 | VAL | 0 | 0.035 | 0.016 | 18.814 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 474 | GLU | -1 | -0.763 | -0.841 | 20.494 | 0.817 | 0.817 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 475 | VAL | 0 | -0.056 | -0.029 | 21.443 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 476 | VAL | 0 | -0.025 | -0.012 | 15.912 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 477 | ASP | -1 | -0.790 | -0.890 | 18.271 | 1.172 | 1.172 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 478 | LYS | 1 | 0.826 | 0.914 | 19.899 | -0.598 | -0.598 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 479 | TYR | 0 | -0.070 | -0.045 | 17.040 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 480 | PHE | 0 | 0.013 | -0.001 | 12.609 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 481 | ASP | -1 | -0.801 | -0.888 | 18.159 | 0.739 | 0.739 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 482 | CYS | 0 | -0.113 | -0.048 | 19.579 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 483 | TYR | 0 | 0.045 | 0.049 | 15.990 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 484 | ASP | -1 | -0.894 | -0.932 | 19.766 | 0.904 | 0.904 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 485 | GLY | 0 | 0.033 | -0.004 | 19.198 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 486 | GLY | 0 | 0.043 | 0.034 | 20.188 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 487 | CYS | -1 | -0.726 | -0.786 | 20.846 | 1.143 | 1.143 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 488 | ILE | 0 | -0.074 | -0.029 | 19.041 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 489 | ASN | 0 | -0.034 | -0.025 | 23.233 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 490 | ALA | 0 | 0.012 | -0.009 | 22.353 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 491 | ASN | 0 | -0.096 | -0.052 | 22.850 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 492 | GLN | 0 | 0.017 | 0.019 | 23.407 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 493 | VAL | 0 | -0.023 | -0.002 | 17.226 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 494 | ILE | 0 | 0.030 | 0.016 | 17.293 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 495 | VAL | 0 | -0.049 | -0.019 | 14.251 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 496 | ASN | 0 | 0.065 | 0.031 | 13.260 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 497 | ASN | 0 | 0.108 | 0.051 | 10.982 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 498 | LEU | 0 | 0.059 | 0.019 | 13.464 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 499 | ASP | -1 | -0.822 | -0.898 | 15.108 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 500 | LYS | 1 | 0.927 | 0.979 | 9.274 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 501 | SER | 0 | -0.053 | -0.069 | 11.557 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 502 | ALA | 0 | 0.030 | 0.014 | 12.889 | 0.106 | 0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 503 | GLY | 0 | 0.080 | 0.043 | 13.482 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 504 | PHE | 0 | 0.003 | 0.005 | 14.299 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 505 | PRO | 0 | -0.068 | -0.032 | 17.007 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 506 | PHE | 0 | -0.016 | -0.011 | 17.388 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 507 | ASN | 0 | 0.039 | 0.001 | 15.243 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 508 | LYS | 1 | 0.890 | 0.965 | 18.119 | -0.558 | -0.558 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 509 | TRP | 0 | -0.071 | -0.061 | 21.453 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 510 | GLY | 0 | -0.019 | -0.011 | 20.805 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 511 | LYS | 1 | 0.926 | 0.974 | 15.650 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 512 | ALA | 0 | 0.026 | 0.005 | 14.432 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 513 | ARG | 1 | 0.841 | 0.899 | 16.593 | -0.188 | -0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 514 | LEU | 0 | -0.047 | 0.001 | 19.666 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 515 | TYR | 0 | -0.051 | -0.049 | 18.809 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 516 | TYR | 0 | 0.082 | 0.033 | 15.781 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 517 | ASP | -1 | -0.835 | -0.900 | 21.299 | 0.361 | 0.361 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 518 | SER | 0 | -0.147 | -0.093 | 24.153 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 519 | MET | 0 | -0.054 | -0.007 | 23.065 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 520 | SER | 0 | 0.039 | 0.033 | 25.763 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 521 | TYR | 0 | 0.080 | 0.035 | 24.172 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 522 | GLU | -1 | -0.836 | -0.931 | 26.597 | 0.503 | 0.503 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 523 | ASP | -1 | -0.882 | -0.940 | 26.468 | 0.522 | 0.522 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 524 | GLN | 0 | -0.001 | -0.011 | 21.205 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 525 | ASP | -1 | -0.766 | -0.872 | 23.858 | 0.776 | 0.776 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 526 | ALA | 0 | -0.052 | -0.026 | 25.910 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 527 | LEU | 0 | -0.046 | -0.034 | 20.736 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 528 | PHE | 0 | 0.043 | 0.021 | 20.597 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 529 | ALA | 0 | 0.038 | 0.018 | 23.122 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 530 | TYR | 0 | -0.063 | -0.026 | 24.938 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 531 | THR | 0 | -0.023 | -0.028 | 20.294 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 532 | LYS | 1 | 0.639 | 0.752 | 23.302 | -0.905 | -0.905 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 533 | ARG | 1 | 0.765 | 0.839 | 25.374 | -0.629 | -0.629 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 534 | ASN | 0 | -0.057 | -0.038 | 25.998 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 535 | VAL | 0 | 0.040 | 0.028 | 21.254 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 536 | ILE | 0 | -0.019 | -0.007 | 20.461 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 537 | PRO | 0 | 0.027 | 0.027 | 19.417 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 538 | THR | 0 | -0.027 | -0.018 | 15.601 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 539 | ILE | 0 | -0.041 | -0.024 | 16.215 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 540 | THR | 0 | 0.014 | 0.006 | 10.029 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 541 | GLN | 0 | -0.026 | -0.024 | 11.683 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 542 | MET | 0 | -0.029 | -0.003 | 9.358 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 543 | ASN | 0 | -0.037 | -0.015 | 9.892 | -0.449 | -0.449 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 544 | LEU | 0 | 0.014 | -0.003 | 9.557 | 0.283 | 0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 545 | LYS | 1 | 0.942 | 0.984 | 2.579 | 3.565 | 5.162 | 0.287 | -0.752 | -1.133 | 0.008 |
466 | A | 546 | TYR | 0 | -0.090 | -0.044 | 8.324 | -0.180 | -0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 547 | ALA | 0 | 0.088 | 0.034 | 7.048 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 548 | ILE | 0 | -0.009 | 0.027 | 9.056 | 0.196 | 0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 549 | SER | 0 | -0.003 | -0.011 | 9.254 | -0.468 | -0.468 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 550 | ALA | 0 | 0.071 | 0.048 | 11.118 | 0.390 | 0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 551 | LYS | 1 | 0.949 | 0.959 | 9.761 | 3.492 | 3.492 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 552 | ASN | 0 | -0.001 | -0.003 | 12.624 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 553 | ARG | 1 | 0.860 | 0.922 | 5.465 | 0.976 | 0.976 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 554 | ALA | 0 | 0.039 | 0.006 | 11.593 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 555 | ARG | 1 | 0.863 | 0.944 | 5.945 | 2.601 | 2.601 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 556 | THR | 0 | -0.035 | -0.043 | 7.818 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 557 | VAL | 0 | 0.021 | 0.025 | 3.735 | -0.711 | 0.216 | 0.034 | -0.279 | -0.682 | 0.002 |
478 | A | 558 | ALA | 0 | -0.035 | -0.026 | 5.826 | -1.040 | -1.040 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 559 | GLY | 0 | 0.050 | 0.037 | 6.488 | 0.460 | 0.460 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 560 | VAL | 0 | 0.017 | 0.009 | 8.104 | -0.383 | -0.383 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 561 | SER | 0 | -0.013 | -0.025 | 10.419 | -0.262 | -0.262 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 562 | ILE | 0 | 0.014 | -0.004 | 13.610 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 563 | CYS | 0 | -0.034 | -0.015 | 15.308 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 564 | SER | 0 | -0.016 | -0.013 | 13.454 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 565 | THR | 0 | 0.049 | 0.017 | 10.309 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 566 | MET | 0 | -0.017 | 0.009 | 12.768 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 567 | THR | 0 | -0.021 | -0.017 | 16.151 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 568 | ASN | 0 | 0.023 | 0.021 | 11.738 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 569 | ARG | 1 | 0.834 | 0.886 | 10.155 | -1.708 | -1.708 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 570 | GLN | 0 | -0.098 | -0.061 | 14.725 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 571 | PHE | 0 | -0.040 | -0.022 | 16.637 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 572 | HIS | 0 | 0.039 | 0.006 | 13.235 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 573 | GLN | 0 | -0.033 | -0.020 | 13.522 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 574 | LYS | 1 | 0.869 | 0.944 | 15.610 | -1.071 | -1.071 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 575 | LEU | 0 | 0.036 | 0.013 | 14.535 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 576 | LEU | 0 | -0.053 | -0.023 | 9.861 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 577 | LYS | 1 | 0.910 | 0.941 | 13.062 | -1.349 | -1.349 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 578 | SER | 0 | -0.001 | -0.010 | 15.651 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 579 | ILE | 0 | -0.057 | -0.037 | 11.956 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 580 | ALA | 0 | 0.022 | 0.024 | 12.217 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 581 | ALA | 0 | 0.055 | 0.045 | 13.888 | -0.246 | -0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 582 | THR | 0 | -0.067 | -0.024 | 16.988 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 583 | ARG | 1 | 0.849 | 0.908 | 15.898 | -0.596 | -0.596 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 584 | GLY | 0 | 0.004 | -0.001 | 19.843 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 585 | ALA | 0 | -0.015 | -0.003 | 17.506 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 586 | THR | 0 | -0.020 | -0.012 | 15.280 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 587 | VAL | 0 | -0.014 | -0.003 | 10.725 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 588 | VAL | 0 | -0.006 | -0.009 | 12.478 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 589 | ILE | 0 | 0.030 | 0.009 | 7.244 | -0.279 | -0.279 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 590 | GLY | 0 | 0.053 | 0.031 | 10.822 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 591 | THR | 0 | -0.124 | -0.058 | 13.279 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 592 | SER | 0 | 0.024 | 0.000 | 15.106 | -0.199 | -0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 593 | LYS | 1 | 0.820 | 0.876 | 13.559 | 1.728 | 1.728 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 594 | PHE | 0 | 0.026 | 0.019 | 15.661 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 595 | TYR | 0 | -0.013 | -0.022 | 20.476 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 596 | GLY | 0 | -0.023 | -0.008 | 23.934 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 597 | GLY | 0 | 0.004 | -0.001 | 20.696 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 598 | TRP | 0 | 0.031 | -0.003 | 14.369 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 599 | HIS | 0 | 0.011 | 0.016 | 20.028 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 600 | ASN | 0 | -0.006 | -0.009 | 22.660 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 601 | MET | 0 | 0.026 | 0.042 | 16.230 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 602 | LEU | 0 | 0.035 | 0.017 | 18.317 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 603 | LYS | 1 | 0.867 | 0.924 | 21.270 | 0.265 | 0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 604 | THR | 0 | -0.034 | -0.023 | 20.831 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 605 | VAL | 0 | -0.006 | 0.005 | 18.056 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 606 | TYR | 0 | -0.037 | -0.030 | 21.101 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 607 | SER | 0 | -0.013 | -0.010 | 24.193 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 608 | ASP | -1 | -0.903 | -0.953 | 26.372 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 609 | VAL | 0 | 0.023 | 0.040 | 24.525 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 610 | GLU | -1 | -0.912 | -0.961 | 27.919 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 611 | ASN | 0 | -0.092 | -0.060 | 29.697 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 612 | PRO | 0 | 0.025 | 0.040 | 26.046 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 613 | HIS | 0 | 0.000 | -0.003 | 23.977 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 614 | LEU | 0 | 0.030 | 0.015 | 19.674 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 615 | MET | 0 | -0.059 | -0.036 | 17.008 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 616 | GLY | 0 | 0.085 | 0.045 | 14.106 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 617 | TRP | 0 | -0.075 | -0.057 | 11.112 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 618 | ASP | -1 | -0.774 | -0.888 | 7.696 | -4.503 | -4.503 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 619 | TYR | 0 | -0.040 | -0.041 | 6.468 | 1.214 | 1.214 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 620 | PRO | 0 | -0.044 | -0.020 | 6.948 | -0.852 | -0.852 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 621 | LYS | 1 | 0.865 | 0.918 | 6.840 | 1.333 | 1.333 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 622 | CYS | 0 | 0.039 | 0.040 | 3.526 | 1.397 | 1.723 | 0.003 | -0.062 | -0.266 | 0.000 |
543 | A | 623 | ASP | -1 | -0.793 | -0.885 | 1.983 | 0.923 | 2.424 | 2.540 | -1.593 | -2.447 | 0.014 |
544 | A | 624 | ARG | 1 | 0.744 | 0.840 | 3.777 | -1.136 | -0.915 | 0.004 | -0.052 | -0.173 | 0.000 |
545 | A | 625 | ALA | 0 | 0.019 | 0.005 | 7.349 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 626 | MET | 0 | -0.010 | 0.027 | 7.277 | 0.173 | 0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 627 | PRO | 0 | 0.027 | 0.010 | 9.138 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 628 | ASN | 0 | 0.018 | -0.013 | 12.505 | 0.300 | 0.300 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 629 | MET | 0 | -0.014 | 0.010 | 13.756 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 630 | LEU | 0 | 0.024 | 0.009 | 12.566 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 631 | ARG | 1 | 0.868 | 0.926 | 8.204 | -4.243 | -4.243 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 632 | ILE | 0 | 0.023 | -0.001 | 11.624 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 633 | MET | 0 | -0.035 | -0.004 | 14.082 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 634 | ALA | 0 | 0.026 | 0.007 | 11.162 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 635 | SER | 0 | 0.010 | -0.004 | 13.266 | 0.273 | 0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 636 | LEU | 0 | -0.059 | -0.022 | 14.231 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 637 | VAL | 0 | 0.002 | 0.001 | 15.275 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 638 | LEU | 0 | -0.014 | -0.004 | 10.441 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 639 | ALA | 0 | 0.004 | 0.003 | 15.202 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 640 | ARG | 1 | 0.702 | 0.803 | 18.329 | -1.113 | -1.113 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 641 | LYS | 1 | 0.769 | 0.875 | 19.249 | -1.264 | -1.264 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 642 | HIS | 0 | 0.108 | 0.034 | 18.598 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 643 | THR | 0 | -0.043 | -0.032 | 23.048 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 644 | THR | 0 | -0.067 | -0.049 | 26.330 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 645 | CYS | -1 | -0.862 | -0.877 | 24.450 | 0.895 | 0.895 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 646 | CYS | -1 | -0.738 | -0.832 | 24.049 | 1.018 | 1.018 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 647 | SER | 0 | -0.086 | -0.061 | 26.574 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 648 | LEU | 0 | 0.049 | 0.006 | 26.917 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 649 | SER | 0 | 0.003 | 0.006 | 26.671 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 650 | HIS | 0 | 0.012 | 0.018 | 25.871 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 651 | ARG | 1 | 0.946 | 0.969 | 21.925 | -0.961 | -0.961 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 652 | PHE | 0 | 0.019 | 0.015 | 21.954 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 653 | TYR | 0 | -0.032 | -0.045 | 22.524 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 654 | ARG | 1 | 0.816 | 0.916 | 16.258 | -1.645 | -1.645 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 655 | LEU | 0 | 0.051 | 0.039 | 16.987 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 656 | ALA | 0 | 0.012 | 0.005 | 17.829 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 657 | ASN | 0 | -0.059 | -0.068 | 18.498 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 658 | GLU | -1 | -0.749 | -0.856 | 14.179 | 2.416 | 2.416 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 659 | CYS | 0 | -0.019 | -0.017 | 13.982 | 0.166 | 0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 660 | ALA | 0 | -0.037 | -0.024 | 15.160 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 661 | GLN | 0 | -0.085 | -0.040 | 14.115 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 662 | VAL | 0 | 0.000 | 0.010 | 9.370 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 663 | LEU | 0 | -0.030 | 0.016 | 9.590 | 0.248 | 0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 664 | SER | 0 | -0.011 | -0.007 | 11.805 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 665 | GLU | -1 | -0.789 | -0.869 | 11.301 | 2.064 | 2.064 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 666 | MET | 0 | -0.068 | -0.033 | 15.361 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 667 | VAL | 0 | 0.047 | 0.016 | 12.463 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 668 | MET | 0 | -0.039 | -0.016 | 15.302 | -0.184 | -0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 669 | CYS | 0 | 0.021 | 0.004 | 15.167 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 670 | GLY | 0 | 0.036 | 0.014 | 17.051 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 671 | GLY | 0 | -0.001 | -0.002 | 19.349 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 672 | SER | 0 | -0.056 | -0.035 | 20.746 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 673 | LEU | 0 | 0.026 | 0.019 | 19.258 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 674 | TYR | 0 | -0.055 | -0.051 | 17.024 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 675 | VAL | 0 | 0.015 | 0.001 | 17.342 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 676 | LYS | 1 | 0.825 | 0.929 | 9.192 | -2.379 | -2.379 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 677 | PRO | 0 | -0.062 | -0.040 | 13.161 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 678 | GLY | 0 | 0.063 | 0.029 | 11.869 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 679 | GLY | 0 | -0.012 | 0.018 | 8.075 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 680 | THR | 0 | -0.014 | -0.013 | 2.947 | -1.630 | -0.928 | 0.023 | -0.272 | -0.453 | -0.001 |
601 | A | 681 | SER | 0 | -0.018 | -0.023 | 5.481 | -0.947 | -0.947 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 682 | SER | 0 | 0.045 | 0.004 | 2.360 | -1.342 | -0.165 | 2.802 | -1.472 | -2.506 | 0.014 |
603 | A | 683 | GLY | 0 | 0.068 | 0.039 | 2.382 | -3.857 | -2.683 | 1.567 | -0.934 | -1.807 | -0.018 |
604 | A | 684 | ASP | -1 | -0.860 | -0.911 | 4.975 | 4.840 | 4.878 | -0.001 | -0.008 | -0.029 | 0.000 |
605 | A | 685 | ALA | 0 | 0.027 | 0.018 | 5.913 | 1.402 | 1.402 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 686 | THR | 0 | -0.033 | -0.044 | 7.957 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 687 | THR | 0 | -0.034 | -0.005 | 1.972 | -8.128 | -9.896 | 8.057 | -2.620 | -3.668 | 0.028 |
608 | A | 688 | ALA | 0 | 0.102 | 0.054 | 3.225 | -1.193 | 0.357 | 0.305 | -0.525 | -1.331 | 0.003 |
609 | A | 689 | TYR | 0 | 0.043 | 0.010 | 3.813 | -4.802 | -4.708 | 0.042 | 0.084 | -0.220 | 0.001 |
610 | A | 690 | ALA | 0 | 0.003 | -0.009 | 7.087 | -1.449 | -1.449 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 691 | ASN | 0 | 0.009 | 0.001 | 2.457 | -11.126 | -8.940 | 1.829 | -1.247 | -2.770 | 0.014 |
612 | A | 692 | SER | 0 | 0.010 | 0.002 | 6.509 | -2.670 | -2.670 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 693 | VAL | 0 | -0.043 | -0.017 | 8.864 | -1.005 | -1.005 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 694 | PHE | 0 | -0.018 | -0.014 | 7.391 | -0.615 | -0.615 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 695 | ASN | 0 | 0.016 | 0.019 | 8.382 | -0.809 | -0.809 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 696 | ILE | 0 | 0.023 | 0.011 | 10.262 | -0.388 | -0.388 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 697 | CYS | 0 | 0.006 | 0.002 | 13.417 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 698 | GLN | 0 | 0.015 | 0.030 | 11.593 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 699 | ALA | 0 | 0.018 | 0.013 | 14.256 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 700 | VAL | 0 | -0.010 | -0.009 | 16.051 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 701 | THR | 0 | -0.033 | -0.034 | 17.367 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 702 | ALA | 0 | 0.014 | 0.013 | 17.826 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 703 | ASN | 0 | -0.024 | -0.022 | 19.696 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 704 | VAL | 0 | -0.002 | 0.005 | 22.177 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 705 | ASN | 0 | 0.033 | 0.032 | 21.974 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 706 | ALA | 0 | -0.011 | 0.014 | 23.894 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 707 | LEU | 0 | -0.011 | 0.001 | 25.632 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 708 | LEU | 0 | 0.009 | 0.002 | 27.630 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 709 | SER | 0 | -0.062 | -0.043 | 27.339 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 710 | THR | 0 | -0.010 | 0.010 | 30.012 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 711 | ASP | -1 | -0.779 | -0.886 | 32.158 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 712 | GLY | 0 | 0.086 | 0.038 | 35.980 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 713 | ASN | 0 | -0.145 | -0.095 | 37.140 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 714 | LYS | 1 | 0.811 | 0.892 | 37.666 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 715 | ILE | 0 | 0.026 | 0.039 | 33.507 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 716 | ALA | 0 | 0.008 | -0.002 | 37.349 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 717 | ASP | -1 | -0.748 | -0.863 | 36.788 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 718 | LYS | 1 | 0.889 | 0.960 | 38.822 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 719 | TYR | 0 | -0.064 | -0.054 | 33.001 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 720 | VAL | 0 | 0.086 | 0.023 | 32.047 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 721 | ARG | 1 | 0.834 | 0.913 | 34.233 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 722 | ASN | 0 | -0.063 | -0.041 | 36.603 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 723 | LEU | 0 | 0.014 | 0.021 | 29.781 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 724 | GLN | 0 | 0.017 | -0.006 | 31.708 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 725 | HIS | 0 | -0.050 | -0.020 | 32.757 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 726 | ARG | 1 | 0.863 | 0.897 | 34.282 | -0.188 | -0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 727 | LEU | 0 | 0.005 | 0.016 | 26.807 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 728 | TYR | 0 | -0.014 | -0.039 | 30.533 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 729 | GLU | -1 | -0.942 | -0.966 | 32.273 | 0.224 | 0.224 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 730 | CYS | 0 | -0.002 | -0.002 | 30.807 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 731 | LEU | 0 | -0.014 | 0.017 | 25.924 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 732 | TYR | 0 | -0.066 | -0.066 | 27.007 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 733 | ARG | 1 | 0.807 | 0.902 | 32.507 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 734 | ASN | 0 | -0.018 | 0.005 | 33.673 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 735 | ARG | 1 | 0.782 | 0.868 | 32.577 | -0.318 | -0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 736 | ASP | -1 | -0.914 | -0.960 | 32.035 | 0.393 | 0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 737 | VAL | 0 | -0.004 | -0.005 | 28.168 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 738 | ASP | -1 | -0.854 | -0.921 | 31.100 | 0.286 | 0.286 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 739 | THR | 0 | 0.023 | -0.020 | 29.899 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 740 | ASP | -1 | -0.927 | -0.943 | 30.487 | 0.327 | 0.327 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 741 | PHE | 0 | -0.032 | -0.021 | 29.201 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 742 | VAL | 0 | 0.015 | 0.011 | 25.750 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 743 | ASN | 0 | -0.012 | -0.011 | 27.296 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 744 | GLU | -1 | -0.814 | -0.857 | 28.924 | 0.170 | 0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 745 | PHE | 0 | 0.018 | -0.007 | 23.507 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 746 | TYR | 0 | 0.026 | 0.018 | 21.188 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 747 | ALA | 0 | -0.008 | -0.005 | 25.341 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 748 | TYR | 0 | -0.057 | -0.045 | 26.806 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 749 | LEU | 0 | 0.007 | -0.001 | 21.223 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 750 | ARG | 1 | 0.939 | 0.966 | 21.999 | -0.391 | -0.391 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 751 | LYS | 1 | 0.789 | 0.919 | 24.587 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 752 | HIS | 0 | -0.099 | -0.064 | 26.366 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 753 | PHE | 0 | 0.002 | -0.020 | 18.044 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 754 | SER | 0 | 0.029 | 0.038 | 21.168 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 755 | MET | 0 | -0.025 | -0.023 | 15.948 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 756 | MET | 0 | -0.006 | 0.010 | 14.384 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 757 | ILE | 0 | -0.031 | -0.022 | 10.368 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 758 | LEU | 0 | 0.037 | 0.010 | 7.038 | 0.543 | 0.543 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 759 | SER | 0 | 0.031 | 0.024 | 3.087 | -0.354 | 1.155 | 0.107 | -0.607 | -1.010 | 0.004 |
680 | A | 760 | ASP | -1 | -0.895 | -0.964 | 3.364 | -11.555 | -12.133 | 0.005 | 1.307 | -0.734 | -0.005 |
681 | A | 761 | ASP | -1 | -0.785 | -0.877 | 5.393 | -6.775 | -6.677 | -0.001 | -0.002 | -0.096 | 0.000 |
682 | A | 762 | ALA | 0 | -0.055 | -0.052 | 7.743 | 1.139 | 1.139 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 763 | VAL | 0 | -0.019 | 0.002 | 11.451 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 764 | VAL | 0 | -0.040 | -0.022 | 14.949 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 765 | CYS | 0 | -0.029 | 0.011 | 17.946 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 766 | PHE | 0 | -0.011 | -0.012 | 21.305 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 767 | ASN | 0 | 0.072 | 0.032 | 23.750 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 768 | SER | 0 | 0.034 | 0.000 | 27.180 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 769 | THR | 0 | -0.023 | -0.013 | 28.118 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 770 | TYR | 0 | 0.021 | 0.006 | 28.685 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 771 | ALA | 0 | 0.035 | 0.030 | 25.316 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 772 | SER | 0 | -0.129 | -0.069 | 27.055 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 773 | GLN | 0 | -0.055 | -0.035 | 29.900 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 774 | GLY | 0 | -0.002 | 0.001 | 28.053 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 775 | LEU | 0 | -0.046 | -0.022 | 28.532 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 776 | VAL | 0 | -0.012 | 0.006 | 24.173 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 777 | ALA | 0 | 0.006 | 0.018 | 20.511 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 778 | SER | 0 | 0.033 | 0.007 | 21.379 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 779 | ILE | 0 | 0.114 | 0.045 | 16.723 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 780 | LYS | 1 | 0.947 | 0.967 | 18.976 | 0.245 | 0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 781 | ASN | 0 | -0.019 | -0.004 | 21.151 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 782 | PHE | 0 | 0.083 | 0.042 | 14.681 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 783 | LYS | 1 | 0.785 | 0.897 | 16.806 | 0.491 | 0.491 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 784 | SER | 0 | -0.025 | -0.022 | 18.249 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 785 | VAL | 0 | -0.001 | 0.001 | 16.112 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 786 | LEU | 0 | -0.015 | -0.016 | 11.791 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 787 | TYR | 0 | -0.047 | -0.020 | 15.323 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 788 | TYR | 0 | -0.047 | -0.041 | 17.936 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 789 | GLN | 0 | -0.036 | -0.019 | 15.774 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 790 | ASN | 0 | -0.012 | -0.019 | 9.615 | 0.276 | 0.276 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 791 | ASN | 0 | -0.008 | 0.006 | 12.679 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 792 | VAL | 0 | -0.009 | -0.009 | 10.813 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 793 | PHE | 0 | -0.028 | -0.005 | 14.172 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 794 | MET | 0 | 0.008 | 0.020 | 12.908 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 795 | SER | 0 | -0.047 | -0.028 | 15.126 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 796 | GLU | -1 | -0.788 | -0.916 | 16.104 | -0.755 | -0.755 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 797 | ALA | 0 | -0.061 | -0.029 | 17.750 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 798 | LYS | 1 | 0.892 | 0.942 | 12.205 | 1.372 | 1.372 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 799 | CYS | 0 | 0.008 | 0.046 | 12.969 | -0.130 | -0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 800 | TRP | 0 | 0.030 | 0.028 | 13.560 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 801 | THR | 0 | -0.066 | -0.059 | 17.611 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 802 | GLU | -1 | -0.854 | -0.916 | 20.481 | -0.662 | -0.662 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 803 | THR | 0 | -0.019 | -0.020 | 22.750 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 804 | ASP | -1 | -0.855 | -0.887 | 25.838 | -0.389 | -0.389 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 805 | LEU | 0 | 0.047 | 0.030 | 24.495 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | A | 806 | THR | 0 | -0.091 | -0.050 | 26.032 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | A | 807 | LYS | 1 | 0.842 | 0.914 | 23.973 | 0.524 | 0.524 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | A | 808 | GLY | 0 | 0.043 | 0.016 | 21.243 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | A | 809 | PRO | 0 | -0.022 | -0.016 | 16.163 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | A | 810 | HIS | 0 | -0.051 | -0.025 | 16.347 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | A | 811 | GLU | -1 | -0.890 | -0.943 | 10.191 | -3.728 | -3.728 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | A | 812 | PHE | 0 | 0.029 | 0.001 | 11.043 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | A | 813 | CYS | 0 | -0.011 | 0.007 | 8.747 | 0.540 | 0.540 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | A | 814 | SER | 0 | 0.085 | 0.022 | 8.694 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | A | 815 | GLN | 0 | -0.129 | -0.054 | 11.201 | 0.559 | 0.559 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | A | 816 | HIS | 0 | -0.026 | -0.011 | 14.635 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | A | 817 | THR | 0 | 0.006 | 0.003 | 17.827 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | A | 818 | MET | 0 | -0.086 | -0.023 | 20.545 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | A | 819 | LEU | 0 | -0.006 | 0.013 | 24.324 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | A | 820 | VAL | 0 | -0.017 | -0.015 | 26.748 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | A | 821 | LYS | 1 | 0.767 | 0.894 | 29.419 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | A | 822 | GLN | 0 | -0.034 | -0.038 | 27.946 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | A | 823 | GLY | 0 | 0.028 | 0.018 | 32.528 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | A | 824 | ASP | -1 | -0.889 | -0.955 | 35.217 | -0.204 | -0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | A | 825 | ASP | -1 | -0.915 | -0.941 | 32.109 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | A | 826 | TYR | 0 | -0.071 | -0.055 | 30.956 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | A | 827 | VAL | 0 | 0.040 | 0.027 | 26.876 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
748 | A | 828 | TYR | 0 | -0.054 | -0.054 | 22.716 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
749 | A | 829 | LEU | 0 | -0.006 | -0.006 | 22.415 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | A | 830 | PRO | 0 | 0.043 | 0.034 | 17.159 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | A | 831 | TYR | 0 | -0.006 | -0.030 | 18.424 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | A | 832 | PRO | 0 | 0.090 | 0.063 | 14.929 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | A | 833 | ASP | -1 | -0.775 | -0.897 | 15.360 | -1.563 | -1.563 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | A | 834 | PRO | 0 | 0.004 | -0.014 | 17.061 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | A | 835 | SER | 0 | -0.061 | -0.049 | 17.837 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | A | 836 | ARG | 1 | 0.753 | 0.875 | 9.556 | 3.273 | 3.273 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | A | 837 | ILE | 0 | 0.072 | 0.035 | 15.019 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | A | 838 | LEU | 0 | -0.010 | -0.001 | 17.152 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | A | 839 | GLY | 0 | 0.000 | -0.002 | 16.661 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | A | 840 | ALA | 0 | 0.037 | 0.027 | 14.594 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | A | 841 | GLY | 0 | 0.046 | 0.044 | 15.894 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | A | 842 | CYS | 0 | -0.114 | -0.067 | 19.510 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | A | 843 | PHE | 0 | -0.049 | -0.043 | 17.095 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | A | 844 | VAL | 0 | 0.003 | 0.011 | 16.123 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | A | 845 | ASP | -1 | -0.838 | -0.932 | 11.552 | -1.632 | -1.632 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | A | 846 | ASP | -1 | -0.949 | -1.001 | 14.970 | -0.519 | -0.519 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | A | 847 | ILE | 0 | 0.060 | 0.060 | 13.456 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | A | 848 | VAL | 0 | 0.006 | -0.008 | 17.342 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | A | 849 | LYS | 1 | 0.819 | 0.905 | 20.595 | 0.563 | 0.563 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | A | 850 | THR | 0 | -0.041 | -0.009 | 20.748 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | A | 851 | ASP | -1 | -0.832 | -0.899 | 23.025 | -0.329 | -0.329 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | A | 852 | GLY | 0 | -0.008 | -0.004 | 23.601 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | A | 853 | THR | 0 | -0.057 | -0.055 | 24.628 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | A | 854 | LEU | 0 | 0.107 | 0.065 | 18.420 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | A | 855 | MET | 0 | -0.085 | -0.023 | 20.210 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | A | 856 | ILE | 0 | 0.004 | -0.007 | 22.088 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | A | 857 | GLU | -1 | -0.806 | -0.906 | 19.451 | -0.626 | -0.626 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | A | 858 | ARG | 1 | 0.867 | 0.962 | 14.238 | 1.330 | 1.330 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | A | 859 | PHE | 0 | -0.049 | -0.045 | 18.264 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | A | 860 | VAL | 0 | 0.030 | 0.010 | 20.916 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | A | 861 | SER | 0 | 0.058 | 0.034 | 15.925 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | A | 862 | LEU | 0 | -0.032 | -0.018 | 14.821 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | A | 863 | ALA | 0 | -0.064 | -0.037 | 18.005 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | A | 864 | ILE | 0 | 0.023 | 0.011 | 18.750 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | A | 865 | ASP | -1 | -0.798 | -0.886 | 14.524 | -1.684 | -1.684 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | A | 866 | ALA | 0 | -0.024 | -0.012 | 18.040 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | A | 867 | TYR | 0 | -0.015 | -0.005 | 20.672 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | A | 868 | PRO | 0 | 0.021 | 0.015 | 21.086 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | A | 869 | LEU | 0 | 0.006 | 0.010 | 20.676 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | A | 870 | THR | 0 | -0.101 | -0.061 | 24.218 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | A | 871 | LYS | 1 | 0.840 | 0.919 | 26.822 | 0.577 | 0.577 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | A | 872 | HIS | 0 | 0.039 | 0.027 | 24.037 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | A | 873 | PRO | 0 | -0.044 | -0.031 | 27.646 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | A | 874 | ASN | 0 | -0.041 | -0.004 | 27.004 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | A | 875 | GLN | 0 | 0.011 | -0.017 | 28.726 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | A | 876 | GLU | -1 | -0.777 | -0.834 | 28.162 | -0.677 | -0.677 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | A | 877 | TYR | 0 | -0.015 | -0.015 | 22.793 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | A | 878 | ALA | 0 | 0.036 | 0.028 | 25.421 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | A | 879 | ASP | -1 | -0.866 | -0.945 | 27.816 | -0.540 | -0.540 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | A | 880 | VAL | 0 | -0.041 | -0.004 | 21.935 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | A | 881 | PHE | 0 | 0.041 | 0.032 | 24.030 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | A | 882 | HIS | 0 | 0.014 | 0.008 | 25.559 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | A | 883 | LEU | 0 | -0.060 | -0.024 | 25.308 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | A | 884 | TYR | 0 | 0.020 | -0.010 | 19.489 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | A | 885 | LEU | 0 | 0.086 | 0.036 | 25.343 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | A | 886 | GLN | 0 | -0.112 | -0.045 | 27.959 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | A | 887 | TYR | 0 | -0.003 | 0.002 | 24.624 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | A | 888 | ILE | 0 | 0.049 | 0.027 | 23.749 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | A | 889 | ARG | 1 | 0.855 | 0.920 | 27.528 | 0.475 | 0.475 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | A | 890 | LYS | 1 | 0.816 | 0.906 | 30.400 | 0.446 | 0.446 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | A | 891 | LEU | 0 | 0.008 | 0.012 | 25.626 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | A | 892 | HIS | 0 | 0.005 | 0.000 | 29.849 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | A | 893 | ASP | -1 | -0.985 | -0.995 | 31.366 | -0.315 | -0.315 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | A | 894 | GLU | -1 | -0.942 | -0.966 | 32.147 | -0.365 | -0.365 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | A | 895 | LEU | 0 | -0.059 | -0.009 | 28.617 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | A | 906 | MET | 0 | 0.048 | 0.018 | 26.751 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | A | 907 | LEU | 0 | -0.024 | -0.011 | 27.886 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | A | 908 | THR | 0 | -0.067 | -0.055 | 30.460 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | A | 909 | ASN | 0 | -0.007 | -0.011 | 28.875 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | A | 910 | ASP | -1 | -0.900 | -0.936 | 29.413 | -0.367 | -0.367 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | A | 911 | ASN | 0 | 0.004 | 0.002 | 26.028 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | A | 912 | THR | 0 | 0.076 | 0.024 | 23.965 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | A | 913 | SER | 0 | -0.062 | -0.035 | 25.050 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | A | 914 | ARG | 1 | 0.799 | 0.885 | 27.064 | 0.256 | 0.256 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | A | 915 | TYR | 0 | 0.080 | 0.061 | 21.434 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | A | 916 | TRP | 0 | -0.028 | -0.026 | 19.228 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | A | 917 | GLU | -1 | -0.876 | -0.916 | 24.984 | -0.341 | -0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | A | 918 | PRO | 0 | -0.020 | -0.003 | 27.462 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | A | 919 | GLU | -1 | -0.861 | -0.899 | 26.796 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | B | 78 | ASP | -1 | -0.797 | -0.912 | 31.330 | 0.292 | 0.292 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | B | 79 | LYS | 1 | 0.872 | 0.941 | 26.534 | -0.352 | -0.352 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | B | 80 | ARG | 1 | 0.873 | 0.930 | 28.243 | -0.420 | -0.420 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | B | 81 | ALA | 0 | 0.014 | 0.006 | 29.265 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | B | 82 | LYS | 1 | 0.948 | 0.983 | 28.876 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | B | 83 | VAL | 0 | 0.062 | 0.036 | 24.177 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | B | 84 | THR | 0 | -0.009 | -0.022 | 27.623 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | B | 85 | SER | 0 | -0.088 | -0.055 | 29.928 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | B | 86 | ALA | 0 | 0.003 | 0.016 | 27.484 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | B | 87 | MET | 0 | 0.039 | 0.031 | 25.150 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
840 | B | 88 | GLN | 0 | 0.001 | 0.000 | 27.833 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
841 | B | 89 | THR | 0 | -0.022 | -0.028 | 31.440 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
842 | B | 90 | MET | 0 | -0.033 | 0.008 | 24.631 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
843 | B | 91 | LEU | 0 | 0.023 | 0.011 | 27.388 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
844 | B | 92 | PHE | 0 | 0.035 | 0.004 | 30.433 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
845 | B | 93 | THR | 0 | -0.098 | -0.062 | 32.073 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
846 | B | 94 | MET | 0 | 0.003 | 0.000 | 25.986 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
847 | B | 95 | LEU | 0 | 0.048 | 0.019 | 32.052 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
848 | B | 96 | ARG | 1 | 0.839 | 0.933 | 35.493 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
849 | B | 97 | LYS | 1 | 0.835 | 0.922 | 32.394 | -0.301 | -0.301 | 0.000 | 0.000 | 0.000 | 0.000 |
850 | B | 98 | LEU | 0 | 0.011 | 0.036 | 32.296 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
851 | B | 99 | ASP | -1 | -0.779 | -0.888 | 35.582 | 0.285 | 0.285 | 0.000 | 0.000 | 0.000 | 0.000 |
852 | B | 100 | ASN | 0 | 0.012 | -0.006 | 38.767 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
853 | B | 101 | ASP | -1 | -0.847 | -0.918 | 41.375 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
854 | B | 102 | ALA | 0 | -0.040 | -0.008 | 39.291 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
855 | B | 103 | LEU | 0 | 0.022 | 0.013 | 34.620 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
856 | B | 104 | ASN | 0 | 0.010 | -0.018 | 38.168 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
857 | B | 105 | ASN | 0 | -0.079 | -0.042 | 41.201 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
858 | B | 106 | ILE | 0 | -0.009 | 0.009 | 35.628 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
859 | B | 107 | ILE | 0 | -0.005 | -0.001 | 35.873 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
860 | B | 108 | ASN | 0 | -0.035 | -0.028 | 38.740 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
861 | B | 109 | ASN | 0 | -0.009 | -0.003 | 40.447 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
862 | B | 110 | ALA | 0 | 0.020 | 0.029 | 37.263 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
863 | B | 111 | ARG | 1 | 0.815 | 0.879 | 35.826 | -0.363 | -0.363 | 0.000 | 0.000 | 0.000 | 0.000 |
864 | B | 112 | ASP | -1 | -0.814 | -0.899 | 35.915 | 0.393 | 0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
865 | B | 113 | GLY | 0 | 0.005 | 0.018 | 37.619 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
866 | B | 114 | CYS | 0 | -0.079 | -0.030 | 31.973 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
867 | B | 115 | VAL | 0 | 0.040 | 0.029 | 32.152 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
868 | B | 116 | PRO | 0 | 0.054 | 0.028 | 27.702 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
869 | B | 117 | LEU | 0 | -0.002 | 0.012 | 24.154 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
870 | B | 118 | ASN | 0 | 0.011 | -0.008 | 22.463 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
871 | B | 119 | ILE | 0 | -0.012 | -0.006 | 26.585 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
872 | B | 120 | ILE | 0 | 0.020 | 0.039 | 29.898 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
873 | B | 121 | PRO | 0 | 0.040 | 0.038 | 27.716 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
874 | B | 122 | LEU | 0 | -0.003 | -0.010 | 29.194 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
875 | B | 123 | THR | 0 | -0.032 | -0.036 | 31.810 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
876 | B | 124 | THR | 0 | -0.042 | -0.025 | 34.252 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
877 | B | 125 | ALA | 0 | 0.010 | 0.028 | 32.737 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
878 | B | 126 | ALA | 0 | 0.019 | -0.003 | 34.898 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
879 | B | 127 | LYS | 1 | 0.892 | 0.961 | 34.132 | -0.181 | -0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
880 | B | 128 | LEU | 0 | -0.014 | 0.005 | 31.234 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
881 | B | 129 | MET | 0 | -0.028 | -0.009 | 28.376 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
882 | B | 130 | VAL | 0 | 0.008 | -0.002 | 29.544 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
883 | B | 131 | VAL | 0 | 0.005 | 0.004 | 25.555 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
884 | B | 132 | ILE | 0 | -0.016 | -0.012 | 27.289 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
885 | B | 133 | PRO | 0 | -0.001 | 0.009 | 25.239 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
886 | B | 134 | ASP | -1 | -0.718 | -0.841 | 27.348 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
887 | B | 135 | TYR | 0 | 0.028 | 0.013 | 30.495 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
888 | B | 136 | ASN | 0 | -0.062 | -0.047 | 32.183 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
889 | B | 137 | THR | 0 | -0.017 | -0.046 | 28.163 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
890 | B | 138 | TYR | 0 | 0.028 | 0.027 | 31.587 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
891 | B | 139 | LYS | 1 | 0.902 | 0.937 | 34.129 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
892 | B | 140 | ASN | 0 | -0.028 | -0.007 | 33.908 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
893 | B | 141 | THR | 0 | -0.069 | -0.036 | 31.689 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
894 | B | 142 | CYS | 0 | -0.068 | -0.028 | 34.635 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
895 | B | 143 | ASP | -1 | -0.859 | -0.925 | 36.720 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
896 | B | 144 | GLY | 0 | -0.026 | -0.006 | 39.826 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
897 | B | 145 | THR | 0 | 0.012 | -0.012 | 42.095 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
898 | B | 146 | THR | 0 | -0.094 | -0.056 | 41.971 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
899 | B | 147 | PHE | 0 | 0.062 | 0.042 | 34.960 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
900 | B | 148 | THR | 0 | -0.060 | -0.042 | 38.809 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
901 | B | 149 | TYR | 0 | 0.073 | 0.018 | 28.805 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
902 | B | 150 | ALA | 0 | 0.013 | 0.011 | 32.601 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
903 | B | 151 | SER | 0 | -0.038 | -0.014 | 34.504 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
904 | B | 152 | ALA | 0 | 0.026 | 0.024 | 37.863 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
905 | B | 153 | LEU | 0 | -0.002 | 0.004 | 39.310 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
906 | B | 154 | TRP | 0 | 0.014 | -0.003 | 35.266 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
907 | B | 155 | GLU | -1 | -0.904 | -0.945 | 40.015 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
908 | B | 156 | ILE | 0 | -0.005 | -0.012 | 38.513 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
909 | B | 157 | GLN | 0 | -0.017 | -0.001 | 39.441 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
910 | B | 158 | GLN | 0 | -0.018 | -0.028 | 37.299 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
911 | B | 159 | VAL | 0 | 0.011 | 0.009 | 35.249 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
912 | B | 160 | VAL | 0 | -0.025 | -0.012 | 32.189 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
913 | B | 161 | ASP | -1 | -0.789 | -0.909 | 32.925 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
914 | B | 162 | ALA | 0 | 0.028 | 0.023 | 27.367 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
915 | B | 163 | ASP | -1 | -0.786 | -0.849 | 28.188 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
916 | B | 164 | SER | 0 | -0.108 | -0.053 | 30.488 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
917 | B | 165 | LYS | 1 | 0.889 | 0.946 | 32.374 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
918 | B | 166 | ILE | 0 | -0.032 | -0.021 | 35.893 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
919 | B | 167 | VAL | 0 | 0.007 | 0.017 | 36.770 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
920 | B | 168 | GLN | 0 | -0.031 | -0.022 | 39.527 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
921 | B | 169 | LEU | 0 | 0.032 | 0.000 | 40.258 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
922 | B | 170 | SER | 0 | -0.021 | -0.008 | 42.451 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
923 | B | 171 | GLU | -1 | -0.898 | -0.945 | 41.201 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
924 | B | 172 | ILE | 0 | -0.005 | 0.012 | 37.173 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
925 | B | 173 | SER | 0 | -0.004 | 0.003 | 39.769 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
926 | B | 174 | MET | 0 | -0.002 | -0.011 | 36.409 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
927 | B | 175 | ASP | -1 | -0.897 | -0.942 | 39.434 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
928 | B | 176 | ASN | 0 | -0.034 | -0.035 | 41.078 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
929 | B | 177 | SER | 0 | 0.010 | 0.027 | 35.411 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
930 | B | 178 | PRO | 0 | 0.001 | -0.007 | 34.974 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
931 | B | 179 | ASN | 0 | -0.037 | -0.040 | 36.037 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
932 | B | 180 | LEU | 0 | -0.017 | 0.006 | 35.174 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
933 | B | 181 | ALA | 0 | 0.011 | 0.016 | 30.481 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
934 | B | 182 | TRP | 0 | 0.010 | -0.004 | 27.347 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
935 | B | 183 | PRO | 0 | -0.009 | -0.007 | 25.988 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
936 | B | 184 | LEU | 0 | 0.020 | 0.031 | 28.255 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
937 | B | 185 | ILE | 0 | -0.032 | -0.021 | 28.635 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
938 | B | 186 | VAL | 0 | 0.015 | 0.012 | 31.397 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
939 | B | 187 | THR | 0 | 0.008 | 0.002 | 33.283 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
940 | B | 188 | ALA | 0 | 0.007 | -0.001 | 35.299 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
941 | B | 189 | LEU | 0 | -0.028 | -0.002 | 36.983 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
942 | B | 190 | ARG | 1 | 0.837 | 0.918 | 35.033 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
943 | B | 191 | ALA | 0 | -0.055 | -0.023 | 40.211 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
944 | C | 2 | LYS | 1 | 0.896 | 0.953 | 31.256 | 0.471 | 0.471 | 0.000 | 0.000 | 0.000 | 0.000 |
945 | C | 3 | MET | 0 | -0.022 | -0.011 | 27.670 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
946 | C | 4 | SER | 0 | 0.098 | 0.045 | 25.855 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
947 | C | 5 | ASP | -1 | -0.872 | -0.934 | 26.540 | -0.545 | -0.545 | 0.000 | 0.000 | 0.000 | 0.000 |
948 | C | 6 | VAL | 0 | -0.003 | 0.002 | 28.352 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
949 | C | 7 | LYS | 1 | 0.787 | 0.887 | 22.773 | 0.856 | 0.856 | 0.000 | 0.000 | 0.000 | 0.000 |
950 | C | 8 | CYS | 0 | 0.008 | 0.003 | 24.277 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
951 | C | 9 | THR | 0 | -0.070 | -0.056 | 25.316 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
952 | C | 10 | SER | 0 | 0.006 | -0.004 | 23.940 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
953 | C | 11 | VAL | 0 | 0.004 | 0.018 | 20.998 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
954 | C | 12 | VAL | 0 | 0.010 | 0.012 | 23.500 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
955 | C | 13 | LEU | 0 | -0.026 | -0.009 | 26.012 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
956 | C | 14 | LEU | 0 | 0.011 | -0.001 | 21.815 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
957 | C | 15 | SER | 0 | 0.021 | 0.011 | 23.282 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
958 | C | 16 | VAL | 0 | -0.044 | -0.027 | 24.553 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
959 | C | 17 | LEU | 0 | 0.036 | 0.004 | 27.567 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
960 | C | 18 | GLN | 0 | -0.060 | -0.040 | 22.126 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
961 | C | 19 | GLN | 0 | -0.028 | -0.002 | 25.584 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
962 | C | 20 | LEU | 0 | -0.081 | -0.032 | 27.176 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
963 | C | 21 | ARG | 1 | 0.917 | 0.954 | 27.818 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
964 | C | 22 | VAL | 0 | 0.042 | 0.024 | 27.357 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
965 | C | 23 | GLU | -1 | -0.838 | -0.894 | 22.154 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
966 | C | 24 | SER | 0 | -0.107 | -0.044 | 26.295 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
967 | C | 25 | SER | 0 | -0.027 | -0.016 | 28.837 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
968 | C | 26 | SER | 0 | -0.009 | -0.039 | 26.696 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
969 | C | 27 | LYS | 1 | 0.844 | 0.926 | 27.615 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
970 | C | 28 | LEU | 0 | 0.008 | 0.008 | 30.139 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
971 | C | 29 | TRP | 0 | 0.050 | 0.019 | 20.993 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
972 | C | 30 | ALA | 0 | 0.055 | 0.022 | 24.657 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
973 | C | 31 | GLN | 0 | -0.040 | -0.018 | 25.377 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
974 | C | 32 | CYS | 0 | -0.051 | -0.026 | 26.579 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
975 | C | 33 | VAL | 0 | 0.025 | 0.015 | 20.479 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
976 | C | 34 | GLN | 0 | -0.038 | -0.014 | 22.598 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
977 | C | 35 | LEU | 0 | -0.010 | -0.019 | 24.202 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
978 | C | 36 | HIS | 0 | 0.038 | 0.026 | 19.958 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
979 | C | 37 | ASN | 0 | -0.022 | -0.009 | 18.852 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
980 | C | 38 | ASP | -1 | -0.796 | -0.877 | 21.174 | -0.631 | -0.631 | 0.000 | 0.000 | 0.000 | 0.000 |
981 | C | 39 | ILE | 0 | -0.031 | -0.016 | 24.087 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
982 | C | 40 | LEU | 0 | -0.016 | 0.013 | 19.098 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
983 | C | 41 | LEU | 0 | -0.012 | -0.002 | 17.871 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
984 | C | 42 | ALA | 0 | -0.045 | 0.008 | 21.624 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
985 | C | 43 | LYS | 1 | 0.955 | 0.967 | 23.546 | 0.850 | 0.850 | 0.000 | 0.000 | 0.000 | 0.000 |
986 | C | 44 | ASP | -1 | -0.760 | -0.876 | 27.031 | -0.450 | -0.450 | 0.000 | 0.000 | 0.000 | 0.000 |
987 | C | 45 | THR | 0 | 0.012 | -0.005 | 29.993 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
988 | C | 46 | THR | 0 | -0.075 | -0.035 | 32.038 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
989 | C | 47 | GLU | -1 | -0.809 | -0.919 | 28.280 | -0.585 | -0.585 | 0.000 | 0.000 | 0.000 | 0.000 |
990 | C | 48 | ALA | 0 | 0.001 | -0.001 | 28.760 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
991 | C | 49 | PHE | 0 | -0.007 | -0.016 | 30.094 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
992 | C | 50 | GLU | -1 | -0.947 | -0.974 | 33.437 | -0.347 | -0.347 | 0.000 | 0.000 | 0.000 | 0.000 |
993 | C | 51 | LYS | 1 | 0.819 | 0.887 | 27.781 | 0.549 | 0.549 | 0.000 | 0.000 | 0.000 | 0.000 |
994 | C | 52 | MET | 0 | 0.036 | 0.026 | 30.300 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
995 | C | 53 | VAL | 0 | -0.027 | -0.016 | 31.447 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
996 | C | 54 | SER | 0 | -0.024 | -0.005 | 32.547 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
997 | C | 55 | LEU | 0 | 0.023 | 0.016 | 27.177 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
998 | C | 56 | LEU | 0 | 0.007 | 0.003 | 31.462 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
999 | C | 57 | SER | 0 | -0.005 | -0.007 | 34.170 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
1000 | C | 58 | VAL | 0 | -0.013 | 0.005 | 31.660 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
1001 | C | 59 | LEU | 0 | 0.008 | 0.005 | 32.414 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
1002 | C | 60 | LEU | 0 | -0.015 | -0.016 | 34.504 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
1003 | C | 61 | SER | 0 | -0.076 | -0.035 | 37.030 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
1004 | C | 62 | MET | 0 | -0.089 | -0.036 | 32.758 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
1005 | C | 63 | GLN | 0 | 0.012 | -0.001 | 37.706 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
1006 | C | 64 | GLY | 0 | -0.039 | -0.004 | 37.730 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1007 | T | 8 | U | -1 | -0.382 | -0.318 | 16.453 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
1008 | T | 8 | p | 1 | -0.570 | -0.614 | 11.505 | 0.548 | 0.548 | 0.000 | 0.000 | 0.000 | 0.000 |
1009 | T | 9 | U | -1 | -0.388 | -0.310 | 10.382 | -0.224 | -0.224 | 0.000 | 0.000 | 0.000 | 0.000 |
1010 | T | 9 | p | 0 | -0.433 | -0.593 | 8.330 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1011 | T | 10 | U | -1 | -0.289 | -0.260 | 2.020 | -14.487 | -18.871 | 15.051 | -4.289 | -6.377 | 0.024 |
1012 | T | 10 | p | 0 | -0.587 | -0.672 | 5.315 | 1.377 | 1.377 | 0.000 | 0.000 | 0.000 | 0.000 |
1013 | T | 11 | A | -1 | -0.331 | -0.271 | 2.607 | -9.571 | -3.592 | 5.072 | -2.635 | -8.416 | -0.024 |
1014 | T | 11 | p | 0 | -0.470 | -0.583 | 3.526 | 2.474 | 2.753 | 0.004 | -0.029 | -0.254 | 0.000 |
1015 | T | 12 | U | -1 | -0.339 | -0.297 | 5.685 | -1.268 | -1.268 | 0.000 | 0.000 | 0.000 | 0.000 |
1016 | T | 12 | p | 0 | -0.556 | -0.649 | 6.781 | 2.749 | 2.749 | 0.000 | 0.000 | 0.000 | 0.000 |
1017 | T | 13 | A | -1 | -0.327 | -0.267 | 7.830 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
1018 | T | 13 | p | 0 | -0.582 | -0.675 | 10.115 | 0.961 | 0.961 | 0.000 | 0.000 | 0.000 | 0.000 |
1019 | T | 14 | A | -1 | -0.335 | -0.280 | 10.880 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
1020 | T | 14 | p | 0 | -0.604 | -0.673 | 13.209 | -0.266 | -0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
1021 | T | 15 | C | -1 | -0.299 | -0.254 | 13.979 | -0.270 | -0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
1022 | T | 15 | p | 0 | -0.567 | -0.659 | 16.119 | -0.489 | -0.489 | 0.000 | 0.000 | 0.000 | 0.000 |
1023 | T | 16 | U | -1 | -0.357 | -0.298 | 17.078 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
1024 | T | 16 | p | 0 | -0.645 | -0.697 | 18.967 | -0.475 | -0.475 | 0.000 | 0.000 | 0.000 | 0.000 |
1025 | T | 17 | U | -1 | -0.344 | -0.286 | 19.858 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
1026 | T | 17 | p | 0 | -0.581 | -0.702 | 23.043 | -0.410 | -0.410 | 0.000 | 0.000 | 0.000 | 0.000 |
1027 | T | 18 | A | -1 | -0.317 | -0.245 | 22.596 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
1028 | T | 18 | p | 0 | -0.634 | -0.716 | 25.654 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
1029 | T | 19 | A | -1 | -0.343 | -0.295 | 25.216 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
1030 | T | 19 | p | 0 | -0.695 | -0.723 | 27.930 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
1031 | T | 20 | U | -1 | -0.314 | -0.266 | 28.818 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
1032 | T | 20 | p | 0 | -0.659 | -0.709 | 30.912 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1033 | T | 21 | C | -1 | -0.297 | -0.249 | 31.719 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
1034 | T | 21 | p | 0 | 0.248 | 0.234 | 33.560 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
1035 | P | 10 | G | -1 | -0.381 | -0.304 | 30.162 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
1036 | P | 10 | p | 1 | -0.621 | -0.709 | 26.684 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
1037 | P | 11 | A | -1 | -0.355 | -0.318 | 27.516 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
1038 | P | 11 | p | 0 | -0.628 | -0.691 | 22.406 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
1039 | P | 12 | U | -1 | -0.344 | -0.278 | 24.224 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
1040 | P | 12 | p | 0 | -0.655 | -0.702 | 20.036 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
1041 | P | 13 | U | -1 | -0.309 | -0.282 | 20.805 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
1042 | P | 13 | p | 0 | -0.637 | -0.683 | 18.273 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
1043 | P | 14 | A | -1 | -0.341 | -0.296 | 19.155 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
1044 | P | 14 | p | 0 | -0.644 | -0.705 | 15.932 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
1045 | P | 15 | A | -1 | -0.351 | -0.297 | 16.025 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
1046 | P | 15 | p | 0 | -0.573 | -0.668 | 13.917 | -0.760 | -0.760 | 0.000 | 0.000 | 0.000 | 0.000 |
1047 | P | 16 | G | -1 | -0.360 | -0.315 | 13.524 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
1048 | P | 16 | p | 0 | -0.565 | -0.682 | 12.136 | -1.617 | -1.617 | 0.000 | 0.000 | 0.000 | 0.000 |
1049 | P | 17 | U | -1 | -0.331 | -0.293 | 10.415 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
1050 | P | 17 | p | 0 | -0.557 | -0.672 | 10.536 | -2.542 | -2.542 | 0.000 | 0.000 | 0.000 | 0.000 |
1051 | P | 18 | U | -1 | -0.331 | -0.298 | 7.216 | -0.385 | -0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
1052 | P | 18 | p | 0 | -0.543 | -0.632 | 8.625 | -4.009 | -4.009 | 0.000 | 0.000 | 0.000 | 0.000 |
1053 | P | 19 | A | -1 | -0.373 | -0.299 | 4.952 | -1.263 | -0.956 | 0.000 | -0.017 | -0.289 | 0.000 |
1054 | P | 19 | p | 0 | -0.474 | -0.591 | 5.524 | -5.828 | -5.828 | 0.000 | 0.000 | 0.000 | 0.000 |
1055 | P | 20 | U | -1 | -0.361 | -0.318 | 1.827 | -17.379 | -16.462 | 14.785 | -6.011 | -9.692 | -0.062 |