FMODB ID: R1338
Calculation Name: 2Y9Y-B-Xray316
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 2Y9Y
Chain ID: B
UniProt ID: P43596
Base Structure: X-ray
Registration Date: 2021-09-06
Reference: C. Watanabe, S. Koyama, K. Kamisaka, D. Takaya, T. Honma et. al., Interaction energy analysis of Apo structure dataset on FMODB, To be pubulished.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptH |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Auto-FMO protocol ver. 1.20200129 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 596 |
LigandCharge | |
Software | ABINIT-MP - Open Ver.1 Rev. 15 / 20190524 |
Total energy (hartree)
FMO2-HF: Electronic energy | -13047242.916301 |
---|---|
FMO2-HF: Nuclear repulsion | 12808004.400909 |
FMO2-HF: Total energy | -239238.515392 |
FMO2-MP2: Total energy | -239944.106327 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(B:137:ACE )
Summations of interaction energy for
fragment #1(B:137:ACE )
IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
2.904 | 4.035 | -0.002 | -0.407 | -0.723 | -0.001 |
Interaction energy analysis for fragmet #1(B:137:ACE )
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | B | 139 | GLU | -1 | -0.905 | -0.944 | 3.763 | 0.976 | 2.107 | -0.002 | -0.407 | -0.723 | -0.001 |
4 | B | 140 | PRO | 0 | -0.041 | -0.005 | 5.931 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | B | 141 | ALA | 0 | 0.057 | 0.022 | 8.730 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | B | 142 | LEU | 0 | -0.023 | -0.025 | 11.242 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | B | 143 | ILE | 0 | 0.002 | 0.013 | 14.953 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | B | 144 | PRO | 0 | 0.061 | 0.022 | 17.901 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | B | 145 | SER | 0 | 0.035 | 0.019 | 21.248 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | B | 146 | ASN | 0 | -0.079 | -0.048 | 19.451 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | B | 147 | TRP | 0 | -0.012 | -0.004 | 17.033 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | B | 148 | THR | 0 | 0.065 | 0.044 | 22.522 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | B | 149 | SER | 0 | 0.069 | 0.049 | 25.934 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | B | 150 | VAL | 0 | -0.077 | -0.048 | 27.830 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | B | 151 | ILE | 0 | 0.013 | 0.010 | 29.412 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | B | 152 | PRO | 0 | -0.053 | -0.005 | 29.386 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | B | 153 | LEU | 0 | 0.019 | 0.019 | 29.489 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | B | 154 | LEU | 0 | -0.039 | -0.003 | 32.848 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | B | 155 | THR | 0 | -0.006 | -0.024 | 33.683 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | B | 156 | SER | 0 | 0.022 | -0.013 | 36.502 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | B | 157 | ASP | -1 | -0.876 | -0.926 | 34.859 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | B | 158 | PHE | 0 | 0.027 | 0.007 | 32.628 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | B | 159 | LYS | 1 | 0.837 | 0.931 | 37.344 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | B | 160 | ASN | 0 | 0.059 | 0.024 | 39.939 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | B | 161 | GLN | 0 | 0.031 | 0.014 | 40.418 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | B | 162 | TYR | 0 | -0.030 | -0.032 | 43.466 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | B | 163 | SER | 0 | -0.058 | -0.029 | 44.346 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | B | 164 | VAL | 0 | 0.033 | 0.030 | 46.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | B | 165 | ILE | 0 | -0.050 | -0.022 | 47.613 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | B | 166 | SER | 0 | 0.084 | 0.027 | 50.955 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | B | 167 | ARG | 1 | 0.893 | 0.978 | 46.990 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | B | 168 | LEU | 0 | 0.032 | -0.010 | 48.384 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | B | 169 | LYS | 1 | 0.982 | 0.993 | 52.850 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | B | 170 | ASN | 0 | 0.030 | 0.016 | 53.327 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | B | 171 | PRO | 0 | 0.069 | 0.016 | 57.221 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | B | 172 | ASN | 0 | -0.008 | 0.005 | 55.468 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | B | 173 | MET | 0 | -0.123 | -0.046 | 51.558 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | B | 174 | LYS | 1 | 0.941 | 0.984 | 56.007 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | B | 175 | PRO | 0 | 0.016 | -0.001 | 57.092 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | B | 176 | VAL | 0 | 0.001 | 0.013 | 56.487 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | B | 177 | PRO | 0 | 0.034 | 0.033 | 56.866 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | B | 178 | TYR | 0 | 0.052 | 0.003 | 57.726 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | B | 179 | ALA | 0 | 0.014 | 0.007 | 54.048 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | B | 180 | GLY | 0 | 0.006 | -0.009 | 52.569 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | B | 181 | ASP | -1 | -0.817 | -0.910 | 53.094 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | B | 182 | ILE | 0 | 0.017 | 0.008 | 55.197 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | B | 183 | ILE | 0 | -0.001 | -0.001 | 49.150 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | B | 184 | LYS | 1 | 0.874 | 0.949 | 50.605 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | B | 185 | LEU | 0 | -0.018 | -0.001 | 51.672 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | B | 186 | MET | 0 | -0.013 | 0.011 | 51.591 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | B | 187 | ALA | 0 | -0.031 | -0.022 | 47.515 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | B | 188 | PHE | 0 | -0.014 | -0.009 | 48.522 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | B | 189 | ILE | 0 | 0.001 | 0.003 | 50.625 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | B | 190 | ASN | 0 | 0.007 | -0.010 | 44.806 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | B | 191 | LYS | 1 | 0.788 | 0.895 | 42.703 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | B | 192 | PHE | 0 | -0.032 | -0.014 | 46.888 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | B | 193 | SER | 0 | 0.014 | 0.023 | 48.254 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | B | 194 | SER | 0 | -0.074 | -0.037 | 49.187 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | B | 195 | PHE | 0 | -0.037 | -0.027 | 49.991 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | B | 196 | PHE | 0 | 0.015 | 0.027 | 53.237 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | B | 197 | HIS | 0 | 0.083 | 0.050 | 55.699 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | B | 198 | SER | 0 | 0.012 | -0.015 | 55.727 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | B | 199 | ASP | -1 | -0.926 | -0.971 | 56.402 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | B | 200 | LEU | 0 | -0.026 | -0.010 | 57.219 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | B | 201 | GLN | 0 | -0.012 | -0.010 | 51.777 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | B | 202 | ASN | 0 | 0.025 | 0.010 | 52.647 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | B | 203 | LEU | 0 | -0.029 | -0.002 | 54.725 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | B | 204 | SER | 0 | 0.023 | 0.014 | 54.483 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | B | 205 | PHE | 0 | -0.005 | -0.021 | 53.641 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | B | 206 | GLN | 0 | 0.043 | -0.008 | 55.804 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | B | 207 | ASP | -1 | -0.849 | -0.927 | 58.826 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | B | 208 | PHE | 0 | -0.005 | -0.024 | 56.283 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | B | 209 | GLU | -1 | -0.872 | -0.941 | 59.343 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | B | 210 | VAL | 0 | 0.053 | 0.024 | 62.311 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | B | 211 | GLY | 0 | -0.021 | 0.000 | 63.838 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | B | 212 | LEU | 0 | -0.122 | -0.091 | 62.354 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | B | 213 | ASP | -1 | -0.867 | -0.936 | 65.916 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | B | 214 | LEU | 0 | -0.058 | -0.022 | 61.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | B | 215 | TYR | 0 | 0.078 | 0.035 | 64.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | B | 216 | PRO | 0 | -0.057 | -0.004 | 59.603 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | B | 217 | GLY | 0 | 0.003 | -0.005 | 60.947 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | B | 218 | ASP | -1 | -0.857 | -0.935 | 62.334 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | B | 219 | PRO | 0 | -0.053 | -0.033 | 61.555 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | B | 220 | ASN | 0 | -0.027 | 0.002 | 62.436 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | B | 221 | GLY | 0 | 0.015 | -0.006 | 63.795 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | B | 222 | SER | 0 | -0.043 | -0.027 | 63.752 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | B | 223 | ALA | 0 | -0.044 | -0.031 | 65.235 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | B | 224 | ALA | 0 | 0.013 | 0.002 | 67.031 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | B | 225 | GLY | 0 | 0.035 | 0.013 | 68.892 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | B | 226 | ILE | 0 | -0.065 | -0.029 | 64.660 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | B | 227 | VAL | 0 | -0.017 | -0.010 | 64.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | B | 228 | LYS | 1 | 0.933 | 0.977 | 65.916 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | B | 229 | GLY | 0 | 0.012 | 0.011 | 65.287 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | B | 230 | PRO | 0 | -0.013 | -0.021 | 62.374 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | B | 231 | GLU | -1 | -0.980 | -0.986 | 64.410 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | B | 232 | ASP | -1 | -0.780 | -0.907 | 67.926 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | B | 233 | THR | 0 | -0.158 | -0.070 | 69.529 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | B | 234 | SER | 0 | 0.036 | 0.039 | 70.837 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | B | 235 | LEU | 0 | -0.069 | -0.033 | 70.563 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | B | 236 | LEU | 0 | -0.017 | -0.008 | 69.561 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | B | 237 | LEU | 0 | 0.085 | 0.032 | 70.099 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | B | 238 | TYR | 0 | 0.001 | -0.028 | 64.004 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | B | 239 | PRO | 0 | -0.062 | -0.044 | 69.807 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | B | 240 | ASP | -1 | -0.848 | -0.909 | 72.872 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | B | 241 | PHE | 0 | -0.091 | -0.034 | 64.911 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | B | 242 | MET | 0 | -0.043 | -0.021 | 65.206 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | B | 243 | ALA | 0 | 0.052 | 0.037 | 69.843 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | B | 244 | ILE | 0 | 0.078 | 0.020 | 71.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | B | 245 | LYS | 1 | 0.932 | 0.971 | 68.992 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | B | 246 | ASP | -1 | -0.866 | -0.952 | 67.373 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | B | 247 | ILE | 0 | 0.024 | 0.014 | 67.117 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | B | 248 | VAL | 0 | -0.013 | -0.019 | 68.302 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | B | 249 | TYR | 0 | -0.099 | -0.037 | 61.996 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | B | 250 | CYS | 0 | -0.007 | -0.003 | 64.070 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | B | 251 | GLN | 0 | -0.003 | -0.005 | 64.658 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | B | 252 | ASP | -1 | -0.930 | -0.965 | 66.737 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | B | 253 | LYS | 1 | 0.810 | 0.924 | 59.677 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | B | 254 | MET | 0 | 0.023 | 0.030 | 60.436 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | B | 255 | ASN | 0 | 0.104 | 0.053 | 63.598 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | B | 256 | LEU | 0 | -0.013 | 0.012 | 61.711 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | B | 257 | LEU | 0 | -0.001 | 0.008 | 57.603 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | B | 258 | PHE | 0 | 0.002 | -0.014 | 61.229 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | B | 259 | LEU | 0 | -0.006 | -0.013 | 63.696 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | B | 260 | SER | 0 | -0.013 | -0.030 | 59.977 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | B | 261 | LEU | 0 | -0.033 | -0.006 | 57.229 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | B | 262 | LEU | 0 | -0.024 | -0.007 | 60.410 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | B | 263 | ASP | -1 | -0.850 | -0.946 | 62.990 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | B | 264 | LEU | 0 | -0.002 | 0.018 | 55.315 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | B | 265 | THR | 0 | -0.028 | -0.013 | 58.777 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | B | 266 | PHE | 0 | -0.099 | -0.049 | 60.259 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | B | 267 | THR | 0 | -0.074 | -0.046 | 63.745 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | B | 268 | GLU | -1 | -0.892 | -0.926 | 59.207 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | B | 269 | ASN | 0 | 0.038 | 0.008 | 59.832 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | B | 270 | PHE | 0 | -0.073 | -0.014 | 61.145 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | B | 271 | ASP | -1 | -0.849 | -0.928 | 58.085 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | B | 272 | GLY | 0 | 0.050 | 0.013 | 59.237 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | B | 273 | LYS | 1 | 0.780 | 0.891 | 54.554 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | B | 274 | SER | 0 | 0.064 | 0.021 | 55.476 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | B | 275 | ALA | 0 | -0.002 | -0.002 | 51.860 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | B | 276 | LYS | 1 | 0.960 | 0.981 | 50.492 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | B | 277 | LYS | 1 | 0.917 | 0.964 | 52.489 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | B | 278 | LYS | 1 | 1.007 | 0.993 | 53.029 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | B | 279 | GLY | 0 | -0.023 | 0.003 | 55.642 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | B | 280 | PRO | 0 | -0.013 | -0.025 | 59.403 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | B | 281 | LEU | 0 | 0.046 | 0.038 | 56.860 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | B | 282 | THR | 0 | 0.081 | 0.039 | 60.525 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | B | 283 | THR | 0 | -0.050 | -0.016 | 62.915 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | B | 284 | TRP | 0 | 0.039 | -0.007 | 64.633 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | B | 285 | GLU | -1 | -0.953 | -0.975 | 66.071 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | B | 286 | ASN | 0 | -0.015 | -0.013 | 66.984 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | B | 287 | LEU | 0 | 0.033 | 0.019 | 66.672 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | B | 288 | LYS | 1 | 0.886 | 0.964 | 69.113 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | B | 289 | SER | 0 | 0.067 | 0.050 | 72.340 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | B | 290 | SER | 0 | 0.008 | 0.007 | 74.439 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | B | 291 | SER | 0 | -0.056 | -0.038 | 76.319 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | B | 292 | LYS | 1 | 0.989 | 0.974 | 77.400 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | B | 293 | LYS | 1 | 0.902 | 0.939 | 75.616 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | B | 294 | VAL | 0 | 0.033 | 0.031 | 71.094 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | B | 295 | PHE | 0 | 0.101 | 0.042 | 67.998 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | B | 296 | SER | 0 | -0.047 | -0.002 | 71.693 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | B | 297 | ASN | 0 | 0.013 | -0.004 | 72.379 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | B | 298 | PRO | 0 | 0.041 | 0.026 | 67.493 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | B | 299 | LEU | 0 | 0.058 | 0.020 | 68.611 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | B | 300 | TYR | 0 | -0.034 | -0.001 | 70.369 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | B | 301 | ARG | 1 | 0.959 | 0.982 | 65.955 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | B | 302 | LEU | 0 | 0.019 | 0.013 | 64.531 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | B | 303 | ARG | 1 | 0.836 | 0.900 | 67.752 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | B | 304 | LEU | 0 | -0.044 | -0.001 | 70.221 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | B | 305 | VAL | 0 | 0.014 | 0.007 | 65.035 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | B | 306 | ALA | 0 | -0.042 | -0.017 | 65.835 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | B | 307 | ARG | 1 | 0.834 | 0.904 | 65.983 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | B | 308 | GLU | -1 | -0.902 | -0.953 | 64.464 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | B | 309 | TRP | 0 | -0.052 | -0.035 | 61.667 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | B | 310 | GLY | 0 | 0.041 | 0.041 | 61.053 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | B | 311 | TYR | 0 | 0.041 | 0.014 | 62.411 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | B | 312 | PRO | 0 | 0.036 | 0.009 | 61.295 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | B | 313 | ARG | 1 | 0.943 | 0.949 | 57.986 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | B | 314 | GLU | -1 | -0.880 | -0.932 | 61.083 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | B | 315 | TRP | 0 | -0.030 | -0.027 | 64.786 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | B | 316 | ARG | 1 | 0.849 | 0.941 | 60.411 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | B | 317 | GLN | 0 | 0.038 | 0.005 | 67.434 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | B | 318 | GLN | 0 | -0.053 | -0.006 | 68.518 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | B | 319 | LEU | 0 | 0.013 | -0.010 | 68.220 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | B | 320 | PRO | 0 | -0.023 | -0.023 | 71.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | B | 321 | SER | 0 | 0.037 | 0.030 | 73.429 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | B | 322 | ASP | -1 | -0.923 | -0.937 | 71.625 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | B | 323 | GLN | 0 | -0.100 | -0.071 | 72.004 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | B | 324 | ASP | -1 | -0.854 | -0.921 | 71.122 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | B | 325 | ILE | 0 | -0.078 | -0.049 | 64.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | B | 326 | SER | 0 | 0.033 | 0.009 | 64.006 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | B | 327 | LYS | 1 | 0.859 | 0.932 | 58.775 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | B | 328 | PRO | 0 | 0.015 | 0.008 | 62.659 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | B | 329 | LYS | 1 | 0.916 | 0.970 | 64.796 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | B | 330 | THR | 0 | -0.045 | -0.018 | 67.774 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | B | 331 | ALA | 0 | 0.070 | 0.033 | 71.326 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | B | 332 | LEU | 0 | -0.040 | 0.010 | 73.306 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | B | 333 | PHE | 0 | -0.038 | -0.009 | 75.061 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | B | 334 | GLU | -1 | -0.835 | -0.934 | 76.671 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | B | 335 | GLN | 0 | -0.072 | -0.040 | 77.688 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | B | 336 | ASP | -1 | -0.942 | -0.978 | 79.177 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | B | 337 | GLU | -1 | -0.960 | -0.966 | 72.728 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | B | 338 | GLN | 0 | 0.008 | -0.001 | 74.548 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | B | 339 | THR | 0 | -0.040 | -0.031 | 76.397 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | B | 340 | PRO | 0 | -0.020 | -0.008 | 77.977 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | B | 341 | VAL | 0 | -0.006 | 0.014 | 75.424 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | B | 342 | VAL | 0 | 0.047 | 0.017 | 76.812 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | B | 343 | ASP | -1 | -0.813 | -0.921 | 74.602 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | B | 344 | PRO | 0 | -0.010 | -0.009 | 75.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | B | 345 | SER | 0 | -0.022 | -0.002 | 74.397 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | B | 346 | HIS | 1 | 0.757 | 0.874 | 69.577 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | B | 347 | PRO | 0 | -0.001 | 0.006 | 71.254 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | B | 348 | GLU | -1 | -0.939 | -0.966 | 67.726 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | B | 349 | ILE | 0 | -0.016 | -0.012 | 69.135 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | B | 350 | LEU | 0 | 0.035 | 0.020 | 65.313 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | B | 351 | THR | 0 | -0.070 | -0.042 | 67.586 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | B | 352 | PRO | 0 | -0.003 | 0.009 | 69.023 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | B | 353 | ASN | 0 | 0.104 | 0.037 | 71.537 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | B | 354 | ILE | 0 | -0.020 | 0.009 | 71.382 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | B | 355 | TYR | 0 | 0.003 | -0.012 | 69.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | B | 356 | THR | 0 | -0.033 | -0.017 | 70.345 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | B | 357 | TRP | 0 | 0.009 | 0.002 | 65.630 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | B | 358 | ASN | 0 | 0.048 | 0.017 | 68.612 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | B | 359 | ALA | 0 | 0.005 | 0.004 | 64.727 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | B | 360 | ASN | 0 | -0.055 | -0.048 | 61.625 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | B | 361 | GLU | -1 | -0.749 | -0.852 | 65.771 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | B | 362 | PRO | 0 | -0.047 | -0.022 | 68.868 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | B | 363 | LEU | 0 | 0.000 | 0.018 | 69.938 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | B | 364 | PRO | 0 | 0.032 | 0.016 | 72.244 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | B | 365 | LEU | 0 | 0.008 | -0.006 | 75.687 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | B | 366 | GLU | -1 | -0.917 | -0.967 | 77.439 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | B | 367 | SER | 0 | -0.043 | -0.023 | 75.452 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | B | 368 | ASN | 0 | -0.004 | 0.015 | 71.040 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | B | 369 | PRO | 0 | 0.055 | 0.020 | 69.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | B | 370 | LEU | 0 | -0.003 | 0.006 | 68.033 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | B | 371 | TYR | 0 | -0.051 | -0.035 | 70.689 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | B | 372 | ASN | 0 | 0.038 | 0.011 | 73.617 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | B | 373 | ARG | 1 | 0.960 | 0.976 | 75.403 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | B | 374 | GLU | -1 | -0.938 | -0.972 | 76.896 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | B | 375 | MET | 0 | -0.088 | -0.037 | 70.465 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | B | 376 | ASP | -1 | -0.877 | -0.927 | 73.839 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | B | 377 | LYS | 1 | 0.914 | 0.952 | 75.092 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | B | 378 | ASN | 0 | -0.013 | 0.007 | 75.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | B | 379 | GLY | 0 | 0.092 | 0.037 | 71.378 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | B | 380 | ILE | 0 | -0.016 | -0.018 | 65.017 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | B | 381 | LEU | 0 | -0.032 | -0.034 | 69.172 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | B | 382 | ALA | 0 | -0.029 | 0.012 | 70.714 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | B | 383 | LEU | 0 | -0.045 | -0.008 | 69.340 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | B | 384 | LYS | 1 | 1.022 | 1.002 | 70.391 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | B | 385 | PRO | 0 | 0.067 | 0.031 | 67.852 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | B | 386 | MET | 0 | 0.031 | 0.017 | 61.903 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | B | 387 | ASP | -1 | -0.810 | -0.912 | 64.597 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | B | 388 | ARG | 1 | 0.846 | 0.938 | 65.344 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | B | 389 | VAL | 0 | 0.040 | 0.018 | 59.749 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | B | 390 | VAL | 0 | -0.004 | 0.016 | 60.929 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | B | 391 | LEU | 0 | 0.001 | 0.004 | 61.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | B | 392 | LEU | 0 | 0.016 | 0.005 | 59.938 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | B | 393 | ARG | 1 | 0.795 | 0.884 | 56.415 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | B | 394 | ALA | 0 | 0.018 | -0.013 | 57.728 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | B | 395 | LEU | 0 | 0.000 | -0.001 | 59.518 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | B | 396 | THR | 0 | -0.045 | -0.002 | 54.123 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | B | 397 | ASP | -1 | -0.887 | -0.931 | 54.281 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | B | 398 | TRP | 0 | -0.024 | -0.035 | 55.727 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | B | 399 | CYS | 0 | 0.011 | -0.003 | 56.564 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | B | 400 | ALA | 0 | 0.047 | 0.010 | 51.911 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | B | 401 | SER | 0 | -0.061 | -0.019 | 52.880 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | B | 402 | HIS | 1 | 0.837 | 0.922 | 55.221 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | B | 403 | SER | 0 | 0.021 | 0.011 | 55.845 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | B | 404 | SER | 0 | -0.004 | 0.002 | 55.211 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | B | 405 | ALA | 0 | 0.014 | 0.023 | 54.533 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | B | 406 | ILE | 0 | 0.030 | -0.002 | 51.608 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | B | 407 | HIS | 0 | -0.044 | -0.017 | 50.380 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | B | 408 | ASP | -1 | -0.851 | -0.929 | 49.956 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | B | 409 | GLU | -1 | -1.048 | -1.028 | 46.411 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | B | 410 | ILE | 0 | 0.043 | 0.008 | 45.989 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | B | 411 | TYR | 0 | 0.017 | 0.006 | 44.747 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | B | 412 | LYS | 1 | 0.910 | 0.943 | 43.941 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | B | 413 | LEU | 0 | -0.070 | -0.024 | 40.042 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | B | 414 | THR | 0 | -0.076 | -0.020 | 40.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | B | 415 | HIS | 0 | -0.049 | -0.008 | 40.214 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | B | 416 | GLY | 0 | 0.020 | 0.016 | 37.027 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | B | 417 | LYS | 1 | 0.927 | 0.946 | 35.377 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | B | 418 | LYS | 1 | 0.923 | 0.971 | 27.182 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | B | 419 | ASP | -1 | -0.820 | -0.907 | 31.629 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | B | 420 | PRO | 0 | -0.039 | -0.021 | 30.080 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | B | 421 | VAL | 0 | 0.038 | 0.019 | 24.234 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | B | 422 | PHE | 0 | -0.080 | -0.044 | 27.308 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | B | 423 | GLY | 0 | 0.031 | 0.025 | 28.591 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | B | 424 | ILE | 0 | -0.003 | -0.004 | 31.400 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | B | 425 | GLN | 0 | 0.012 | -0.003 | 33.300 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | B | 426 | THR | 0 | -0.034 | -0.018 | 36.270 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | B | 427 | GLN | 0 | -0.014 | -0.012 | 38.400 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | B | 428 | GLN | 0 | 0.026 | 0.008 | 34.942 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | B | 429 | VAL | 0 | 0.038 | 0.021 | 34.723 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | B | 430 | PRO | 0 | 0.116 | 0.041 | 33.791 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | B | 431 | ARG | 1 | 0.868 | 0.962 | 24.902 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | B | 432 | TYR | 0 | 0.071 | 0.015 | 31.086 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | B | 433 | THR | 0 | -0.048 | -0.016 | 32.697 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | B | 434 | ILE | 0 | -0.010 | -0.017 | 31.638 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | B | 435 | GLU | -1 | -0.973 | -0.992 | 27.951 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | B | 436 | GLY | 0 | 0.020 | 0.021 | 30.699 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | B | 437 | VAL | 0 | 0.078 | 0.026 | 30.585 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | B | 438 | ASP | -1 | -0.822 | -0.918 | 29.966 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | B | 439 | ASN | 0 | -0.115 | -0.061 | 27.106 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | B | 440 | THR | 0 | -0.036 | -0.023 | 25.949 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | B | 441 | ILE | 0 | 0.024 | 0.022 | 25.823 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | B | 442 | ASN | 0 | -0.021 | -0.019 | 22.721 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | B | 443 | GLN | 0 | -0.044 | -0.022 | 21.238 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | B | 444 | PHE | 0 | 0.114 | 0.065 | 20.888 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | B | 445 | LYS | 1 | 1.009 | 1.011 | 19.945 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | B | 446 | LYS | 1 | 0.922 | 0.957 | 16.780 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | B | 447 | LEU | 0 | 0.026 | 0.023 | 15.800 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | B | 448 | CYS | 0 | 0.003 | -0.010 | 16.349 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | B | 449 | SER | 0 | -0.021 | -0.014 | 13.411 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | B | 450 | LEU | 0 | -0.042 | -0.014 | 11.603 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | B | 451 | ILE | 0 | -0.038 | -0.012 | 11.877 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | B | 452 | GLN | 0 | 0.005 | 0.016 | 11.557 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | B | 453 | SER | 0 | 0.016 | -0.002 | 6.918 | -0.197 | -0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | B | 454 | ARG | 1 | 0.866 | 0.945 | 8.765 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | B | 455 | TYR | 0 | 0.035 | 0.017 | 11.266 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | B | 456 | GLU | -1 | -1.014 | -1.001 | 8.061 | -0.573 | -0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | B | 457 | ILE | 0 | 0.057 | 0.047 | 5.441 | -0.545 | -0.545 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | B | 458 | ARG | 1 | 0.883 | 0.924 | 7.430 | 1.187 | 1.187 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | B | 459 | SER | 0 | 0.058 | 0.041 | 8.574 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | B | 460 | LYS | 1 | 0.933 | 0.958 | 10.037 | 0.444 | 0.444 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | B | 461 | LYS | 1 | 1.035 | 1.007 | 11.800 | 0.583 | 0.583 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | B | 462 | LYS | 1 | 0.954 | 0.986 | 14.867 | 0.295 | 0.295 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | B | 463 | HIS | 0 | -0.023 | -0.016 | 17.423 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | B | 464 | PHE | 0 | -0.022 | -0.016 | 16.947 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | B | 465 | VAL | 0 | 0.009 | -0.001 | 16.768 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | B | 466 | LYS | 1 | 0.954 | 0.984 | 19.769 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | B | 467 | GLN | 0 | 0.033 | 0.019 | 22.423 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | B | 468 | LEU | 0 | 0.060 | 0.037 | 23.754 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | B | 469 | LYS | 1 | 0.952 | 0.970 | 25.119 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | B | 470 | GLU | -1 | -0.966 | -1.000 | 26.627 | -0.116 | -0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | B | 471 | GLY | 0 | 0.130 | 0.072 | 27.520 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | B | 472 | LYS | 1 | 0.896 | 0.938 | 21.800 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | B | 473 | LYS | 1 | 0.979 | 0.990 | 22.238 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | B | 474 | PRO | 0 | 0.025 | 0.021 | 23.880 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | B | 475 | ASP | -1 | -0.784 | -0.881 | 20.467 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | B | 476 | LEU | 0 | -0.107 | -0.081 | 18.259 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | B | 477 | SER | 0 | -0.025 | -0.011 | 20.242 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | B | 478 | ARG | 1 | 1.000 | 0.994 | 22.272 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | B | 479 | LYS | 1 | 0.887 | 0.969 | 16.203 | 0.321 | 0.321 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | B | 480 | LEU | 0 | -0.039 | -0.019 | 17.409 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | B | 481 | GLU | -1 | -0.890 | -0.948 | 19.619 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | B | 482 | ILE | 0 | 0.066 | 0.034 | 17.442 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | B | 483 | LEU | 0 | -0.027 | -0.008 | 14.386 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | B | 484 | LYS | 1 | 0.837 | 0.908 | 17.951 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | B | 485 | GLU | -1 | -0.852 | -0.921 | 20.855 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | B | 486 | ILE | 0 | 0.038 | 0.024 | 15.793 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | B | 487 | LYS | 1 | 0.871 | 0.924 | 15.073 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | B | 488 | ALA | 0 | -0.039 | -0.006 | 20.325 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | B | 489 | GLU | -1 | -0.823 | -0.899 | 22.806 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | B | 490 | LEU | 0 | -0.072 | -0.052 | 17.918 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | B | 491 | LYS | 1 | 0.856 | 0.922 | 18.546 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | B | 492 | ASN | 0 | -0.043 | -0.004 | 23.471 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | B | 493 | ALA | 0 | 0.124 | 0.061 | 26.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | B | 494 | VAL | 0 | -0.036 | -0.014 | 26.434 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | B | 495 | LYS | 1 | 0.882 | 0.936 | 25.694 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | B | 496 | SER | 0 | 0.060 | 0.047 | 27.294 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | B | 497 | GLU | -1 | -0.850 | -0.934 | 28.877 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | B | 498 | LYS | 1 | 0.827 | 0.899 | 24.290 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | B | 499 | ASP | -1 | -0.841 | -0.904 | 27.183 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | B | 500 | GLU | -1 | -0.834 | -0.927 | 28.890 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | B | 501 | LEU | 0 | -0.112 | -0.033 | 21.618 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | B | 502 | LEU | 0 | -0.047 | -0.057 | 24.319 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | B | 503 | PHE | 0 | 0.007 | 0.001 | 26.486 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | B | 504 | SER | 0 | 0.030 | 0.031 | 28.612 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | B | 505 | LEU | 0 | -0.036 | -0.018 | 22.514 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | B | 506 | TYR | 0 | -0.064 | -0.040 | 25.360 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | B | 507 | ASP | -1 | -0.851 | -0.929 | 26.873 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | B | 508 | LYS | 1 | 0.908 | 0.945 | 24.960 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | B | 509 | TRP | 0 | 0.018 | 0.001 | 17.299 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | B | 510 | VAL | 0 | 0.022 | 0.022 | 22.643 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | B | 511 | PRO | 0 | -0.024 | -0.027 | 24.487 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | B | 512 | LEU | 0 | -0.067 | -0.019 | 17.223 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | B | 513 | PHE | 0 | -0.024 | -0.034 | 20.250 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | B | 514 | GLU | -1 | -0.935 | -0.949 | 21.501 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | B | 515 | GLY | 0 | 0.019 | 0.007 | 21.548 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | B | 516 | GLU | -1 | -0.981 | -0.990 | 16.119 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | B | 517 | LEU | 0 | -0.047 | -0.027 | 17.271 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | B | 518 | PRO | 0 | -0.035 | -0.024 | 21.167 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | B | 519 | ASP | -1 | -0.852 | -0.916 | 24.080 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | B | 520 | GLN | 0 | 0.050 | 0.008 | 23.260 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | B | 521 | PRO | 0 | -0.008 | -0.019 | 23.489 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | B | 522 | LEU | 0 | -0.089 | -0.056 | 25.849 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | B | 523 | ALA | 0 | 0.076 | 0.069 | 28.257 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | B | 524 | ASN | 0 | 0.040 | 0.012 | 30.239 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | B | 525 | PRO | 0 | 0.032 | 0.013 | 32.781 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | B | 526 | PHE | 0 | -0.066 | -0.026 | 34.453 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | B | 527 | SER | 0 | -0.008 | -0.019 | 35.382 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | B | 528 | GLU | -1 | -0.852 | -0.913 | 32.588 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | B | 529 | ARG | 1 | 0.876 | 0.930 | 35.898 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | B | 530 | LEU | 0 | 0.007 | 0.010 | 32.019 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | B | 531 | TYR | 0 | 0.036 | 0.006 | 29.324 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | B | 532 | LYS | 1 | 0.910 | 0.976 | 36.080 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | B | 533 | LEU | 0 | 0.035 | 0.014 | 39.562 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | B | 534 | ARG | 1 | 0.948 | 0.967 | 38.887 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | B | 535 | LEU | 0 | -0.005 | 0.024 | 36.528 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | B | 536 | GLN | 0 | -0.026 | -0.004 | 39.210 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | B | 537 | GLU | -1 | -0.734 | -0.864 | 40.792 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | B | 538 | PHE | 0 | -0.025 | 0.003 | 42.348 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | B | 539 | PHE | 0 | -0.028 | -0.016 | 37.237 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | B | 540 | LEU | 0 | 0.003 | -0.008 | 40.449 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | B | 541 | GLY | 0 | 0.065 | 0.031 | 38.348 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | B | 542 | ARG | 1 | 0.761 | 0.900 | 37.152 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | B | 543 | VAL | 0 | 0.006 | 0.012 | 38.295 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | B | 544 | PRO | 0 | -0.025 | -0.026 | 37.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | B | 545 | HIS | 0 | -0.025 | -0.030 | 39.882 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | B | 546 | ILE | 0 | -0.006 | 0.010 | 43.132 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | B | 547 | GLY | 0 | -0.013 | 0.006 | 43.268 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | B | 548 | ASP | -1 | -0.833 | -0.917 | 41.720 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | B | 549 | PHE | 0 | 0.014 | 0.009 | 42.888 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | B | 550 | TYR | 0 | -0.024 | -0.012 | 43.181 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | B | 551 | MET | 0 | 0.019 | 0.012 | 44.749 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | B | 552 | PRO | 0 | -0.026 | -0.005 | 47.143 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | B | 553 | ARG | 1 | 0.894 | 0.954 | 46.582 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | B | 554 | LEU | 0 | 0.047 | 0.002 | 47.871 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | B | 555 | HIS | 1 | 0.860 | 0.943 | 47.969 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | B | 556 | SER | 0 | -0.016 | -0.007 | 42.724 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | B | 557 | TYR | 0 | 0.024 | -0.031 | 41.183 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | B | 558 | GLY | 0 | -0.050 | -0.034 | 44.141 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | B | 559 | ASP | -1 | -0.901 | -0.940 | 45.353 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | B | 560 | SER | 0 | 0.007 | -0.016 | 47.608 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | B | 561 | LEU | 0 | -0.066 | -0.004 | 42.415 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | B | 562 | GLU | -1 | -0.940 | -0.969 | 43.670 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | B | 563 | MET | 0 | -0.023 | -0.016 | 44.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | B | 564 | SER | 0 | -0.039 | -0.007 | 43.362 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | B | 565 | THR | 0 | 0.024 | -0.003 | 42.220 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | B | 566 | PHE | 0 | -0.063 | -0.009 | 40.346 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | B | 567 | THR | 0 | 0.048 | 0.017 | 36.763 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | B | 568 | ASP | -1 | -0.840 | -0.935 | 32.211 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | B | 569 | LEU | 0 | -0.008 | -0.013 | 30.985 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | B | 570 | ARG | 1 | 0.931 | 0.981 | 30.329 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | B | 571 | ASN | 0 | 0.040 | 0.013 | 32.990 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | B | 572 | LEU | 0 | -0.024 | 0.005 | 36.227 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | B | 573 | GLN | 0 | 0.003 | -0.003 | 34.914 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | B | 574 | ALA | 0 | -0.026 | -0.009 | 36.329 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | B | 575 | LEU | 0 | -0.022 | -0.003 | 38.043 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | B | 576 | LEU | 0 | 0.012 | -0.012 | 40.140 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | B | 577 | SER | 0 | 0.005 | 0.003 | 39.442 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | B | 578 | LYS | 1 | 0.936 | 0.982 | 40.872 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | B | 579 | PHE | 0 | 0.013 | 0.002 | 44.139 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | B | 580 | LYS | 1 | 0.924 | 0.974 | 41.337 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | B | 581 | ASN | 0 | -0.047 | -0.025 | 44.207 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | B | 582 | ASN | 0 | -0.045 | -0.027 | 46.427 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | B | 583 | GLU | -1 | -0.926 | -0.940 | 44.785 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | B | 584 | TYR | 0 | -0.040 | -0.028 | 45.489 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | B | 585 | ASN | 0 | 0.059 | 0.027 | 49.209 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | B | 586 | ALA | 0 | 0.078 | 0.027 | 52.471 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | B | 587 | PHE | 0 | -0.053 | -0.023 | 54.168 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | B | 588 | THR | 0 | -0.011 | -0.032 | 50.674 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | B | 589 | LEU | 0 | 0.018 | 0.024 | 50.492 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | B | 590 | PHE | 0 | -0.043 | -0.009 | 52.387 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | B | 591 | GLU | -1 | -0.942 | -0.975 | 53.365 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | B | 592 | ASN | 0 | -0.031 | 0.001 | 48.147 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | B | 593 | ASP | -1 | -0.869 | -0.947 | 50.339 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | B | 594 | GLY | 0 | 0.039 | 0.004 | 51.146 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | B | 595 | GLN | 0 | 0.014 | -0.014 | 52.193 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | B | 596 | SER | 0 | -0.088 | -0.037 | 51.740 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | B | 597 | MET | 0 | -0.056 | -0.005 | 46.774 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | B | 598 | SER | 0 | -0.052 | -0.012 | 50.967 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | B | 599 | ALA | 0 | -0.016 | 0.008 | 52.255 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | B | 600 | GLN | 0 | 0.042 | 0.021 | 53.817 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | B | 601 | PHE | 0 | 0.010 | -0.009 | 50.248 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | B | 602 | LYS | 1 | 0.866 | 0.969 | 51.934 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | B | 603 | LEU | 0 | -0.012 | -0.002 | 46.309 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | B | 604 | PHE | 0 | 0.025 | 0.000 | 49.319 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | B | 605 | TYR | 0 | -0.045 | -0.040 | 46.712 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | B | 606 | HIS | 0 | -0.015 | -0.024 | 46.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | B | 607 | ASP | -1 | -0.721 | -0.869 | 46.962 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | B | 608 | THR | 0 | -0.017 | -0.019 | 43.916 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | B | 609 | PRO | 0 | -0.039 | -0.015 | 44.456 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | B | 610 | SER | 0 | 0.010 | -0.012 | 46.247 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | B | 611 | LEU | 0 | 0.014 | 0.027 | 47.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | B | 612 | ALA | 0 | 0.016 | 0.000 | 44.962 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | B | 613 | HIS | 1 | 0.816 | 0.917 | 45.220 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | B | 614 | ASP | -1 | -0.873 | -0.947 | 48.774 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | B | 615 | VAL | 0 | -0.039 | -0.025 | 49.139 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | B | 616 | ALA | 0 | -0.023 | -0.006 | 47.340 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | B | 617 | ARG | 1 | 0.914 | 0.977 | 49.140 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | B | 618 | GLY | 0 | 0.043 | 0.008 | 52.537 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | B | 619 | ARG | 1 | 0.906 | 0.964 | 52.213 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | B | 620 | ASN | 0 | -0.014 | -0.013 | 56.044 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | B | 621 | THR | 0 | 0.009 | -0.005 | 53.745 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | B | 622 | SER | 0 | -0.043 | -0.027 | 57.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | B | 623 | GLY | 0 | 0.116 | 0.062 | 59.892 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | B | 624 | LYS | 1 | 0.870 | 0.964 | 55.988 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | B | 625 | VAL | 0 | 0.062 | 0.030 | 56.026 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | B | 626 | TYR | 0 | -0.062 | -0.036 | 51.034 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | B | 627 | TRP | 0 | 0.022 | 0.039 | 47.888 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | B | 628 | TYR | 0 | 0.004 | -0.003 | 52.134 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | B | 629 | GLU | -1 | -0.806 | -0.917 | 52.351 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | B | 630 | LEU | 0 | -0.048 | -0.025 | 48.832 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | B | 631 | CYS | 0 | 0.000 | 0.005 | 51.982 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | B | 632 | HIS | 0 | -0.019 | -0.013 | 54.411 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | B | 633 | ASP | -1 | -0.758 | -0.855 | 55.606 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | B | 634 | SER | 0 | -0.076 | -0.077 | 52.848 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | B | 635 | ALA | 0 | -0.002 | 0.004 | 53.601 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | B | 636 | THR | 0 | 0.049 | -0.010 | 55.491 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | B | 637 | LEU | 0 | -0.041 | -0.028 | 48.284 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | B | 638 | LEU | 0 | -0.009 | -0.012 | 50.287 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | B | 639 | GLU | -1 | -0.804 | -0.888 | 51.768 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | B | 640 | PHE | 0 | -0.046 | -0.024 | 47.043 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | B | 641 | LEU | 0 | -0.065 | -0.040 | 45.391 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | B | 642 | GLU | -1 | -0.908 | -0.935 | 48.223 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | B | 643 | PHE | 0 | -0.050 | -0.017 | 50.612 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | B | 644 | LEU | 0 | -0.046 | -0.040 | 44.305 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | B | 645 | ASP | -1 | -0.797 | -0.923 | 46.086 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | B | 646 | TYR | 0 | -0.038 | -0.017 | 46.756 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | B | 647 | LYS | 1 | 0.797 | 0.911 | 45.470 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | B | 648 | ILE | 0 | -0.045 | -0.005 | 41.732 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | B | 649 | VAL | 0 | 0.022 | 0.040 | 41.952 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | B | 650 | LYS | 1 | 0.947 | 0.951 | 38.890 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | B | 651 | PRO | 0 | -0.056 | -0.040 | 42.817 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | B | 652 | GLN | 0 | -0.014 | 0.000 | 44.864 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | B | 653 | ASP | -1 | -0.919 | -0.955 | 46.391 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | B | 654 | GLU | -1 | -0.969 | -0.975 | 48.252 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | B | 655 | LYS | 1 | 0.911 | 0.952 | 51.196 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | B | 656 | LYS | 1 | 0.965 | 0.981 | 54.494 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | B | 657 | GLU | -1 | -0.899 | -0.955 | 58.045 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | B | 658 | GLY | 0 | -0.043 | -0.023 | 59.364 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | B | 659 | ASN | 0 | 0.028 | 0.018 | 62.002 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | B | 660 | GLU | -1 | -0.948 | -0.971 | 64.639 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | B | 661 | LYS | 1 | 0.864 | 0.923 | 68.278 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | B | 662 | NME | 0 | 0.052 | 0.045 | 67.666 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | B | 678 | ACE | 0 | 0.006 | -0.008 | 70.064 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | B | 679 | THR | 0 | -0.016 | -0.017 | 66.818 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | B | 680 | ASP | -1 | -0.931 | -0.943 | 63.577 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | B | 681 | ASN | 0 | 0.011 | -0.006 | 66.118 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | B | 682 | LYS | 1 | 0.879 | 0.925 | 58.313 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | B | 683 | PRO | 0 | 0.048 | 0.041 | 63.898 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | B | 684 | SER | 0 | 0.049 | 0.022 | 61.770 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | B | 685 | ILE | 0 | -0.020 | -0.016 | 55.037 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | B | 686 | ASN | 0 | 0.019 | 0.021 | 57.880 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | B | 687 | THR | 0 | -0.139 | -0.071 | 52.853 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | B | 688 | ASN | 0 | 0.121 | 0.037 | 51.603 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | B | 689 | PRO | 0 | 0.023 | 0.017 | 49.631 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | B | 690 | LEU | 0 | 0.012 | 0.007 | 44.010 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | B | 691 | PRO | 0 | -0.063 | -0.036 | 42.356 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | B | 692 | LYS | 1 | 0.985 | 0.991 | 44.218 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | B | 693 | ASP | -1 | -0.823 | -0.907 | 42.382 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | B | 694 | ALA | 0 | -0.005 | -0.014 | 38.183 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | B | 695 | LYS | 1 | 0.986 | 1.002 | 38.231 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | B | 696 | TYR | 0 | -0.044 | -0.024 | 38.775 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | B | 697 | ASN | 0 | 0.040 | -0.012 | 35.133 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | B | 698 | THR | 0 | -0.041 | -0.021 | 34.497 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | B | 699 | ALA | 0 | 0.006 | -0.003 | 35.855 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | B | 700 | ARG | 1 | 0.980 | 1.008 | 38.586 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | B | 701 | LYS | 1 | 0.985 | 0.998 | 31.234 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | B | 702 | LYS | 1 | 0.943 | 0.979 | 32.355 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | B | 703 | LEU | 0 | 0.004 | 0.010 | 37.209 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | B | 704 | GLN | 0 | 0.043 | 0.016 | 37.959 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | B | 705 | ILE | 0 | 0.065 | 0.029 | 34.432 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | B | 706 | LEU | 0 | -0.016 | 0.002 | 37.479 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | B | 707 | LYS | 1 | 0.940 | 0.968 | 40.551 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | B | 708 | GLU | -1 | -0.949 | -0.965 | 36.193 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | B | 709 | PHE | 0 | 0.006 | -0.001 | 34.917 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | B | 710 | LEU | 0 | 0.005 | -0.005 | 40.587 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | B | 711 | SER | 0 | -0.002 | 0.002 | 42.989 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | B | 712 | ASP | -1 | -0.916 | -0.956 | 39.752 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | B | 713 | TYR | 0 | -0.054 | -0.053 | 40.294 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | B | 714 | TYR | 0 | 0.032 | 0.025 | 44.861 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | B | 715 | PHE | 0 | 0.017 | 0.004 | 45.319 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | B | 716 | ILE | 0 | 0.018 | 0.005 | 45.702 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | B | 717 | LEU | 0 | -0.013 | -0.008 | 48.054 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | B | 718 | ARG | 1 | 0.963 | 0.995 | 50.344 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | B | 719 | GLN | 0 | -0.040 | -0.019 | 51.251 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | B | 720 | PHE | 0 | 0.033 | 0.003 | 48.086 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | B | 721 | GLU | -1 | -0.777 | -0.862 | 53.513 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | B | 722 | GLN | 0 | 0.027 | 0.016 | 56.475 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | B | 723 | MET | 0 | -0.047 | -0.017 | 54.417 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | B | 724 | LYS | 1 | 0.925 | 0.967 | 57.557 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | B | 725 | VAL | 0 | -0.052 | -0.018 | 59.723 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | B | 726 | GLN | 0 | -0.062 | -0.021 | 60.823 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | B | 727 | PHE | 0 | -0.028 | -0.023 | 58.486 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | B | 728 | ALA | 0 | 0.039 | 0.023 | 60.792 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | B | 729 | ASP | -1 | -0.840 | -0.909 | 59.615 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | B | 730 | MET | 0 | -0.026 | -0.003 | 61.483 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | B | 731 | LYS | 1 | 0.932 | 0.939 | 61.414 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | B | 732 | PRO | 0 | 0.062 | 0.050 | 58.202 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | B | 733 | GLY | 0 | -0.014 | 0.001 | 61.219 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | B | 734 | LYS | 1 | 0.976 | 0.964 | 60.877 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | B | 735 | ARG | 1 | 0.992 | 0.984 | 62.420 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | B | 736 | GLN | 0 | -0.025 | -0.037 | 64.867 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | B | 737 | LEU | 0 | 0.063 | 0.045 | 57.124 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | B | 738 | ARG | 1 | 1.027 | 1.024 | 59.410 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | B | 739 | ARG | 1 | 0.875 | 0.944 | 61.581 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | B | 740 | ILE | 0 | 0.056 | 0.024 | 61.175 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | B | 741 | GLN | 0 | 0.049 | 0.044 | 55.914 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | B | 742 | ARG | 1 | 0.869 | 0.927 | 60.070 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | B | 743 | GLN | 0 | -0.030 | -0.006 | 62.475 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | B | 744 | THR | 0 | -0.019 | -0.004 | 62.209 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | B | 745 | VAL | 0 | -0.020 | -0.007 | 62.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | B | 746 | ASN | 0 | 0.028 | 0.009 | 62.310 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | B | 747 | NME | 0 | 0.009 | 0.020 | 64.414 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |