FMODB ID: LJNR9
Calculation Name: 6FTL-AEIK-Xray434
Preferred Name:
Target Type:
Ligand Name: 2-carboxyarabinitol-1,5-diphosphate
ligand 3-letter code: CAP
PDB ID: 6FTL
Chain ID: AEIK
UniProt ID: A0A3B6
Base Structure: X-ray
Registration Date: 2023-09-26
Reference: M. Fujii, S. Tanaka, Interspecies Comparison of Interaction Energies between Photosynthetic Protein RuBisCO and 2CABP Ligand, Int. J. Mol. Sci. 2022, 23(19), 11347.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptH |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Manual calculation |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Manual |
Number of fragment | 1246 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -45488548.8298 |
---|---|
FMO2-HF: Nuclear repulsion | 44991637.081847 |
FMO2-HF: Total energy | -496911.747953 |
FMO2-MP2: Total energy | -498339.667955 |
3D Structure
Ligand structure
CAP
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. |
-419.322 | -454.023 | 217.295 | -95.359 | -87.229 | -0.683 |
Interactive mode: IFIE and PIEDA for fragment #623(A:501:CAP)
Summations of interaction energy for
fragment #623(A:501:CAP)
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. |
-419.322 | -454.023 | 217.295 | -95.359 | -87.229 | 0.683 |
Interaction energy analysis for fragmet #623(A:501:CAP)
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]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
174 | A | 176 | ALA | 0 | -0.004 | 0.005 | 5.029 | 5.368 | 5.491 | -0.001 | -0.004 | -0.117 | 0.000 |
175 | A | 177 | THR | 0 | 0.101 | 0.022 | 1.810 | -21.469 | -20.709 | 11.954 | -6.901 | -5.812 | -0.021 |
176 | A | 178 | VAL | 0 | -0.057 | -0.026 | 3.996 | 7.737 | 8.084 | -0.001 | -0.120 | -0.227 | 0.000 |
177 | A | 179 | LYS | 1 | 0.870 | 0.950 | 2.240 | -236.091 | -233.155 | 7.048 | -4.034 | -5.950 | 0.057 |
179 | A | 181 | LYS | 1 | 0.760 | 0.892 | 4.202 | -163.231 | -162.776 | -0.001 | -0.159 | -0.295 | 0.000 |
203 | A | 205 | KCX | -1 | -0.518 | -0.812 | 1.550 | 179.983 | 166.189 | 34.589 | -13.058 | -7.736 | -0.099 |
205 | A | 207 | ASP | 0 | 0.224 | 0.062 | 4.427 | 6.260 | 6.394 | -0.001 | -0.033 | -0.099 | 0.000 |
206 | A | 208 | GLU | 0 | 0.128 | -0.028 | 4.284 | -16.285 | -16.024 | -0.001 | -0.034 | -0.224 | 0.000 |
296 | A | 297 | HIS | 0 | 0.119 | 0.035 | 2.088 | -9.113 | -8.056 | 4.104 | -1.850 | -3.311 | 0.013 |
297 | A | 298 | ARG | 1 | 0.770 | 0.844 | 1.575 | -281.535 | -295.098 | 42.941 | -18.952 | -10.426 | 0.192 |
298 | A | 299 | ALA | 0 | 0.033 | 0.012 | 5.216 | -1.287 | -1.230 | -0.001 | -0.005 | -0.051 | 0.000 |
329 | A | 330 | HIS | 0 | 0.134 | 0.144 | 1.762 | -60.123 | -61.411 | 18.767 | -9.340 | -8.139 | 0.105 |
330 | A | 331 | ALA | 0 | 0.006 | -0.012 | 4.506 | -5.640 | -5.376 | 0.000 | -0.042 | -0.221 | 0.000 |
331 | A | 332 | GLY | 0 | 0.039 | 0.019 | 4.009 | -11.682 | -11.302 | 0.003 | -0.146 | -0.238 | 0.001 |
332 | A | 333 | THR | 0 | 0.028 | 0.023 | 4.896 | -18.673 | -18.507 | -0.001 | -0.010 | -0.154 | 0.000 |
336 | A | 337 | LYS | 1 | 0.783 | 0.873 | 1.673 | -281.114 | -287.988 | 20.981 | -8.233 | -5.874 | 0.093 |
337 | A | 338 | LEU | 0 | -0.029 | -0.011 | 2.369 | -20.651 | -18.784 | 6.672 | -3.316 | -5.223 | 0.032 |
338 | A | 339 | GLU | -1 | -0.848 | -0.950 | 5.230 | 87.209 | 87.270 | -0.001 | -0.002 | -0.058 | 0.000 |
379 | A | 380 | VAL | 0 | -0.014 | -0.002 | 4.709 | -5.196 | -5.110 | -0.001 | -0.009 | -0.075 | 0.000 |
380 | A | 381 | ALA | 0 | 0.014 | 0.016 | 4.438 | 21.230 | 21.439 | -0.001 | -0.013 | -0.196 | 0.000 |
381 | A | 382 | SER | 0 | 0.024 | -0.012 | 2.036 | -29.313 | -23.242 | 4.382 | -4.690 | -5.762 | 0.035 |
382 | A | 383 | GLY | 0 | 0.075 | 0.029 | 2.090 | 4.010 | 6.412 | 9.206 | -6.188 | -5.420 | 0.033 |
383 | A | 384 | GLY | 0 | -0.017 | -0.004 | 2.087 | -39.727 | -43.082 | 4.018 | 2.281 | -2.944 | 0.042 |
384 | A | 385 | ILE | 0 | -0.049 | -0.002 | 4.135 | -26.307 | -25.869 | 0.008 | -0.171 | -0.276 | 0.001 |
403 | A | 404 | GLN | 0 | 0.002 | -0.017 | 4.246 | -21.831 | -21.606 | -0.001 | -0.012 | -0.212 | 0.000 |
404 | A | 405 | PHE | 0 | 0.005 | -0.012 | 4.026 | 17.689 | 18.231 | 0.006 | -0.151 | -0.397 | 0.000 |
405 | A | 406 | GLY | 0 | 0.058 | 0.025 | 2.054 | -34.316 | -34.083 | 8.403 | -4.940 | -3.696 | 0.058 |
406 | A | 407 | GLY | 0 | 0.021 | -0.015 | 1.754 | -50.419 | -60.539 | 15.735 | -1.877 | -3.738 | 0.056 |
407 | A | 408 | GLY | 0 | -0.002 | -0.003 | 3.694 | -28.451 | -27.687 | 0.040 | -0.402 | -0.401 | 0.005 |
685 | E | 64 | GLU | -1 | -0.792 | -0.867 | 5.417 | 179.613 | 179.633 | -0.001 | -0.015 | -0.004 | 0.000 |
690 | E | 69 | THR | 0 | -0.026 | -0.052 | 1.595 | -7.599 | -18.806 | 25.003 | -9.619 | -4.178 | 0.064 |
691 | E | 70 | TRP | 0 | 0.035 | 0.012 | 2.474 | -43.137 | -40.720 | 2.026 | -1.720 | -2.722 | 0.023 |
748 | E | 127 | ASN | 0 | 0.103 | 0.005 | 2.544 | 6.255 | 9.392 | 1.422 | -1.588 | -2.972 | -0.007 |
749 | E | 128 | VAL | 0 | 0.032 | 0.012 | 4.767 | 3.010 | 3.098 | -0.001 | -0.006 | -0.081 | 0.000 |
1 | A | 3 | GLN | 0 | 0.041 | 0.017 | 64.864 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
2 | A | 4 | SER | 0 | 0.040 | 0.009 | 61.403 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
3 | A | 5 | VAL | 0 | 0.005 | -0.016 | 59.918 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
4 | A | 6 | SER | 0 | 0.040 | 0.048 | 57.092 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | 7 | GLU | -1 | -0.883 | -0.936 | 57.725 | 20.275 | 20.275 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 8 | ARG | 1 | 0.824 | 0.907 | 59.718 | -18.806 | -18.806 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 9 | THR | 0 | -0.095 | -0.070 | 57.637 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 10 | ARG | 1 | 0.914 | 0.986 | 55.207 | -21.168 | -21.168 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 11 | ILE | 0 | -0.046 | -0.025 | 50.790 | -0.320 | -0.320 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 12 | LYS | 1 | 0.997 | 0.991 | 53.995 | -20.316 | -20.316 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 13 | SER | 0 | -0.051 | -0.012 | 51.806 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 14 | ASP | -1 | -0.838 | -0.928 | 50.691 | 22.822 | 22.822 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 15 | ARG | 1 | 0.836 | 0.931 | 41.574 | -26.893 | -26.893 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 16 | TYR | 0 | -0.036 | -0.044 | 44.162 | 0.518 | 0.518 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 17 | GLU | -1 | -0.918 | -0.930 | 48.787 | 22.071 | 22.071 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 18 | SER | 0 | -0.011 | -0.018 | 48.422 | 0.306 | 0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 19 | GLY | 0 | 0.039 | 0.024 | 47.295 | -0.333 | -0.333 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 20 | VAL | 0 | -0.004 | -0.004 | 42.094 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 21 | ILE | 0 | -0.035 | -0.018 | 43.414 | -0.450 | -0.450 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 22 | PRO | 0 | 0.025 | 0.005 | 40.754 | 0.406 | 0.406 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 23 | TYR | 0 | 0.029 | -0.002 | 35.516 | -0.448 | -0.448 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 24 | ALA | 0 | -0.012 | -0.012 | 38.523 | -0.231 | -0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 25 | LYS | 1 | 0.899 | 0.953 | 39.483 | -25.800 | -25.800 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 26 | MET | 0 | -0.031 | -0.007 | 39.850 | -0.570 | -0.570 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 27 | GLY | 0 | -0.019 | -0.017 | 40.509 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 28 | TYR | 0 | -0.032 | -0.044 | 35.012 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 29 | TRP | 0 | -0.004 | 0.007 | 34.778 | 1.199 | 1.199 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 30 | ASP | -1 | -0.850 | -0.944 | 37.008 | 28.244 | 28.244 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 31 | ALA | 0 | -0.017 | -0.004 | 37.192 | 0.540 | 0.540 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 32 | SER | 0 | -0.094 | -0.034 | 38.277 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 33 | TYR | 0 | -0.067 | -0.045 | 34.306 | -0.751 | -0.751 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 34 | THR | 0 | -0.062 | -0.027 | 37.087 | 0.331 | 0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 35 | VAL | 0 | 0.012 | 0.002 | 31.456 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 36 | LYS | 1 | 0.932 | 0.975 | 34.578 | -31.485 | -31.485 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 37 | ASP | -1 | -0.878 | -0.950 | 32.152 | 35.077 | 35.077 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 38 | THR | 0 | -0.037 | -0.039 | 30.997 | 0.797 | 0.797 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 39 | ASP | -1 | -0.804 | -0.868 | 30.988 | 34.657 | 34.657 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 40 | VAL | 0 | 0.006 | 0.003 | 24.808 | 1.026 | 1.026 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 41 | LEU | 0 | -0.059 | -0.010 | 25.926 | -1.074 | -1.074 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 42 | ALA | 0 | 0.007 | 0.003 | 23.418 | 1.959 | 1.959 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 43 | LEU | 0 | -0.006 | 0.021 | 21.918 | -1.793 | -1.793 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 44 | PHE | 0 | 0.015 | -0.009 | 22.088 | 2.383 | 2.383 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 45 | ARG | 1 | 0.789 | 0.869 | 19.041 | -54.442 | -54.442 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 46 | ILE | 0 | -0.010 | -0.008 | 23.294 | 1.090 | 1.090 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 47 | THR | 0 | 0.008 | 0.002 | 24.705 | -0.356 | -0.356 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 48 | PRO | 0 | -0.026 | -0.007 | 27.201 | 0.247 | 0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 49 | GLN | 0 | -0.009 | -0.011 | 30.728 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 50 | PRO | 0 | 0.027 | 0.005 | 32.221 | -0.777 | -0.777 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 51 | GLY | 0 | -0.020 | -0.004 | 35.132 | -0.477 | -0.477 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 52 | VAL | 0 | -0.045 | -0.011 | 34.357 | -0.781 | -0.781 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 53 | ASP | -1 | -0.888 | -0.951 | 35.455 | 31.025 | 31.025 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 54 | PRO | 0 | 0.027 | 0.008 | 32.736 | 0.586 | 0.586 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 55 | VAL | 0 | 0.011 | 0.003 | 33.065 | 0.863 | 0.863 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 56 | GLU | -1 | -0.776 | -0.894 | 35.501 | 30.818 | 30.818 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 57 | ALA | 0 | -0.014 | -0.006 | 31.166 | 0.298 | 0.298 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 58 | ALA | 0 | 0.003 | -0.003 | 30.523 | 0.924 | 0.924 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 59 | ALA | 0 | 0.009 | 0.005 | 31.594 | 0.377 | 0.377 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 60 | ALA | 0 | 0.003 | 0.001 | 32.567 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 61 | VAL | 0 | 0.006 | 0.014 | 26.665 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 62 | ALA | 0 | 0.017 | 0.047 | 29.429 | 0.620 | 0.620 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 63 | GLY | 0 | 0.049 | 0.022 | 31.297 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 64 | GLU | -1 | -0.792 | -0.907 | 30.759 | 33.712 | 33.712 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 65 | SER | 0 | -0.039 | -0.023 | 27.283 | 0.702 | 0.702 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 66 | SER | 0 | -0.023 | -0.048 | 29.023 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 67 | THR | 0 | -0.016 | 0.017 | 31.949 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 68 | ALA | 0 | -0.008 | 0.007 | 34.798 | -0.874 | -0.874 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 69 | THR | 0 | -0.026 | -0.039 | 35.184 | 0.847 | 0.847 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 70 | TRP | 0 | 0.016 | 0.013 | 37.184 | -0.480 | -0.480 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 71 | THR | 0 | -0.013 | 0.006 | 38.647 | -0.707 | -0.707 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 72 | VAL | 0 | -0.014 | 0.013 | 41.785 | 0.508 | 0.508 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 73 | VAL | 0 | 0.017 | 0.001 | 41.625 | -0.338 | -0.338 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 74 | TRP | 0 | 0.056 | 0.009 | 44.666 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 75 | THR | 0 | -0.029 | -0.040 | 43.037 | -0.361 | -0.361 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 76 | ASP | -1 | -0.802 | -0.908 | 41.628 | 28.460 | 28.460 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 77 | LEU | 0 | -0.033 | -0.015 | 43.719 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 78 | LEU | 0 | -0.088 | -0.030 | 45.614 | -0.521 | -0.521 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 79 | THR | 0 | -0.075 | -0.033 | 41.167 | 0.363 | 0.363 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 80 | ALA | 0 | 0.040 | 0.016 | 42.615 | -0.478 | -0.478 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 81 | CYS | 0 | -0.009 | -0.009 | 41.144 | 0.508 | 0.508 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 82 | GLU | -1 | -0.961 | -0.988 | 40.412 | 26.731 | 26.731 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 83 | ARG | 1 | 0.823 | 0.924 | 37.954 | -29.615 | -29.615 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 84 | TYR | 0 | 0.011 | -0.004 | 36.297 | 0.282 | 0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 85 | ARG | 1 | 0.874 | 0.952 | 34.998 | -27.532 | -27.532 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 86 | ALA | 0 | 0.032 | 0.026 | 31.391 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 87 | LYS | 1 | 0.906 | 0.939 | 32.951 | -31.051 | -31.051 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 88 | ALA | 0 | 0.002 | 0.014 | 31.850 | 0.900 | 0.900 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 89 | TYR | 0 | 0.023 | -0.002 | 29.049 | -0.926 | -0.926 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 90 | ARG | 1 | 0.857 | 0.914 | 29.283 | -38.385 | -38.385 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 91 | VAL | 0 | -0.007 | 0.001 | 31.071 | 1.056 | 1.056 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 92 | ASP | -1 | -0.829 | -0.887 | 29.562 | 35.393 | 35.393 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 93 | PRO | 0 | -0.011 | -0.012 | 29.799 | 0.833 | 0.833 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 94 | VAL | 0 | -0.004 | 0.010 | 24.461 | 0.513 | 0.513 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 95 | PRO | 0 | -0.013 | -0.009 | 25.594 | -1.015 | -1.015 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 96 | ASN | 0 | -0.054 | -0.037 | 26.344 | 1.952 | 1.952 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 97 | SER | 0 | 0.044 | 0.011 | 26.848 | 0.557 | 0.557 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 98 | ALA | 0 | -0.039 | -0.012 | 28.991 | -0.505 | -0.505 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 99 | ASP | -1 | -0.902 | -0.947 | 30.089 | 34.700 | 34.700 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 100 | VAL | 0 | -0.050 | -0.008 | 24.278 | 0.619 | 0.619 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 101 | PHE | 0 | 0.007 | -0.020 | 27.554 | -0.629 | -0.629 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 102 | PHE | 0 | -0.023 | -0.001 | 21.949 | 1.482 | 1.482 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 103 | ALA | 0 | 0.008 | -0.009 | 26.335 | -1.653 | -1.653 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 104 | PHE | 0 | 0.008 | 0.003 | 26.362 | 1.549 | 1.549 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 105 | ILE | 0 | -0.029 | -0.016 | 27.612 | -1.648 | -1.648 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 106 | ALA | 0 | 0.016 | 0.004 | 28.478 | 1.043 | 1.043 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 107 | TYR | 0 | -0.035 | -0.046 | 26.649 | -0.600 | -0.600 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 108 | GLU | -1 | -0.847 | -0.921 | 30.663 | 32.947 | 32.947 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 109 | CYS | 0 | 0.038 | 0.005 | 30.669 | 0.912 | 0.912 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 110 | ASP | -1 | -0.884 | -0.950 | 31.205 | 32.373 | 32.373 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 111 | LEU | 0 | -0.091 | -0.047 | 30.726 | -0.545 | -0.545 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 112 | PHE | 0 | -0.024 | -0.013 | 26.234 | 0.676 | 0.676 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 113 | GLU | -1 | -0.833 | -0.897 | 27.921 | 37.668 | 37.668 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 114 | GLU | -1 | -0.799 | -0.890 | 27.323 | 36.613 | 36.613 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 115 | ALA | 0 | 0.026 | 0.017 | 24.934 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 116 | SER | 0 | 0.008 | 0.016 | 23.615 | 1.916 | 1.916 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 117 | LEU | 0 | 0.054 | 0.024 | 16.133 | -0.476 | -0.476 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 118 | ALA | 0 | 0.022 | 0.029 | 20.789 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 119 | ASN | 0 | 0.010 | 0.002 | 21.921 | -0.862 | -0.862 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 120 | LEU | 0 | -0.007 | 0.006 | 20.603 | -0.782 | -0.782 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 121 | THR | 0 | -0.047 | -0.058 | 17.978 | -0.614 | -0.614 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 122 | ALA | 0 | 0.046 | 0.033 | 21.242 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 123 | SER | 0 | -0.011 | -0.010 | 24.201 | -1.412 | -1.412 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 124 | ILE | 0 | -0.064 | -0.024 | 21.677 | -0.288 | -0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 125 | ILE | 0 | -0.010 | -0.020 | 17.863 | 0.388 | 0.388 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 126 | GLY | 0 | -0.010 | 0.023 | 21.840 | 0.400 | 0.400 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 127 | ASN | 0 | 0.091 | 0.011 | 24.076 | 1.564 | 1.564 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 128 | VAL | 0 | 0.036 | 0.016 | 24.491 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 129 | PHE | 0 | 0.004 | 0.013 | 19.998 | -0.265 | -0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 130 | GLY | 0 | -0.027 | -0.013 | 23.914 | 0.536 | 0.536 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 131 | PHE | 0 | 0.035 | 0.030 | 26.103 | -1.385 | -1.385 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 132 | LYS | 1 | 0.835 | 0.913 | 29.210 | -32.940 | -32.940 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 133 | ALA | 0 | 0.018 | 0.009 | 31.575 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 134 | VAL | 0 | -0.007 | -0.001 | 26.804 | -0.441 | -0.441 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 135 | SER | 0 | 0.017 | 0.022 | 27.877 | 0.852 | 0.852 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 136 | ALA | 0 | -0.001 | -0.010 | 22.574 | 1.659 | 1.659 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 137 | LEU | 0 | 0.020 | 0.012 | 22.394 | -1.606 | -1.606 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 138 | ARG | 1 | 0.828 | 0.931 | 13.309 | -66.113 | -66.113 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 139 | LEU | 0 | -0.013 | 0.019 | 17.893 | -1.854 | -1.854 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 140 | GLU | -1 | -0.763 | -0.889 | 17.308 | 63.843 | 63.843 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 141 | ASP | -1 | -0.767 | -0.882 | 17.497 | 58.367 | 58.367 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 142 | MET | 0 | -0.021 | -0.001 | 19.371 | -1.431 | -1.431 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 143 | ARG | 1 | 0.885 | 0.961 | 21.229 | -38.560 | -38.560 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 144 | ILE | 0 | 0.009 | -0.021 | 20.681 | -1.679 | -1.679 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 145 | PRO | 0 | 0.017 | 0.030 | 23.895 | 0.250 | 0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 146 | HIS | 0 | 0.080 | 0.020 | 26.996 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 147 | SER | 0 | -0.013 | -0.027 | 28.321 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 148 | TYR | 0 | 0.010 | 0.006 | 23.815 | 0.182 | 0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 149 | LEU | 0 | 0.037 | 0.035 | 21.989 | 0.599 | 0.599 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 150 | LOH | 1 | 0.862 | 0.948 | 25.133 | -39.876 | -39.876 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 151 | THR | 0 | -0.069 | -0.042 | 26.914 | -0.457 | -0.457 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 152 | PHE | 0 | -0.026 | -0.015 | 21.181 | 0.313 | 0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 153 | GLN | 0 | -0.004 | -0.004 | 20.950 | -2.727 | -2.727 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 154 | GLY | 0 | 0.000 | 0.004 | 19.586 | -0.691 | -0.691 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 155 | HYP | 0 | -0.087 | -0.054 | 15.881 | -0.799 | -0.799 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 156 | ALA | 0 | 0.031 | 0.029 | 18.487 | -3.265 | -3.265 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 157 | THR | 0 | -0.052 | -0.021 | 18.532 | -4.116 | -4.116 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 158 | GLY | 0 | -0.019 | -0.020 | 18.063 | -2.861 | -2.861 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 159 | ILE | 0 | -0.024 | -0.017 | 15.196 | 0.582 | 0.582 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 160 | ILE | 0 | -0.009 | 0.011 | 17.854 | 0.459 | 0.459 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 161 | VAL | 0 | 0.082 | 0.032 | 21.542 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 162 | GLU | -1 | -0.845 | -0.885 | 14.983 | 75.109 | 75.109 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 163 | ARG | 1 | 0.792 | 0.865 | 17.054 | -63.481 | -63.481 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 164 | GLU | -1 | -0.866 | -0.934 | 20.517 | 44.882 | 44.882 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 165 | ARG | 1 | 0.876 | 0.936 | 20.576 | -53.473 | -53.473 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 166 | LEU | 0 | -0.041 | -0.025 | 16.699 | -0.354 | -0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 167 | ASN | 0 | -0.023 | -0.008 | 20.963 | -1.131 | -1.131 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 168 | LYS | 1 | 0.764 | 0.877 | 17.316 | -63.475 | -63.475 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 169 | TYR | 0 | 0.077 | 0.032 | 20.905 | 1.805 | 1.805 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 170 | GLY | 0 | 0.030 | 0.019 | 21.352 | -1.376 | -1.376 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 171 | THR | 0 | -0.031 | -0.003 | 17.632 | -0.865 | -0.865 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 172 | PRO | 0 | 0.013 | 0.020 | 13.710 | -0.575 | -0.575 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 173 | LEU | 0 | -0.012 | 0.013 | 13.506 | -1.517 | -1.517 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 174 | HLU | 0 | -0.004 | -0.003 | 10.047 | 7.482 | 7.482 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 175 | GLY | 0 | 0.070 | 0.021 | 8.569 | -4.365 | -4.365 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 180 | PRO | 0 | 0.028 | 0.007 | 6.670 | -9.089 | -9.089 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 182 | LEU | 0 | -0.008 | -0.009 | 7.592 | -6.334 | -6.334 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 183 | GLY | 0 | 0.041 | 0.009 | 11.161 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 184 | LEU | 0 | -0.050 | -0.019 | 10.984 | -5.958 | -5.958 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 185 | SER | 0 | 0.073 | 0.038 | 14.561 | -0.387 | -0.387 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 186 | GLY | 0 | 0.100 | 0.025 | 16.118 | 2.621 | 2.621 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 187 | LYS | 1 | 0.957 | 0.975 | 17.137 | -47.430 | -47.430 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 188 | ASN | 0 | -0.034 | -0.024 | 15.746 | -2.174 | -2.174 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 189 | TYR | 0 | 0.086 | 0.041 | 8.101 | 0.544 | 0.544 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 190 | GLY | 0 | 0.065 | 0.020 | 13.758 | 2.452 | 2.452 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 191 | ARG | 1 | 0.835 | 0.934 | 16.144 | -56.785 | -56.785 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 192 | VAL | 0 | 0.039 | 0.011 | 9.981 | -1.362 | -1.362 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 193 | VAL | 0 | 0.026 | 0.015 | 11.502 | 1.623 | 1.623 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 194 | TYR | 0 | 0.004 | -0.001 | 13.433 | -2.210 | -2.210 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 195 | GLU | -1 | -0.894 | -0.939 | 14.360 | 58.402 | 58.402 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 196 | GLY | 0 | 0.058 | 0.011 | 11.867 | -1.418 | -1.418 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 197 | LEU | 0 | -0.003 | 0.013 | 12.839 | -0.648 | -0.648 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 198 | LYO | 1 | 0.903 | 0.953 | 15.105 | -53.336 | -53.336 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 199 | GLY | 0 | -0.035 | -0.017 | 15.751 | -2.535 | -2.535 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 200 | GLY | 0 | 0.030 | 0.019 | 15.602 | -0.415 | -0.415 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 201 | LEU | 0 | -0.026 | 0.003 | 9.001 | -0.727 | -0.727 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 202 | ASP | -1 | -0.793 | -0.874 | 12.865 | 67.326 | 67.326 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 203 | PHE | 0 | 0.024 | 0.000 | 10.450 | -4.165 | -4.165 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 204 | LEU | 0 | -0.057 | -0.018 | 8.570 | 3.066 | 3.066 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 206 | ASP | -1 | -0.782 | -0.882 | 6.738 | 88.018 | 88.018 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 209 | ASN | 0 | 0.014 | 0.014 | 5.933 | -4.202 | -4.202 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 210 | ILE | 0 | -0.025 | 0.008 | 8.495 | -10.131 | -10.131 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 211 | ASN | 0 | -0.020 | 0.000 | 10.414 | -3.279 | -3.279 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 212 | SER | 0 | 0.023 | -0.016 | 13.150 | -2.607 | -2.607 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 213 | GLN | 0 | 0.036 | 0.019 | 12.522 | -1.923 | -1.923 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 214 | PRO | 0 | -0.016 | -0.013 | 17.837 | -0.920 | -0.920 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 215 | PHE | 0 | -0.017 | 0.004 | 13.152 | -1.643 | -1.643 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 216 | MET | 0 | -0.057 | -0.007 | 12.511 | -0.594 | -0.594 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 217 | ARG | 1 | 0.825 | 0.938 | 17.324 | -50.616 | -50.616 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 218 | TRP | 0 | 0.017 | 0.002 | 16.900 | -0.302 | -0.302 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 219 | ARG | 1 | 0.958 | 0.985 | 17.949 | -46.327 | -46.327 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 220 | GLU | -1 | -0.904 | -0.955 | 19.910 | 50.602 | 50.602 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 221 | ARG | 1 | 0.816 | 0.887 | 12.338 | -75.552 | -75.552 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 222 | PHE | 0 | 0.005 | 0.008 | 14.523 | 0.237 | 0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 223 | LEU | 0 | -0.018 | -0.003 | 17.998 | -0.479 | -0.479 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 224 | ASN | 0 | -0.054 | -0.037 | 18.545 | -2.043 | -2.043 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 225 | CYS | 0 | 0.004 | 0.010 | 13.660 | 0.562 | 0.562 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 226 | MET | 0 | 0.011 | 0.030 | 16.937 | 1.552 | 1.552 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 227 | GLU | -1 | -0.770 | -0.836 | 19.764 | 44.211 | 44.211 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 228 | GLY | 0 | -0.035 | -0.031 | 17.949 | -0.838 | -0.838 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 229 | ILE | 0 | 0.045 | 0.007 | 15.194 | 0.260 | 0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 230 | ASN | 0 | 0.013 | 0.014 | 18.322 | -0.678 | -0.678 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 231 | ARG | 1 | 0.857 | 0.941 | 21.365 | -49.273 | -49.273 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 232 | ALA | 0 | 0.005 | 0.006 | 18.566 | -1.416 | -1.416 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 233 | SER | 0 | -0.010 | 0.003 | 20.512 | -1.492 | -1.492 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 234 | ALA | 0 | -0.010 | -0.015 | 22.193 | -1.362 | -1.362 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 235 | ALA | 0 | -0.081 | -0.039 | 22.374 | -1.676 | -1.676 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 236 | THR | 0 | -0.008 | -0.040 | 19.935 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 237 | GLY | 0 | 0.050 | 0.021 | 23.355 | -0.865 | -0.865 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 238 | GLU | -1 | -0.777 | -0.845 | 19.274 | 58.663 | 58.663 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 239 | VAL | 0 | 0.031 | 0.040 | 19.410 | -0.200 | -0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 240 | LYS | 1 | 0.788 | 0.896 | 16.356 | -62.328 | -62.328 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 241 | GLY | 0 | 0.025 | 0.003 | 15.321 | -2.772 | -2.772 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 242 | SER | 0 | 0.007 | -0.006 | 10.954 | 4.996 | 4.996 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 243 | TYR | 0 | -0.019 | -0.013 | 7.143 | -8.803 | -8.803 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 244 | LEU | 0 | 0.002 | 0.009 | 10.059 | 3.049 | 3.049 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 245 | ASN | 0 | 0.029 | 0.032 | 8.538 | -6.544 | -6.544 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 246 | ILE | 0 | -0.045 | -0.026 | 11.319 | -3.921 | -3.921 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 247 | THR | 0 | 0.000 | -0.025 | 10.789 | -4.282 | -4.282 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 248 | ALA | 0 | -0.024 | -0.026 | 13.558 | -0.979 | -0.979 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 249 | ALA | 0 | 0.040 | 0.029 | 16.642 | 0.725 | 0.725 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 250 | THR | 0 | 0.028 | 0.025 | 19.242 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 251 | MET | 0 | 0.060 | 0.035 | 19.901 | 1.861 | 1.861 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 252 | GLU | -1 | -0.798 | -0.880 | 21.901 | 44.115 | 44.115 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 253 | GLU | -1 | -0.828 | -0.906 | 19.730 | 48.913 | 48.913 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 254 | VAL | 0 | 0.010 | 0.000 | 16.734 | 0.764 | 0.764 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 255 | TYR | 0 | -0.006 | -0.040 | 18.903 | 1.613 | 1.613 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 256 | LYS | 1 | 0.825 | 0.917 | 21.772 | -45.927 | -45.927 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 257 | ARG | 1 | 0.725 | 0.850 | 16.020 | -59.396 | -59.396 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 258 | ALA | 0 | 0.044 | 0.023 | 18.379 | 0.934 | 0.934 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 259 | GLU | -1 | -0.836 | -0.919 | 19.254 | 44.571 | 44.571 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 260 | TYR | 0 | -0.069 | -0.043 | 20.761 | -1.768 | -1.768 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 261 | ALA | 0 | 0.011 | -0.003 | 17.776 | -0.700 | -0.700 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 262 | LYS | 1 | 0.944 | 0.980 | 19.698 | -43.934 | -43.934 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 263 | ALA | 0 | -0.065 | -0.020 | 22.199 | -1.146 | -1.146 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 264 | VAL | 0 | -0.106 | -0.055 | 20.697 | -1.279 | -1.279 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 265 | GLY | 0 | 0.002 | -0.002 | 22.882 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 266 | SER | 0 | -0.067 | -0.038 | 16.173 | 0.914 | 0.914 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 267 | ILE | 0 | 0.059 | 0.030 | 16.609 | -0.964 | -0.964 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 268 | VAL | 0 | -0.027 | -0.022 | 12.510 | 0.581 | 0.581 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 269 | VAL | 0 | -0.011 | 0.006 | 13.469 | -0.876 | -0.876 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 270 | MET | 0 | -0.049 | -0.015 | 5.304 | 2.496 | 2.496 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 271 | ILE | 0 | -0.001 | -0.005 | 10.140 | -5.134 | -5.134 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 272 | ASP | -1 | -0.757 | -0.883 | 7.883 | 112.425 | 112.425 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 273 | LEU | 0 | -0.033 | -0.036 | 8.143 | -7.568 | -7.568 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 274 | VAL | 0 | -0.043 | -0.017 | 9.721 | -6.421 | -6.421 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 275 | MET | 0 | -0.024 | 0.000 | 12.030 | -6.647 | -6.647 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 276 | GLY | 0 | 0.005 | 0.006 | 13.695 | -4.858 | -4.858 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 277 | TYR | 0 | 0.047 | 0.000 | 13.081 | -1.455 | -1.455 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 278 | THR | 0 | 0.012 | 0.009 | 16.759 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 279 | ALA | 0 | 0.019 | 0.006 | 17.333 | -1.422 | -1.422 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 280 | ILE | 0 | -0.046 | -0.015 | 12.620 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 281 | GLN | 0 | 0.039 | -0.008 | 16.442 | -0.796 | -0.796 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 282 | SER | 0 | -0.010 | 0.018 | 19.283 | -1.333 | -1.333 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 283 | ILE | 0 | 0.017 | 0.009 | 16.116 | -1.374 | -1.374 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 284 | ALA | 0 | 0.005 | 0.003 | 17.291 | 0.550 | 0.550 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 285 | TYR | 0 | -0.008 | -0.003 | 18.970 | -1.098 | -1.098 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 286 | TRP | 0 | -0.014 | -0.017 | 18.887 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 287 | ALA | 0 | -0.009 | -0.018 | 18.306 | -1.168 | -1.168 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 288 | ARG | 1 | 0.808 | 0.901 | 20.380 | -48.793 | -48.793 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 289 | GLU | -1 | -0.990 | -0.988 | 23.234 | 40.114 | 40.114 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 290 | ASN | 0 | -0.069 | -0.031 | 22.708 | -2.877 | -2.877 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 291 | ASP | -1 | -0.958 | -0.966 | 23.105 | 45.304 | 45.304 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 292 | MET | 0 | -0.086 | -0.018 | 17.113 | 0.686 | 0.686 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 293 | LEU | 0 | -0.045 | -0.011 | 14.971 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 294 | LEU | 0 | 0.010 | 0.008 | 13.610 | 0.820 | 0.820 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 295 | HIS | 0 | 0.003 | -0.013 | 5.410 | -6.946 | -6.946 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 296 | LEU | 0 | 0.002 | -0.006 | 8.101 | -1.731 | -1.731 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 300 | GLY | 0 | 0.036 | 0.015 | 6.605 | -10.688 | -10.688 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 301 | ASN | 0 | 0.055 | 0.042 | 5.689 | -18.090 | -18.090 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 302 | SER | 0 | 0.020 | 0.000 | 5.772 | -8.822 | -8.822 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 303 | THR | 0 | -0.049 | -0.027 | 8.394 | -8.311 | -8.311 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 304 | TYR | 0 | 0.047 | 0.013 | 9.726 | -5.842 | -5.842 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 305 | ALA | 0 | -0.007 | 0.002 | 9.080 | -3.098 | -3.098 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 306 | ARG | 1 | 0.823 | 0.929 | 8.922 | -93.560 | -93.560 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 307 | GLN | 0 | -0.026 | -0.034 | 10.961 | -3.481 | -3.481 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 308 | LYS | 1 | 0.892 | 0.964 | 14.682 | -56.109 | -56.109 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 309 | ASN | 0 | -0.007 | -0.020 | 16.858 | 0.273 | 0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 310 | HIS | 0 | -0.017 | -0.027 | 18.065 | -3.265 | -3.265 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 311 | GLY | 0 | 0.011 | 0.017 | 15.867 | 3.163 | 3.163 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 312 | ILE | 0 | -0.043 | -0.027 | 13.836 | -3.815 | -3.815 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 313 | ASN | 0 | 0.024 | 0.020 | 13.013 | 7.149 | 7.149 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 314 | PHE | 0 | 0.063 | 0.010 | 7.094 | 0.498 | 0.498 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 315 | ARG | 1 | 0.922 | 0.968 | 10.661 | -64.748 | -64.748 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 316 | VAL | 0 | -0.008 | 0.007 | 13.194 | -2.266 | -2.266 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 317 | ILE | 0 | -0.019 | 0.003 | 9.333 | -2.263 | -2.263 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 318 | CYS | 0 | -0.028 | -0.003 | 10.247 | 1.074 | 1.074 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 319 | LYS | 1 | 0.846 | 0.905 | 12.039 | -58.882 | -58.882 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 320 | TRP | 0 | 0.066 | 0.009 | 14.524 | -1.615 | -1.615 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 321 | MET | 0 | -0.023 | -0.009 | 10.440 | -2.113 | -2.113 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 322 | ARG | 1 | 0.792 | 0.908 | 13.608 | -59.859 | -59.859 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 323 | MET | 0 | -0.039 | -0.010 | 15.616 | -2.538 | -2.538 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 324 | SER | 0 | -0.056 | -0.050 | 15.857 | -3.070 | -3.070 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 325 | GLY | 0 | 0.035 | 0.026 | 16.575 | -1.994 | -1.994 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 326 | VAL | 0 | 0.011 | 0.016 | 11.235 | -0.832 | -0.832 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 327 | ASP | -1 | -0.728 | -0.853 | 14.239 | 63.710 | 63.710 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 328 | HIS | 1 | 0.761 | 0.866 | 9.206 | -90.030 | -90.030 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 329 | ILE | 0 | 0.047 | 0.018 | 6.809 | -2.215 | -2.215 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 334 | VAL | 0 | -0.005 | 0.020 | 7.182 | -10.855 | -10.855 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 335 | VAL | 0 | -0.021 | -0.015 | 9.467 | -2.115 | -2.115 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 336 | GLY | 0 | 0.020 | 0.018 | 7.079 | -3.010 | -3.010 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 340 | GLY | 0 | 0.014 | -0.014 | 5.947 | 11.702 | 11.702 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 341 | ASP | -1 | -0.813 | -0.907 | 8.227 | 67.676 | 67.676 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 342 | PRO | 0 | -0.022 | -0.030 | 11.474 | 2.792 | 2.792 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 343 | LEU | 0 | 0.000 | 0.007 | 13.249 | 0.705 | 0.705 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 344 | MET | 0 | -0.022 | 0.010 | 11.539 | -2.189 | -2.189 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 345 | ILE | 0 | -0.013 | 0.008 | 7.097 | 2.632 | 2.632 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 346 | M3L | 1 | 0.893 | 0.958 | 10.571 | -63.321 | -63.321 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 347 | GLY | 0 | 0.081 | 0.058 | 13.920 | -2.562 | -2.562 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 348 | PHE | 0 | -0.035 | -0.022 | 8.413 | -0.686 | -0.686 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 349 | TYR | 0 | -0.050 | -0.058 | 7.184 | -2.922 | -2.922 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 350 | ASP | -1 | -0.868 | -0.933 | 12.714 | 59.922 | 59.922 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 351 | ILE | 0 | -0.057 | -0.018 | 14.579 | -3.113 | -3.113 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 352 | LEU | 0 | -0.054 | -0.026 | 9.908 | -2.213 | -2.213 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 353 | ARG | 1 | 0.826 | 0.896 | 13.820 | -77.246 | -77.246 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 354 | LEU | 0 | 0.024 | 0.045 | 16.688 | -2.261 | -2.261 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 355 | THR | 0 | -0.023 | -0.025 | 20.074 | 1.537 | 1.537 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 356 | GLU | -1 | -0.878 | -0.938 | 23.168 | 42.376 | 42.376 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 357 | LEU | 0 | -0.065 | -0.028 | 19.210 | 2.054 | 2.054 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 358 | GLU | -1 | -0.858 | -0.934 | 23.047 | 40.634 | 40.634 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 359 | VAL | 0 | -0.054 | -0.031 | 23.524 | 1.638 | 1.638 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 360 | ASN | 0 | 0.018 | -0.001 | 21.202 | -1.405 | -1.405 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 361 | LEU | 0 | 0.004 | 0.001 | 21.066 | 1.967 | 1.967 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 362 | PRO | 0 | -0.007 | 0.005 | 20.635 | 1.982 | 1.982 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 363 | PHE | 0 | -0.004 | -0.009 | 17.220 | 2.488 | 2.488 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 364 | GLY | 0 | -0.021 | -0.016 | 16.564 | 3.299 | 3.299 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 365 | ILE | 0 | -0.022 | 0.001 | 16.937 | 0.865 | 0.865 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 366 | PHE | 0 | 0.002 | -0.015 | 18.802 | -2.504 | -2.504 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 367 | PHE | 0 | -0.051 | -0.030 | 22.268 | -2.500 | -2.500 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 368 | GLU | -1 | -0.922 | -0.941 | 23.444 | 40.522 | 40.522 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 369 | MET | 0 | -0.102 | -0.055 | 20.480 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 370 | ASP | -1 | -0.771 | -0.878 | 24.338 | 42.786 | 42.786 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 371 | TRP | 0 | -0.008 | -0.008 | 17.408 | 0.670 | 0.670 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 372 | ALA | 0 | -0.019 | -0.007 | 23.578 | 0.351 | 0.351 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 373 | SER | 0 | -0.065 | -0.060 | 25.312 | -1.380 | -1.380 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 374 | LEU | 0 | -0.018 | 0.016 | 21.017 | 0.330 | 0.330 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 375 | ARG | 1 | 0.936 | 0.963 | 20.523 | -47.962 | -47.962 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 376 | ARG | 1 | 0.865 | 0.936 | 17.766 | -55.469 | -55.469 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 377 | CYS | 0 | -0.023 | -0.008 | 12.680 | 1.779 | 1.779 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 378 | MET | 0 | 0.013 | 0.008 | 11.331 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 379 | PRO | 0 | 0.000 | 0.011 | 8.865 | 5.398 | 5.398 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 386 | HIS | 0 | 0.020 | 0.002 | 6.063 | 5.810 | 5.810 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 387 | CYS | 0 | 0.049 | 0.014 | 8.819 | -6.226 | -6.226 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 388 | GLY | 0 | 0.021 | 0.004 | 11.665 | -5.191 | -5.191 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 389 | GLN | 0 | 0.006 | 0.000 | 9.697 | 3.031 | 3.031 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 390 | MET | 0 | -0.019 | 0.000 | 11.772 | 2.119 | 2.119 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 391 | HIS | 0 | 0.045 | 0.017 | 14.454 | 0.306 | 0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 392 | GLN | 0 | -0.002 | -0.017 | 14.781 | 0.990 | 0.990 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 393 | LEU | 0 | 0.000 | 0.010 | 10.206 | -0.209 | -0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 394 | ILE | 0 | 0.035 | 0.021 | 13.365 | -0.428 | -0.428 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 395 | HIS | 1 | 0.879 | 0.965 | 16.163 | -63.933 | -63.933 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 396 | TYR | 0 | -0.040 | -0.043 | 13.227 | -4.266 | -4.266 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 397 | LEU | 0 | 0.030 | 0.019 | 9.327 | -0.856 | -0.856 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 398 | GLY | 0 | -0.007 | 0.019 | 12.918 | -0.828 | -0.828 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 399 | ASP | -1 | -0.837 | -0.920 | 15.293 | 61.776 | 61.776 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 400 | ASP | -1 | -0.824 | -0.907 | 15.258 | 64.435 | 64.435 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 401 | VAL | 0 | 0.025 | 0.003 | 9.231 | 2.471 | 2.471 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 402 | VAL | 0 | -0.013 | 0.004 | 8.924 | -4.224 | -4.224 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 403 | LEU | 0 | -0.011 | -0.004 | 8.127 | 11.806 | 11.806 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 409 | THR | 0 | -0.057 | -0.019 | 6.078 | -20.031 | -20.031 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 410 | ILE | 0 | -0.038 | -0.043 | 6.291 | -14.228 | -14.228 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 411 | GLY | 0 | 0.024 | 0.022 | 7.100 | -8.090 | -8.090 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 412 | HIS | 0 | -0.060 | -0.016 | 8.551 | -6.819 | -6.819 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 413 | PRO | 0 | 0.010 | 0.010 | 11.601 | -1.601 | -1.601 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 414 | ASP | -1 | -0.858 | -0.942 | 14.713 | 53.842 | 53.842 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 415 | GLY | 0 | -0.008 | -0.005 | 14.422 | -2.828 | -2.828 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 416 | ILE | 0 | 0.003 | -0.002 | 10.731 | 1.419 | 1.419 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 417 | GLN | 0 | -0.056 | -0.057 | 12.771 | 0.727 | 0.727 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 418 | ALA | 0 | 0.032 | 0.028 | 15.204 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 419 | GLY | 0 | 0.046 | 0.014 | 11.265 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 420 | ALA | 0 | -0.014 | 0.005 | 11.348 | 3.098 | 3.098 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 421 | THR | 0 | -0.034 | -0.040 | 12.267 | -1.982 | -1.982 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 422 | ALA | 0 | -0.022 | -0.003 | 13.207 | -2.191 | -2.191 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 423 | ASN | 0 | -0.018 | -0.013 | 8.567 | -2.461 | -2.461 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 424 | ARG | 1 | 0.834 | 0.908 | 12.170 | -62.569 | -62.569 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 425 | VAL | 0 | 0.022 | 0.007 | 14.951 | -2.622 | -2.622 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 426 | ALA | 0 | -0.003 | -0.009 | 14.274 | -2.567 | -2.567 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 427 | LEU | 0 | 0.002 | 0.006 | 13.841 | -1.010 | -1.010 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 428 | GLU | -1 | -0.773 | -0.899 | 15.901 | 55.177 | 55.177 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 429 | SER | 0 | -0.043 | -0.023 | 19.250 | -2.888 | -2.888 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 430 | MET | 0 | -0.033 | -0.002 | 17.921 | -2.950 | -2.950 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 431 | VAL | 0 | -0.009 | -0.010 | 18.572 | -1.244 | -1.244 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 432 | LEU | 0 | -0.018 | 0.003 | 21.168 | -2.240 | -2.240 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 433 | ALA | 0 | 0.060 | 0.019 | 23.629 | -1.738 | -1.738 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 434 | ARG | 1 | 0.791 | 0.890 | 19.760 | -58.012 | -58.012 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 435 | ASN | 0 | -0.014 | -0.022 | 24.656 | -0.416 | -0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 436 | GLU | -1 | -0.975 | -0.985 | 26.937 | 39.928 | 39.928 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 437 | GLY | 0 | -0.036 | -0.007 | 28.445 | -1.625 | -1.625 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 438 | VAL | 0 | -0.036 | -0.014 | 26.134 | -0.722 | -0.722 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 439 | ASP | -1 | -0.910 | -0.944 | 26.646 | 47.947 | 47.947 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 440 | TYR | 0 | -0.007 | -0.037 | 19.392 | 1.543 | 1.543 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 441 | PHE | 0 | -0.042 | -0.030 | 18.207 | 2.520 | 2.520 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 442 | ASP | -1 | -0.791 | -0.887 | 22.316 | 47.943 | 47.943 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 443 | GLN | 0 | -0.020 | -0.023 | 21.762 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 444 | GLN | 0 | -0.056 | -0.028 | 22.838 | 2.021 | 2.021 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 445 | VAL | 0 | -0.012 | -0.009 | 24.973 | 0.198 | 0.198 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 446 | GLY | 0 | 0.061 | 0.031 | 21.309 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 447 | PRO | 0 | -0.020 | -0.027 | 19.606 | 0.858 | 0.858 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 448 | GLN | 0 | -0.043 | -0.013 | 20.872 | 0.279 | 0.279 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 449 | ILE | 0 | 0.044 | 0.026 | 21.623 | -1.050 | -1.050 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 450 | LEU | 0 | -0.026 | -0.003 | 16.198 | -0.349 | -0.349 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 451 | ARG | 1 | 0.970 | 0.978 | 20.140 | -52.252 | -52.252 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 452 | ASP | -1 | -0.931 | -0.963 | 22.620 | 42.898 | 42.898 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 453 | ALA | 0 | -0.004 | -0.005 | 20.967 | -1.267 | -1.267 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 454 | ALA | 0 | -0.021 | -0.009 | 20.308 | -0.319 | -0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 455 | LYS | 1 | 0.929 | 0.974 | 21.935 | -42.629 | -42.629 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 456 | THR | 0 | -0.049 | -0.019 | 24.767 | -1.691 | -1.691 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 457 | CYS | 0 | -0.034 | -0.005 | 19.572 | 1.248 | 1.248 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 458 | GLY | 0 | 0.064 | 0.042 | 20.706 | 1.192 | 1.192 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 459 | PRO | 0 | 0.030 | 0.016 | 16.771 | 0.954 | 0.954 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 460 | LEU | 0 | 0.051 | 0.025 | 15.531 | 3.362 | 3.362 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 461 | GLN | 0 | -0.025 | -0.005 | 17.177 | 0.764 | 0.764 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 462 | THR | 0 | -0.038 | -0.036 | 16.010 | -0.259 | -0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 463 | ALA | 0 | 0.006 | 0.000 | 12.814 | 1.225 | 1.225 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 464 | LEU | 0 | -0.041 | -0.016 | 14.076 | 3.266 | 3.266 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 465 | ASP | -1 | -0.913 | -0.964 | 16.461 | 54.832 | 54.832 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 466 | LEU | 0 | -0.067 | -0.029 | 11.751 | -1.109 | -1.109 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 467 | TRP | 0 | -0.010 | -0.023 | 8.618 | 2.305 | 2.305 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 468 | LYS | 1 | 0.924 | 0.981 | 13.178 | -54.340 | -54.340 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 469 | ASP | -1 | -0.964 | -0.982 | 16.101 | 58.961 | 58.961 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 470 | ILE | 0 | -0.038 | -0.003 | 9.413 | 0.835 | 0.835 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 471 | SER | 0 | -0.055 | -0.034 | 11.824 | 1.099 | 1.099 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 472 | PHE | 0 | 0.010 | 0.002 | 7.186 | 1.648 | 1.648 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 473 | ASP | -1 | -0.947 | -0.969 | 11.808 | 72.189 | 72.189 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 474 | TYR | 0 | 0.022 | -0.007 | 12.201 | -0.245 | -0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 475 | THR | 0 | -0.014 | -0.004 | 14.361 | 0.932 | 0.932 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 476 | SER | 0 | 0.022 | 0.023 | 11.663 | 2.199 | 2.199 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 477 | THR | 0 | -0.052 | -0.019 | 12.181 | -2.875 | -2.875 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 478 | ASP | -1 | -0.902 | -0.945 | 10.871 | 75.924 | 75.924 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 479 | THR | 0 | 0.014 | -0.001 | 12.793 | 0.650 | 0.650 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 480 | ALA | 0 | 0.055 | 0.018 | 15.632 | -1.771 | -1.771 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 481 | ASP | -1 | -0.838 | -0.917 | 18.350 | 50.671 | 50.671 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 482 | PHE | 0 | -0.001 | 0.000 | 21.860 | -2.290 | -2.290 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 483 | ALA | 0 | 0.013 | 0.003 | 22.080 | 1.921 | 1.921 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 484 | GLU | -1 | -0.959 | -0.977 | 21.788 | 42.807 | 42.807 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | I | 1 | MET | 0 | -0.110 | -0.037 | 26.098 | -0.419 | -0.419 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | I | 2 | ARG | 1 | 0.817 | 0.894 | 25.268 | -44.871 | -44.871 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | I | 3 | LEU | 0 | -0.005 | -0.013 | 25.469 | 1.675 | 1.675 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | I | 4 | THR | 0 | -0.038 | -0.039 | 21.487 | -1.193 | -1.193 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | I | 5 | GLN | 0 | 0.015 | 0.016 | 22.258 | 1.850 | 1.850 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | I | 6 | GLY | 0 | 0.000 | 0.016 | 24.432 | -1.138 | -1.138 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | I | 7 | CYS | 0 | -0.015 | -0.010 | 21.360 | 0.589 | 0.589 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | I | 8 | PHE | 0 | 0.036 | 0.011 | 21.469 | 0.978 | 0.978 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | I | 9 | SER | 0 | -0.039 | -0.022 | 23.344 | -1.723 | -1.723 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | I | 10 | PHE | 0 | -0.044 | -0.022 | 17.706 | -0.685 | -0.685 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | I | 11 | LEU | 0 | -0.033 | 0.002 | 21.597 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | I | 12 | PRO | 0 | -0.030 | -0.020 | 24.098 | -0.876 | -0.876 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | I | 13 | ASP | -1 | -0.821 | -0.916 | 27.750 | 39.179 | 39.179 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | I | 14 | LEU | 0 | -0.008 | 0.008 | 27.324 | -0.338 | -0.338 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | I | 15 | THR | 0 | -0.009 | -0.007 | 31.137 | -1.364 | -1.364 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | I | 16 | ASP | -1 | -0.810 | -0.907 | 34.257 | 32.640 | 32.640 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | I | 17 | ALA | 0 | -0.011 | -0.017 | 36.043 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | I | 18 | GLN | 0 | 0.021 | 0.019 | 29.280 | -0.313 | -0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | I | 19 | ILE | 0 | 0.014 | 0.007 | 31.960 | 0.800 | 0.800 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | I | 20 | GLU | -1 | -0.921 | -0.972 | 33.041 | 34.512 | 34.512 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | I | 21 | LYS | 1 | 0.998 | 0.999 | 31.744 | -36.209 | -36.209 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | I | 22 | GLN | 0 | 0.000 | 0.015 | 27.099 | 1.686 | 1.686 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | I | 23 | VAL | 0 | 0.001 | -0.003 | 30.547 | 0.506 | 0.506 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | I | 24 | ALA | 0 | 0.017 | 0.005 | 33.414 | -0.299 | -0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | I | 25 | TYR | 0 | -0.033 | -0.005 | 23.747 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | I | 26 | ALA | 0 | 0.005 | -0.010 | 29.347 | 0.393 | 0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | I | 27 | MET | 0 | -0.011 | 0.002 | 30.320 | -0.336 | -0.336 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | I | 28 | ALA | 0 | -0.072 | -0.027 | 31.693 | -0.765 | -0.765 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | I | 29 | LYS | 1 | 0.879 | 0.948 | 24.159 | -47.472 | -47.472 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | I | 30 | GLY | 0 | -0.023 | 0.004 | 30.081 | 0.260 | 0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | I | 31 | TRP | 0 | -0.017 | -0.005 | 24.572 | 0.249 | 0.249 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | I | 32 | ALA | 0 | 0.019 | 0.016 | 31.587 | -0.967 | -0.967 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | I | 33 | MET | 0 | 0.000 | 0.007 | 31.374 | 1.265 | 1.265 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | I | 34 | ASN | 0 | -0.035 | -0.029 | 34.181 | -0.331 | -0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | I | 35 | VAL | 0 | 0.025 | 0.027 | 34.883 | 1.077 | 1.077 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | I | 36 | GLU | -1 | -0.749 | -0.877 | 33.640 | 36.800 | 36.800 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | I | 37 | TRP | 0 | -0.010 | -0.009 | 35.808 | 0.590 | 0.590 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | I | 38 | THR | 0 | 0.064 | 0.039 | 33.568 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | I | 39 | ASP | -1 | -0.769 | -0.892 | 36.396 | 31.064 | 31.064 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | I | 40 | ASP | -1 | -0.829 | -0.936 | 34.023 | 35.685 | 35.685 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | I | 41 | PRO | 0 | -0.049 | -0.015 | 30.496 | 0.860 | 0.860 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | I | 42 | HIS | 0 | 0.002 | -0.008 | 28.974 | 2.213 | 2.213 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | I | 43 | PRO | 0 | -0.019 | -0.005 | 24.872 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | I | 44 | ARG | 1 | 0.887 | 0.932 | 25.139 | -44.353 | -44.353 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | I | 45 | ASN | 0 | -0.013 | 0.008 | 28.307 | -1.057 | -1.057 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | I | 46 | ASN | 0 | -0.007 | -0.014 | 29.169 | 1.123 | 1.123 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | I | 47 | TYR | 0 | -0.056 | -0.028 | 30.943 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | I | 48 | TRP | 0 | -0.013 | 0.006 | 30.308 | -0.570 | -0.570 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | I | 49 | GLU | -1 | -0.898 | -0.950 | 35.485 | 31.558 | 31.558 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | I | 50 | LEU | 0 | -0.022 | -0.022 | 37.402 | 0.441 | 0.441 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | I | 51 | TRP | 0 | -0.035 | -0.010 | 39.638 | -0.836 | -0.836 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | I | 52 | GLY | 0 | -0.008 | -0.006 | 41.246 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | I | 53 | LEU | 0 | -0.020 | -0.024 | 41.156 | 0.460 | 0.460 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | I | 54 | PRO | 0 | 0.015 | -0.011 | 36.468 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | I | 55 | LEU | 0 | -0.035 | -0.009 | 38.084 | -0.825 | -0.825 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | I | 56 | PHE | 0 | 0.005 | -0.008 | 35.853 | 0.387 | 0.387 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | I | 57 | ASP | -1 | -0.929 | -0.943 | 38.674 | 29.862 | 29.862 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | I | 58 | ILE | 0 | -0.029 | -0.024 | 39.936 | -0.900 | -0.900 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | I | 59 | LYS | 1 | 0.969 | 0.972 | 38.032 | -31.178 | -31.178 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | I | 60 | ASP | -1 | -0.883 | -0.954 | 40.447 | 29.393 | 29.393 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | I | 61 | PRO | 0 | 0.061 | 0.017 | 37.372 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | I | 62 | ALA | 0 | 0.005 | 0.007 | 39.274 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | I | 63 | THR | 0 | -0.011 | -0.004 | 42.333 | -0.599 | -0.599 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | I | 64 | VAL | 0 | 0.019 | 0.014 | 36.658 | -0.197 | -0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | I | 65 | MET | 0 | -0.035 | -0.005 | 37.012 | 0.317 | 0.317 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | I | 66 | PHE | 0 | -0.040 | -0.013 | 40.371 | -0.376 | -0.376 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | I | 67 | GLU | -1 | -0.834 | -0.929 | 41.693 | 27.935 | 27.935 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | I | 68 | LEU | 0 | -0.033 | 0.000 | 36.338 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | I | 69 | ASN | 0 | -0.017 | -0.034 | 40.079 | 0.360 | 0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | I | 70 | GLU | -1 | -0.842 | -0.914 | 42.871 | 25.859 | 25.859 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | I | 71 | ALA | 0 | 0.011 | 0.020 | 40.572 | -0.368 | -0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | I | 72 | ARG | 1 | 0.766 | 0.842 | 35.940 | -32.947 | -32.947 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | I | 73 | LYS | 1 | 0.760 | 0.889 | 41.848 | -26.517 | -26.517 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | I | 74 | SER | 0 | -0.035 | -0.008 | 45.459 | -0.620 | -0.620 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | I | 75 | CYS | 0 | -0.043 | -0.003 | 41.749 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | I | 76 | ALA | 0 | 0.012 | 0.018 | 43.011 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | I | 77 | ALA | 0 | -0.021 | -0.018 | 40.489 | 0.622 | 0.622 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | I | 78 | GLY | 0 | 0.013 | -0.007 | 37.109 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | I | 79 | TYR | 0 | -0.095 | -0.094 | 30.650 | 0.996 | 0.996 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | I | 80 | ILE | 0 | 0.016 | 0.016 | 34.289 | -0.688 | -0.688 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | I | 81 | ARG | 1 | 0.839 | 0.930 | 29.406 | -39.145 | -39.145 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | I | 82 | ILE | 0 | 0.013 | 0.015 | 31.607 | -1.193 | -1.193 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | I | 83 | ASN | 0 | -0.027 | -0.014 | 29.992 | 2.895 | 2.895 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | I | 84 | ALA | 0 | 0.013 | 0.001 | 28.177 | -1.428 | -1.428 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | I | 85 | PHE | 0 | -0.017 | -0.014 | 28.457 | 1.534 | 1.534 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | I | 86 | ASP | -1 | -0.815 | -0.897 | 26.633 | 42.011 | 42.011 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | I | 87 | ALA | 0 | 0.002 | -0.022 | 28.582 | 0.572 | 0.572 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | I | 88 | SER | 0 | -0.018 | -0.007 | 27.572 | -1.153 | -1.153 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | I | 89 | TYR | 0 | 0.067 | 0.030 | 27.485 | 1.469 | 1.469 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | I | 90 | GLY | 0 | -0.015 | -0.004 | 24.583 | 0.970 | 0.970 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | I | 91 | VAL | 0 | -0.082 | -0.045 | 23.051 | 2.925 | 2.925 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | I | 92 | GLU | -1 | -0.972 | -0.988 | 24.934 | 39.618 | 39.618 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | I | 93 | SER | 0 | 0.005 | 0.002 | 25.087 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | I | 94 | CYS | 0 | -0.035 | 0.002 | 26.791 | -0.272 | -0.272 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | I | 95 | VAL | 0 | 0.025 | 0.007 | 23.572 | 1.871 | 1.871 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | I | 96 | MET | 0 | -0.043 | -0.045 | 23.710 | 1.911 | 1.911 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | I | 97 | SER | 0 | -0.007 | 0.009 | 25.539 | -1.794 | -1.794 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | I | 98 | PHE | 0 | 0.013 | -0.007 | 25.613 | 2.021 | 2.021 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | I | 99 | ILE | 0 | -0.001 | 0.014 | 27.406 | -1.450 | -1.450 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | I | 100 | THR | 0 | 0.006 | -0.017 | 29.635 | 0.479 | 0.479 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | I | 101 | ASN | 0 | -0.014 | 0.013 | 32.708 | -0.520 | -0.520 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | I | 102 | ARG | 1 | 0.919 | 0.972 | 27.208 | -40.654 | -40.654 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | I | 103 | PRO | 0 | 0.020 | 0.024 | 33.533 | -0.889 | -0.889 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | I | 104 | THR | 0 | -0.031 | -0.014 | 34.722 | 0.416 | 0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | I | 105 | ASN | 0 | -0.059 | -0.037 | 35.158 | 0.747 | 0.747 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | I | 106 | GLU | -1 | -0.701 | -0.783 | 30.748 | 35.963 | 35.963 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | I | 107 | PRO | 0 | 0.016 | 0.002 | 32.333 | 0.732 | 0.732 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | I | 108 | GLY | 0 | 0.019 | 0.015 | 30.141 | 0.857 | 0.857 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | I | 109 | PHE | 0 | -0.034 | -0.028 | 28.166 | -1.245 | -1.245 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | I | 110 | TYR | 0 | -0.104 | -0.071 | 30.067 | 0.498 | 0.498 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | I | 111 | LEU | 0 | -0.046 | -0.032 | 25.149 | 0.427 | 0.427 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | I | 112 | ASP | -1 | -0.971 | -0.981 | 29.263 | 33.980 | 33.980 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | I | 113 | ARG | 1 | 0.842 | 0.904 | 26.524 | -40.225 | -40.225 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | I | 114 | THR | 0 | 0.037 | 0.033 | 31.174 | -1.433 | -1.433 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | I | 115 | ASP | -1 | -0.931 | -0.958 | 31.528 | 36.197 | 36.197 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | I | 116 | GLY | 0 | 0.009 | -0.005 | 31.217 | -0.750 | -0.750 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | I | 117 | PRO | 0 | 0.011 | -0.002 | 30.760 | -0.765 | -0.765 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | I | 118 | GLY | 0 | 0.024 | 0.016 | 30.512 | 1.165 | 1.165 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | I | 119 | ARG | 1 | 0.887 | 0.924 | 27.071 | -38.352 | -38.352 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | I | 120 | GLN | 0 | 0.003 | 0.022 | 26.354 | 0.715 | 0.715 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | I | 121 | ILE | 0 | -0.002 | 0.015 | 26.469 | -1.486 | -1.486 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | I | 122 | VAL | 0 | -0.003 | -0.009 | 27.163 | 1.303 | 1.303 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | I | 123 | TYR | 0 | -0.001 | -0.061 | 24.196 | -0.533 | -0.533 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | I | 124 | SER | 0 | -0.006 | 0.011 | 28.224 | -0.619 | -0.619 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | I | 125 | ILE | 0 | 0.027 | 0.017 | 24.951 | -0.265 | -0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | I | 126 | LYS | 1 | 0.914 | 0.957 | 29.588 | -35.464 | -35.464 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | I | 127 | SER | 0 | 0.085 | 0.054 | 32.532 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | I | 128 | TYR | 0 | 0.004 | -0.025 | 32.500 | -1.427 | -1.427 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | I | 129 | SER | 0 | -0.013 | -0.005 | 35.932 | -0.975 | -0.975 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | I | 130 | VAL | 0 | 0.031 | 0.002 | 36.011 | -0.956 | -0.956 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | I | 131 | GLN | 0 | -0.022 | 0.037 | 38.051 | -0.457 | -0.457 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | I | 132 | ALA | 0 | -0.048 | -0.016 | 39.845 | -0.741 | -0.741 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | I | 133 | ASN | 0 | -0.024 | -0.010 | 41.918 | -1.379 | -1.379 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | I | 134 | PRO | 0 | 0.014 | 0.015 | 42.358 | 0.742 | 0.742 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | I | 135 | GLU | -1 | -0.910 | -0.952 | 41.492 | 29.727 | 29.727 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | I | 136 | GLY | 0 | -0.015 | -0.010 | 42.558 | -0.752 | -0.752 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | I | 137 | SER | 0 | -0.129 | -0.070 | 43.944 | -0.565 | -0.565 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | I | 138 | ARG | 1 | 0.880 | 0.938 | 38.904 | -31.113 | -31.113 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | I | 139 | TYR | 0 | -0.072 | -0.040 | 34.145 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | E | 3 | GLN | 0 | 0.033 | 0.005 | 27.699 | -0.390 | -0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | E | 4 | SER | 0 | 0.038 | 0.032 | 24.255 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | E | 5 | VAL | 0 | 0.028 | -0.009 | 23.449 | 0.257 | 0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | E | 6 | SER | 0 | 0.020 | 0.018 | 19.575 | -0.816 | -0.816 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | E | 7 | GLU | -1 | -0.888 | -0.936 | 20.449 | 48.337 | 48.337 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | E | 8 | ARG | 1 | 0.782 | 0.879 | 22.418 | -40.230 | -40.230 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | E | 9 | THR | 0 | -0.089 | -0.047 | 21.425 | -0.315 | -0.315 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | E | 10 | ARG | 1 | 0.931 | 0.992 | 18.429 | -53.917 | -53.917 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | E | 11 | ILE | 0 | -0.025 | -0.013 | 15.633 | -2.588 | -2.588 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | E | 12 | LYS | 1 | 0.995 | 0.985 | 18.129 | -45.086 | -45.086 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | E | 13 | SER | 0 | -0.028 | 0.003 | 18.882 | -0.286 | -0.286 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | E | 14 | ASP | -1 | -0.843 | -0.936 | 18.561 | 51.011 | 51.011 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | E | 15 | ARG | 1 | 0.833 | 0.942 | 11.870 | -74.099 | -74.099 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | E | 16 | TYR | 0 | -0.032 | -0.033 | 13.022 | 4.313 | 4.313 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | E | 17 | GLU | -1 | -0.926 | -0.933 | 14.618 | 56.155 | 56.155 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | E | 18 | SER | 0 | -0.031 | -0.035 | 12.116 | 1.408 | 1.408 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | E | 19 | GLY | 0 | 0.025 | 0.013 | 11.236 | -4.004 | -4.004 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | E | 20 | VAL | 0 | -0.010 | -0.003 | 9.255 | 2.256 | 2.256 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | E | 21 | ILE | 0 | -0.020 | -0.006 | 11.367 | -6.691 | -6.691 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | E | 22 | PRO | 0 | 0.017 | 0.005 | 12.138 | 5.015 | 5.015 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | E | 23 | TYR | 0 | 0.013 | -0.047 | 6.418 | -5.516 | -5.516 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | E | 24 | ALA | 0 | 0.032 | 0.007 | 13.166 | -2.634 | -2.634 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | E | 25 | LYS | 1 | 0.870 | 0.928 | 16.394 | -57.817 | -57.817 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | E | 26 | MET | 0 | -0.031 | 0.007 | 8.590 | -2.343 | -2.343 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | E | 27 | GLY | 0 | 0.004 | -0.003 | 14.564 | 0.595 | 0.595 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | E | 28 | TYR | 0 | -0.076 | -0.051 | 10.906 | 0.613 | 0.613 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | E | 29 | TRP | 0 | 0.008 | 0.000 | 16.203 | 0.426 | 0.426 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | E | 30 | ASP | -1 | -0.914 | -0.969 | 19.543 | 47.372 | 47.372 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | E | 31 | ALA | 0 | -0.016 | -0.007 | 23.019 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | E | 32 | SER | 0 | -0.038 | -0.005 | 26.184 | -1.635 | -1.635 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | E | 33 | TYR | 0 | -0.043 | -0.043 | 24.088 | -0.622 | -0.622 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | E | 34 | THR | 0 | -0.058 | -0.031 | 26.285 | -1.372 | -1.372 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | E | 35 | VAL | 0 | -0.007 | -0.003 | 25.163 | 0.789 | 0.789 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | E | 36 | LYS | 1 | 0.933 | 0.975 | 24.543 | -49.544 | -49.544 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | E | 37 | ASP | -1 | -0.866 | -0.941 | 27.421 | 39.561 | 39.561 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | E | 38 | THR | 0 | -0.049 | -0.044 | 25.172 | -0.341 | -0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | E | 39 | ASP | -1 | -0.804 | -0.865 | 22.958 | 51.647 | 51.647 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | E | 40 | VAL | 0 | 0.024 | 0.015 | 18.174 | -1.908 | -1.908 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | E | 41 | LEU | 0 | -0.054 | -0.006 | 20.543 | 1.703 | 1.703 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | E | 42 | ALA | 0 | 0.009 | 0.000 | 17.431 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | E | 43 | LEU | 0 | -0.007 | 0.011 | 19.354 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | E | 44 | PHE | 0 | 0.004 | -0.013 | 13.572 | 0.847 | 0.847 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | E | 45 | ARG | 1 | 0.782 | 0.882 | 18.545 | -52.784 | -52.784 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | E | 46 | ILE | 0 | 0.017 | -0.004 | 15.624 | 2.981 | 2.981 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | E | 47 | THR | 0 | 0.028 | 0.020 | 17.480 | -3.495 | -3.495 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | E | 48 | PRO | 0 | -0.008 | -0.006 | 16.968 | 4.384 | 4.384 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | E | 49 | GLN | 0 | -0.005 | 0.000 | 13.632 | -6.898 | -6.898 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | E | 50 | PRO | 0 | 0.004 | -0.012 | 17.762 | -1.599 | -1.599 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | E | 51 | GLY | 0 | -0.018 | 0.002 | 20.408 | 1.510 | 1.510 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | E | 52 | VAL | 0 | -0.047 | -0.008 | 16.271 | 0.572 | 0.572 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | E | 53 | ASP | -1 | -0.870 | -0.945 | 19.052 | 52.549 | 52.549 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | E | 54 | PRO | 0 | 0.022 | 0.003 | 19.208 | 3.200 | 3.200 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | E | 55 | VAL | 0 | -0.007 | 0.006 | 19.682 | 1.834 | 1.834 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | E | 56 | GLU | -1 | -0.836 | -0.923 | 13.985 | 79.079 | 79.079 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | E | 57 | ALA | 0 | 0.025 | 0.011 | 14.800 | 4.733 | 4.733 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | E | 58 | ALA | 0 | 0.020 | 0.008 | 14.502 | 3.766 | 3.766 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | E | 59 | ALA | 0 | -0.010 | -0.013 | 15.527 | 1.819 | 1.819 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | E | 60 | ALA | 0 | -0.007 | -0.013 | 11.266 | 3.528 | 3.528 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | E | 61 | VAL | 0 | -0.027 | -0.006 | 10.730 | 8.103 | 8.103 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | E | 62 | ALA | 0 | 0.028 | 0.015 | 11.439 | 2.565 | 2.565 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | E | 63 | GLY | 0 | 0.032 | -0.006 | 11.291 | 1.192 | 1.192 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | E | 65 | SER | 0 | 0.037 | 0.049 | 7.325 | 5.767 | 5.767 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | E | 66 | SER | 0 | -0.050 | -0.037 | 9.896 | -6.768 | -6.768 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | E | 67 | THR | 0 | -0.010 | 0.005 | 9.795 | 1.869 | 1.869 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | E | 68 | ALA | 0 | -0.002 | 0.015 | 8.007 | 3.858 | 3.858 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | E | 71 | THR | 0 | 0.002 | 0.004 | 5.316 | -20.411 | -20.411 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | E | 72 | VAL | 0 | -0.046 | 0.013 | 6.641 | 8.215 | 8.215 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | E | 73 | VAL | 0 | 0.034 | 0.007 | 6.035 | 1.299 | 1.299 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | E | 74 | TRP | 0 | 0.043 | 0.005 | 9.113 | -5.844 | -5.844 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | E | 75 | THR | 0 | -0.021 | -0.036 | 9.253 | -4.784 | -4.784 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | E | 76 | ASP | -1 | -0.766 | -0.891 | 10.326 | 87.270 | 87.270 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | E | 77 | LEU | 0 | -0.042 | -0.014 | 12.554 | -3.692 | -3.692 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | E | 78 | LEU | 0 | -0.092 | -0.032 | 14.250 | -3.800 | -3.800 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | E | 79 | THR | 0 | -0.086 | -0.045 | 14.028 | -1.144 | -1.144 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | E | 80 | ALA | 0 | 0.031 | 0.015 | 16.876 | -1.400 | -1.400 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | E | 81 | CYS | 0 | 0.000 | -0.008 | 14.632 | -0.676 | -0.676 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | E | 82 | GLU | -1 | -0.951 | -0.984 | 16.226 | 56.283 | 56.283 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | E | 83 | ARG | 1 | 0.811 | 0.905 | 18.904 | -50.760 | -50.760 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | E | 84 | TYR | 0 | 0.017 | 0.012 | 14.976 | -0.714 | -0.714 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | E | 85 | ARG | 1 | 0.866 | 0.939 | 13.287 | -68.503 | -68.503 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | E | 86 | ALA | 0 | 0.034 | 0.027 | 14.894 | -4.035 | -4.035 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | E | 87 | LYS | 1 | 0.894 | 0.951 | 16.697 | -59.049 | -59.049 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | E | 88 | ALA | 0 | 0.022 | 0.021 | 17.712 | -1.165 | -1.165 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | E | 89 | TYR | 0 | 0.001 | -0.028 | 19.396 | -0.671 | -0.671 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | E | 90 | ARG | 1 | 0.853 | 0.925 | 22.773 | -45.115 | -45.115 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | E | 91 | VAL | 0 | -0.007 | -0.003 | 21.501 | 2.178 | 2.178 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | E | 92 | ASP | -1 | -0.832 | -0.887 | 24.199 | 41.986 | 41.986 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | E | 93 | PRO | 0 | -0.016 | -0.008 | 25.445 | 1.892 | 1.892 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | E | 94 | VAL | 0 | -0.014 | -0.019 | 24.506 | -0.962 | -0.962 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | E | 95 | PRO | 0 | -0.012 | -0.008 | 27.356 | -0.740 | -0.740 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | E | 96 | ASN | 0 | -0.077 | -0.032 | 30.267 | -0.239 | -0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | E | 97 | SER | 0 | 0.051 | 0.012 | 26.665 | 0.809 | 0.809 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | E | 98 | ALA | 0 | -0.043 | -0.014 | 28.346 | -0.185 | -0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | E | 99 | ASP | -1 | -0.890 | -0.950 | 23.508 | 46.963 | 46.963 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | E | 100 | VAL | 0 | -0.031 | -0.007 | 21.469 | 2.878 | 2.878 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | E | 101 | PHE | 0 | 0.009 | 0.005 | 21.350 | -2.420 | -2.420 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | E | 102 | PHE | 0 | -0.012 | 0.005 | 21.588 | 1.936 | 1.936 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | E | 103 | ALA | 0 | 0.020 | -0.003 | 18.736 | -0.937 | -0.937 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | E | 104 | PHE | 0 | -0.003 | 0.005 | 19.999 | 1.352 | 1.352 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | E | 105 | ILE | 0 | 0.014 | 0.002 | 15.190 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | E | 106 | ALA | 0 | -0.024 | -0.008 | 19.182 | -1.244 | -1.244 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | E | 107 | TYR | 0 | -0.055 | -0.059 | 13.359 | 1.119 | 1.119 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | E | 108 | GLU | -1 | -0.855 | -0.933 | 18.493 | 49.126 | 49.126 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | E | 109 | CYS | 0 | 0.036 | 0.007 | 18.809 | 1.948 | 1.948 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | E | 110 | ASP | -1 | -0.889 | -0.945 | 19.771 | 52.703 | 52.703 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | E | 111 | LEU | 0 | -0.084 | -0.043 | 14.173 | 2.096 | 2.096 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | E | 112 | PHE | 0 | -0.031 | -0.011 | 14.658 | 4.460 | 4.460 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | E | 113 | GLU | -1 | -0.826 | -0.908 | 16.225 | 57.684 | 57.684 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | E | 114 | GLU | -1 | -0.790 | -0.895 | 17.991 | 51.824 | 51.824 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | E | 115 | ALA | 0 | 0.007 | 0.012 | 21.207 | 0.513 | 0.513 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | E | 116 | SER | 0 | 0.004 | 0.003 | 16.419 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | E | 117 | LEU | 0 | 0.057 | 0.030 | 17.211 | 2.199 | 2.199 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | E | 118 | ALA | 0 | 0.015 | 0.015 | 14.349 | 3.286 | 3.286 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | E | 119 | ASN | 0 | -0.010 | -0.010 | 12.423 | 2.529 | 2.529 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | E | 120 | LEU | 0 | -0.014 | 0.007 | 12.909 | 3.812 | 3.812 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | E | 121 | THR | 0 | -0.031 | -0.048 | 12.633 | 4.518 | 4.518 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | E | 122 | ALA | 0 | 0.018 | 0.018 | 8.977 | 5.104 | 5.104 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | E | 123 | SER | 0 | 0.001 | -0.008 | 8.235 | 11.493 | 11.493 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | E | 124 | ILE | 0 | -0.051 | -0.011 | 9.820 | 4.565 | 4.565 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | E | 125 | ILE | 0 | -0.015 | -0.024 | 10.097 | -0.776 | -0.776 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | E | 126 | GLY | 0 | -0.013 | 0.018 | 6.447 | 4.055 | 4.055 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | E | 129 | PHE | 0 | 0.000 | 0.015 | 8.082 | -3.808 | -3.808 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | E | 130 | GLY | 0 | 0.002 | -0.008 | 5.816 | -7.417 | -7.417 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | E | 131 | PHE | 0 | -0.008 | 0.004 | 5.303 | 6.995 | 6.995 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | E | 132 | LYS | 1 | 0.861 | 0.931 | 8.078 | -120.340 | -120.340 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | E | 133 | ALA | 0 | -0.029 | -0.012 | 10.049 | -7.102 | -7.102 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | E | 134 | VAL | 0 | 0.001 | 0.007 | 12.206 | -6.403 | -6.403 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | E | 135 | SER | 0 | -0.018 | -0.006 | 12.450 | 4.100 | 4.100 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | E | 136 | ALA | 0 | 0.015 | 0.006 | 14.386 | 0.506 | 0.506 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | E | 137 | LEU | 0 | 0.019 | 0.009 | 11.929 | -0.353 | -0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | E | 138 | ARG | 1 | 0.827 | 0.947 | 15.061 | -51.837 | -51.837 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | E | 139 | LEU | 0 | -0.015 | 0.012 | 15.237 | -1.077 | -1.077 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | E | 140 | GLU | -1 | -0.748 | -0.876 | 17.302 | 49.458 | 49.458 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | E | 141 | ASP | -1 | -0.741 | -0.879 | 20.862 | 44.329 | 44.329 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | E | 142 | MET | 0 | -0.018 | -0.003 | 17.466 | 3.165 | 3.165 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | E | 143 | ARG | 1 | 0.867 | 0.954 | 21.658 | -47.219 | -47.219 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | E | 144 | ILE | 0 | 0.017 | -0.023 | 20.821 | 1.553 | 1.553 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | E | 145 | PRO | 0 | 0.009 | 0.029 | 23.306 | -2.025 | -2.025 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | E | 146 | HIS | 0 | 0.070 | 0.015 | 26.320 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | E | 147 | SER | 0 | 0.002 | -0.018 | 26.898 | -0.439 | -0.439 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | E | 148 | TYR | 0 | 0.007 | 0.004 | 18.691 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | E | 149 | LEU | 0 | 0.047 | 0.037 | 24.620 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | E | 150 | LOH | 1 | 0.905 | 0.961 | 26.791 | -36.109 | -36.109 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | E | 151 | THR | 0 | -0.094 | -0.057 | 24.254 | -0.194 | -0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | E | 152 | PHE | 0 | -0.006 | -0.006 | 20.544 | 0.550 | 0.550 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | E | 153 | GLN | 0 | -0.018 | -0.011 | 26.564 | -1.706 | -1.706 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | E | 154 | GLY | 0 | 0.017 | 0.014 | 28.037 | -1.381 | -1.381 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | E | 155 | HYP | 0 | -0.083 | -0.033 | 29.497 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | E | 156 | ALA | 0 | 0.050 | 0.037 | 31.462 | -0.757 | -0.757 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | E | 157 | THR | 0 | -0.073 | -0.046 | 33.142 | -1.197 | -1.197 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | E | 158 | GLY | 0 | -0.001 | -0.015 | 35.065 | -0.402 | -0.402 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | E | 159 | ILE | 0 | -0.034 | -0.019 | 35.958 | -0.835 | -0.835 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | E | 160 | ILE | 0 | -0.011 | 0.004 | 38.231 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | E | 161 | VAL | 0 | 0.044 | 0.017 | 39.695 | -0.540 | -0.540 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | E | 162 | GLU | -1 | -0.869 | -0.904 | 37.894 | 30.984 | 30.984 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | E | 163 | ARG | 1 | 0.845 | 0.893 | 40.764 | -28.351 | -28.351 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | E | 164 | GLU | -1 | -0.861 | -0.920 | 43.769 | 26.291 | 26.291 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | E | 165 | ARG | 1 | 0.872 | 0.942 | 38.445 | -30.695 | -30.695 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | E | 166 | LEU | 0 | -0.044 | -0.030 | 41.905 | -0.394 | -0.394 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | E | 167 | ASN | 0 | -0.039 | -0.006 | 45.776 | -0.418 | -0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | E | 168 | LYS | 1 | 0.831 | 0.942 | 46.027 | -26.202 | -26.202 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | E | 169 | TYR | 0 | 0.089 | 0.031 | 46.323 | 0.771 | 0.771 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | E | 170 | GLY | 0 | 0.047 | 0.021 | 47.335 | -0.586 | -0.586 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | E | 171 | THR | 0 | -0.053 | -0.015 | 47.278 | -0.235 | -0.235 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | E | 172 | PRO | 0 | -0.012 | 0.007 | 42.255 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | E | 173 | LEU | 0 | 0.013 | 0.016 | 40.488 | -0.594 | -0.594 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | E | 174 | HLU | 0 | -0.019 | 0.003 | 42.010 | 0.485 | 0.485 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | E | 175 | GLY | 0 | 0.074 | 0.018 | 39.880 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | E | 176 | ALA | 0 | -0.006 | 0.007 | 39.746 | -0.180 | -0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | E | 177 | THR | 0 | 0.137 | -0.002 | 34.468 | -0.158 | -0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | E | 178 | VAL | 0 | -0.041 | -0.015 | 37.531 | -0.803 | -0.803 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | E | 179 | LYS | 1 | 0.859 | 0.930 | 34.734 | -32.110 | -32.110 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | E | 180 | PRO | 0 | 0.030 | 0.019 | 38.463 | -0.865 | -0.865 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | E | 181 | LYS | 1 | 0.761 | 0.896 | 30.689 | -36.166 | -36.166 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | E | 182 | LEU | 0 | 0.008 | 0.002 | 31.079 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | E | 183 | GLY | 0 | 0.018 | 0.002 | 35.526 | -0.624 | -0.624 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | E | 184 | LEU | 0 | -0.038 | -0.016 | 38.596 | -0.870 | -0.870 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | E | 185 | SER | 0 | 0.060 | 0.031 | 39.854 | 0.430 | 0.430 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | E | 186 | GLY | 0 | 0.078 | 0.013 | 41.457 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | E | 187 | LYS | 1 | 0.936 | 0.967 | 42.257 | -23.983 | -23.983 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | E | 188 | ASN | 0 | -0.003 | -0.011 | 44.447 | -0.790 | -0.790 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | E | 189 | TYR | 0 | 0.106 | 0.049 | 36.683 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | E | 190 | GLY | 0 | 0.040 | 0.020 | 42.737 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | E | 191 | ARG | 1 | 0.816 | 0.919 | 45.187 | -23.654 | -23.654 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | E | 192 | VAL | 0 | 0.028 | 0.005 | 42.945 | -0.425 | -0.425 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | E | 193 | VAL | 0 | 0.050 | 0.017 | 41.866 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | E | 194 | TYR | 0 | -0.011 | 0.009 | 44.652 | -0.551 | -0.551 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | E | 195 | GLU | -1 | -0.864 | -0.937 | 48.349 | 22.671 | 22.671 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | E | 196 | GLY | 0 | 0.039 | 0.010 | 46.038 | -0.322 | -0.322 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | E | 197 | LEU | 0 | -0.001 | 0.011 | 44.016 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | E | 198 | LYO | 1 | 0.868 | 0.928 | 47.519 | -22.191 | -22.191 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | E | 199 | GLY | 0 | -0.013 | 0.002 | 50.278 | -0.434 | -0.434 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | E | 200 | GLY | 0 | 0.024 | 0.019 | 49.983 | -0.234 | -0.234 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | E | 201 | LEU | 0 | -0.011 | 0.013 | 43.391 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | E | 202 | ASP | -1 | -0.865 | -0.936 | 43.458 | 25.927 | 25.927 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | E | 203 | PHE | 0 | -0.010 | -0.016 | 39.700 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | E | 204 | LEU | 0 | -0.050 | -0.024 | 40.256 | -0.414 | -0.414 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | E | 205 | KCX | -1 | -0.517 | -0.797 | 32.367 | 36.227 | 36.227 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | E | 206 | ASP | -1 | -0.760 | -0.871 | 33.870 | 31.742 | 31.742 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | E | 207 | ASP | 0 | 0.233 | 0.065 | 33.027 | 0.412 | 0.412 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | E | 208 | GLU | 0 | 0.157 | -0.030 | 27.305 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | E | 501 | merge:E:AS | -1 | -2.203 | -1.545 | 27.290 | 35.415 | 35.415 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | E | 209 | ASN | 0 | -0.009 | -0.002 | 27.937 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | E | 210 | ILE | 0 | -0.030 | 0.008 | 29.067 | -0.459 | -0.459 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | E | 211 | ASN | 0 | -0.032 | -0.011 | 27.381 | 1.634 | 1.634 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | E | 212 | SER | 0 | 0.032 | -0.007 | 31.137 | -1.738 | -1.738 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | E | 213 | GLN | 0 | 0.025 | 0.017 | 30.768 | 0.282 | 0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | E | 214 | PRO | 0 | -0.009 | -0.003 | 33.618 | -0.981 | -0.981 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | E | 215 | PHE | 0 | -0.027 | -0.003 | 34.073 | -0.893 | -0.893 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | E | 216 | MET | 0 | -0.053 | -0.005 | 36.604 | -1.201 | -1.201 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | E | 217 | ARG | 1 | 0.835 | 0.925 | 33.275 | -32.109 | -32.109 | 0.000 | 0.000 | 0.000 | 0.000 |
840 | E | 218 | TRP | 0 | 0.030 | 0.002 | 34.063 | -1.069 | -1.069 | 0.000 | 0.000 | 0.000 | 0.000 |
841 | E | 219 | ARG | 1 | 0.945 | 0.980 | 36.433 | -31.660 | -31.660 | 0.000 | 0.000 | 0.000 | 0.000 |
842 | E | 220 | GLU | -1 | -0.910 | -0.949 | 39.547 | 28.005 | 28.005 | 0.000 | 0.000 | 0.000 | 0.000 |
843 | E | 221 | ARG | 1 | 0.818 | 0.882 | 33.868 | -33.550 | -33.550 | 0.000 | 0.000 | 0.000 | 0.000 |
844 | E | 222 | PHE | 0 | -0.005 | 0.000 | 34.425 | -0.701 | -0.701 | 0.000 | 0.000 | 0.000 | 0.000 |
845 | E | 223 | LEU | 0 | -0.008 | -0.002 | 40.435 | -0.464 | -0.464 | 0.000 | 0.000 | 0.000 | 0.000 |
846 | E | 224 | ASN | 0 | -0.067 | -0.042 | 43.777 | -1.140 | -1.140 | 0.000 | 0.000 | 0.000 | 0.000 |
847 | E | 225 | CYS | 0 | -0.002 | -0.003 | 40.283 | -0.565 | -0.565 | 0.000 | 0.000 | 0.000 | 0.000 |
848 | E | 226 | MET | 0 | -0.007 | 0.026 | 43.110 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
849 | E | 227 | GLU | -1 | -0.768 | -0.850 | 45.229 | 22.683 | 22.683 | 0.000 | 0.000 | 0.000 | 0.000 |
850 | E | 228 | GLY | 0 | -0.026 | -0.024 | 47.258 | -0.479 | -0.479 | 0.000 | 0.000 | 0.000 | 0.000 |
851 | E | 229 | ILE | 0 | 0.051 | 0.013 | 42.378 | -0.342 | -0.342 | 0.000 | 0.000 | 0.000 | 0.000 |
852 | E | 230 | ASN | 0 | 0.013 | 0.007 | 46.950 | -0.387 | -0.387 | 0.000 | 0.000 | 0.000 | 0.000 |
853 | E | 231 | ARG | 1 | 0.878 | 0.951 | 49.879 | -22.798 | -22.798 | 0.000 | 0.000 | 0.000 | 0.000 |
854 | E | 232 | ALA | 0 | 0.004 | 0.011 | 48.990 | -0.458 | -0.458 | 0.000 | 0.000 | 0.000 | 0.000 |
855 | E | 233 | SER | 0 | 0.042 | 0.023 | 49.739 | -0.421 | -0.421 | 0.000 | 0.000 | 0.000 | 0.000 |
856 | E | 234 | ALA | 0 | -0.030 | -0.016 | 51.550 | -0.378 | -0.378 | 0.000 | 0.000 | 0.000 | 0.000 |
857 | E | 235 | ALA | 0 | -0.053 | -0.031 | 54.392 | -0.442 | -0.442 | 0.000 | 0.000 | 0.000 | 0.000 |
858 | E | 236 | THR | 0 | -0.005 | -0.016 | 52.432 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
859 | E | 237 | GLY | 0 | 0.044 | 0.017 | 54.689 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
860 | E | 238 | GLU | -1 | -0.787 | -0.875 | 49.730 | 24.184 | 24.184 | 0.000 | 0.000 | 0.000 | 0.000 |
861 | E | 239 | VAL | 0 | 0.045 | 0.022 | 45.636 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
862 | E | 240 | LYS | 1 | 0.779 | 0.891 | 45.875 | -24.676 | -24.676 | 0.000 | 0.000 | 0.000 | 0.000 |
863 | E | 241 | GLY | 0 | 0.018 | 0.001 | 42.147 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
864 | E | 242 | SER | 0 | 0.011 | -0.011 | 39.328 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
865 | E | 243 | TYR | 0 | -0.008 | -0.018 | 34.254 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
866 | E | 244 | LEU | 0 | -0.007 | 0.003 | 35.426 | 0.272 | 0.272 | 0.000 | 0.000 | 0.000 | 0.000 |
867 | E | 245 | ASN | 0 | 0.015 | 0.013 | 29.163 | 1.325 | 1.325 | 0.000 | 0.000 | 0.000 | 0.000 |
868 | E | 246 | ILE | 0 | -0.041 | -0.022 | 29.339 | -0.590 | -0.590 | 0.000 | 0.000 | 0.000 | 0.000 |
869 | E | 247 | THR | 0 | -0.003 | -0.029 | 24.834 | 1.328 | 1.328 | 0.000 | 0.000 | 0.000 | 0.000 |
870 | E | 248 | ALA | 0 | -0.042 | -0.028 | 25.687 | -1.210 | -1.210 | 0.000 | 0.000 | 0.000 | 0.000 |
871 | E | 249 | ALA | 0 | 0.019 | 0.024 | 23.222 | 1.461 | 1.461 | 0.000 | 0.000 | 0.000 | 0.000 |
872 | E | 250 | THR | 0 | 0.032 | 0.028 | 22.289 | 1.515 | 1.515 | 0.000 | 0.000 | 0.000 | 0.000 |
873 | E | 251 | MET | 0 | 0.061 | 0.011 | 23.501 | -0.377 | -0.377 | 0.000 | 0.000 | 0.000 | 0.000 |
874 | E | 252 | GLU | -1 | -0.808 | -0.875 | 25.224 | 43.524 | 43.524 | 0.000 | 0.000 | 0.000 | 0.000 |
875 | E | 253 | GLU | -1 | -0.871 | -0.949 | 27.921 | 34.438 | 34.438 | 0.000 | 0.000 | 0.000 | 0.000 |
876 | E | 254 | VAL | 0 | 0.042 | 0.021 | 25.458 | -1.192 | -1.192 | 0.000 | 0.000 | 0.000 | 0.000 |
877 | E | 255 | TYR | 0 | -0.012 | -0.038 | 27.102 | -1.487 | -1.487 | 0.000 | 0.000 | 0.000 | 0.000 |
878 | E | 256 | LYS | 1 | 0.861 | 0.947 | 31.051 | -36.520 | -36.520 | 0.000 | 0.000 | 0.000 | 0.000 |
879 | E | 257 | ARG | 1 | 0.759 | 0.858 | 30.333 | -38.481 | -38.481 | 0.000 | 0.000 | 0.000 | 0.000 |
880 | E | 258 | ALA | 0 | 0.045 | 0.025 | 31.909 | -0.970 | -0.970 | 0.000 | 0.000 | 0.000 | 0.000 |
881 | E | 259 | GLU | -1 | -0.856 | -0.930 | 33.906 | 31.924 | 31.924 | 0.000 | 0.000 | 0.000 | 0.000 |
882 | E | 260 | TYR | 0 | -0.080 | -0.035 | 36.527 | -1.215 | -1.215 | 0.000 | 0.000 | 0.000 | 0.000 |
883 | E | 261 | ALA | 0 | 0.000 | -0.016 | 36.579 | -0.909 | -0.909 | 0.000 | 0.000 | 0.000 | 0.000 |
884 | E | 262 | LYS | 1 | 0.934 | 0.968 | 37.995 | -30.955 | -30.955 | 0.000 | 0.000 | 0.000 | 0.000 |
885 | E | 263 | ALA | 0 | -0.053 | -0.011 | 39.737 | -0.815 | -0.815 | 0.000 | 0.000 | 0.000 | 0.000 |
886 | E | 264 | VAL | 0 | -0.090 | -0.058 | 41.516 | -0.866 | -0.866 | 0.000 | 0.000 | 0.000 | 0.000 |
887 | E | 265 | GLY | 0 | 0.007 | -0.001 | 42.942 | -0.548 | -0.548 | 0.000 | 0.000 | 0.000 | 0.000 |
888 | E | 266 | SER | 0 | -0.052 | -0.025 | 38.453 | -0.429 | -0.429 | 0.000 | 0.000 | 0.000 | 0.000 |
889 | E | 267 | ILE | 0 | 0.043 | 0.030 | 40.682 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
890 | E | 268 | VAL | 0 | 0.001 | -0.028 | 35.826 | 0.475 | 0.475 | 0.000 | 0.000 | 0.000 | 0.000 |
891 | E | 269 | VAL | 0 | -0.002 | 0.006 | 32.309 | -0.420 | -0.420 | 0.000 | 0.000 | 0.000 | 0.000 |
892 | E | 270 | MET | 0 | -0.062 | -0.015 | 30.026 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
893 | E | 271 | ILE | 0 | -0.002 | 0.000 | 25.416 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
894 | E | 272 | ASP | -1 | -0.754 | -0.889 | 24.076 | 41.721 | 41.721 | 0.000 | 0.000 | 0.000 | 0.000 |
895 | E | 273 | LEU | 0 | -0.035 | -0.030 | 19.580 | 0.794 | 0.794 | 0.000 | 0.000 | 0.000 | 0.000 |
896 | E | 274 | VAL | 0 | -0.033 | -0.009 | 18.869 | 2.425 | 2.425 | 0.000 | 0.000 | 0.000 | 0.000 |
897 | E | 275 | MET | 0 | 0.003 | 0.016 | 18.941 | 0.801 | 0.801 | 0.000 | 0.000 | 0.000 | 0.000 |
898 | E | 276 | GLY | 0 | -0.023 | 0.002 | 17.620 | 2.102 | 2.102 | 0.000 | 0.000 | 0.000 | 0.000 |
899 | E | 277 | TYR | 0 | 0.038 | -0.008 | 14.689 | -2.152 | -2.152 | 0.000 | 0.000 | 0.000 | 0.000 |
900 | E | 278 | THR | 0 | 0.006 | 0.007 | 17.414 | -1.074 | -1.074 | 0.000 | 0.000 | 0.000 | 0.000 |
901 | E | 279 | ALA | 0 | 0.036 | 0.005 | 19.471 | -2.344 | -2.344 | 0.000 | 0.000 | 0.000 | 0.000 |
902 | E | 280 | ILE | 0 | -0.045 | -0.008 | 20.783 | -2.400 | -2.400 | 0.000 | 0.000 | 0.000 | 0.000 |
903 | E | 281 | GLN | 0 | 0.051 | 0.005 | 20.423 | 0.261 | 0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
904 | E | 282 | SER | 0 | -0.029 | -0.006 | 23.715 | -0.700 | -0.700 | 0.000 | 0.000 | 0.000 | 0.000 |
905 | E | 283 | ILE | 0 | -0.017 | -0.014 | 25.500 | -1.816 | -1.816 | 0.000 | 0.000 | 0.000 | 0.000 |
906 | E | 284 | ALA | 0 | 0.027 | 0.012 | 26.839 | -1.670 | -1.670 | 0.000 | 0.000 | 0.000 | 0.000 |
907 | E | 285 | TYR | 0 | -0.001 | 0.003 | 24.701 | -1.379 | -1.379 | 0.000 | 0.000 | 0.000 | 0.000 |
908 | E | 286 | TRP | 0 | -0.023 | -0.025 | 29.706 | -1.187 | -1.187 | 0.000 | 0.000 | 0.000 | 0.000 |
909 | E | 287 | ALA | 0 | -0.001 | -0.002 | 31.415 | -1.272 | -1.272 | 0.000 | 0.000 | 0.000 | 0.000 |
910 | E | 288 | ARG | 1 | 0.784 | 0.876 | 32.684 | -35.950 | -35.950 | 0.000 | 0.000 | 0.000 | 0.000 |
911 | E | 289 | GLU | -1 | -0.990 | -0.992 | 33.055 | 33.626 | 33.626 | 0.000 | 0.000 | 0.000 | 0.000 |
912 | E | 290 | ASN | 0 | -0.063 | -0.020 | 34.773 | -1.815 | -1.815 | 0.000 | 0.000 | 0.000 | 0.000 |
913 | E | 291 | ASP | -1 | -0.951 | -0.965 | 37.792 | 29.004 | 29.004 | 0.000 | 0.000 | 0.000 | 0.000 |
914 | E | 292 | MET | 0 | -0.105 | -0.015 | 35.600 | -0.706 | -0.706 | 0.000 | 0.000 | 0.000 | 0.000 |
915 | E | 293 | LEU | 0 | -0.032 | -0.007 | 35.699 | 0.569 | 0.569 | 0.000 | 0.000 | 0.000 | 0.000 |
916 | E | 294 | LEU | 0 | 0.001 | -0.002 | 28.337 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
917 | E | 295 | HIS | 1 | 0.868 | 0.934 | 31.175 | -35.456 | -35.456 | 0.000 | 0.000 | 0.000 | 0.000 |
918 | E | 296 | LEU | 0 | 0.016 | 0.000 | 23.936 | 0.340 | 0.340 | 0.000 | 0.000 | 0.000 | 0.000 |
919 | E | 297 | HIS | 0 | 0.508 | 0.437 | 26.592 | 0.520 | 0.520 | 0.000 | 0.000 | 0.000 | 0.000 |
920 | E | 298 | ARG | 1 | 0.816 | 0.889 | 23.913 | -40.345 | -40.345 | 0.000 | 0.000 | 0.000 | 0.000 |
921 | E | 299 | ALA | 0 | 0.024 | 0.008 | 23.309 | 1.218 | 1.218 | 0.000 | 0.000 | 0.000 | 0.000 |
922 | E | 300 | GLY | 0 | 0.039 | 0.014 | 19.645 | 1.557 | 1.557 | 0.000 | 0.000 | 0.000 | 0.000 |
923 | E | 301 | ASN | 0 | 0.074 | 0.048 | 18.971 | 4.216 | 4.216 | 0.000 | 0.000 | 0.000 | 0.000 |
924 | E | 302 | SER | 0 | 0.004 | -0.010 | 19.453 | 1.824 | 1.824 | 0.000 | 0.000 | 0.000 | 0.000 |
925 | E | 303 | THR | 0 | -0.014 | 0.003 | 16.813 | 0.983 | 0.983 | 0.000 | 0.000 | 0.000 | 0.000 |
926 | E | 304 | TYR | 0 | 0.052 | 0.008 | 14.888 | 2.457 | 2.457 | 0.000 | 0.000 | 0.000 | 0.000 |
927 | E | 305 | ALA | 0 | -0.024 | -0.007 | 16.798 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
928 | E | 306 | ARG | 1 | 0.779 | 0.894 | 20.193 | -44.137 | -44.137 | 0.000 | 0.000 | 0.000 | 0.000 |
929 | E | 307 | GLN | 0 | -0.049 | -0.040 | 19.694 | -2.479 | -2.479 | 0.000 | 0.000 | 0.000 | 0.000 |
930 | E | 308 | LYS | 1 | 0.932 | 0.977 | 20.863 | -41.098 | -41.098 | 0.000 | 0.000 | 0.000 | 0.000 |
931 | E | 309 | ASN | 0 | -0.009 | -0.022 | 18.181 | 0.383 | 0.383 | 0.000 | 0.000 | 0.000 | 0.000 |
932 | E | 310 | HIS | 0 | -0.038 | -0.040 | 11.679 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
933 | E | 311 | GLY | 0 | 0.037 | 0.036 | 14.928 | -1.896 | -1.896 | 0.000 | 0.000 | 0.000 | 0.000 |
934 | E | 312 | ILE | 0 | -0.036 | -0.022 | 14.184 | 2.108 | 2.108 | 0.000 | 0.000 | 0.000 | 0.000 |
935 | E | 313 | ASN | 0 | 0.024 | 0.017 | 17.556 | -2.733 | -2.733 | 0.000 | 0.000 | 0.000 | 0.000 |
936 | E | 314 | PHE | 0 | 0.044 | 0.005 | 21.251 | 0.792 | 0.792 | 0.000 | 0.000 | 0.000 | 0.000 |
937 | E | 315 | ARG | 1 | 0.904 | 0.940 | 23.005 | -46.593 | -46.593 | 0.000 | 0.000 | 0.000 | 0.000 |
938 | E | 316 | VAL | 0 | -0.005 | 0.013 | 18.418 | -0.866 | -0.866 | 0.000 | 0.000 | 0.000 | 0.000 |
939 | E | 317 | ILE | 0 | -0.025 | -0.001 | 17.994 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
940 | E | 318 | CYS | 0 | -0.046 | -0.012 | 21.485 | -1.450 | -1.450 | 0.000 | 0.000 | 0.000 | 0.000 |
941 | E | 319 | LYS | 1 | 0.863 | 0.928 | 22.882 | -46.827 | -46.827 | 0.000 | 0.000 | 0.000 | 0.000 |
942 | E | 320 | TRP | 0 | 0.055 | 0.001 | 15.070 | -0.348 | -0.348 | 0.000 | 0.000 | 0.000 | 0.000 |
943 | E | 321 | MET | 0 | -0.005 | 0.007 | 20.521 | -0.369 | -0.369 | 0.000 | 0.000 | 0.000 | 0.000 |
944 | E | 322 | ARG | 1 | 0.801 | 0.909 | 24.103 | -38.798 | -38.798 | 0.000 | 0.000 | 0.000 | 0.000 |
945 | E | 323 | MET | 0 | -0.038 | -0.020 | 21.252 | -0.718 | -0.718 | 0.000 | 0.000 | 0.000 | 0.000 |
946 | E | 324 | SER | 0 | -0.058 | -0.036 | 22.360 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
947 | E | 325 | GLY | 0 | 0.015 | 0.009 | 24.576 | -0.634 | -0.634 | 0.000 | 0.000 | 0.000 | 0.000 |
948 | E | 326 | VAL | 0 | -0.006 | 0.009 | 26.302 | -1.239 | -1.239 | 0.000 | 0.000 | 0.000 | 0.000 |
949 | E | 327 | ASP | -1 | -0.710 | -0.834 | 29.003 | 34.709 | 34.709 | 0.000 | 0.000 | 0.000 | 0.000 |
950 | E | 328 | HIS | 0 | -0.053 | -0.042 | 31.764 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
951 | E | 329 | ILE | 0 | 0.021 | 0.003 | 25.029 | 1.311 | 1.311 | 0.000 | 0.000 | 0.000 | 0.000 |
952 | E | 330 | HIS | 0 | -0.002 | 0.005 | 28.399 | -1.301 | -1.301 | 0.000 | 0.000 | 0.000 | 0.000 |
953 | E | 331 | ALA | 0 | 0.009 | -0.014 | 28.196 | 1.492 | 1.492 | 0.000 | 0.000 | 0.000 | 0.000 |
954 | E | 332 | GLY | 0 | 0.056 | 0.031 | 29.937 | 0.196 | 0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
955 | E | 333 | THR | 0 | 0.025 | 0.011 | 31.669 | -0.821 | -0.821 | 0.000 | 0.000 | 0.000 | 0.000 |
956 | E | 334 | VAL | 0 | 0.015 | 0.024 | 34.210 | -0.940 | -0.940 | 0.000 | 0.000 | 0.000 | 0.000 |
957 | E | 335 | VAL | 0 | -0.021 | 0.000 | 35.795 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
958 | E | 336 | GLY | 0 | 0.027 | 0.020 | 36.511 | -0.617 | -0.617 | 0.000 | 0.000 | 0.000 | 0.000 |
959 | E | 337 | LYS | 1 | 0.749 | 0.872 | 32.922 | -33.468 | -33.468 | 0.000 | 0.000 | 0.000 | 0.000 |
960 | E | 338 | LEU | 0 | -0.009 | -0.001 | 28.664 | 0.448 | 0.448 | 0.000 | 0.000 | 0.000 | 0.000 |
961 | E | 339 | GLU | -1 | -0.840 | -0.938 | 26.988 | 39.113 | 39.113 | 0.000 | 0.000 | 0.000 | 0.000 |
962 | E | 340 | GLY | 0 | 0.018 | -0.019 | 29.527 | 0.661 | 0.661 | 0.000 | 0.000 | 0.000 | 0.000 |
963 | E | 341 | ASP | -1 | -0.831 | -0.907 | 31.096 | 34.844 | 34.844 | 0.000 | 0.000 | 0.000 | 0.000 |
964 | E | 342 | PRO | 0 | -0.008 | -0.024 | 32.953 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
965 | E | 343 | LEU | 0 | -0.016 | 0.001 | 33.589 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
966 | E | 344 | MET | 0 | -0.001 | 0.022 | 28.846 | 0.815 | 0.815 | 0.000 | 0.000 | 0.000 | 0.000 |
967 | E | 345 | ILE | 0 | -0.020 | 0.000 | 30.347 | 0.516 | 0.516 | 0.000 | 0.000 | 0.000 | 0.000 |
968 | E | 346 | M3L | 1 | 0.900 | 0.965 | 32.100 | -30.576 | -30.576 | 0.000 | 0.000 | 0.000 | 0.000 |
969 | E | 347 | GLY | 0 | 0.073 | 0.050 | 31.142 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
970 | E | 348 | PHE | 0 | -0.037 | -0.023 | 26.686 | 0.624 | 0.624 | 0.000 | 0.000 | 0.000 | 0.000 |
971 | E | 349 | TYR | 0 | -0.017 | -0.040 | 29.902 | -0.340 | -0.340 | 0.000 | 0.000 | 0.000 | 0.000 |
972 | E | 350 | ASP | -1 | -0.901 | -0.950 | 33.105 | 33.360 | 33.360 | 0.000 | 0.000 | 0.000 | 0.000 |
973 | E | 351 | ILE | 0 | -0.040 | -0.011 | 26.789 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
974 | E | 352 | LEU | 0 | -0.041 | -0.016 | 28.170 | 0.302 | 0.302 | 0.000 | 0.000 | 0.000 | 0.000 |
975 | E | 353 | ARG | 1 | 0.826 | 0.903 | 31.237 | -32.703 | -32.703 | 0.000 | 0.000 | 0.000 | 0.000 |
976 | E | 354 | LEU | 0 | 0.039 | 0.047 | 34.244 | -0.931 | -0.931 | 0.000 | 0.000 | 0.000 | 0.000 |
977 | E | 355 | THR | 0 | -0.043 | -0.037 | 34.055 | 0.961 | 0.961 | 0.000 | 0.000 | 0.000 | 0.000 |
978 | E | 356 | GLU | -1 | -0.884 | -0.929 | 33.319 | 32.957 | 32.957 | 0.000 | 0.000 | 0.000 | 0.000 |
979 | E | 357 | LEU | 0 | -0.074 | -0.035 | 29.013 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
980 | E | 358 | GLU | -1 | -0.851 | -0.924 | 33.099 | 32.127 | 32.127 | 0.000 | 0.000 | 0.000 | 0.000 |
981 | E | 359 | VAL | 0 | -0.040 | -0.027 | 31.022 | 0.355 | 0.355 | 0.000 | 0.000 | 0.000 | 0.000 |
982 | E | 360 | ASN | 0 | 0.019 | 0.001 | 32.417 | -1.218 | -1.218 | 0.000 | 0.000 | 0.000 | 0.000 |
983 | E | 361 | LEU | 0 | 0.000 | -0.005 | 30.084 | 0.596 | 0.596 | 0.000 | 0.000 | 0.000 | 0.000 |
984 | E | 362 | PRO | 0 | 0.019 | 0.022 | 31.628 | 1.115 | 1.115 | 0.000 | 0.000 | 0.000 | 0.000 |
985 | E | 363 | PHE | 0 | -0.018 | -0.011 | 32.759 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
986 | E | 364 | GLY | 0 | -0.018 | -0.012 | 28.698 | 0.787 | 0.787 | 0.000 | 0.000 | 0.000 | 0.000 |
987 | E | 365 | ILE | 0 | -0.040 | -0.008 | 27.495 | 1.835 | 1.835 | 0.000 | 0.000 | 0.000 | 0.000 |
988 | E | 366 | PHE | 0 | 0.019 | -0.013 | 25.831 | -0.878 | -0.878 | 0.000 | 0.000 | 0.000 | 0.000 |
989 | E | 367 | PHE | 0 | -0.067 | -0.028 | 22.457 | -0.243 | -0.243 | 0.000 | 0.000 | 0.000 | 0.000 |
990 | E | 368 | GLU | -1 | -0.926 | -0.947 | 27.994 | 35.972 | 35.972 | 0.000 | 0.000 | 0.000 | 0.000 |
991 | E | 369 | MET | 0 | -0.066 | -0.046 | 25.819 | 2.269 | 2.269 | 0.000 | 0.000 | 0.000 | 0.000 |
992 | E | 370 | ASP | -1 | -0.788 | -0.878 | 30.106 | 34.584 | 34.584 | 0.000 | 0.000 | 0.000 | 0.000 |
993 | E | 371 | TRP | 0 | -0.017 | -0.019 | 26.096 | 2.075 | 2.075 | 0.000 | 0.000 | 0.000 | 0.000 |
994 | E | 372 | ALA | 0 | -0.007 | -0.015 | 30.720 | 0.341 | 0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
995 | E | 373 | SER | 0 | -0.084 | -0.069 | 32.689 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
996 | E | 374 | LEU | 0 | -0.009 | 0.020 | 27.904 | -0.462 | -0.462 | 0.000 | 0.000 | 0.000 | 0.000 |
997 | E | 375 | ARG | 1 | 0.939 | 0.971 | 32.465 | -32.480 | -32.480 | 0.000 | 0.000 | 0.000 | 0.000 |
998 | E | 376 | ARG | 1 | 0.848 | 0.918 | 32.595 | -29.950 | -29.950 | 0.000 | 0.000 | 0.000 | 0.000 |
999 | E | 377 | CYS | 0 | -0.048 | -0.021 | 30.372 | -0.334 | -0.334 | 0.000 | 0.000 | 0.000 | 0.000 |
1000 | E | 378 | MET | 0 | 0.027 | 0.011 | 32.619 | -0.392 | -0.392 | 0.000 | 0.000 | 0.000 | 0.000 |
1001 | E | 379 | PRO | 0 | -0.015 | 0.002 | 32.552 | 0.700 | 0.700 | 0.000 | 0.000 | 0.000 | 0.000 |
1002 | E | 380 | VAL | 0 | -0.020 | -0.001 | 32.508 | -0.995 | -0.995 | 0.000 | 0.000 | 0.000 | 0.000 |
1003 | E | 381 | ALA | 0 | 0.012 | 0.005 | 33.085 | 0.936 | 0.936 | 0.000 | 0.000 | 0.000 | 0.000 |
1004 | E | 382 | SER | 0 | 0.004 | -0.013 | 33.146 | -1.266 | -1.266 | 0.000 | 0.000 | 0.000 | 0.000 |
1005 | E | 383 | GLY | 0 | 0.078 | 0.028 | 33.479 | 0.862 | 0.862 | 0.000 | 0.000 | 0.000 | 0.000 |
1006 | E | 384 | GLY | 0 | -0.026 | -0.038 | 34.825 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
1007 | E | 385 | ILE | 0 | -0.040 | 0.007 | 37.730 | -0.265 | -0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
1008 | E | 386 | HIS | 0 | 0.010 | -0.016 | 40.110 | -0.686 | -0.686 | 0.000 | 0.000 | 0.000 | 0.000 |
1009 | E | 387 | CYS | 0 | 0.021 | 0.013 | 43.844 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
1010 | E | 388 | GLY | 0 | 0.028 | 0.012 | 46.846 | -0.381 | -0.381 | 0.000 | 0.000 | 0.000 | 0.000 |
1011 | E | 389 | GLN | 0 | 0.025 | 0.004 | 40.758 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
1012 | E | 390 | MET | 0 | -0.034 | 0.004 | 44.661 | 0.564 | 0.564 | 0.000 | 0.000 | 0.000 | 0.000 |
1013 | E | 391 | HIS | 0 | 0.054 | 0.013 | 45.836 | 0.301 | 0.301 | 0.000 | 0.000 | 0.000 | 0.000 |
1014 | E | 392 | GLN | 0 | -0.005 | -0.019 | 42.704 | 0.209 | 0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
1015 | E | 393 | LEU | 0 | 0.021 | 0.010 | 39.757 | 0.505 | 0.505 | 0.000 | 0.000 | 0.000 | 0.000 |
1016 | E | 394 | ILE | 0 | 0.026 | 0.019 | 41.647 | 0.466 | 0.466 | 0.000 | 0.000 | 0.000 | 0.000 |
1017 | E | 395 | HIS | 1 | 0.901 | 0.970 | 43.148 | -27.137 | -27.137 | 0.000 | 0.000 | 0.000 | 0.000 |
1018 | E | 396 | TYR | 0 | -0.051 | -0.050 | 38.742 | 0.270 | 0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
1019 | E | 397 | LEU | 0 | 0.020 | 0.021 | 36.301 | 0.660 | 0.660 | 0.000 | 0.000 | 0.000 | 0.000 |
1020 | E | 398 | GLY | 0 | -0.006 | 0.016 | 39.209 | 0.426 | 0.426 | 0.000 | 0.000 | 0.000 | 0.000 |
1021 | E | 399 | ASP | -1 | -0.838 | -0.929 | 41.957 | 26.731 | 26.731 | 0.000 | 0.000 | 0.000 | 0.000 |
1022 | E | 400 | ASP | -1 | -0.858 | -0.916 | 39.183 | 29.062 | 29.062 | 0.000 | 0.000 | 0.000 | 0.000 |
1023 | E | 401 | VAL | 0 | 0.039 | 0.015 | 36.725 | 0.905 | 0.905 | 0.000 | 0.000 | 0.000 | 0.000 |
1024 | E | 402 | VAL | 0 | 0.001 | 0.011 | 37.033 | -0.874 | -0.874 | 0.000 | 0.000 | 0.000 | 0.000 |
1025 | E | 403 | LEU | 0 | -0.019 | -0.003 | 37.354 | 0.828 | 0.828 | 0.000 | 0.000 | 0.000 | 0.000 |
1026 | E | 404 | GLN | 0 | 0.026 | -0.005 | 34.033 | -0.798 | -0.798 | 0.000 | 0.000 | 0.000 | 0.000 |
1027 | E | 405 | PHE | 0 | 0.008 | -0.011 | 38.688 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
1028 | E | 406 | GLY | 0 | 0.010 | 0.011 | 38.737 | -0.685 | -0.685 | 0.000 | 0.000 | 0.000 | 0.000 |
1029 | E | 407 | GLY | 0 | 0.048 | -0.005 | 39.427 | -0.754 | -0.754 | 0.000 | 0.000 | 0.000 | 0.000 |
1030 | E | 408 | GLY | 0 | -0.003 | 0.001 | 41.291 | -0.685 | -0.685 | 0.000 | 0.000 | 0.000 | 0.000 |
1031 | E | 409 | THR | 0 | -0.061 | -0.027 | 43.322 | -0.801 | -0.801 | 0.000 | 0.000 | 0.000 | 0.000 |
1032 | E | 410 | ILE | 0 | -0.053 | -0.047 | 41.546 | -0.734 | -0.734 | 0.000 | 0.000 | 0.000 | 0.000 |
1033 | E | 411 | GLY | 0 | -0.008 | -0.002 | 44.537 | -0.385 | -0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
1034 | E | 412 | HIS | 0 | -0.062 | -0.024 | 45.877 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
1035 | E | 413 | PRO | 0 | 0.029 | 0.010 | 49.278 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
1036 | E | 414 | ASP | -1 | -0.881 | -0.946 | 52.176 | 21.233 | 21.233 | 0.000 | 0.000 | 0.000 | 0.000 |
1037 | E | 415 | GLY | 0 | -0.013 | -0.012 | 51.379 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
1038 | E | 416 | ILE | 0 | 0.024 | 0.003 | 46.637 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
1039 | E | 417 | GLN | 0 | -0.044 | -0.039 | 49.163 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
1040 | E | 418 | ALA | 0 | 0.001 | 0.012 | 51.574 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
1041 | E | 419 | GLY | 0 | 0.043 | 0.015 | 48.501 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
1042 | E | 420 | ALA | 0 | -0.024 | -0.002 | 47.487 | 0.204 | 0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
1043 | E | 421 | THR | 0 | -0.004 | -0.030 | 48.468 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
1044 | E | 422 | ALA | 0 | -0.041 | -0.014 | 50.211 | -0.167 | -0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
1045 | E | 423 | ASN | 0 | 0.018 | 0.001 | 45.402 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
1046 | E | 424 | ARG | 1 | 0.823 | 0.898 | 48.227 | -23.806 | -23.806 | 0.000 | 0.000 | 0.000 | 0.000 |
1047 | E | 425 | VAL | 0 | 0.023 | 0.017 | 49.660 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
1048 | E | 426 | ALA | 0 | -0.001 | 0.028 | 49.174 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
1049 | E | 427 | LEU | 0 | 0.022 | 0.005 | 45.656 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
1050 | E | 428 | GLU | -1 | -0.772 | -0.884 | 48.919 | 23.116 | 23.116 | 0.000 | 0.000 | 0.000 | 0.000 |
1051 | E | 429 | SER | 0 | -0.015 | -0.049 | 51.809 | -0.225 | -0.225 | 0.000 | 0.000 | 0.000 | 0.000 |
1052 | E | 430 | MET | 0 | -0.052 | 0.005 | 48.619 | -0.245 | -0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
1053 | E | 431 | VAL | 0 | -0.017 | -0.007 | 48.239 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
1054 | E | 432 | LEU | 0 | -0.025 | -0.009 | 50.867 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
1055 | E | 433 | ALA | 0 | 0.025 | 0.003 | 53.852 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
1056 | E | 434 | ARG | 1 | 0.816 | 0.910 | 46.411 | -25.640 | -25.640 | 0.000 | 0.000 | 0.000 | 0.000 |
1057 | E | 435 | ASN | 0 | -0.014 | -0.013 | 51.679 | 0.289 | 0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
1058 | E | 436 | GLU | -1 | -0.967 | -0.982 | 54.075 | 20.561 | 20.561 | 0.000 | 0.000 | 0.000 | 0.000 |
1059 | E | 437 | GLY | 0 | -0.039 | -0.011 | 55.593 | -0.382 | -0.382 | 0.000 | 0.000 | 0.000 | 0.000 |
1060 | E | 438 | VAL | 0 | -0.037 | -0.011 | 55.298 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
1061 | E | 439 | ASP | -1 | -0.895 | -0.939 | 52.198 | 24.106 | 24.106 | 0.000 | 0.000 | 0.000 | 0.000 |
1062 | E | 440 | TYR | 0 | 0.011 | -0.033 | 46.813 | 0.282 | 0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
1063 | E | 441 | PHE | 0 | -0.052 | -0.038 | 43.958 | 0.280 | 0.280 | 0.000 | 0.000 | 0.000 | 0.000 |
1064 | E | 442 | ASP | -1 | -0.785 | -0.877 | 49.011 | 23.147 | 23.147 | 0.000 | 0.000 | 0.000 | 0.000 |
1065 | E | 443 | GLN | 0 | -0.042 | -0.041 | 49.988 | -0.363 | -0.363 | 0.000 | 0.000 | 0.000 | 0.000 |
1066 | E | 444 | GLN | 0 | -0.041 | -0.010 | 51.379 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
1067 | E | 445 | VAL | 0 | -0.026 | -0.012 | 54.295 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
1068 | E | 446 | GLY | 0 | 0.059 | 0.036 | 51.203 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
1069 | E | 447 | PRO | 0 | -0.018 | -0.024 | 50.887 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
1070 | E | 448 | GLN | 0 | -0.055 | -0.017 | 52.922 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
1071 | E | 449 | ILE | 0 | 0.058 | 0.023 | 53.732 | -0.297 | -0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
1072 | E | 450 | LEU | 0 | 0.005 | 0.015 | 49.584 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
1073 | E | 451 | ARG | 1 | 0.931 | 0.955 | 54.264 | -22.019 | -22.019 | 0.000 | 0.000 | 0.000 | 0.000 |
1074 | E | 452 | ASP | -1 | -0.935 | -0.972 | 57.025 | 20.033 | 20.033 | 0.000 | 0.000 | 0.000 | 0.000 |
1075 | E | 453 | ALA | 0 | 0.020 | 0.013 | 55.479 | -0.282 | -0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
1076 | E | 454 | ALA | 0 | -0.037 | -0.027 | 56.044 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
1077 | E | 455 | LYS | 1 | 0.883 | 0.956 | 57.618 | -20.154 | -20.154 | 0.000 | 0.000 | 0.000 | 0.000 |
1078 | E | 456 | THR | 0 | -0.014 | -0.002 | 60.045 | -0.378 | -0.378 | 0.000 | 0.000 | 0.000 | 0.000 |
1079 | E | 457 | CYS | 0 | -0.063 | -0.006 | 55.115 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
1080 | E | 458 | GLY | 0 | 0.040 | 0.022 | 57.633 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
1081 | E | 459 | PRO | 0 | 0.023 | -0.002 | 53.869 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
1082 | E | 460 | LEU | 0 | 0.069 | 0.030 | 51.580 | 0.393 | 0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
1083 | E | 461 | GLN | 0 | -0.057 | -0.002 | 53.676 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
1084 | E | 462 | THR | 0 | 0.029 | 0.011 | 53.608 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
1085 | E | 463 | ALA | 0 | -0.003 | 0.006 | 49.418 | 0.252 | 0.252 | 0.000 | 0.000 | 0.000 | 0.000 |
1086 | E | 464 | LEU | 0 | -0.051 | -0.036 | 50.251 | 0.412 | 0.412 | 0.000 | 0.000 | 0.000 | 0.000 |
1087 | E | 465 | ASP | -1 | -0.923 | -0.977 | 52.059 | 21.626 | 21.626 | 0.000 | 0.000 | 0.000 | 0.000 |
1088 | E | 466 | LEU | 0 | -0.075 | -0.027 | 48.462 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
1089 | E | 467 | TRP | 0 | 0.006 | -0.012 | 45.400 | 0.225 | 0.225 | 0.000 | 0.000 | 0.000 | 0.000 |
1090 | E | 468 | LYS | 1 | 0.928 | 0.969 | 47.091 | -22.644 | -22.644 | 0.000 | 0.000 | 0.000 | 0.000 |
1091 | E | 469 | ASP | -1 | -0.930 | -0.954 | 48.356 | 23.897 | 23.897 | 0.000 | 0.000 | 0.000 | 0.000 |
1092 | E | 470 | ILE | 0 | -0.090 | -0.029 | 42.277 | 0.440 | 0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
1093 | E | 471 | SER | 0 | -0.031 | -0.024 | 41.833 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
1094 | E | 472 | PHE | 0 | -0.002 | -0.005 | 36.532 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
1095 | E | 473 | ASP | -1 | -0.965 | -0.969 | 37.349 | 30.127 | 30.127 | 0.000 | 0.000 | 0.000 | 0.000 |
1096 | E | 474 | TYR | 0 | 0.029 | 0.000 | 34.263 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
1097 | E | 475 | THR | 0 | -0.015 | -0.011 | 32.530 | -0.350 | -0.350 | 0.000 | 0.000 | 0.000 | 0.000 |
1098 | E | 476 | SER | 0 | 0.006 | 0.012 | 30.391 | 0.380 | 0.380 | 0.000 | 0.000 | 0.000 | 0.000 |
1099 | E | 477 | THR | 0 | -0.055 | -0.017 | 25.586 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
1100 | E | 478 | ASP | -1 | -0.922 | -0.968 | 25.107 | 46.428 | 46.428 | 0.000 | 0.000 | 0.000 | 0.000 |
1101 | E | 479 | THR | 0 | -0.002 | 0.002 | 26.733 | -1.230 | -1.230 | 0.000 | 0.000 | 0.000 | 0.000 |
1102 | E | 480 | ALA | 0 | 0.074 | 0.025 | 28.330 | 1.414 | 1.414 | 0.000 | 0.000 | 0.000 | 0.000 |
1103 | E | 481 | ASP | -1 | -0.847 | -0.930 | 27.470 | 44.172 | 44.172 | 0.000 | 0.000 | 0.000 | 0.000 |
1104 | E | 482 | PHE | 0 | -0.016 | -0.021 | 29.277 | -0.557 | -0.557 | 0.000 | 0.000 | 0.000 | 0.000 |
1105 | E | 483 | ALA | 0 | 0.003 | 0.001 | 33.784 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
1106 | E | 484 | GLU | -1 | -0.940 | -0.966 | 36.760 | 30.250 | 30.250 | 0.000 | 0.000 | 0.000 | 0.000 |
1107 | K | 1 | MET | 0 | -0.066 | -0.002 | 57.804 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
1108 | K | 2 | ARG | 1 | 0.779 | 0.859 | 58.726 | -20.663 | -20.663 | 0.000 | 0.000 | 0.000 | 0.000 |
1109 | K | 3 | LEU | 0 | 0.030 | 0.016 | 57.149 | 0.326 | 0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
1110 | K | 4 | THR | 0 | -0.071 | -0.042 | 53.485 | -0.262 | -0.262 | 0.000 | 0.000 | 0.000 | 0.000 |
1111 | K | 5 | GLN | 0 | 0.032 | 0.028 | 53.058 | 0.526 | 0.526 | 0.000 | 0.000 | 0.000 | 0.000 |
1112 | K | 6 | GLY | 0 | 0.005 | 0.015 | 53.153 | -0.414 | -0.414 | 0.000 | 0.000 | 0.000 | 0.000 |
1113 | K | 7 | CYS | 0 | -0.015 | -0.014 | 50.635 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
1114 | K | 8 | PHE | 0 | 0.010 | 0.009 | 52.211 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
1115 | K | 9 | SER | 0 | -0.023 | -0.021 | 54.526 | -0.589 | -0.589 | 0.000 | 0.000 | 0.000 | 0.000 |
1116 | K | 10 | PHE | 0 | -0.037 | -0.016 | 52.962 | -0.311 | -0.311 | 0.000 | 0.000 | 0.000 | 0.000 |
1117 | K | 11 | LEU | 0 | -0.020 | 0.010 | 55.109 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
1118 | K | 12 | PRO | 0 | -0.032 | -0.029 | 58.087 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
1119 | K | 13 | ASP | -1 | -0.831 | -0.915 | 61.468 | 19.601 | 19.601 | 0.000 | 0.000 | 0.000 | 0.000 |
1120 | K | 14 | LEU | 0 | 0.026 | 0.022 | 58.676 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
1121 | K | 15 | THR | 0 | -0.028 | -0.013 | 63.061 | -0.275 | -0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
1122 | K | 16 | ASP | -1 | -0.771 | -0.886 | 65.063 | 18.405 | 18.405 | 0.000 | 0.000 | 0.000 | 0.000 |
1123 | K | 17 | ALA | 0 | -0.017 | -0.016 | 65.762 | 0.198 | 0.198 | 0.000 | 0.000 | 0.000 | 0.000 |
1124 | K | 18 | GLN | 0 | 0.011 | -0.006 | 61.766 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
1125 | K | 19 | ILE | 0 | 0.002 | 0.009 | 61.134 | 0.385 | 0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
1126 | K | 20 | GLU | -1 | -0.902 | -0.959 | 61.294 | 19.746 | 19.746 | 0.000 | 0.000 | 0.000 | 0.000 |
1127 | K | 21 | LYS | 1 | 0.990 | 0.998 | 60.103 | -19.526 | -19.526 | 0.000 | 0.000 | 0.000 | 0.000 |
1128 | K | 22 | GLN | 0 | 0.021 | 0.019 | 55.525 | 0.692 | 0.692 | 0.000 | 0.000 | 0.000 | 0.000 |
1129 | K | 23 | VAL | 0 | 0.004 | -0.004 | 56.986 | 0.353 | 0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
1130 | K | 24 | ALA | 0 | 0.001 | -0.006 | 58.379 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
1131 | K | 25 | TYR | 0 | -0.046 | -0.012 | 49.257 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
1132 | K | 26 | ALA | 0 | 0.032 | -0.001 | 53.702 | 0.345 | 0.345 | 0.000 | 0.000 | 0.000 | 0.000 |
1133 | K | 27 | MET | 0 | -0.015 | -0.001 | 54.482 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
1134 | K | 28 | ALA | 0 | -0.045 | -0.021 | 55.669 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
1135 | K | 29 | LYS | 1 | 0.873 | 0.948 | 47.377 | -25.274 | -25.274 | 0.000 | 0.000 | 0.000 | 0.000 |
1136 | K | 30 | GLY | 0 | -0.007 | 0.010 | 51.131 | 0.439 | 0.439 | 0.000 | 0.000 | 0.000 | 0.000 |
1137 | K | 31 | TRP | 0 | -0.050 | -0.021 | 48.046 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
1138 | K | 32 | ALA | 0 | 0.033 | 0.024 | 53.298 | -0.450 | -0.450 | 0.000 | 0.000 | 0.000 | 0.000 |
1139 | K | 33 | MET | 0 | -0.003 | 0.002 | 55.244 | 0.353 | 0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
1140 | K | 34 | ASN | 0 | -0.027 | -0.034 | 57.246 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
1141 | K | 35 | VAL | 0 | 0.032 | 0.028 | 59.210 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
1142 | K | 36 | GLU | -1 | -0.747 | -0.876 | 57.140 | 21.817 | 21.817 | 0.000 | 0.000 | 0.000 | 0.000 |
1143 | K | 37 | TRP | 0 | 0.001 | -0.007 | 61.383 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
1144 | K | 38 | THR | 0 | 0.066 | 0.043 | 60.111 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
1145 | K | 39 | ASP | -1 | -0.762 | -0.887 | 63.137 | 18.544 | 18.544 | 0.000 | 0.000 | 0.000 | 0.000 |
1146 | K | 40 | ASP | -1 | -0.872 | -0.951 | 60.086 | 20.590 | 20.590 | 0.000 | 0.000 | 0.000 | 0.000 |
1147 | K | 41 | PRO | 0 | -0.023 | 0.000 | 59.354 | 0.333 | 0.333 | 0.000 | 0.000 | 0.000 | 0.000 |
1148 | K | 42 | HIS | 0 | -0.018 | -0.018 | 53.732 | 0.540 | 0.540 | 0.000 | 0.000 | 0.000 | 0.000 |
1149 | K | 43 | PRO | 0 | -0.023 | -0.018 | 51.537 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
1150 | K | 44 | ARG | 1 | 0.902 | 0.949 | 47.766 | -24.674 | -24.674 | 0.000 | 0.000 | 0.000 | 0.000 |
1151 | K | 45 | ASN | 0 | -0.013 | 0.007 | 52.656 | 0.170 | 0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
1152 | K | 46 | ASN | 0 | -0.013 | -0.019 | 50.161 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
1153 | K | 47 | TYR | 0 | -0.037 | -0.025 | 51.395 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
1154 | K | 48 | TRP | 0 | -0.014 | 0.005 | 56.485 | -0.403 | -0.403 | 0.000 | 0.000 | 0.000 | 0.000 |
1155 | K | 49 | GLU | -1 | -0.908 | -0.959 | 59.303 | 20.055 | 20.055 | 0.000 | 0.000 | 0.000 | 0.000 |
1156 | K | 50 | LEU | 0 | -0.026 | -0.016 | 58.363 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
1157 | K | 51 | TRP | 0 | -0.020 | 0.007 | 62.074 | -0.351 | -0.351 | 0.000 | 0.000 | 0.000 | 0.000 |
1158 | K | 52 | GLY | 0 | -0.015 | -0.008 | 64.388 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
1159 | K | 53 | LEU | 0 | -0.030 | -0.029 | 61.479 | 0.270 | 0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
1160 | K | 54 | PRO | 0 | 0.014 | -0.006 | 57.493 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
1161 | K | 55 | LEU | 0 | -0.023 | 0.002 | 59.941 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
1162 | K | 56 | PHE | 0 | -0.003 | -0.016 | 55.212 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
1163 | K | 57 | ASP | -1 | -0.907 | -0.946 | 58.908 | 20.383 | 20.383 | 0.000 | 0.000 | 0.000 | 0.000 |
1164 | K | 58 | ILE | 0 | -0.085 | -0.032 | 61.487 | -0.170 | -0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
1165 | K | 59 | LYS | 1 | 0.973 | 0.979 | 61.184 | -19.591 | -19.591 | 0.000 | 0.000 | 0.000 | 0.000 |
1166 | K | 60 | ASP | -1 | -0.884 | -0.969 | 63.150 | 18.563 | 18.563 | 0.000 | 0.000 | 0.000 | 0.000 |
1167 | K | 61 | PRO | 0 | 0.082 | 0.040 | 62.074 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
1168 | K | 62 | ALA | 0 | -0.006 | 0.006 | 64.127 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
1169 | K | 63 | THR | 0 | 0.011 | 0.009 | 65.707 | -0.259 | -0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
1170 | K | 64 | VAL | 0 | 0.020 | 0.015 | 61.429 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
1171 | K | 65 | MET | 0 | -0.024 | -0.005 | 64.612 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
1172 | K | 66 | PHE | 0 | -0.043 | -0.025 | 66.883 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
1173 | K | 67 | GLU | -1 | -0.843 | -0.931 | 66.164 | 18.024 | 18.024 | 0.000 | 0.000 | 0.000 | 0.000 |
1174 | K | 68 | LEU | 0 | -0.043 | -0.006 | 64.292 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
1175 | K | 69 | ASN | 0 | -0.030 | -0.023 | 66.956 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
1176 | K | 70 | GLU | -1 | -0.856 | -0.927 | 70.607 | 16.621 | 16.621 | 0.000 | 0.000 | 0.000 | 0.000 |
1177 | K | 71 | ALA | 0 | 0.010 | 0.021 | 67.359 | -0.166 | -0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
1178 | K | 72 | ARG | 1 | 0.770 | 0.832 | 65.917 | -18.646 | -18.646 | 0.000 | 0.000 | 0.000 | 0.000 |
1179 | K | 73 | LYS | 1 | 0.808 | 0.915 | 70.442 | -16.852 | -16.852 | 0.000 | 0.000 | 0.000 | 0.000 |
1180 | K | 74 | SER | 0 | -0.042 | -0.018 | 71.921 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
1181 | K | 75 | CYS | 0 | -0.079 | -0.022 | 68.521 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
1182 | K | 76 | ALA | 0 | 0.029 | 0.018 | 70.773 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
1183 | K | 77 | ALA | 0 | -0.026 | -0.019 | 70.028 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
1184 | K | 78 | GLY | 0 | 0.009 | -0.012 | 66.606 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
1185 | K | 79 | TYR | 0 | -0.093 | -0.078 | 61.478 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
1186 | K | 80 | ILE | 0 | 0.017 | 0.016 | 62.829 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
1187 | K | 81 | ARG | 1 | 0.837 | 0.931 | 55.020 | -22.048 | -22.048 | 0.000 | 0.000 | 0.000 | 0.000 |
1188 | K | 82 | ILE | 0 | 0.014 | 0.009 | 57.885 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
1189 | K | 83 | ASN | 0 | -0.038 | -0.006 | 53.965 | 0.414 | 0.414 | 0.000 | 0.000 | 0.000 | 0.000 |
1190 | K | 84 | ALA | 0 | 0.011 | 0.001 | 52.684 | -0.353 | -0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
1191 | K | 85 | PHE | 0 | -0.026 | -0.018 | 49.551 | 0.441 | 0.441 | 0.000 | 0.000 | 0.000 | 0.000 |
1192 | K | 86 | ASP | -1 | -0.797 | -0.873 | 46.727 | 25.739 | 25.739 | 0.000 | 0.000 | 0.000 | 0.000 |
1193 | K | 87 | ALA | 0 | 0.003 | -0.013 | 47.617 | 0.414 | 0.414 | 0.000 | 0.000 | 0.000 | 0.000 |
1194 | K | 88 | SER | 0 | -0.039 | -0.046 | 44.871 | 0.248 | 0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
1195 | K | 89 | TYR | 0 | 0.079 | 0.041 | 36.830 | 0.341 | 0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
1196 | K | 90 | GLY | 0 | -0.012 | -0.002 | 39.768 | 0.386 | 0.386 | 0.000 | 0.000 | 0.000 | 0.000 |
1197 | K | 91 | VAL | 0 | -0.085 | -0.056 | 40.364 | 0.503 | 0.503 | 0.000 | 0.000 | 0.000 | 0.000 |
1198 | K | 92 | GLU | -1 | -0.958 | -0.974 | 43.189 | 27.765 | 27.765 | 0.000 | 0.000 | 0.000 | 0.000 |
1199 | K | 93 | SER | 0 | -0.014 | -0.011 | 45.179 | -0.205 | -0.205 | 0.000 | 0.000 | 0.000 | 0.000 |
1200 | K | 94 | CYS | 0 | -0.051 | -0.007 | 47.203 | -0.445 | -0.445 | 0.000 | 0.000 | 0.000 | 0.000 |
1201 | K | 95 | VAL | 0 | 0.019 | 0.009 | 45.950 | 0.542 | 0.542 | 0.000 | 0.000 | 0.000 | 0.000 |
1202 | K | 96 | MET | 0 | -0.062 | -0.048 | 48.320 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1203 | K | 97 | SER | 0 | 0.020 | 0.003 | 51.299 | -0.347 | -0.347 | 0.000 | 0.000 | 0.000 | 0.000 |
1204 | K | 98 | PHE | 0 | 0.010 | 0.003 | 53.554 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
1205 | K | 99 | ILE | 0 | 0.014 | 0.016 | 56.237 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
1206 | K | 100 | THR | 0 | -0.025 | -0.026 | 59.327 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
1207 | K | 101 | ASN | 0 | -0.020 | 0.003 | 62.646 | -0.221 | -0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
1208 | K | 102 | ARG | 1 | 0.914 | 0.947 | 58.765 | -20.107 | -20.107 | 0.000 | 0.000 | 0.000 | 0.000 |
1209 | K | 103 | PRO | 0 | -0.003 | 0.038 | 64.718 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
1210 | K | 104 | THR | 0 | 0.011 | -0.020 | 66.860 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
1211 | K | 105 | ASN | 0 | -0.085 | -0.035 | 68.473 | 0.307 | 0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
1212 | K | 106 | GLU | -1 | -0.682 | -0.770 | 62.122 | 19.506 | 19.506 | 0.000 | 0.000 | 0.000 | 0.000 |
1213 | K | 107 | PRO | 0 | -0.009 | 0.005 | 64.593 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
1214 | K | 108 | GLY | 0 | 0.019 | -0.002 | 61.204 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
1215 | K | 109 | PHE | 0 | -0.031 | -0.030 | 57.937 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
1216 | K | 110 | TYR | 0 | -0.110 | -0.064 | 59.367 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1217 | K | 111 | LEU | 0 | -0.040 | -0.023 | 52.417 | 0.159 | 0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
1218 | K | 112 | ASP | -1 | -0.969 | -0.978 | 56.565 | 20.473 | 20.473 | 0.000 | 0.000 | 0.000 | 0.000 |
1219 | K | 113 | ARG | 1 | 0.818 | 0.887 | 53.868 | -21.639 | -21.639 | 0.000 | 0.000 | 0.000 | 0.000 |
1220 | K | 114 | THR | 0 | 0.036 | 0.026 | 54.781 | -0.489 | -0.489 | 0.000 | 0.000 | 0.000 | 0.000 |
1221 | K | 115 | ASP | -1 | -0.925 | -0.955 | 53.670 | 22.376 | 22.376 | 0.000 | 0.000 | 0.000 | 0.000 |
1222 | K | 116 | GLY | 0 | 0.013 | 0.004 | 50.538 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
1223 | K | 117 | PRO | 0 | 0.007 | -0.008 | 47.557 | -0.227 | -0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
1224 | K | 118 | GLY | 0 | 0.010 | 0.008 | 48.139 | 0.313 | 0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
1225 | K | 119 | ARG | 1 | 0.897 | 0.930 | 47.041 | -24.077 | -24.077 | 0.000 | 0.000 | 0.000 | 0.000 |
1226 | K | 120 | GLN | 0 | 0.004 | 0.029 | 46.091 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
1227 | K | 121 | ILE | 0 | -0.007 | 0.000 | 48.039 | -0.533 | -0.533 | 0.000 | 0.000 | 0.000 | 0.000 |
1228 | K | 122 | VAL | 0 | -0.009 | -0.007 | 49.319 | 0.503 | 0.503 | 0.000 | 0.000 | 0.000 | 0.000 |
1229 | K | 123 | TYR | 0 | 0.008 | -0.034 | 48.360 | -0.399 | -0.399 | 0.000 | 0.000 | 0.000 | 0.000 |
1230 | K | 124 | SER | 0 | -0.011 | 0.008 | 52.494 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
1231 | K | 125 | ILE | 0 | 0.004 | 0.009 | 51.917 | -0.319 | -0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
1232 | K | 126 | LYS | 1 | 0.953 | 0.970 | 55.902 | -20.799 | -20.799 | 0.000 | 0.000 | 0.000 | 0.000 |
1233 | K | 127 | SER | 0 | 0.069 | 0.043 | 59.672 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
1234 | K | 128 | TYR | 0 | -0.014 | -0.024 | 61.831 | -0.326 | -0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
1235 | K | 129 | SER | 0 | 0.018 | 0.002 | 64.684 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
1236 | K | 130 | VAL | 0 | 0.027 | 0.005 | 62.654 | -0.282 | -0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
1237 | K | 131 | GLN | 0 | -0.024 | 0.025 | 65.011 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
1238 | K | 132 | ALA | 0 | -0.056 | -0.022 | 66.705 | -0.220 | -0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
1239 | K | 133 | ASN | 0 | -0.025 | -0.009 | 69.380 | -0.483 | -0.483 | 0.000 | 0.000 | 0.000 | 0.000 |
1240 | K | 134 | PRO | 0 | 0.021 | 0.024 | 69.099 | 0.319 | 0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
1241 | K | 135 | GLU | -1 | -0.912 | -0.963 | 66.566 | 18.609 | 18.609 | 0.000 | 0.000 | 0.000 | 0.000 |
1242 | K | 136 | GLY | 0 | -0.007 | -0.008 | 68.754 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
1243 | K | 137 | SER | 0 | -0.119 | -0.070 | 71.346 | -0.331 | -0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
1244 | K | 138 | ARG | 1 | 0.861 | 0.936 | 65.000 | -18.960 | -18.960 | 0.000 | 0.000 | 0.000 | 0.000 |
1245 | K | 139 | TYR | 0 | -0.078 | -0.050 | 63.941 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
1246 | E | 502 | CAP | -4 | -3.048 | -3.398 | 28.419 | 140.881 | 140.881 | 0.000 | 0.000 | 0.000 | 0.000 |