FMODB ID: 8JZ6Y
Calculation Name: 1UX5-A-Xray310
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 1UX5
Chain ID: A
UniProt ID: P41832
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. 1.20200116 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 411 |
LigandCharge | |
Software | ABINIT-MP - Open Ver.1 Rev. 15 / 20190524 |
Total energy (hartree)
FMO2-HF: Electronic energy | -6086439.388431 |
---|---|
FMO2-HF: Nuclear repulsion | 5921526.612306 |
FMO2-HF: Total energy | -164912.776125 |
FMO2-MP2: Total energy | -165398.565463 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(A:1350:LYS )
Summations of interaction energy for
fragment #1(A:1350:LYS )
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. |
-35.115 | -33.808 | -0.01 | -0.584 | -0.713 | 0.002 |
Interaction energy analysis for fragmet #1(A:1350:LYS )
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | 1352 | PRO | 0 | 0.010 | 0.045 | 3.828 | 3.245 | 4.552 | -0.010 | -0.584 | -0.713 | 0.002 |
4 | A | 1353 | ARG | 1 | 0.891 | 0.935 | 4.860 | 26.968 | 26.968 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | 1354 | PRO | 0 | 0.003 | 0.022 | 8.208 | 0.518 | 0.518 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 1355 | HIS | 0 | 0.016 | -0.001 | 11.686 | -0.736 | -0.736 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 1356 | LYS | 1 | 0.888 | 0.942 | 13.841 | 12.375 | 12.375 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 1357 | LYS | 1 | 0.927 | 0.956 | 12.588 | 15.987 | 15.987 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 1358 | LEU | 0 | 0.061 | 0.038 | 14.138 | 0.608 | 0.608 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 1359 | LYS | 1 | 0.909 | 0.963 | 17.206 | 10.942 | 10.942 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 1360 | GLN | 0 | -0.053 | -0.029 | 14.809 | -0.992 | -0.992 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 1361 | LEU | 0 | 0.029 | 0.021 | 17.278 | 0.688 | 0.688 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 1362 | HIS | 0 | -0.035 | -0.024 | 17.972 | -0.716 | -0.716 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 1363 | TRP | 0 | -0.017 | 0.004 | 13.329 | 0.418 | 0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 1364 | GLU | -1 | -0.897 | -0.951 | 19.657 | -12.121 | -12.121 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 1365 | LYS | 1 | 0.906 | 0.945 | 14.047 | 18.198 | 18.198 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 1366 | LEU | 0 | 0.023 | 0.022 | 17.592 | 0.417 | 0.417 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 1367 | ASP | -1 | -0.929 | -0.978 | 16.461 | -16.377 | -16.377 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 1368 | CYS | 0 | -0.049 | -0.022 | 15.231 | -2.058 | -2.058 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 1369 | THR | 0 | -0.036 | 0.019 | 13.639 | 0.432 | 0.432 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 1370 | ASP | -1 | -0.834 | -0.923 | 15.859 | -17.064 | -17.064 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 1371 | ASN | 0 | -0.047 | -0.012 | 19.087 | -0.486 | -0.486 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 1372 | SER | 0 | -0.031 | -0.031 | 19.456 | 0.614 | 0.614 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 1373 | ILE | 0 | 0.013 | -0.002 | 19.018 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 1374 | TRP | 0 | -0.022 | -0.006 | 15.175 | -0.823 | -0.823 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 1375 | GLY | 0 | 0.074 | 0.015 | 12.600 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 1376 | THR | 0 | -0.022 | -0.011 | 13.628 | -0.260 | -0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 1377 | GLY | 0 | 0.028 | 0.009 | 9.983 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 1378 | LYS | 1 | 0.930 | 0.951 | 10.079 | 15.232 | 15.232 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 1379 | ALA | 0 | 0.038 | 0.023 | 10.655 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 1380 | GLU | -1 | -0.886 | -0.945 | 5.246 | -40.325 | -40.325 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 1381 | LYS | 1 | 0.983 | 1.000 | 8.061 | 22.098 | 22.098 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 1382 | PHE | 0 | -0.012 | 0.004 | 10.481 | 0.995 | 0.995 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 1383 | ALA | 0 | -0.022 | 0.000 | 8.088 | 0.948 | 0.948 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 1384 | ASP | -1 | -0.874 | -0.955 | 6.545 | -30.329 | -30.329 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 1385 | ASP | -1 | -0.868 | -0.936 | 9.262 | -14.905 | -14.905 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 1386 | LEU | 0 | -0.036 | -0.040 | 13.001 | 1.103 | 1.103 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 1387 | TYR | 0 | -0.051 | -0.038 | 10.176 | 0.792 | 0.792 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 1388 | GLU | -1 | -0.943 | -0.968 | 11.861 | -17.948 | -17.948 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 1389 | LYS | 1 | 0.854 | 0.932 | 13.787 | 15.207 | 15.207 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 1390 | GLY | 0 | 0.008 | 0.013 | 15.603 | 0.771 | 0.771 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 1391 | VAL | 0 | 0.055 | 0.032 | 16.459 | 0.209 | 0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 1392 | LEU | 0 | -0.045 | -0.020 | 10.704 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 1393 | ALA | 0 | 0.018 | 0.011 | 14.868 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 1394 | ASP | -1 | -0.901 | -0.947 | 16.772 | -11.741 | -11.741 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 1395 | LEU | 0 | 0.001 | -0.011 | 16.062 | 0.427 | 0.427 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 1396 | GLU | -1 | -0.851 | -0.916 | 14.792 | -15.131 | -15.131 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 1397 | LYS | 1 | 0.881 | 0.928 | 17.440 | 11.941 | 11.941 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 1398 | ALA | 0 | -0.008 | 0.002 | 21.079 | 0.368 | 0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 1399 | PHE | 0 | -0.021 | -0.016 | 19.070 | 0.379 | 0.379 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 1400 | ALA | 0 | 0.032 | 0.028 | 19.382 | -0.358 | -0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 1401 | ALA | 0 | -0.042 | -0.028 | 19.875 | 0.438 | 0.438 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 1402 | ARG | 1 | 0.873 | 0.935 | 21.554 | 10.960 | 10.960 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 1403 | GLU | -1 | -0.833 | -0.916 | 23.946 | -8.912 | -8.912 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 1404 | ILE | 0 | -0.008 | 0.002 | 24.980 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 1405 | LYS | 1 | 0.987 | 0.971 | 25.817 | 10.033 | 10.033 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 1406 | SER | 0 | 0.018 | 0.017 | 29.057 | 0.313 | 0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 1407 | LEU | 0 | 0.085 | 0.019 | 28.947 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 1408 | ALA | 0 | 0.002 | 0.006 | 30.231 | 0.198 | 0.198 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 1409 | SER | 0 | -0.048 | -0.025 | 32.221 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 1410 | LYS | 1 | 1.063 | 1.044 | 35.200 | 7.591 | 7.591 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 1411 | ARG | 1 | 0.946 | 0.975 | 33.575 | 8.143 | 8.143 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 1412 | LYS | 1 | 0.903 | 0.947 | 32.939 | 8.222 | 8.222 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 1413 | GLU | -1 | -0.900 | -0.948 | 38.123 | -6.774 | -6.774 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 1414 | ASP | -1 | -0.966 | -0.997 | 40.424 | -6.459 | -6.459 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 1415 | LEU | 0 | -0.023 | 0.002 | 38.883 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 1416 | GLN | 0 | -0.087 | -0.057 | 42.296 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 1417 | LYS | 1 | 0.853 | 0.962 | 44.065 | 6.524 | 6.524 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 1418 | ILE | 0 | 0.000 | 0.031 | 47.371 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 1419 | THR | 0 | -0.014 | -0.008 | 48.844 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 1420 | PHE | 0 | -0.051 | -0.026 | 51.195 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 1421 | LEU | 0 | -0.053 | -0.006 | 50.307 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 1422 | SER | 0 | 0.000 | -0.007 | 51.384 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 1423 | ARG | 1 | 0.962 | 0.968 | 47.642 | 5.926 | 5.926 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 1424 | ASP | -1 | -0.862 | -0.931 | 47.192 | -5.948 | -5.948 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 1425 | ILE | 0 | 0.030 | 0.010 | 47.984 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 1426 | SER | 0 | 0.048 | 0.020 | 47.076 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 1427 | GLN | 0 | -0.029 | -0.004 | 43.008 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 1428 | GLN | 0 | -0.030 | -0.033 | 43.881 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 1429 | PHE | 0 | 0.052 | 0.023 | 45.766 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 1430 | GLY | 0 | -0.024 | -0.010 | 41.778 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 1431 | ILE | 0 | -0.018 | -0.006 | 40.710 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 1432 | ASN | 0 | -0.004 | -0.009 | 41.452 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 1433 | LEU | 0 | 0.047 | 0.033 | 43.226 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 1434 | HIS | 0 | 0.006 | 0.018 | 36.849 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 1435 | MET | 0 | 0.001 | 0.042 | 38.078 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 1436 | TYR | 0 | 0.010 | -0.029 | 39.132 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 1437 | SER | 0 | -0.069 | -0.082 | 36.232 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 1438 | SER | 0 | -0.097 | -0.046 | 35.280 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 1439 | LEU | 0 | 0.032 | 0.056 | 36.998 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 1440 | SER | 0 | 0.012 | 0.020 | 40.543 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 1441 | VAL | 0 | 0.065 | 0.018 | 42.804 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 1442 | ALA | 0 | 0.020 | 0.021 | 45.904 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 1443 | ASP | -1 | -0.869 | -0.939 | 43.830 | -6.424 | -6.424 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 1444 | LEU | 0 | -0.022 | -0.012 | 44.128 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 1445 | VAL | 0 | 0.053 | 0.018 | 45.780 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 1446 | LYS | 1 | 0.946 | 0.971 | 48.444 | 6.054 | 6.054 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 1447 | LYS | 1 | 0.818 | 0.929 | 43.645 | 6.603 | 6.603 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 1448 | ILE | 0 | -0.017 | -0.001 | 48.361 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 1449 | LEU | 0 | -0.016 | 0.000 | 50.696 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 1450 | ASN | 0 | 0.020 | -0.016 | 50.802 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 1451 | CYS | 0 | -0.043 | -0.031 | 52.258 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 1452 | ASP | -1 | -0.849 | -0.919 | 47.332 | -6.131 | -6.131 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 1453 | ARG | 1 | 0.978 | 0.982 | 47.794 | 5.873 | 5.873 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 1454 | ASP | -1 | -0.837 | -0.932 | 43.741 | -6.554 | -6.554 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 1455 | PHE | 0 | 0.016 | 0.035 | 45.825 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 1456 | LEU | 0 | 0.012 | 0.002 | 47.589 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 1457 | GLN | 0 | -0.057 | -0.031 | 46.428 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 1458 | THR | 0 | -0.022 | -0.005 | 44.439 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 1459 | PRO | 0 | 0.046 | -0.001 | 46.758 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 1460 | SER | 0 | 0.015 | 0.005 | 44.655 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 1461 | VAL | 0 | -0.007 | 0.000 | 45.632 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 1462 | VAL | 0 | 0.018 | 0.012 | 48.318 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 1463 | GLU | -1 | -0.933 | -0.943 | 51.225 | -5.651 | -5.651 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 1464 | PHE | 0 | -0.002 | -0.020 | 48.685 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 1465 | LEU | 0 | -0.027 | -0.017 | 50.181 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 1466 | SER | 0 | 0.004 | -0.035 | 52.873 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 1467 | LYS | 1 | 0.918 | 0.980 | 49.535 | 5.968 | 5.968 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 1468 | SER | 0 | 0.039 | 0.015 | 55.701 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 1469 | GLU | -1 | -0.917 | -0.961 | 54.795 | -5.421 | -5.421 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 1470 | ILE | 0 | -0.080 | -0.018 | 51.538 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 1471 | ILE | 0 | -0.038 | -0.024 | 55.356 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 1472 | GLU | -1 | -0.962 | -0.981 | 58.168 | -4.783 | -4.783 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 1473 | VAL | 0 | 0.020 | 0.034 | 58.960 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 1474 | SER | 0 | -0.018 | -0.011 | 60.686 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 1475 | VAL | 0 | 0.083 | 0.015 | 62.911 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 1476 | ASN | 0 | -0.040 | -0.030 | 62.405 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 1477 | LEU | 0 | 0.027 | 0.031 | 56.943 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 1478 | ALA | 0 | 0.092 | 0.054 | 60.139 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 1479 | ARG | 1 | 0.920 | 0.957 | 62.238 | 4.470 | 4.470 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 1480 | ASN | 0 | -0.028 | -0.027 | 58.469 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 1481 | TYR | 0 | -0.034 | -0.053 | 53.087 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 1482 | ALA | 0 | 0.005 | 0.017 | 58.821 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 1483 | PRO | 0 | -0.083 | -0.046 | 59.587 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 1484 | TYR | 0 | 0.014 | -0.007 | 55.693 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 1485 | SER | 0 | -0.015 | 0.013 | 57.922 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 1486 | THR | 0 | -0.033 | -0.002 | 58.992 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 1487 | ASP | -1 | -0.855 | -0.933 | 61.021 | -4.537 | -4.537 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 1488 | TRP | 0 | -0.024 | -0.049 | 57.060 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 1489 | GLU | -1 | -0.909 | -0.935 | 63.325 | -4.401 | -4.401 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 1490 | GLY | 0 | -0.051 | -0.011 | 66.822 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 1491 | VAL | 0 | -0.069 | -0.026 | 62.077 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 1492 | ARG | 1 | 0.977 | 0.982 | 64.260 | 4.317 | 4.317 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 1493 | ASN | 0 | -0.044 | -0.052 | 60.277 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 1494 | LEU | 0 | 0.036 | 0.010 | 54.469 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 1495 | GLU | -1 | -1.008 | -1.003 | 57.002 | -5.179 | -5.179 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 1496 | ASP | -1 | -0.954 | -0.975 | 58.581 | -4.591 | -4.591 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 1497 | ALA | 0 | -0.020 | 0.022 | 60.243 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 1498 | LYS | 1 | 0.919 | 0.930 | 60.320 | 4.797 | 4.797 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 1499 | PRO | 0 | 0.003 | 0.019 | 61.308 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 1500 | PRO | 0 | -0.030 | 0.002 | 58.264 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 1501 | GLU | -1 | -0.870 | -0.936 | 59.497 | -4.664 | -4.664 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 1502 | LYS | 1 | 0.841 | 0.919 | 57.563 | 5.094 | 5.094 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 1503 | ASP | -1 | -0.813 | -0.920 | 51.850 | -5.671 | -5.671 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 1504 | PRO | 0 | 0.006 | 0.007 | 51.784 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 1505 | ASN | 0 | 0.024 | 0.017 | 47.162 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 1506 | ASP | -1 | -0.874 | -0.946 | 48.086 | -5.800 | -5.800 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 1507 | LEU | 0 | -0.086 | -0.055 | 49.739 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 1508 | GLN | 0 | -0.039 | -0.015 | 45.324 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 1509 | ARG | 1 | 0.881 | 0.924 | 41.484 | 6.939 | 6.939 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 1510 | ALA | 0 | 0.001 | -0.001 | 45.579 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 1511 | ASP | -1 | -0.659 | -0.857 | 47.125 | -5.720 | -5.720 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 1512 | GLN | 0 | -0.059 | -0.035 | 46.556 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 1513 | ILE | 0 | -0.031 | -0.015 | 46.579 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 1514 | TYR | 0 | -0.015 | -0.020 | 50.157 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 1515 | LEU | 0 | -0.019 | -0.007 | 52.831 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 1516 | GLN | 0 | 0.020 | -0.004 | 51.737 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 1517 | LEU | 0 | -0.028 | -0.021 | 51.636 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 1518 | MET | 0 | -0.022 | 0.004 | 52.529 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 1519 | VAL | 0 | 0.012 | 0.027 | 57.178 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 1520 | ASN | 0 | -0.024 | -0.021 | 57.896 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 1521 | LEU | 0 | 0.045 | 0.041 | 56.821 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 1522 | GLU | -1 | -0.898 | -0.940 | 60.739 | -4.677 | -4.677 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 1523 | SER | 0 | -0.009 | 0.001 | 62.318 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 1524 | TYR | 0 | -0.110 | -0.103 | 60.142 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 1525 | TRP | 0 | 0.098 | 0.049 | 54.175 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 1526 | GLY | 0 | 0.081 | 0.028 | 60.268 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 1527 | SER | 0 | -0.039 | -0.034 | 61.427 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 1528 | ARG | 1 | 0.820 | 0.939 | 54.734 | 5.313 | 5.313 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 1529 | MET | 0 | -0.015 | 0.005 | 54.870 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 1530 | ARG | 1 | 0.961 | 0.984 | 58.556 | 4.653 | 4.653 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 1531 | ALA | 0 | 0.016 | 0.024 | 61.194 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 1532 | LEU | 0 | 0.027 | -0.016 | 55.098 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 1533 | THR | 0 | -0.039 | -0.030 | 56.246 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 1534 | VAL | 0 | 0.065 | 0.064 | 57.432 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 1535 | VAL | 0 | -0.026 | -0.005 | 57.687 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 1536 | THR | 0 | -0.139 | -0.072 | 53.655 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 1537 | SER | 0 | -0.014 | -0.030 | 54.773 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 1538 | TYR | 0 | 0.024 | 0.009 | 57.126 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 1539 | GLU | -1 | -0.958 | -0.964 | 56.567 | -5.119 | -5.119 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 1540 | ARG | 1 | 0.957 | 0.962 | 53.440 | 5.509 | 5.509 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 1541 | GLU | -1 | -0.892 | -0.947 | 57.198 | -5.049 | -5.049 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 1542 | TYR | 0 | 0.015 | 0.013 | 59.633 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 1543 | ASN | 0 | -0.027 | -0.015 | 58.018 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 1544 | GLU | -1 | -0.871 | -0.940 | 56.027 | -5.340 | -5.340 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 1545 | LEU | 0 | -0.030 | -0.013 | 59.827 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 1546 | LEU | 0 | 0.036 | 0.019 | 63.471 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 1547 | ALA | 0 | -0.021 | -0.013 | 60.510 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 1548 | LYS | 1 | 0.905 | 0.942 | 60.797 | 5.007 | 5.007 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 1549 | LEU | 0 | 0.036 | 0.009 | 64.076 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 1550 | ARG | 1 | 0.851 | 0.948 | 64.956 | 4.565 | 4.565 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 1551 | LYS | 1 | 0.882 | 0.948 | 60.649 | 5.045 | 5.045 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 1552 | VAL | 0 | 0.027 | 0.001 | 66.367 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 1553 | ASP | -1 | -0.769 | -0.870 | 69.620 | -4.280 | -4.280 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 1554 | LYS | 1 | 0.901 | 0.959 | 65.106 | 4.727 | 4.727 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 1555 | ALA | 0 | -0.012 | 0.006 | 69.950 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 1556 | VAL | 0 | 0.016 | -0.006 | 71.505 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 1557 | SER | 0 | -0.026 | -0.009 | 73.629 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 1558 | ALA | 0 | 0.059 | 0.027 | 72.598 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 1559 | LEU | 0 | -0.023 | -0.027 | 74.722 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 1560 | GLN | 0 | 0.000 | -0.004 | 77.017 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 1561 | GLU | -1 | -0.982 | -0.989 | 76.170 | -4.032 | -4.032 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 1562 | SER | 0 | -0.001 | 0.008 | 77.414 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 1563 | ASP | -1 | -0.847 | -0.927 | 79.307 | -3.753 | -3.753 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 1564 | ASN | 0 | -0.033 | -0.006 | 78.136 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 1565 | LEU | 0 | -0.001 | 0.021 | 77.427 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 1566 | ARG | 1 | 0.876 | 0.918 | 80.093 | 3.846 | 3.846 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 1567 | ASN | 0 | 0.005 | -0.002 | 83.573 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 1568 | VAL | 0 | -0.009 | 0.001 | 79.711 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 1569 | PHE | 0 | -0.008 | -0.023 | 80.014 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 1570 | ASN | 0 | 0.032 | 0.019 | 84.615 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 1571 | VAL | 0 | -0.022 | 0.013 | 85.301 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 1572 | ILE | 0 | -0.041 | -0.032 | 81.822 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 1573 | LEU | 0 | -0.026 | -0.010 | 86.381 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 1574 | ALA | 0 | -0.029 | 0.000 | 89.554 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 1575 | VAL | 0 | 0.012 | -0.003 | 87.777 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 1576 | GLY | 0 | 0.026 | 0.004 | 89.595 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 1577 | ASN | 0 | -0.003 | -0.011 | 90.534 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 1578 | PHE | 0 | -0.070 | -0.015 | 93.216 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 1579 | MET | 0 | -0.046 | -0.017 | 88.448 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 1580 | ASN | 0 | -0.023 | -0.004 | 91.524 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 1581 | ASP | -1 | -0.796 | -0.872 | 95.032 | -3.243 | -3.243 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 1582 | THR | 0 | 0.033 | -0.022 | 98.057 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 1583 | SER | 0 | -0.101 | -0.056 | 98.438 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 1584 | LYS | 1 | 0.892 | 0.947 | 92.894 | 3.334 | 3.334 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 1585 | GLN | 0 | -0.075 | -0.017 | 94.697 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 1586 | ALA | 0 | -0.017 | -0.016 | 92.767 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 1587 | GLN | 0 | -0.003 | -0.011 | 94.566 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 1588 | GLY | 0 | 0.048 | 0.029 | 90.649 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 1589 | PHE | 0 | -0.048 | -0.020 | 83.874 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 1590 | LYS | 1 | 0.997 | 0.996 | 85.008 | 3.600 | 3.600 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 1591 | LEU | 0 | 0.130 | 0.062 | 78.915 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 1592 | SER | 0 | -0.032 | -0.011 | 80.822 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 1593 | THR | 0 | -0.059 | -0.039 | 81.567 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 1594 | LEU | 0 | 0.026 | 0.023 | 78.193 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 1595 | GLN | 0 | -0.036 | -0.008 | 76.993 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 1596 | ARG | 1 | 0.900 | 0.943 | 78.499 | 3.761 | 3.761 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 1597 | LEU | 0 | 0.008 | 0.019 | 80.309 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 1598 | THR | 0 | 0.059 | 0.017 | 76.195 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 1599 | PHE | 0 | -0.083 | -0.054 | 77.499 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 1600 | ILE | 0 | 0.028 | 0.029 | 81.498 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 1601 | LYS | 1 | 0.923 | 0.971 | 79.713 | 3.906 | 3.906 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 1602 | ASP | -1 | -0.772 | -0.891 | 83.331 | -3.755 | -3.755 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 1603 | THR | 0 | 0.032 | 0.018 | 85.347 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 1604 | THR | 0 | -0.057 | 0.006 | 83.256 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 1605 | ASN | 0 | -0.067 | -0.055 | 80.558 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 1606 | SER | 0 | -0.034 | -0.020 | 79.043 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 1607 | MET | 0 | -0.039 | -0.004 | 78.530 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 1608 | THR | 0 | 0.020 | 0.028 | 77.990 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 1609 | PHE | 0 | 0.044 | -0.010 | 80.720 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 1610 | LEU | 0 | 0.043 | 0.000 | 76.298 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 1611 | ASN | 0 | -0.046 | -0.024 | 76.013 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 1612 | TYR | 0 | 0.040 | 0.012 | 79.350 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 1613 | VAL | 0 | -0.007 | 0.019 | 81.433 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 1614 | GLU | -1 | -0.726 | -0.850 | 76.209 | -4.120 | -4.120 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 1615 | LYS | 1 | 0.933 | 0.967 | 79.490 | 3.986 | 3.986 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 1616 | ILE | 0 | -0.060 | -0.027 | 81.231 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 1617 | VAL | 0 | -0.020 | -0.018 | 80.309 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 1618 | ARG | 1 | 0.790 | 0.875 | 76.325 | 4.119 | 4.119 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 1619 | LEU | 0 | -0.052 | -0.034 | 80.156 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 1620 | ASN | 0 | -0.065 | -0.021 | 83.001 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 1621 | TYR | 0 | -0.072 | -0.032 | 83.826 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 1622 | PRO | 0 | 0.050 | 0.024 | 79.863 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 1623 | SER | 0 | 0.061 | 0.031 | 78.983 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 1624 | PHE | 0 | 0.031 | 0.019 | 78.822 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 1625 | ASN | 0 | -0.008 | -0.019 | 75.154 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 1626 | ASP | -1 | -0.846 | -0.914 | 74.531 | -4.217 | -4.217 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 1627 | PHE | 0 | -0.050 | -0.038 | 73.840 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 1628 | LEU | 0 | -0.066 | -0.028 | 71.277 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 1629 | SER | 0 | -0.018 | -0.015 | 69.472 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 1630 | GLU | -1 | -0.829 | -0.924 | 69.934 | -4.157 | -4.157 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 1631 | LEU | 0 | -0.031 | -0.013 | 71.667 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 1632 | GLU | -1 | -0.911 | -0.956 | 65.670 | -4.794 | -4.794 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 1633 | PRO | 0 | -0.004 | 0.000 | 67.014 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 1634 | VAL | 0 | 0.003 | -0.001 | 68.069 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 1635 | LEU | 0 | -0.044 | -0.027 | 65.829 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 1636 | ASP | -1 | -0.952 | -0.976 | 62.605 | -5.006 | -5.006 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 1637 | VAL | 0 | -0.074 | -0.028 | 63.963 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 1638 | VAL | 0 | 0.011 | 0.006 | 64.663 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 1639 | LYS | 1 | 0.842 | 0.928 | 59.294 | 5.104 | 5.104 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 1640 | VAL | 0 | 0.017 | 0.004 | 63.232 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 1641 | SER | 0 | 0.002 | 0.022 | 65.745 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 1642 | ILE | 0 | 0.056 | 0.020 | 68.466 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 1643 | GLU | -1 | -0.887 | -0.938 | 70.751 | -4.138 | -4.138 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 1644 | GLN | 0 | -0.061 | -0.039 | 64.888 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 1645 | LEU | 0 | -0.021 | -0.002 | 65.672 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 1646 | VAL | 0 | 0.049 | 0.007 | 67.851 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 1647 | ASN | 0 | 0.004 | -0.040 | 69.488 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 1648 | ASP | -1 | -0.790 | -0.897 | 64.935 | -4.745 | -4.745 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 1649 | CYS | 0 | -0.129 | 0.012 | 66.692 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 1650 | LYS | 1 | 0.992 | 0.991 | 68.617 | 4.136 | 4.136 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 1651 | ASP | -1 | -0.896 | -0.947 | 66.456 | -4.506 | -4.506 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 1652 | PHE | 0 | -0.037 | 0.003 | 62.231 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 1653 | SER | 0 | 0.053 | 0.022 | 66.300 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 1654 | GLN | 0 | -0.036 | -0.018 | 69.347 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 1655 | SER | 0 | -0.084 | -0.059 | 64.636 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 1656 | ILE | 0 | 0.016 | -0.006 | 65.260 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 1657 | VAL | 0 | 0.009 | 0.008 | 67.136 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 1658 | ASN | 0 | -0.022 | -0.018 | 68.046 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 1659 | VAL | 0 | -0.034 | -0.006 | 63.893 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 1660 | GLU | -1 | -0.762 | -0.876 | 67.053 | -4.326 | -4.326 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 1661 | ARG | 1 | 0.993 | 1.008 | 69.741 | 4.107 | 4.107 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 1662 | SER | 0 | -0.126 | -0.082 | 67.329 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 1663 | VAL | 0 | 0.024 | 0.004 | 66.160 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 1664 | GLU | -1 | -0.920 | -0.950 | 68.854 | -4.154 | -4.154 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 1665 | ILE | 0 | -0.093 | -0.051 | 72.536 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 1666 | GLY | 0 | -0.022 | 0.004 | 70.989 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 1667 | ASN | 0 | -0.056 | -0.015 | 67.042 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 1668 | LEU | 0 | -0.045 | -0.031 | 63.283 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 1669 | SER | 0 | -0.009 | -0.016 | 67.185 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 1670 | ASP | -1 | -0.880 | -0.947 | 69.784 | -4.282 | -4.282 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 1671 | SER | 0 | 0.000 | -0.021 | 65.905 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 1672 | SER | 0 | -0.104 | -0.033 | 65.643 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 1673 | LYS | 1 | 0.986 | 1.002 | 66.416 | 4.406 | 4.406 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 1674 | PHE | 0 | -0.058 | -0.015 | 61.888 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 1675 | HIS | 0 | 0.090 | 0.072 | 55.675 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 1676 | PRO | 0 | 0.007 | 0.002 | 58.608 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 1677 | LEU | 0 | -0.064 | -0.055 | 52.771 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 1678 | ASP | -1 | -0.811 | -0.874 | 55.840 | -5.200 | -5.200 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 1679 | LYS | 1 | 0.908 | 0.979 | 54.360 | 5.461 | 5.461 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 1680 | VAL | 0 | 0.064 | 0.011 | 58.024 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 1681 | LEU | 0 | 0.024 | 0.008 | 59.253 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 1682 | ILE | 0 | 0.005 | 0.006 | 57.320 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 1683 | LYS | 1 | 0.907 | 0.960 | 54.865 | 5.351 | 5.351 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 1684 | THR | 0 | 0.009 | -0.025 | 58.713 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 1685 | LEU | 0 | -0.005 | 0.023 | 61.449 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 1686 | PRO | 0 | -0.058 | -0.027 | 61.337 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 1687 | VAL | 0 | 0.043 | 0.029 | 59.413 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 1688 | LEU | 0 | 0.013 | 0.022 | 62.814 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 1689 | PRO | 0 | 0.044 | 0.030 | 65.705 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 1690 | GLU | -1 | -0.985 | -1.002 | 62.302 | -4.826 | -4.826 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 1691 | ALA | 0 | 0.016 | 0.010 | 63.549 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 1692 | ARG | 1 | 0.874 | 0.918 | 64.996 | 4.274 | 4.274 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 1693 | LYS | 1 | 0.914 | 0.967 | 67.607 | 4.470 | 4.470 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 1694 | LYS | 1 | 0.880 | 0.944 | 61.673 | 4.921 | 4.921 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 1695 | GLY | 0 | 0.028 | 0.009 | 66.831 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 1696 | ASP | -1 | -0.862 | -0.939 | 68.790 | -4.220 | -4.220 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 1697 | LEU | 0 | -0.040 | -0.021 | 67.652 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 1698 | LEU | 0 | -0.005 | 0.002 | 66.773 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 1699 | GLU | -1 | -0.963 | -0.979 | 69.504 | -4.070 | -4.070 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 1700 | ASP | -1 | -0.901 | -0.953 | 72.685 | -4.053 | -4.053 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 1701 | GLU | -1 | -0.877 | -0.942 | 70.173 | -4.272 | -4.272 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 1702 | VAL | 0 | -0.015 | -0.014 | 70.358 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 1703 | LYS | 1 | 0.896 | 0.940 | 72.867 | 4.008 | 4.008 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 1704 | LEU | 0 | -0.001 | 0.008 | 75.672 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 1705 | THR | 0 | 0.053 | 0.011 | 72.248 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 1706 | ILE | 0 | -0.093 | -0.048 | 75.084 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 1707 | MET | 0 | -0.031 | -0.006 | 76.943 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 1708 | GLU | -1 | -0.898 | -0.955 | 76.616 | -4.019 | -4.019 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 1709 | PHE | 0 | -0.012 | -0.020 | 74.620 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 1710 | GLU | -1 | -0.919 | -0.974 | 77.778 | -3.860 | -3.860 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 1711 | SER | 0 | -0.056 | -0.026 | 80.646 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 1712 | LEU | 0 | -0.020 | 0.003 | 77.177 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 1713 | MET | 0 | -0.046 | -0.015 | 78.959 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 1714 | HIS | 0 | -0.001 | -0.001 | 81.652 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 1715 | THR | 0 | -0.011 | 0.012 | 83.474 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 1716 | TYR | 0 | -0.073 | -0.039 | 80.702 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 1717 | GLY | 0 | -0.036 | -0.007 | 84.232 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 1718 | GLU | -1 | -0.984 | -1.005 | 80.824 | -3.825 | -3.825 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 1719 | ASP | -1 | -0.839 | -0.929 | 83.759 | -3.669 | -3.669 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 1720 | SER | 0 | 0.006 | 0.011 | 81.338 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 1721 | GLY | 0 | 0.024 | 0.009 | 81.268 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 1722 | ASP | -1 | -0.904 | -0.960 | 80.441 | -3.916 | -3.916 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 1723 | LYS | 1 | 0.940 | 0.965 | 73.402 | 4.128 | 4.128 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 1724 | PHE | 0 | -0.009 | -0.013 | 74.151 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 1725 | ALA | 0 | -0.003 | -0.002 | 76.380 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 1726 | LYS | 1 | 0.947 | 0.970 | 76.122 | 3.921 | 3.921 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 1727 | ILE | 0 | -0.058 | -0.026 | 71.088 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 1728 | SER | 0 | -0.084 | -0.041 | 72.228 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 1729 | PHE | 0 | 0.042 | 0.034 | 74.138 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 1730 | PHE | 0 | 0.089 | 0.020 | 71.102 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 1731 | LYS | 1 | 0.889 | 0.967 | 68.338 | 4.486 | 4.486 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 1732 | LYS | 1 | 0.933 | 0.974 | 71.601 | 4.000 | 4.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 1733 | PHE | 0 | 0.037 | 0.023 | 74.093 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 1734 | ALA | 0 | 0.025 | 0.016 | 69.044 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 1735 | ASP | -1 | -0.903 | -0.974 | 70.179 | -4.473 | -4.473 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 1736 | PHE | 0 | 0.009 | 0.007 | 71.754 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 1737 | ILE | 0 | 0.051 | 0.029 | 70.149 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 1738 | ASN | 0 | -0.038 | -0.022 | 67.357 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 1739 | GLU | -1 | -0.937 | -0.973 | 70.001 | -4.329 | -4.329 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 1740 | TYR | 0 | -0.002 | 0.002 | 72.770 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 1741 | LYS | 1 | 0.985 | 0.994 | 66.317 | 4.669 | 4.669 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 1742 | LYS | 1 | 0.938 | 0.977 | 69.564 | 4.464 | 4.464 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 1743 | ALA | 0 | 0.002 | -0.002 | 70.696 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 1744 | GLN | 0 | -0.058 | -0.049 | 72.236 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 1745 | ALA | 0 | -0.042 | -0.014 | 68.954 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 1746 | GLN | 0 | 0.010 | -0.012 | 70.942 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 1747 | ASN | 0 | -0.061 | -0.031 | 72.974 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 1748 | LEU | 0 | 0.020 | 0.014 | 71.419 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 1749 | ALA | 0 | -0.006 | 0.013 | 70.801 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 1750 | ALA | 0 | 0.037 | 0.012 | 72.433 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 1751 | GLU | -1 | -0.801 | -0.911 | 75.754 | -4.033 | -4.033 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 1752 | GLU | -1 | -1.010 | -1.017 | 70.598 | -4.501 | -4.501 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 1753 | GLU | -1 | -0.944 | -0.970 | 73.041 | -4.316 | -4.316 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 1754 | GLU | -1 | -0.936 | -0.977 | 75.504 | -3.911 | -3.911 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 1755 | ARG | 1 | 0.890 | 0.955 | 74.387 | 4.240 | 4.240 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 1756 | LEU | 0 | -0.079 | -0.020 | 73.610 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 1757 | TYR | 0 | -0.008 | -0.018 | 75.391 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 1758 | ILE | 0 | -0.023 | 0.004 | 79.907 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 1759 | LYS | 1 | 0.836 | 0.928 | 76.366 | 4.200 | 4.200 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 1760 | HIS | -1 | -0.948 | -0.969 | 75.887 | -3.884 | -3.884 | 0.000 | 0.000 | 0.000 | 0.000 |