FMODB ID: 9YJZ2
Calculation Name: 7E8M-EHL-Xray297
Preferred Name:
Target Type:
Ligand Name: 2-acetamido-2-deoxy-beta-d-glucopyranose
ligand 3-letter code: NAG
PDB ID: 7E8M
Chain ID: EHL
Base Structure: X-ray
Registration Date: 2021-08-02
Reference: C. Watanabe, K. Kamisaka, T. Honma et al., Interaction energy analysis between SARS-CoV-2 spike protein and antibodiy, To be pubulished.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptAll |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | All crystal waters in PDB. |
Procedure | Auto-FMO protocol ver. 2.20210516 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 1116 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -16030112.483618 |
---|---|
FMO2-HF: Nuclear repulsion | 15753119.056379 |
FMO2-HF: Total energy | -276993.427239 |
FMO2-MP2: Total energy | -277787.385932 |
3D Structure
Ligand structure
Ligand Interaction
SARS-CoV-2 spike protein and antibody binding energy (frag 1-191 : frag 192-617)
"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. |
-127.0365 | -77.1480 | 193.6462 | -95.9155 | -147.6192 | 0.2434 |
Interactive mode: IFIE and PIEDA for fragment #1(E:333:THR )
Summations of interaction energy for
fragment #1(E:333:THR )
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. |
-1.078 | 0.718 | -0.002 | -0.627 | -1.168 | 0.003 |
Interaction energy analysis for fragmet #1(E:333:THR )
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | E | 335 | LEU | 0 | 0.067 | 0.035 | 3.864 | -0.348 | 0.971 | -0.010 | -0.548 | -0.763 | 0.003 |
4 | E | 361 | CYS | 0 | -0.085 | -0.013 | 4.619 | 0.708 | 0.825 | -0.002 | -0.021 | -0.093 | 0.000 |
5 | E | 337 | PRO | 0 | 0.018 | 0.030 | 9.132 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | E | 338 | PHE | 0 | 0.046 | -0.010 | 11.885 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | E | 339 | GLY | 0 | 0.049 | 0.031 | 14.522 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | E | 340 | GLU | -1 | -0.795 | -0.884 | 14.439 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | E | 341 | VAL | 0 | -0.059 | -0.016 | 17.321 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | E | 342 | PHE | 0 | 0.042 | 0.012 | 17.085 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | E | 343 | ASN | 0 | 0.005 | 0.011 | 20.267 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | E | 344 | ALA | 0 | -0.034 | 0.018 | 21.962 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | E | 345 | THR | 0 | 0.057 | 0.019 | 23.431 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | E | 346 | ARG | 1 | 0.878 | 0.941 | 26.843 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | E | 347 | PHE | 0 | 0.038 | 0.022 | 24.106 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | E | 348 | ALA | 0 | -0.011 | 0.007 | 27.550 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | E | 349 | SER | 0 | 0.005 | -0.018 | 29.324 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | E | 350 | VAL | 0 | -0.052 | -0.016 | 31.422 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | E | 351 | TYR | 0 | 0.034 | 0.021 | 32.208 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | E | 352 | ALA | 0 | -0.020 | 0.000 | 31.392 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | E | 353 | TRP | 0 | -0.048 | 0.005 | 24.929 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | E | 354 | ASN | 0 | 0.039 | 0.027 | 23.534 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | E | 355 | ARG | 1 | 0.811 | 0.871 | 20.888 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | E | 356 | LYS | 1 | 0.803 | 0.920 | 14.556 | -0.283 | -0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | E | 357 | ARG | 1 | 0.894 | 0.930 | 13.393 | -0.356 | -0.356 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | E | 358 | ILE | 0 | -0.049 | -0.029 | 11.152 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | E | 359 | SER | 0 | -0.024 | -0.042 | 10.453 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | E | 360 | ASN | 0 | 0.014 | 0.002 | 6.336 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | E | 362 | VAL | 0 | 0.019 | 0.023 | 3.671 | -0.591 | -0.231 | 0.010 | -0.058 | -0.312 | 0.000 |
30 | E | 363 | ALA | 0 | 0.003 | -0.021 | 5.612 | -0.272 | -0.272 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | E | 364 | ASP | -1 | -0.763 | -0.848 | 9.101 | -0.188 | -0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | E | 365 | TYR | 0 | 0.044 | -0.001 | 11.662 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | E | 366 | SER | 0 | -0.040 | -0.036 | 14.888 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | E | 367 | VAL | 0 | 0.005 | -0.004 | 13.871 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | E | 368 | LEU | 0 | -0.044 | -0.018 | 15.133 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | E | 369 | TYR | 0 | -0.039 | -0.031 | 17.733 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | E | 370 | ASN | 0 | -0.009 | -0.023 | 18.656 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | E | 371 | SER | 0 | -0.024 | 0.003 | 20.152 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | E | 372 | ALA | 0 | -0.015 | -0.005 | 21.787 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | E | 373 | SER | 0 | -0.041 | -0.014 | 23.797 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | E | 374 | PHE | 0 | -0.037 | -0.022 | 21.039 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | E | 375 | SER | 0 | 0.022 | 0.001 | 26.748 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | E | 376 | THR | 0 | -0.073 | -0.044 | 27.837 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | E | 377 | PHE | 0 | 0.081 | 0.042 | 19.234 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | E | 378 | LYS | 1 | 0.856 | 0.958 | 25.455 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | E | 432 | CYS | 0 | -0.105 | -0.029 | 20.891 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | E | 380 | TYR | 0 | 0.023 | -0.007 | 24.143 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | E | 381 | GLY | 0 | 0.051 | 0.020 | 24.177 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | E | 382 | VAL | 0 | -0.030 | -0.008 | 19.181 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | E | 383 | SER | 0 | 0.000 | 0.000 | 21.145 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | E | 384 | PRO | 0 | 0.059 | 0.005 | 19.454 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | E | 385 | THR | 0 | -0.008 | 0.007 | 17.916 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | E | 386 | LYS | 1 | 0.999 | 0.992 | 17.051 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | E | 387 | LEU | 0 | -0.005 | -0.003 | 15.433 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | E | 388 | ASN | 0 | -0.017 | -0.018 | 12.409 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | E | 389 | ASP | -1 | -0.878 | -0.879 | 11.794 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | E | 390 | LEU | 0 | -0.029 | -0.007 | 13.084 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | E | 525 | CYS | 0 | -0.001 | -0.005 | 7.247 | -0.194 | -0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | E | 392 | PHE | 0 | 0.032 | 0.009 | 12.445 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | E | 393 | THR | 0 | -0.024 | 0.002 | 12.662 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | E | 394 | ASN | 0 | -0.009 | 0.005 | 13.438 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | E | 395 | VAL | 0 | 0.033 | 0.020 | 13.354 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | E | 396 | TYR | 0 | -0.068 | -0.052 | 15.453 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | E | 397 | ALA | 0 | 0.042 | 0.026 | 17.444 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | E | 398 | ASP | -1 | -0.701 | -0.769 | 19.281 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | E | 399 | SER | 0 | -0.016 | -0.009 | 22.953 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | E | 400 | PHE | 0 | 0.006 | -0.004 | 24.905 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | E | 401 | VAL | 0 | 0.025 | 0.025 | 28.571 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | E | 402 | ILE | 0 | 0.009 | 0.014 | 31.494 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | E | 403 | ARG | 1 | 0.771 | 0.875 | 34.380 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | E | 404 | GLY | 0 | 0.071 | 0.043 | 35.964 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | E | 405 | ASP | -1 | -0.777 | -0.830 | 36.823 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | E | 406 | GLU | -1 | -0.769 | -0.824 | 36.851 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | E | 407 | VAL | 0 | -0.011 | 0.005 | 31.147 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | E | 408 | ARG | 1 | 0.802 | 0.903 | 32.630 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | E | 409 | GLN | 0 | 0.020 | 0.015 | 34.483 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | E | 410 | ILE | 0 | -0.030 | 0.006 | 28.454 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | E | 411 | ALA | 0 | 0.045 | 0.017 | 29.958 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | E | 412 | PRO | 0 | 0.033 | 0.051 | 29.404 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | E | 413 | GLY | 0 | 0.018 | 0.018 | 32.152 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | E | 414 | GLN | 0 | -0.096 | -0.022 | 34.735 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | E | 415 | THR | 0 | 0.039 | 0.002 | 37.068 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | E | 416 | GLY | 0 | 0.058 | 0.040 | 39.638 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | E | 417 | ASN | 0 | 0.006 | 0.024 | 39.739 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | E | 418 | ILE | 0 | -0.027 | -0.005 | 34.121 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | E | 419 | ALA | 0 | 0.069 | 0.040 | 34.967 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | E | 420 | ASP | -1 | -0.727 | -0.788 | 36.040 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | E | 421 | TYR | 0 | -0.018 | -0.020 | 38.500 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | E | 422 | ASN | 0 | -0.026 | 0.000 | 34.706 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | E | 423 | TYR | 0 | 0.027 | -0.018 | 25.377 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | E | 424 | LYS | 1 | 0.794 | 0.923 | 31.533 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | E | 425 | LEU | 0 | 0.040 | 0.039 | 26.459 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | E | 426 | PRO | 0 | 0.033 | 0.026 | 27.543 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | E | 427 | ASP | -1 | -0.758 | -0.843 | 30.280 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | E | 428 | ASP | -1 | -0.882 | -0.921 | 28.396 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | E | 429 | PHE | 0 | -0.086 | -0.027 | 23.751 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | E | 430 | THR | 0 | 0.019 | 0.019 | 22.194 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | E | 431 | GLY | 0 | 0.024 | -0.007 | 20.957 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | E | 433 | VAL | 0 | 0.001 | 0.007 | 22.652 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | E | 434 | ILE | 0 | -0.005 | 0.007 | 20.182 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | E | 435 | ALA | 0 | -0.018 | -0.013 | 24.572 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | E | 436 | TRP | 0 | 0.022 | 0.012 | 23.573 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | E | 437 | ASN | 0 | -0.007 | 0.012 | 29.121 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | E | 438 | SER | 0 | 0.027 | -0.008 | 30.454 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | E | 439 | ASN | 0 | 0.032 | 0.009 | 32.389 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | E | 440 | ASN | 0 | 0.005 | 0.003 | 31.559 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | E | 441 | LEU | 0 | -0.015 | 0.007 | 29.126 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | E | 442 | ASP | -1 | -0.740 | -0.769 | 31.703 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | E | 443 | SER | 0 | -0.045 | -0.021 | 34.872 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | E | 444 | LYS | 1 | 0.857 | 0.908 | 38.644 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | E | 445 | VAL | 0 | 0.039 | 0.008 | 41.509 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | E | 446 | GLY | 0 | -0.002 | -0.007 | 45.203 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | E | 447 | GLY | 0 | 0.043 | 0.045 | 43.840 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | E | 448 | ASN | 0 | -0.067 | -0.038 | 36.251 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | E | 449 | TYR | 0 | 0.028 | -0.005 | 40.712 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | E | 450 | ASN | 0 | -0.016 | 0.002 | 35.579 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | E | 451 | TYR | 0 | -0.032 | -0.021 | 31.419 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | E | 452 | LEU | 0 | -0.001 | -0.001 | 36.347 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | E | 453 | TYR | 0 | 0.009 | -0.002 | 36.507 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | E | 454 | ARG | 1 | 0.754 | 0.841 | 37.418 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | E | 455 | LEU | 0 | 0.007 | 0.015 | 40.174 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | E | 456 | PHE | 0 | -0.019 | 0.004 | 43.450 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | E | 457 | ARG | 1 | 0.767 | 0.874 | 38.372 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | E | 458 | LYS | 1 | 0.944 | 0.990 | 44.125 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | E | 459 | SER | 0 | -0.019 | -0.006 | 41.778 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | E | 460 | ASN | 0 | 0.040 | 0.031 | 39.345 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | E | 461 | LEU | 0 | -0.041 | 0.015 | 34.020 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | E | 462 | LYS | 1 | 1.013 | 0.997 | 33.987 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | E | 463 | PRO | 0 | 0.061 | 0.019 | 30.321 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | E | 464 | PHE | 0 | -0.006 | 0.009 | 24.983 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | E | 465 | GLU | -1 | -0.742 | -0.810 | 28.779 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | E | 466 | ARG | 1 | 0.842 | 0.927 | 25.505 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | E | 467 | ASP | -1 | -0.761 | -0.854 | 31.936 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | E | 468 | ILE | 0 | 0.037 | 0.017 | 32.366 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | E | 469 | SER | 0 | 0.003 | 0.021 | 35.805 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | E | 470 | THR | 0 | 0.004 | -0.019 | 39.378 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | E | 471 | GLU | -1 | -0.794 | -0.809 | 42.044 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | E | 472 | ILE | 0 | -0.049 | -0.014 | 45.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | E | 473 | TYR | 0 | -0.030 | -0.023 | 46.224 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | E | 474 | GLN | 0 | 0.039 | 0.011 | 48.345 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | E | 475 | ALA | 0 | -0.008 | 0.000 | 51.463 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | E | 476 | GLY | 0 | 0.059 | 0.003 | 53.111 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | E | 477 | SER | 0 | 0.014 | 0.007 | 55.602 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | E | 478 | THR | 0 | 0.008 | 0.027 | 57.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | E | 479 | PRO | 0 | 0.035 | 0.022 | 54.199 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | E | 488 | CYS | 0 | 0.039 | 0.061 | 51.674 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | E | 481 | ASN | 0 | 0.012 | 0.032 | 52.597 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | E | 482 | GLY | 0 | 0.033 | 0.025 | 50.093 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | E | 483 | VAL | 0 | -0.049 | -0.008 | 51.070 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | E | 484 | LYS | 1 | 0.855 | 0.918 | 49.789 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | E | 485 | GLY | 0 | 0.017 | 0.001 | 53.735 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | E | 486 | PHE | 0 | -0.010 | -0.007 | 55.745 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | E | 487 | ASN | 0 | -0.057 | -0.045 | 55.324 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | E | 489 | TYR | 0 | 0.036 | 0.027 | 49.850 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | E | 490 | PHE | 0 | 0.011 | 0.013 | 42.703 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | E | 491 | PRO | 0 | 0.010 | 0.035 | 42.699 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | E | 492 | LEU | 0 | 0.003 | 0.014 | 38.740 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | E | 493 | GLN | 0 | 0.059 | 0.062 | 41.782 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | E | 494 | SER | 0 | 0.038 | 0.014 | 40.888 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | E | 495 | TYR | 0 | -0.020 | -0.025 | 36.139 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | E | 496 | GLY | 0 | 0.024 | 0.034 | 40.978 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | E | 497 | PHE | 0 | 0.022 | 0.031 | 36.328 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | E | 498 | GLN | 0 | 0.062 | 0.054 | 40.928 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | E | 499 | PRO | 0 | 0.017 | 0.034 | 40.900 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | E | 500 | THR | 0 | 0.025 | 0.000 | 41.997 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | E | 501 | TYR | 0 | -0.022 | 0.003 | 42.171 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | E | 502 | GLY | 0 | 0.059 | 0.034 | 43.203 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | E | 503 | VAL | 0 | 0.027 | -0.001 | 37.855 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | E | 504 | GLY | 0 | 0.034 | 0.019 | 38.976 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | E | 505 | TYR | 0 | -0.030 | -0.035 | 40.402 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | E | 506 | GLN | 0 | 0.021 | 0.042 | 37.816 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | E | 507 | PRO | 0 | -0.009 | 0.006 | 34.249 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | E | 508 | TYR | 0 | -0.002 | -0.015 | 31.526 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | E | 509 | ARG | 1 | 0.768 | 0.870 | 26.839 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | E | 510 | VAL | 0 | -0.011 | -0.011 | 26.707 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | E | 511 | VAL | 0 | 0.000 | -0.014 | 20.192 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | E | 512 | VAL | 0 | -0.012 | -0.003 | 23.027 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | E | 513 | LEU | 0 | -0.019 | 0.017 | 16.871 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | E | 514 | SER | 0 | 0.029 | -0.008 | 19.576 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | E | 515 | PHE | 0 | 0.004 | -0.013 | 15.506 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | E | 516 | GLU | -1 | -0.784 | -0.858 | 17.710 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | E | 517 | LEU | 0 | 0.021 | 0.005 | 18.137 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | E | 518 | LEU | 0 | -0.037 | -0.022 | 19.269 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | E | 519 | HIS | 0 | 0.047 | 0.022 | 19.340 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | E | 520 | ALA | 0 | -0.009 | 0.006 | 17.576 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | E | 521 | PRO | 0 | 0.032 | 0.016 | 12.906 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | E | 522 | ALA | 0 | 0.032 | 0.012 | 11.406 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | E | 523 | THR | 0 | -0.055 | -0.025 | 8.941 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | E | 524 | VAL | 0 | -0.010 | 0.001 | 7.966 | 0.451 | 0.451 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | E | 526 | GLY | 0 | 0.050 | 0.025 | 8.325 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | E | 527 | PRO | 0 | -0.043 | -0.020 | 8.649 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | H | 2 | VAL | 0 | 0.014 | 0.014 | 62.141 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | H | 3 | GLN | 0 | -0.040 | -0.011 | 65.076 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | H | 4 | LEU | 0 | -0.011 | 0.000 | 60.561 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | H | 5 | VAL | 0 | 0.042 | 0.031 | 64.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | H | 6 | GLU | -1 | -0.763 | -0.834 | 64.765 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | H | 7 | SER | 0 | -0.030 | -0.022 | 66.991 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | H | 8 | GLY | 0 | 0.008 | 0.006 | 67.269 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | H | 9 | GLY | 0 | 0.066 | 0.043 | 68.995 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | H | 10 | GLY | 0 | 0.011 | 0.005 | 69.765 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | H | 11 | LEU | 0 | -0.020 | 0.010 | 71.699 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | H | 12 | VAL | 0 | -0.039 | -0.003 | 68.624 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | H | 13 | GLN | 0 | 0.056 | 0.039 | 71.764 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | H | 14 | PRO | 0 | 0.029 | 0.018 | 68.951 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | H | 15 | GLY | 0 | 0.011 | 0.024 | 65.844 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | H | 16 | GLY | 0 | 0.026 | 0.025 | 66.044 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | H | 17 | SER | 0 | -0.027 | -0.021 | 64.178 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | H | 18 | LEU | 0 | -0.009 | 0.008 | 64.635 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | H | 19 | ARG | 1 | 0.884 | 0.935 | 61.166 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | H | 20 | LEU | 0 | 0.002 | 0.026 | 63.009 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | H | 21 | SER | 0 | 0.022 | -0.001 | 62.876 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | H | 95 | CYS | 0 | -0.038 | -0.005 | 60.242 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | H | 23 | ALA | 0 | 0.016 | 0.037 | 62.188 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | H | 24 | ALA | 0 | 0.037 | 0.024 | 60.814 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | H | 25 | SER | 0 | 0.004 | 0.002 | 62.786 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | H | 26 | GLY | 0 | 0.059 | 0.027 | 62.526 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | H | 27 | ILE | 0 | 0.015 | 0.025 | 57.281 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | H | 28 | THR | 0 | -0.011 | 0.018 | 54.782 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | H | 29 | VAL | 0 | 0.048 | 0.022 | 54.857 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | H | 30 | SER | 0 | -0.027 | -0.018 | 51.865 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | H | 31 | SER | 0 | 0.030 | 0.039 | 50.323 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | H | 32 | ASN | 0 | -0.026 | -0.028 | 50.860 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | H | 33 | TYR | 0 | -0.023 | 0.002 | 45.105 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | H | 34 | MET | 0 | -0.044 | -0.009 | 51.253 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | H | 35 | ASN | 0 | 0.025 | -0.018 | 53.689 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | H | 36 | TRP | 0 | -0.009 | -0.011 | 55.811 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | H | 37 | VAL | 0 | -0.019 | -0.013 | 57.824 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | H | 38 | ARG | 1 | 0.746 | 0.846 | 60.341 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | H | 39 | GLN | 0 | 0.058 | 0.047 | 63.472 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | H | 40 | ALA | 0 | 0.022 | 0.032 | 66.355 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | H | 41 | PRO | 0 | -0.023 | -0.021 | 68.399 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | H | 42 | GLY | 0 | 0.045 | 0.039 | 71.890 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | H | 43 | LYS | 1 | 0.836 | 0.949 | 66.585 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | H | 44 | GLY | 0 | 0.083 | 0.043 | 64.846 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | H | 45 | LEU | 0 | -0.043 | -0.005 | 61.790 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | H | 46 | GLU | -1 | -0.665 | -0.742 | 59.016 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | H | 47 | TRP | 0 | 0.004 | 0.001 | 50.619 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | H | 48 | VAL | 0 | -0.003 | 0.008 | 56.873 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | H | 49 | SER | 0 | -0.013 | -0.032 | 53.041 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | H | 50 | LEU | 0 | -0.016 | 0.010 | 48.732 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | H | 51 | ILE | 0 | -0.041 | -0.009 | 49.856 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | H | 52 | TYR | 0 | 0.020 | -0.013 | 42.823 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | H | 53 | SER | 0 | -0.031 | -0.012 | 47.112 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | H | 54 | GLY | 0 | 0.074 | 0.040 | 44.323 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | H | 55 | GLY | 0 | 0.020 | 0.030 | 44.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | H | 56 | SER | 0 | 0.031 | -0.002 | 42.614 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | H | 57 | THR | 0 | -0.061 | -0.022 | 45.569 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | H | 58 | TYR | 0 | -0.047 | -0.012 | 42.725 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | H | 59 | TYR | 0 | -0.014 | -0.009 | 49.167 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | H | 60 | ALA | 0 | 0.072 | 0.057 | 51.247 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | H | 61 | ASP | -1 | -0.768 | -0.862 | 50.975 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | H | 62 | SER | 0 | -0.043 | -0.022 | 53.774 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | H | 63 | VAL | 0 | -0.025 | -0.009 | 55.681 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | H | 64 | LYS | 1 | 0.792 | 0.901 | 48.306 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | H | 65 | GLY | 0 | 0.066 | 0.053 | 52.792 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | H | 66 | ARG | 1 | 0.714 | 0.843 | 53.774 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | H | 67 | PHE | 0 | 0.014 | 0.007 | 56.593 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | H | 68 | THR | 0 | 0.015 | 0.007 | 53.322 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | H | 69 | ILE | 0 | 0.010 | 0.035 | 52.698 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | H | 70 | SER | 0 | 0.004 | -0.005 | 53.768 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | H | 71 | ARG | 1 | 0.826 | 0.897 | 48.712 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | H | 72 | ASP | -1 | -0.691 | -0.753 | 56.115 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | H | 73 | ASN | 0 | 0.064 | 0.035 | 54.585 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | H | 74 | SER | 0 | -0.068 | -0.048 | 56.740 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | H | 75 | LYS | 1 | 0.876 | 0.942 | 59.577 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | H | 76 | ASN | 0 | -0.019 | -0.005 | 58.705 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | H | 77 | THR | 0 | 0.003 | 0.004 | 59.622 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | H | 78 | LEU | 0 | 0.001 | 0.008 | 55.889 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | H | 79 | TYR | 0 | -0.023 | -0.040 | 58.258 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | H | 80 | LEU | 0 | 0.012 | -0.001 | 57.470 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | H | 81 | GLN | 0 | 0.017 | 0.035 | 58.445 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | H | 82 | MET | 0 | -0.046 | -0.012 | 59.256 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | H | 83 | ASN | 0 | 0.033 | 0.007 | 58.799 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | H | 84 | SER | 0 | -0.014 | -0.009 | 61.180 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | H | 85 | LEU | 0 | -0.026 | 0.014 | 63.079 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | H | 86 | ARG | 1 | 0.902 | 0.940 | 58.723 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | H | 87 | ALA | 0 | 0.052 | 0.036 | 66.384 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | H | 88 | GLU | -1 | -0.751 | -0.841 | 64.584 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | H | 89 | ASP | -1 | -0.772 | -0.817 | 63.020 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | H | 90 | THR | 0 | -0.003 | 0.019 | 65.689 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | H | 91 | ALA | 0 | 0.012 | 0.011 | 66.367 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | H | 92 | VAL | 0 | -0.023 | 0.005 | 68.406 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | H | 93 | TYR | 0 | -0.029 | -0.031 | 62.143 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | H | 94 | HIS | 1 | 0.803 | 0.878 | 63.432 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | H | 96 | ALA | 0 | 0.030 | 0.002 | 58.734 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | H | 97 | ARG | 1 | 0.767 | 0.854 | 54.729 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | H | 98 | ASP | -1 | -0.763 | -0.884 | 52.659 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | H | 99 | LEU | 0 | 0.006 | 0.012 | 51.858 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | H | 100 | VAL | 0 | -0.049 | 0.008 | 47.023 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | H | 101 | VAL | 0 | 0.003 | 0.003 | 47.405 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | H | 102 | TYR | 0 | -0.023 | -0.019 | 49.809 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | H | 103 | GLY | 0 | 0.055 | 0.031 | 53.994 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | H | 104 | MET | 0 | -0.031 | 0.001 | 54.861 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | H | 105 | ASP | -1 | -0.680 | -0.786 | 57.474 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | H | 106 | VAL | 0 | -0.029 | 0.016 | 59.745 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | H | 107 | TRP | 0 | 0.016 | -0.003 | 60.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | H | 108 | GLY | 0 | 0.072 | 0.058 | 63.468 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | H | 109 | GLN | 0 | 0.053 | 0.024 | 66.077 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | H | 110 | GLY | 0 | -0.038 | -0.006 | 67.221 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | H | 111 | THR | 0 | -0.043 | -0.038 | 66.903 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | H | 112 | THR | 0 | -0.023 | -0.009 | 68.736 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | H | 113 | VAL | 0 | -0.014 | 0.006 | 66.833 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | H | 114 | THR | 0 | 0.004 | -0.012 | 70.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | H | 115 | VAL | 0 | 0.008 | 0.014 | 67.674 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | H | 116 | SER | 0 | 0.018 | 0.019 | 71.128 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | H | 117 | SER | 0 | 0.029 | 0.003 | 73.947 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | H | 118 | ALA | 0 | -0.020 | 0.024 | 75.925 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | H | 119 | SER | 0 | 0.003 | 0.005 | 78.920 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | H | 120 | THR | 0 | -0.028 | -0.021 | 81.778 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | H | 121 | LYS | 1 | 0.868 | 0.925 | 84.080 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | H | 122 | GLY | 0 | 0.066 | 0.037 | 86.749 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | H | 123 | PRO | 0 | -0.030 | 0.003 | 89.054 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | H | 124 | SER | 0 | 0.001 | 0.002 | 90.263 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | H | 125 | VAL | 0 | -0.004 | -0.006 | 92.051 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | H | 126 | PHE | 0 | 0.045 | 0.025 | 92.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | H | 127 | PRO | 0 | 0.059 | 0.037 | 95.830 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | H | 128 | LEU | 0 | -0.055 | 0.003 | 92.661 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | H | 129 | ALA | 0 | 0.031 | 0.015 | 97.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | H | 130 | PRO | 0 | -0.004 | 0.016 | 100.800 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | H | 131 | SER | 0 | 0.004 | 0.008 | 101.842 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | H | 132 | SER | 0 | 0.006 | -0.005 | 103.639 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | H | 133 | LYS | 1 | 0.814 | 0.894 | 103.019 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | H | 134 | SER | 0 | -0.032 | -0.014 | 104.493 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | H | 135 | THR | 0 | -0.020 | 0.002 | 103.248 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | H | 136 | SER | 0 | 0.015 | 0.025 | 100.703 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | H | 137 | GLY | 0 | 0.009 | 0.004 | 102.720 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | H | 138 | GLY | 0 | 0.030 | 0.030 | 104.953 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | H | 139 | THR | 0 | 0.010 | 0.017 | 99.148 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | H | 140 | ALA | 0 | 0.012 | 0.021 | 101.397 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | H | 141 | ALA | 0 | 0.004 | 0.013 | 96.594 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | H | 142 | LEU | 0 | 0.017 | 0.026 | 98.322 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | H | 143 | GLY | 0 | 0.043 | 0.000 | 95.359 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | H | 200 | CYS | 0 | -0.062 | 0.004 | 94.452 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | H | 145 | LEU | 0 | 0.031 | 0.040 | 89.278 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | H | 146 | VAL | 0 | -0.022 | -0.015 | 88.918 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | H | 147 | LYS | 1 | 0.891 | 0.917 | 86.789 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | H | 148 | ASP | -1 | -0.763 | -0.819 | 85.779 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | H | 149 | TYR | 0 | 0.026 | 0.035 | 83.322 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | H | 150 | PHE | 0 | 0.051 | 0.023 | 77.034 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | H | 151 | PRO | 0 | 0.027 | 0.031 | 79.284 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | H | 152 | GLU | -1 | -0.715 | -0.780 | 78.003 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | H | 153 | PRO | 0 | -0.003 | 0.008 | 80.802 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | H | 154 | VAL | 0 | -0.034 | -0.031 | 82.996 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | H | 155 | THR | 0 | -0.034 | -0.017 | 86.380 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | H | 156 | VAL | 0 | 0.005 | -0.010 | 89.079 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | H | 157 | SER | 0 | -0.010 | 0.025 | 91.873 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | H | 158 | TRP | 0 | 0.028 | 0.005 | 94.072 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | H | 159 | ASN | 0 | 0.000 | 0.000 | 97.766 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | H | 160 | SER | 0 | -0.018 | -0.016 | 99.258 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | H | 161 | GLY | 0 | -0.007 | 0.008 | 96.917 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | H | 162 | ALA | 0 | -0.012 | 0.001 | 97.867 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | H | 163 | LEU | 0 | -0.039 | 0.013 | 98.402 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | H | 164 | THR | 0 | 0.004 | -0.021 | 94.513 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | H | 165 | SER | 0 | 0.015 | 0.006 | 94.682 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | H | 166 | GLY | 0 | 0.059 | 0.030 | 94.804 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | H | 167 | VAL | 0 | -0.034 | 0.005 | 92.360 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | H | 168 | HIS | 0 | 0.016 | 0.041 | 89.125 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | H | 169 | THR | 0 | -0.003 | 0.001 | 87.060 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | H | 170 | PHE | 0 | -0.030 | 0.004 | 84.654 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | H | 171 | PRO | 0 | 0.011 | 0.007 | 79.749 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | H | 172 | ALA | 0 | -0.029 | 0.000 | 80.942 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | H | 173 | VAL | 0 | -0.014 | 0.006 | 79.705 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | H | 174 | LEU | 0 | -0.025 | -0.006 | 74.826 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | H | 175 | GLN | 0 | 0.004 | 0.002 | 78.825 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | H | 176 | SER | 0 | 0.023 | 0.009 | 77.622 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | H | 177 | SER | 0 | 0.008 | -0.007 | 78.192 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | H | 178 | GLY | 0 | 0.002 | 0.018 | 77.757 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | H | 179 | LEU | 0 | -0.055 | -0.004 | 78.671 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | H | 180 | TYR | 0 | -0.010 | -0.012 | 77.052 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | H | 181 | SER | 0 | -0.037 | -0.034 | 82.484 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | H | 182 | LEU | 0 | -0.029 | 0.003 | 84.052 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | H | 183 | SER | 0 | 0.048 | 0.025 | 86.383 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | H | 184 | SER | 0 | -0.007 | -0.004 | 88.678 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | H | 185 | VAL | 0 | 0.017 | -0.008 | 91.362 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | H | 186 | VAL | 0 | 0.020 | 0.009 | 93.847 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | H | 187 | THR | 0 | 0.003 | 0.028 | 95.336 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | H | 188 | VAL | 0 | -0.001 | 0.006 | 97.881 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | H | 189 | PRO | 0 | 0.053 | 0.021 | 101.577 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | H | 190 | SER | 0 | -0.007 | -0.012 | 104.724 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | H | 191 | SER | 0 | 0.011 | -0.003 | 106.231 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | H | 192 | SER | 0 | 0.012 | 0.019 | 105.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | H | 193 | LEU | 0 | -0.028 | -0.012 | 103.923 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | H | 194 | GLY | 0 | 0.003 | 0.010 | 107.661 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | H | 195 | THR | 0 | -0.026 | -0.016 | 110.413 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | H | 196 | GLN | 0 | -0.058 | -0.018 | 105.967 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | H | 197 | THR | 0 | 0.002 | 0.021 | 106.028 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | H | 198 | TYR | 0 | 0.021 | 0.018 | 101.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | H | 199 | ILE | 0 | 0.029 | 0.011 | 100.447 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | H | 201 | ASN | 0 | 0.019 | -0.005 | 96.361 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | H | 202 | VAL | 0 | 0.013 | 0.013 | 91.535 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | H | 203 | ASN | 0 | -0.045 | -0.039 | 90.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | H | 204 | HIS | 1 | 0.835 | 0.892 | 84.425 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | H | 205 | LYS | 1 | 1.032 | 1.003 | 86.765 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | H | 206 | PRO | 0 | 0.023 | 0.024 | 83.629 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | H | 207 | SER | 0 | -0.001 | 0.009 | 85.687 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | H | 208 | ASN | 0 | -0.051 | -0.037 | 88.759 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | H | 209 | THR | 0 | 0.011 | 0.048 | 91.125 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | H | 210 | LYS | 1 | 0.948 | 0.966 | 92.609 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | H | 211 | VAL | 0 | 0.020 | 0.009 | 95.255 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | H | 212 | ASP | -1 | -0.822 | -0.888 | 97.056 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | H | 213 | LYS | 1 | 0.832 | 0.933 | 98.119 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | H | 214 | LYS | 1 | 0.864 | 0.915 | 100.119 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | H | 215 | VAL | 0 | -0.043 | -0.022 | 98.931 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | H | 216 | GLU | -1 | -0.821 | -0.885 | 102.370 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | H | 217 | PRO | 0 | 0.028 | 0.029 | 104.571 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | L | 1 | GLU | -1 | -0.917 | -0.941 | 47.652 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | L | 2 | ILE | 0 | -0.027 | -0.011 | 46.645 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | L | 3 | VAL | 0 | 0.044 | 0.026 | 50.268 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | L | 4 | LEU | 0 | -0.034 | -0.022 | 53.993 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | L | 5 | THR | 0 | 0.011 | -0.009 | 56.604 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | L | 6 | GLN | 0 | -0.045 | -0.041 | 59.803 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | L | 7 | SER | 0 | -0.037 | 0.002 | 62.654 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | L | 8 | PRO | 0 | 0.071 | 0.039 | 65.392 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | L | 9 | GLY | 0 | 0.043 | 0.027 | 68.177 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | L | 10 | THR | 0 | 0.007 | -0.006 | 69.098 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | L | 11 | LEU | 0 | -0.029 | 0.002 | 70.032 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | L | 12 | SER | 0 | -0.035 | -0.037 | 73.192 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | L | 13 | ILE | 0 | -0.046 | -0.011 | 73.303 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | L | 14 | SER | 0 | 0.042 | 0.012 | 77.630 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | L | 15 | PRO | 0 | 0.001 | -0.020 | 79.007 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | L | 16 | GLY | 0 | -0.023 | -0.007 | 79.119 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | L | 17 | GLU | -1 | -0.820 | -0.871 | 76.930 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | L | 18 | ARG | 1 | 0.906 | 0.962 | 67.892 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | L | 19 | ALA | 0 | 0.010 | 0.001 | 71.369 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | L | 20 | THR | 0 | -0.002 | -0.010 | 66.103 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | L | 21 | LEU | 0 | -0.006 | 0.020 | 65.781 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | L | 22 | SER | 0 | 0.051 | 0.023 | 62.355 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | L | 89 | CYS | 0 | -0.055 | 0.001 | 58.441 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | L | 24 | ARG | 1 | 0.867 | 0.928 | 56.021 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | L | 25 | ALA | 0 | 0.031 | 0.026 | 51.948 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | L | 26 | SER | 0 | -0.012 | -0.020 | 51.262 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | L | 27 | GLN | 0 | -0.021 | -0.007 | 46.373 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | L | 28 | SER | 0 | -0.010 | -0.013 | 47.120 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | L | 29 | VAL | 0 | -0.018 | -0.005 | 46.530 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | L | 30 | SER | 0 | -0.014 | 0.008 | 45.162 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | L | 31 | SER | 0 | 0.104 | 0.019 | 47.239 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | L | 32 | SER | 0 | -0.049 | -0.010 | 46.718 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | L | 33 | TYR | 0 | -0.024 | -0.020 | 44.024 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | L | 34 | LEU | 0 | -0.046 | 0.006 | 50.330 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | L | 35 | ALA | 0 | -0.018 | -0.006 | 53.637 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | L | 36 | TRP | 0 | -0.002 | -0.013 | 56.867 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | L | 37 | TYR | 0 | -0.031 | -0.024 | 57.046 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | L | 38 | GLN | 0 | 0.014 | 0.003 | 63.366 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | L | 39 | GLN | 0 | 0.015 | -0.005 | 67.001 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | L | 40 | LYS | 1 | 0.875 | 0.961 | 69.123 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | L | 41 | PRO | 0 | 0.041 | 0.018 | 72.874 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | L | 42 | GLY | 0 | 0.003 | 0.013 | 74.719 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | L | 43 | GLN | 0 | -0.052 | -0.008 | 71.541 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | L | 44 | ALA | 0 | 0.067 | 0.039 | 66.779 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | L | 45 | PRO | 0 | -0.016 | -0.006 | 63.867 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | L | 46 | ARG | 1 | 0.878 | 0.951 | 65.121 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | L | 47 | LEU | 0 | -0.044 | 0.000 | 58.538 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | L | 48 | LEU | 0 | -0.010 | 0.002 | 62.419 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | L | 49 | ILE | 0 | -0.010 | 0.000 | 58.519 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | L | 50 | TYR | 0 | 0.024 | 0.016 | 54.500 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | L | 51 | GLY | 0 | 0.071 | 0.040 | 52.523 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | L | 52 | ALA | 0 | -0.010 | 0.012 | 53.439 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | L | 53 | SER | 0 | -0.049 | -0.023 | 55.410 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | L | 54 | SER | 0 | -0.004 | 0.012 | 55.414 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | L | 55 | ARG | 1 | 0.810 | 0.901 | 57.986 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | L | 56 | ALA | 0 | 0.000 | 0.011 | 60.819 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | L | 57 | THR | 0 | 0.004 | -0.029 | 61.337 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | L | 58 | GLY | 0 | -0.001 | -0.002 | 63.711 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | L | 59 | ILE | 0 | -0.081 | -0.016 | 64.806 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | L | 60 | PRO | 0 | 0.025 | 0.004 | 67.648 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | L | 61 | ASP | -1 | -0.786 | -0.896 | 67.985 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | L | 62 | ARG | 1 | 0.770 | 0.867 | 68.862 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | L | 63 | PHE | 0 | -0.014 | 0.018 | 66.294 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | L | 64 | SER | 0 | -0.005 | -0.009 | 63.607 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | L | 65 | GLY | 0 | 0.010 | 0.010 | 60.694 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | L | 66 | SER | 0 | -0.010 | -0.015 | 58.492 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | L | 67 | GLY | 0 | 0.082 | 0.050 | 56.872 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | L | 68 | SER | 0 | -0.019 | -0.011 | 51.456 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | L | 69 | GLY | 0 | 0.035 | 0.026 | 49.572 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | L | 70 | THR | 0 | -0.016 | -0.006 | 50.619 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | L | 71 | ASP | -1 | -0.807 | -0.842 | 52.864 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | L | 72 | PHE | 0 | -0.017 | 0.007 | 51.815 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | L | 73 | THR | 0 | 0.016 | -0.012 | 57.847 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | L | 74 | LEU | 0 | -0.010 | 0.018 | 61.219 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | L | 75 | THR | 0 | -0.010 | -0.015 | 63.732 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | L | 76 | ILE | 0 | 0.005 | 0.005 | 66.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | L | 77 | SER | 0 | -0.058 | -0.043 | 69.942 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | L | 78 | ARG | 1 | 0.853 | 0.909 | 71.495 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | L | 79 | LEU | 0 | -0.023 | 0.002 | 73.124 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | L | 80 | GLU | -1 | -0.791 | -0.879 | 75.766 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | L | 81 | PRO | 0 | 0.025 | 0.002 | 77.397 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | L | 82 | GLU | -1 | -0.785 | -0.874 | 75.528 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | L | 83 | ASP | -1 | -0.747 | -0.819 | 73.305 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | L | 84 | PHE | 0 | 0.000 | 0.028 | 73.521 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | L | 85 | ALA | 0 | -0.011 | 0.008 | 72.091 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | L | 86 | VAL | 0 | 0.007 | 0.016 | 68.015 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | L | 87 | TYR | 0 | -0.023 | -0.028 | 65.995 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | L | 88 | TYR | 0 | -0.010 | -0.003 | 62.115 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | L | 90 | GLN | 0 | -0.018 | -0.011 | 53.498 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | L | 91 | GLN | 0 | 0.038 | 0.012 | 48.777 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | L | 92 | TYR | 0 | 0.010 | 0.007 | 46.298 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | L | 93 | GLY | 0 | 0.077 | 0.049 | 46.302 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | L | 94 | SER | 0 | 0.003 | 0.008 | 43.979 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | L | 95 | SER | 0 | -0.057 | -0.021 | 45.448 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | L | 96 | PRO | 0 | 0.023 | 0.018 | 49.140 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | L | 97 | THR | 0 | -0.018 | 0.028 | 52.319 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | L | 98 | PHE | 0 | 0.038 | 0.002 | 54.477 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | L | 99 | GLY | 0 | 0.065 | 0.055 | 57.945 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | L | 100 | GLN | 0 | 0.018 | 0.017 | 59.962 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | L | 101 | GLY | 0 | 0.030 | 0.020 | 63.173 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | L | 102 | THR | 0 | -0.029 | -0.008 | 65.363 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | L | 103 | LYS | 1 | 0.850 | 0.936 | 67.899 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | L | 104 | LEU | 0 | -0.003 | 0.002 | 71.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | L | 105 | GLU | -1 | -0.747 | -0.776 | 73.411 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | L | 106 | ILE | 0 | 0.036 | 0.018 | 77.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | L | 107 | LYS | 1 | 0.885 | 0.949 | 79.749 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | L | 108 | ARG | 1 | 0.862 | 0.938 | 81.356 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | L | 109 | THR | 0 | 0.037 | 0.020 | 84.766 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | L | 110 | VAL | 0 | -0.022 | 0.001 | 85.324 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | L | 111 | ALA | 0 | -0.027 | -0.008 | 87.493 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | L | 112 | ALA | 0 | 0.052 | 0.031 | 88.847 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | L | 113 | PRO | 0 | -0.019 | 0.012 | 88.903 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | L | 114 | SER | 0 | -0.022 | -0.012 | 91.194 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | L | 115 | VAL | 0 | 0.016 | -0.002 | 91.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | L | 116 | PHE | 0 | -0.012 | 0.004 | 93.847 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | L | 117 | ILE | 0 | -0.005 | 0.015 | 93.953 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | L | 118 | PHE | 0 | 0.010 | 0.017 | 94.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | L | 119 | PRO | 0 | 0.034 | 0.033 | 95.267 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | L | 120 | PRO | 0 | -0.006 | 0.022 | 94.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | L | 121 | SER | 0 | 0.010 | 0.000 | 96.620 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | L | 122 | ASP | -1 | -0.788 | -0.901 | 99.038 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | L | 123 | GLU | -1 | -0.810 | -0.866 | 98.702 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | L | 124 | GLN | 0 | 0.008 | 0.006 | 91.413 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | L | 125 | LEU | 0 | 0.023 | 0.022 | 96.215 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | L | 126 | LYS | 1 | 0.799 | 0.887 | 98.209 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | L | 127 | SER | 0 | -0.079 | -0.041 | 94.491 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | L | 128 | GLY | 0 | 0.041 | 0.020 | 94.090 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | L | 129 | THR | 0 | -0.027 | -0.005 | 90.056 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | L | 130 | ALA | 0 | 0.013 | -0.001 | 92.001 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | L | 131 | SER | 0 | -0.001 | 0.000 | 89.203 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | L | 132 | VAL | 0 | -0.027 | 0.009 | 91.103 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | L | 133 | VAL | 0 | 0.018 | 0.007 | 90.102 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | L | 194 | CYS | 0 | -0.076 | -0.028 | 89.745 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | L | 135 | LEU | 0 | -0.026 | 0.005 | 89.610 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | L | 136 | LEU | 0 | 0.029 | 0.012 | 86.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | L | 137 | ASN | 0 | -0.012 | -0.018 | 89.132 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | L | 138 | ASN | 0 | 0.076 | 0.050 | 89.434 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | L | 139 | PHE | 0 | 0.003 | 0.022 | 83.706 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | L | 140 | TYR | 0 | 0.049 | -0.001 | 80.162 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | L | 141 | PRO | 0 | 0.048 | 0.021 | 80.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | L | 142 | ARG | 1 | 0.873 | 0.912 | 77.559 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | L | 143 | GLU | -1 | -0.878 | -0.897 | 78.547 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | L | 144 | ALA | 0 | 0.019 | 0.016 | 80.359 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | L | 145 | LYS | 1 | 0.862 | 0.940 | 81.549 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | L | 146 | VAL | 0 | 0.038 | 0.009 | 83.451 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | L | 147 | GLN | 0 | -0.049 | -0.006 | 84.336 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | L | 148 | TRP | 0 | 0.020 | 0.002 | 86.070 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | L | 149 | LYS | 1 | 0.827 | 0.910 | 88.247 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | L | 150 | VAL | 0 | -0.004 | 0.006 | 90.989 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | L | 151 | ASP | -1 | -0.738 | -0.865 | 93.082 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | L | 152 | ASN | 0 | -0.028 | -0.023 | 93.521 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | L | 153 | ALA | 0 | 0.026 | 0.035 | 89.703 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | L | 154 | LEU | 0 | 0.005 | -0.006 | 85.649 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | L | 155 | GLN | 0 | -0.012 | 0.010 | 86.037 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | L | 156 | SER | 0 | 0.021 | 0.004 | 79.775 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | L | 157 | GLY | 0 | 0.042 | 0.035 | 79.362 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | L | 158 | ASN | 0 | 0.030 | 0.024 | 80.271 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | L | 159 | SER | 0 | -0.013 | -0.014 | 82.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | L | 160 | GLN | 0 | 0.022 | 0.043 | 78.864 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | L | 161 | GLU | -1 | -0.786 | -0.854 | 80.623 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | L | 162 | SER | 0 | -0.026 | -0.009 | 80.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | L | 163 | VAL | 0 | -0.015 | -0.002 | 80.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | L | 164 | THR | 0 | 0.014 | 0.009 | 81.626 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | L | 165 | GLU | -1 | -0.751 | -0.792 | 77.924 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | L | 166 | GLN | 0 | -0.002 | 0.004 | 80.417 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | L | 167 | ASP | -1 | -0.742 | -0.832 | 82.515 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | L | 168 | SER | 0 | -0.012 | -0.002 | 85.233 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | L | 169 | LYS | 1 | 0.870 | 0.949 | 86.384 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | L | 170 | ASP | -1 | -0.783 | -0.852 | 89.200 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | L | 171 | SER | 0 | -0.014 | -0.004 | 84.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | L | 172 | THR | 0 | -0.093 | -0.061 | 84.663 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | L | 173 | TYR | 0 | -0.034 | -0.038 | 79.086 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | L | 174 | SER | 0 | 0.063 | 0.031 | 85.106 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | L | 175 | LEU | 0 | -0.042 | -0.018 | 82.784 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | L | 176 | SER | 0 | 0.032 | 0.018 | 85.594 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | L | 177 | SER | 0 | -0.027 | -0.005 | 84.817 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | L | 178 | THR | 0 | 0.035 | 0.007 | 85.647 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | L | 179 | LEU | 0 | 0.009 | 0.017 | 85.734 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | L | 180 | THR | 0 | -0.009 | -0.013 | 85.854 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | L | 181 | LEU | 0 | -0.026 | 0.000 | 87.221 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | L | 182 | SER | 0 | 0.014 | -0.002 | 89.724 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | L | 183 | LYS | 1 | 0.848 | 0.895 | 91.497 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | L | 184 | ALA | 0 | 0.022 | 0.007 | 93.609 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | L | 185 | ASP | -1 | -0.829 | -0.919 | 91.074 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | L | 186 | TYR | 0 | 0.044 | 0.015 | 93.309 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | L | 187 | GLU | -1 | -0.765 | -0.838 | 94.936 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | L | 188 | LYS | 1 | 0.841 | 0.936 | 91.331 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | L | 189 | HIS | 0 | -0.015 | 0.031 | 92.307 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | L | 190 | LYS | 1 | 0.880 | 0.932 | 97.592 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | L | 191 | VAL | 0 | -0.014 | -0.010 | 97.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | L | 192 | TYR | 0 | -0.015 | -0.001 | 93.236 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | L | 193 | ALA | 0 | 0.024 | -0.013 | 93.960 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | L | 195 | GLU | -1 | -0.782 | -0.855 | 88.205 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | L | 196 | VAL | 0 | 0.010 | 0.012 | 87.874 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | L | 197 | THR | 0 | 0.000 | -0.007 | 85.242 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | L | 198 | HIS | 0 | 0.031 | 0.003 | 84.902 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | L | 199 | GLN | 0 | 0.057 | 0.028 | 82.553 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | L | 200 | GLY | 0 | -0.032 | -0.021 | 85.964 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | L | 201 | LEU | 0 | -0.078 | -0.036 | 89.127 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | L | 202 | SER | 0 | 0.009 | 0.004 | 89.865 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | L | 203 | SER | 0 | -0.006 | -0.003 | 91.057 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | L | 204 | PRO | 0 | 0.037 | 0.020 | 88.652 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | L | 205 | VAL | 0 | 0.028 | 0.054 | 91.012 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | L | 206 | THR | 0 | -0.010 | -0.017 | 92.438 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | L | 207 | LYS | 1 | 0.845 | 0.945 | 94.578 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | L | 208 | SER | 0 | 0.003 | -0.016 | 95.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | L | 209 | PHE | 0 | 0.019 | 0.024 | 96.033 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | L | 210 | ASN | 0 | 0.008 | 0.005 | 99.532 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | L | 211 | ARG | 1 | 0.838 | 0.912 | 98.825 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | L | 212 | GLY | 0 | 0.029 | 0.018 | 101.679 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | L | 213 | GLU | -1 | -0.850 | -0.897 | 105.053 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | L | 214 | CYS | 0 | 0.025 | 0.036 | 105.942 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | E | 701 | HOH | 0 | -0.044 | -0.041 | 39.249 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | E | 702 | HOH | 0 | -0.023 | -0.031 | 12.282 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | E | 703 | HOH | 0 | -0.019 | -0.018 | 25.046 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | E | 704 | HOH | 0 | 0.034 | 0.017 | 31.789 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | E | 705 | HOH | 0 | -0.005 | -0.013 | 29.573 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | E | 706 | HOH | 0 | -0.010 | -0.026 | 40.393 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | E | 707 | HOH | 0 | -0.022 | -0.016 | 44.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | E | 708 | HOH | 0 | -0.024 | -0.034 | 32.931 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | E | 709 | HOH | 0 | -0.003 | -0.005 | 21.302 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | E | 710 | HOH | 0 | -0.001 | -0.008 | 47.264 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | E | 711 | HOH | 0 | -0.008 | -0.002 | 43.650 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | E | 712 | HOH | 0 | -0.021 | -0.026 | 33.422 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | E | 713 | HOH | 0 | 0.005 | 0.001 | 44.898 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | E | 714 | HOH | 0 | -0.009 | -0.027 | 47.930 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | E | 715 | HOH | 0 | -0.029 | -0.031 | 42.072 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | E | 716 | HOH | 0 | -0.005 | -0.017 | 25.227 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | E | 717 | HOH | 0 | -0.005 | -0.010 | 50.435 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | E | 718 | HOH | 0 | 0.016 | 0.006 | 32.732 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | E | 719 | HOH | 0 | 0.002 | -0.009 | 38.046 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | E | 720 | HOH | 0 | -0.001 | 0.004 | 32.648 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | E | 721 | HOH | 0 | -0.022 | -0.029 | 45.674 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | E | 722 | HOH | 0 | 0.002 | 0.001 | 47.612 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | E | 723 | HOH | 0 | 0.001 | 0.003 | 47.080 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | E | 724 | HOH | 0 | 0.018 | 0.011 | 44.290 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | E | 725 | HOH | 0 | 0.000 | -0.004 | 30.557 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | E | 726 | HOH | 0 | 0.017 | 0.020 | 31.201 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | E | 727 | HOH | 0 | -0.001 | -0.018 | 42.567 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | E | 728 | HOH | 0 | -0.019 | -0.029 | 33.695 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | E | 729 | HOH | 0 | -0.023 | -0.031 | 35.609 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | E | 730 | HOH | 0 | -0.030 | -0.024 | 36.908 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | E | 731 | HOH | 0 | -0.048 | -0.055 | 43.314 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | E | 732 | HOH | 0 | -0.019 | -0.016 | 34.065 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | E | 733 | HOH | 0 | -0.028 | -0.024 | 37.371 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | E | 734 | HOH | 0 | 0.005 | -0.014 | 32.771 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | E | 735 | HOH | 0 | -0.024 | -0.030 | 36.745 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | E | 736 | HOH | 0 | 0.011 | -0.003 | 45.642 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | E | 737 | HOH | 0 | 0.002 | -0.002 | 47.940 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | E | 738 | HOH | 0 | -0.020 | -0.013 | 39.641 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | E | 739 | HOH | 0 | -0.029 | -0.023 | 56.977 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | E | 740 | HOH | 0 | -0.025 | -0.017 | 32.970 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | E | 741 | HOH | 0 | -0.001 | -0.001 | 47.050 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | E | 742 | HOH | 0 | -0.002 | -0.014 | 35.822 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | E | 743 | HOH | 0 | -0.008 | -0.019 | 34.293 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | E | 744 | HOH | 0 | -0.028 | -0.042 | 13.842 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | E | 745 | HOH | 0 | -0.026 | -0.032 | 36.143 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | E | 746 | HOH | 0 | -0.027 | -0.036 | 41.562 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | E | 747 | HOH | 0 | -0.023 | -0.043 | 39.712 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | E | 748 | HOH | 0 | -0.013 | -0.015 | 22.902 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | E | 749 | HOH | 0 | -0.006 | -0.023 | 39.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | E | 750 | HOH | 0 | -0.048 | -0.028 | 44.909 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | E | 751 | HOH | 0 | -0.034 | -0.027 | 45.173 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | E | 752 | HOH | 0 | -0.004 | -0.010 | 24.428 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | E | 753 | HOH | 0 | 0.000 | -0.008 | 29.788 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | E | 754 | HOH | 0 | -0.014 | -0.011 | 37.301 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | E | 755 | HOH | 0 | -0.006 | -0.009 | 23.607 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | E | 756 | HOH | 0 | 0.008 | 0.003 | 46.016 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | E | 757 | HOH | 0 | -0.010 | -0.033 | 41.118 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | E | 758 | HOH | 0 | 0.038 | 0.022 | 47.892 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | E | 759 | HOH | 0 | -0.018 | -0.015 | 33.753 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | E | 760 | HOH | 0 | -0.019 | -0.020 | 32.005 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | E | 761 | HOH | 0 | 0.000 | -0.007 | 57.292 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | E | 762 | HOH | 0 | 0.032 | 0.020 | 35.920 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | E | 763 | HOH | 0 | -0.002 | 0.003 | 46.594 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | E | 764 | HOH | 0 | 0.001 | -0.013 | 24.043 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | E | 765 | HOH | 0 | -0.012 | -0.020 | 51.615 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | E | 766 | HOH | 0 | 0.016 | 0.001 | 42.599 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | E | 767 | HOH | 0 | 0.000 | 0.000 | 18.965 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | E | 768 | HOH | 0 | -0.007 | -0.006 | 41.816 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | E | 769 | HOH | 0 | -0.030 | -0.020 | 41.021 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | E | 770 | HOH | 0 | -0.009 | -0.014 | 37.383 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | E | 771 | HOH | 0 | -0.035 | -0.037 | 21.909 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | E | 772 | HOH | 0 | -0.042 | -0.033 | 59.504 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | E | 773 | HOH | 0 | -0.040 | -0.036 | 36.104 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | E | 774 | HOH | 0 | 0.005 | -0.002 | 43.669 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | E | 775 | HOH | 0 | 0.009 | -0.002 | 40.126 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | E | 776 | HOH | 0 | 0.020 | 0.013 | 42.481 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | E | 777 | HOH | 0 | -0.028 | -0.024 | 47.225 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | E | 778 | HOH | 0 | -0.015 | -0.022 | 43.544 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | E | 779 | HOH | 0 | -0.008 | -0.008 | 28.465 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | E | 780 | HOH | 0 | -0.003 | -0.012 | 31.645 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | E | 781 | HOH | 0 | -0.019 | -0.023 | 43.782 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | E | 782 | HOH | 0 | -0.019 | -0.022 | 51.689 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | E | 783 | HOH | 0 | -0.022 | -0.018 | 22.127 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | E | 784 | HOH | 0 | 0.016 | 0.006 | 34.145 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | E | 785 | HOH | 0 | -0.003 | -0.023 | 23.978 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | E | 786 | HOH | 0 | 0.006 | -0.002 | 50.948 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | E | 787 | HOH | 0 | 0.016 | 0.015 | 38.134 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | E | 788 | HOH | 0 | 0.007 | -0.010 | 43.670 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | E | 789 | HOH | 0 | 0.036 | 0.023 | 41.363 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | E | 790 | HOH | 0 | 0.015 | 0.006 | 47.080 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | E | 791 | HOH | 0 | -0.003 | -0.006 | 39.342 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | E | 792 | HOH | 0 | -0.043 | -0.031 | 29.414 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | E | 793 | HOH | 0 | -0.002 | -0.012 | 51.687 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | E | 794 | HOH | 0 | 0.013 | 0.005 | 47.173 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | E | 795 | HOH | 0 | 0.028 | 0.013 | 30.743 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | E | 796 | HOH | 0 | -0.029 | -0.020 | 31.437 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | E | 797 | HOH | 0 | 0.027 | 0.007 | 30.495 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | E | 798 | HOH | 0 | 0.025 | 0.002 | 48.940 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | E | 799 | HOH | 0 | -0.023 | -0.026 | 55.501 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | E | 800 | HOH | 0 | 0.028 | 0.018 | 59.970 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | E | 801 | HOH | 0 | 0.008 | -0.002 | 25.656 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | E | 802 | HOH | 0 | -0.023 | -0.033 | 41.484 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | E | 803 | HOH | 0 | 0.008 | -0.008 | 53.207 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | E | 804 | HOH | 0 | -0.035 | -0.031 | 30.902 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | E | 805 | HOH | 0 | -0.007 | -0.022 | 33.947 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | E | 806 | HOH | 0 | 0.026 | 0.009 | 47.320 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | E | 807 | HOH | 0 | 0.001 | 0.001 | 44.932 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | E | 808 | HOH | 0 | -0.021 | -0.018 | 55.929 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | E | 809 | HOH | 0 | -0.002 | -0.005 | 48.991 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | E | 810 | HOH | 0 | 0.020 | 0.018 | 22.003 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | E | 811 | HOH | 0 | 0.020 | 0.015 | 61.390 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | E | 812 | HOH | 0 | -0.016 | -0.013 | 37.460 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | E | 813 | HOH | 0 | -0.005 | -0.024 | 49.083 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | E | 814 | HOH | 0 | -0.018 | -0.014 | 55.780 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | E | 815 | HOH | 0 | 0.011 | -0.010 | 31.403 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | E | 816 | HOH | 0 | -0.064 | -0.044 | 13.667 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | E | 817 | HOH | 0 | 0.008 | 0.010 | 51.456 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | E | 818 | HOH | 0 | 0.025 | 0.004 | 42.222 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | E | 819 | HOH | 0 | -0.002 | 0.000 | 23.561 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | E | 820 | HOH | 0 | -0.028 | -0.023 | 37.890 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | E | 821 | HOH | 0 | -0.011 | -0.018 | 41.773 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | E | 822 | HOH | 0 | 0.003 | 0.001 | 39.654 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | E | 823 | HOH | 0 | -0.017 | -0.014 | 22.344 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | E | 824 | HOH | 0 | 0.001 | -0.007 | 41.496 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | E | 825 | HOH | 0 | 0.000 | 0.001 | 33.772 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | E | 826 | HOH | 0 | -0.011 | -0.013 | 38.531 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | E | 827 | HOH | 0 | 0.015 | 0.003 | 44.822 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | E | 828 | HOH | 0 | 0.013 | 0.012 | 39.702 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | E | 829 | HOH | 0 | 0.027 | 0.010 | 45.047 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | E | 830 | HOH | 0 | -0.003 | -0.011 | 39.791 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
748 | E | 831 | HOH | 0 | 0.011 | 0.003 | 41.042 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
749 | H | 301 | HOH | 0 | 0.007 | -0.006 | 104.514 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | H | 302 | HOH | 0 | 0.000 | -0.007 | 109.439 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | H | 303 | HOH | 0 | 0.014 | 0.004 | 109.414 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | H | 304 | HOH | 0 | 0.021 | 0.010 | 102.320 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | H | 305 | HOH | 0 | -0.008 | -0.018 | 76.925 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | H | 306 | HOH | 0 | -0.032 | -0.022 | 58.858 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | H | 307 | HOH | 0 | -0.009 | -0.026 | 81.574 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | H | 308 | HOH | 0 | 0.008 | -0.008 | 58.476 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | H | 309 | HOH | 0 | -0.005 | -0.014 | 67.756 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | H | 310 | HOH | 0 | -0.002 | -0.005 | 110.476 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | H | 311 | HOH | 0 | 0.003 | -0.002 | 56.742 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | H | 312 | HOH | 0 | 0.000 | -0.009 | 49.694 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | H | 313 | HOH | 0 | -0.009 | -0.004 | 67.677 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | H | 314 | HOH | 0 | -0.021 | -0.026 | 67.746 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | H | 315 | HOH | 0 | -0.038 | -0.025 | 63.633 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | H | 316 | HOH | 0 | -0.023 | -0.025 | 99.046 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | H | 317 | HOH | 0 | -0.016 | -0.011 | 56.857 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | H | 318 | HOH | 0 | 0.003 | -0.011 | 42.050 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | H | 319 | HOH | 0 | -0.008 | -0.015 | 61.209 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | H | 320 | HOH | 0 | 0.009 | -0.003 | 51.877 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | H | 321 | HOH | 0 | 0.001 | -0.018 | 76.571 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | H | 322 | HOH | 0 | -0.004 | -0.028 | 105.290 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | H | 323 | HOH | 0 | -0.001 | -0.007 | 51.861 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | H | 324 | HOH | 0 | -0.028 | -0.020 | 48.849 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | H | 325 | HOH | 0 | -0.031 | -0.020 | 57.231 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | H | 326 | HOH | 0 | 0.037 | 0.021 | 75.123 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | H | 327 | HOH | 0 | 0.016 | 0.004 | 60.286 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | H | 328 | HOH | 0 | 0.024 | 0.002 | 104.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | H | 329 | HOH | 0 | -0.007 | -0.003 | 51.009 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | H | 330 | HOH | 0 | -0.004 | -0.010 | 62.822 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | H | 331 | HOH | 0 | -0.013 | -0.018 | 52.666 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | H | 332 | HOH | 0 | -0.014 | -0.019 | 64.169 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | H | 333 | HOH | 0 | -0.015 | -0.026 | 68.816 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | H | 334 | HOH | 0 | -0.034 | -0.028 | 107.311 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | H | 335 | HOH | 0 | -0.025 | -0.022 | 64.518 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | H | 336 | HOH | 0 | 0.003 | -0.001 | 73.858 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | H | 337 | HOH | 0 | -0.006 | -0.015 | 63.329 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | H | 338 | HOH | 0 | 0.001 | -0.005 | 64.429 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | H | 339 | HOH | 0 | -0.005 | 0.004 | 56.119 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | H | 340 | HOH | 0 | 0.013 | -0.003 | 62.483 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | H | 341 | HOH | 0 | -0.012 | -0.023 | 68.212 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | H | 342 | HOH | 0 | -0.014 | -0.020 | 71.204 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | H | 343 | HOH | 0 | -0.034 | -0.032 | 50.815 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | H | 344 | HOH | 0 | 0.009 | 0.000 | 59.049 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | H | 345 | HOH | 0 | -0.020 | -0.022 | 89.540 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | H | 346 | HOH | 0 | -0.011 | -0.011 | 51.490 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | H | 347 | HOH | 0 | -0.027 | -0.020 | 59.073 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | H | 348 | HOH | 0 | -0.024 | -0.031 | 61.444 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | H | 349 | HOH | 0 | 0.014 | 0.008 | 64.885 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | H | 350 | HOH | 0 | -0.034 | -0.035 | 80.276 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | H | 351 | HOH | 0 | 0.002 | -0.017 | 93.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | H | 352 | HOH | 0 | 0.008 | -0.015 | 66.385 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | H | 353 | HOH | 0 | -0.013 | -0.013 | 85.053 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | H | 354 | HOH | 0 | -0.033 | -0.026 | 109.796 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | H | 355 | HOH | 0 | 0.009 | -0.015 | 46.024 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | H | 356 | HOH | 0 | -0.013 | -0.018 | 55.884 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | H | 357 | HOH | 0 | -0.013 | -0.010 | 75.694 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | H | 358 | HOH | 0 | -0.009 | -0.014 | 43.452 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | H | 359 | HOH | 0 | -0.024 | -0.014 | 54.478 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | H | 360 | HOH | 0 | -0.018 | -0.009 | 57.567 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | H | 361 | HOH | 0 | -0.003 | 0.005 | 71.886 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | H | 362 | HOH | 0 | -0.012 | -0.014 | 99.608 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | H | 363 | HOH | 0 | 0.009 | 0.007 | 92.790 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | H | 364 | HOH | 0 | -0.007 | 0.003 | 72.833 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | H | 365 | HOH | 0 | -0.029 | -0.027 | 76.517 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | H | 366 | HOH | 0 | -0.011 | -0.021 | 67.415 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | H | 367 | HOH | 0 | 0.012 | -0.003 | 65.487 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | H | 368 | HOH | 0 | -0.008 | -0.006 | 69.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | H | 369 | HOH | 0 | 0.007 | -0.008 | 94.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | H | 370 | HOH | 0 | -0.034 | -0.024 | 69.448 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | H | 371 | HOH | 0 | -0.021 | -0.018 | 72.857 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | H | 372 | HOH | 0 | -0.004 | -0.008 | 108.337 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | H | 373 | HOH | 0 | -0.009 | -0.012 | 52.092 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | H | 374 | HOH | 0 | 0.021 | 0.007 | 69.934 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | H | 375 | HOH | 0 | 0.003 | -0.007 | 54.409 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | H | 376 | HOH | 0 | -0.027 | -0.030 | 60.191 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | H | 377 | HOH | 0 | -0.019 | -0.016 | 56.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | H | 378 | HOH | 0 | -0.020 | -0.021 | 79.966 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | H | 379 | HOH | 0 | -0.022 | -0.019 | 77.835 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | H | 380 | HOH | 0 | 0.036 | 0.010 | 99.429 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | H | 381 | HOH | 0 | -0.001 | -0.013 | 75.095 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | H | 382 | HOH | 0 | -0.003 | -0.007 | 47.355 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | H | 383 | HOH | 0 | -0.004 | -0.004 | 103.364 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | H | 384 | HOH | 0 | -0.010 | -0.015 | 88.424 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | H | 385 | HOH | 0 | 0.009 | 0.000 | 49.683 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | H | 386 | HOH | 0 | -0.009 | -0.018 | 72.705 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | H | 387 | HOH | 0 | 0.024 | 0.013 | 76.999 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | H | 388 | HOH | 0 | 0.009 | 0.004 | 56.541 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | H | 389 | HOH | 0 | -0.015 | -0.020 | 70.783 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | H | 390 | HOH | 0 | -0.009 | -0.010 | 52.438 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | H | 391 | HOH | 0 | -0.009 | -0.017 | 57.013 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
840 | H | 392 | HOH | 0 | -0.042 | -0.040 | 50.045 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
841 | H | 393 | HOH | 0 | 0.014 | 0.001 | 71.129 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
842 | H | 394 | HOH | 0 | -0.013 | -0.009 | 82.318 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
843 | H | 395 | HOH | 0 | -0.004 | -0.013 | 80.035 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
844 | H | 396 | HOH | 0 | -0.073 | -0.069 | 97.672 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
845 | H | 397 | HOH | 0 | -0.035 | -0.039 | 63.600 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
846 | H | 398 | HOH | 0 | -0.020 | -0.011 | 46.981 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
847 | H | 399 | HOH | 0 | -0.002 | -0.006 | 64.273 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
848 | H | 400 | HOH | 0 | 0.005 | -0.005 | 56.890 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
849 | H | 401 | HOH | 0 | -0.013 | -0.010 | 75.551 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
850 | H | 402 | HOH | 0 | -0.004 | -0.016 | 94.994 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
851 | H | 403 | HOH | 0 | 0.025 | 0.007 | 75.848 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
852 | H | 404 | HOH | 0 | 0.005 | 0.000 | 58.513 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
853 | H | 405 | HOH | 0 | -0.056 | -0.042 | 44.055 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
854 | H | 406 | HOH | 0 | -0.007 | -0.014 | 48.658 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
855 | H | 407 | HOH | 0 | -0.032 | -0.021 | 60.339 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
856 | H | 408 | HOH | 0 | -0.016 | -0.008 | 78.103 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
857 | H | 409 | HOH | 0 | 0.014 | 0.004 | 71.070 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
858 | H | 410 | HOH | 0 | -0.010 | -0.010 | 75.160 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
859 | H | 411 | HOH | 0 | -0.024 | -0.015 | 94.343 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
860 | H | 412 | HOH | 0 | 0.006 | 0.004 | 73.393 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
861 | H | 413 | HOH | 0 | 0.004 | -0.014 | 89.130 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
862 | H | 414 | HOH | 0 | -0.021 | -0.019 | 90.900 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
863 | H | 415 | HOH | 0 | -0.018 | -0.022 | 63.375 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
864 | H | 416 | HOH | 0 | 0.019 | 0.005 | 52.288 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
865 | H | 417 | HOH | 0 | -0.013 | -0.015 | 70.805 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
866 | H | 418 | HOH | 0 | -0.021 | -0.020 | 62.133 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
867 | H | 419 | HOH | 0 | -0.027 | -0.023 | 67.364 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
868 | H | 420 | HOH | 0 | -0.023 | -0.019 | 66.296 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
869 | H | 421 | HOH | 0 | 0.002 | -0.002 | 90.440 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
870 | H | 422 | HOH | 0 | -0.002 | -0.006 | 63.055 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
871 | H | 423 | HOH | 0 | -0.003 | -0.006 | 90.997 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
872 | H | 424 | HOH | 0 | 0.017 | 0.005 | 45.138 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
873 | H | 425 | HOH | 0 | 0.000 | -0.005 | 80.926 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
874 | H | 426 | HOH | 0 | -0.036 | -0.037 | 104.295 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
875 | H | 427 | HOH | 0 | -0.008 | -0.019 | 69.351 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
876 | H | 428 | HOH | 0 | -0.002 | -0.010 | 104.170 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
877 | H | 429 | HOH | 0 | 0.008 | -0.012 | 68.446 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
878 | H | 430 | HOH | 0 | -0.030 | -0.022 | 47.874 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
879 | H | 431 | HOH | 0 | 0.001 | -0.001 | 65.780 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
880 | H | 432 | HOH | 0 | -0.005 | -0.012 | 83.230 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
881 | H | 433 | HOH | 0 | -0.016 | -0.018 | 72.807 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
882 | H | 434 | HOH | 0 | 0.009 | -0.008 | 56.502 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
883 | H | 435 | HOH | 0 | 0.000 | -0.008 | 87.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
884 | H | 436 | HOH | 0 | 0.015 | 0.012 | 106.891 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
885 | H | 437 | HOH | 0 | -0.028 | -0.023 | 63.477 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
886 | H | 438 | HOH | 0 | -0.023 | -0.025 | 102.870 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
887 | H | 439 | HOH | 0 | 0.006 | -0.004 | 55.135 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
888 | H | 440 | HOH | 0 | -0.022 | -0.022 | 90.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
889 | H | 441 | HOH | 0 | -0.006 | -0.011 | 96.522 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
890 | H | 442 | HOH | 0 | 0.004 | -0.006 | 84.686 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
891 | H | 443 | HOH | 0 | 0.005 | 0.007 | 55.501 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
892 | H | 444 | HOH | 0 | 0.009 | 0.001 | 103.178 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
893 | H | 445 | HOH | 0 | 0.010 | -0.005 | 71.132 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
894 | H | 446 | HOH | 0 | 0.038 | 0.018 | 72.184 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
895 | H | 447 | HOH | 0 | -0.032 | -0.023 | 72.424 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
896 | H | 448 | HOH | 0 | -0.016 | -0.025 | 83.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
897 | H | 449 | HOH | 0 | -0.004 | -0.011 | 73.513 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
898 | H | 450 | HOH | 0 | -0.006 | -0.014 | 64.516 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
899 | H | 451 | HOH | 0 | -0.010 | -0.007 | 56.161 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
900 | H | 452 | HOH | 0 | -0.019 | -0.014 | 74.222 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
901 | H | 453 | HOH | 0 | -0.019 | -0.012 | 91.636 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
902 | H | 454 | HOH | 0 | -0.006 | -0.024 | 101.084 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
903 | H | 455 | HOH | 0 | 0.001 | 0.000 | 69.473 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
904 | H | 456 | HOH | 0 | -0.027 | -0.015 | 82.106 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
905 | H | 457 | HOH | 0 | -0.011 | -0.007 | 69.458 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
906 | H | 458 | HOH | 0 | -0.020 | -0.019 | 50.273 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
907 | H | 459 | HOH | 0 | 0.013 | 0.001 | 62.282 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
908 | H | 460 | HOH | 0 | 0.034 | 0.017 | 104.474 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
909 | H | 461 | HOH | 0 | -0.003 | -0.012 | 75.199 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
910 | H | 462 | HOH | 0 | 0.024 | 0.021 | 51.732 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
911 | H | 463 | HOH | 0 | 0.009 | 0.004 | 77.110 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
912 | H | 464 | HOH | 0 | -0.009 | -0.003 | 106.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
913 | H | 465 | HOH | 0 | -0.021 | -0.015 | 71.555 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
914 | H | 466 | HOH | 0 | -0.013 | -0.007 | 47.141 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
915 | H | 467 | HOH | 0 | -0.010 | -0.008 | 76.367 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
916 | H | 468 | HOH | 0 | -0.017 | -0.013 | 70.611 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
917 | H | 469 | HOH | 0 | 0.007 | 0.003 | 78.442 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
918 | H | 470 | HOH | 0 | 0.012 | 0.004 | 58.898 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
919 | H | 471 | HOH | 0 | 0.005 | -0.003 | 101.103 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
920 | H | 472 | HOH | 0 | -0.012 | -0.019 | 49.734 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
921 | H | 473 | HOH | 0 | 0.019 | 0.012 | 57.063 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
922 | H | 474 | HOH | 0 | 0.003 | 0.004 | 73.096 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
923 | H | 475 | HOH | 0 | -0.012 | -0.015 | 50.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
924 | H | 476 | HOH | 0 | -0.019 | -0.024 | 50.178 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
925 | H | 477 | HOH | 0 | 0.036 | 0.022 | 56.503 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
926 | H | 478 | HOH | 0 | 0.015 | 0.006 | 69.242 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
927 | H | 479 | HOH | 0 | 0.008 | 0.007 | 47.402 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
928 | H | 480 | HOH | 0 | -0.023 | -0.007 | 65.447 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
929 | H | 481 | HOH | 0 | 0.030 | 0.026 | 74.368 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
930 | H | 482 | HOH | 0 | -0.009 | -0.012 | 98.944 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
931 | H | 483 | HOH | 0 | 0.008 | 0.009 | 58.917 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
932 | H | 484 | HOH | 0 | 0.019 | 0.027 | 42.935 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
933 | H | 485 | HOH | 0 | 0.001 | 0.006 | 49.965 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
934 | H | 486 | HOH | 0 | -0.013 | -0.020 | 80.011 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
935 | H | 487 | HOH | 0 | -0.021 | -0.019 | 68.500 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
936 | H | 488 | HOH | 0 | -0.018 | -0.036 | 101.399 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
937 | H | 489 | HOH | 0 | 0.026 | 0.014 | 48.807 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
938 | H | 490 | HOH | 0 | 0.021 | -0.002 | 56.866 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
939 | H | 491 | HOH | 0 | 0.009 | 0.005 | 56.766 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
940 | H | 492 | HOH | 0 | -0.017 | -0.022 | 65.626 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
941 | H | 493 | HOH | 0 | 0.018 | 0.012 | 46.309 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
942 | H | 494 | HOH | 0 | -0.016 | -0.026 | 72.521 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
943 | H | 495 | HOH | 0 | 0.001 | -0.001 | 60.134 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
944 | H | 496 | HOH | 0 | 0.010 | -0.001 | 75.443 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
945 | H | 497 | HOH | 0 | 0.015 | 0.011 | 43.881 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
946 | H | 498 | HOH | 0 | 0.017 | 0.008 | 57.112 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
947 | H | 499 | HOH | 0 | 0.026 | 0.024 | 70.905 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
948 | H | 500 | HOH | 0 | -0.030 | -0.019 | 101.334 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
949 | H | 501 | HOH | 0 | -0.034 | -0.032 | 70.432 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
950 | H | 502 | HOH | 0 | -0.036 | -0.026 | 71.328 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
951 | H | 503 | HOH | 0 | 0.001 | 0.000 | 51.652 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
952 | H | 504 | HOH | 0 | -0.013 | -0.018 | 56.569 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
953 | H | 505 | HOH | 0 | 0.024 | 0.000 | 103.828 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
954 | H | 506 | HOH | 0 | 0.024 | 0.006 | 76.531 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
955 | H | 507 | HOH | 0 | -0.007 | -0.010 | 64.193 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
956 | H | 508 | HOH | 0 | 0.004 | 0.002 | 52.781 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
957 | H | 509 | HOH | 0 | 0.007 | 0.005 | 101.682 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
958 | H | 510 | HOH | 0 | -0.026 | -0.017 | 58.161 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
959 | H | 511 | HOH | 0 | -0.024 | -0.011 | 102.544 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
960 | H | 512 | HOH | 0 | 0.020 | 0.013 | 107.647 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
961 | L | 301 | HOH | 0 | 0.005 | -0.015 | 80.760 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
962 | L | 302 | HOH | 0 | 0.008 | 0.007 | 62.504 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
963 | L | 303 | HOH | 0 | 0.007 | 0.006 | 49.481 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
964 | L | 304 | HOH | 0 | -0.041 | -0.041 | 46.614 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
965 | L | 305 | HOH | 0 | -0.058 | -0.061 | 82.184 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
966 | L | 306 | HOH | 0 | -0.023 | -0.027 | 78.675 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
967 | L | 307 | HOH | 0 | -0.009 | -0.003 | 54.126 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
968 | L | 308 | HOH | 0 | -0.012 | 0.007 | 83.790 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
969 | L | 309 | HOH | 0 | -0.034 | -0.026 | 62.041 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
970 | L | 310 | HOH | 0 | 0.031 | 0.018 | 77.333 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
971 | L | 311 | HOH | 0 | 0.015 | -0.003 | 76.345 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
972 | L | 312 | HOH | 0 | -0.009 | -0.012 | 48.854 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
973 | L | 313 | HOH | 0 | 0.018 | 0.009 | 93.513 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
974 | L | 314 | HOH | 0 | -0.021 | -0.027 | 86.832 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
975 | L | 315 | HOH | 0 | -0.025 | -0.023 | 79.318 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
976 | L | 316 | HOH | 0 | -0.010 | -0.023 | 61.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
977 | L | 317 | HOH | 0 | -0.037 | -0.042 | 83.705 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
978 | L | 318 | HOH | 0 | -0.005 | -0.018 | 76.141 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
979 | L | 319 | HOH | 0 | 0.017 | -0.003 | 47.518 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
980 | L | 320 | HOH | 0 | -0.026 | -0.016 | 84.095 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
981 | L | 321 | HOH | 0 | -0.032 | -0.024 | 92.241 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
982 | L | 322 | HOH | 0 | -0.025 | -0.018 | 76.015 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
983 | L | 323 | HOH | 0 | -0.020 | -0.020 | 78.383 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
984 | L | 324 | HOH | 0 | -0.004 | -0.014 | 44.212 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
985 | L | 325 | HOH | 0 | 0.004 | 0.008 | 69.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
986 | L | 326 | HOH | 0 | 0.007 | 0.000 | 78.192 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
987 | L | 327 | HOH | 0 | 0.013 | -0.004 | 67.178 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
988 | L | 328 | HOH | 0 | 0.014 | 0.028 | 84.247 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
989 | L | 329 | HOH | 0 | 0.013 | -0.010 | 78.395 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
990 | L | 330 | HOH | 0 | 0.007 | -0.004 | 94.626 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
991 | L | 331 | HOH | 0 | 0.015 | 0.006 | 69.072 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
992 | L | 332 | HOH | 0 | 0.010 | -0.001 | 47.881 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
993 | L | 333 | HOH | 0 | 0.002 | 0.000 | 63.458 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
994 | L | 334 | HOH | 0 | -0.009 | -0.015 | 101.333 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
995 | L | 335 | HOH | 0 | -0.044 | -0.044 | 101.015 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
996 | L | 336 | HOH | 0 | 0.005 | -0.006 | 94.855 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
997 | L | 337 | HOH | 0 | -0.005 | -0.017 | 63.995 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
998 | L | 338 | HOH | 0 | -0.013 | -0.021 | 60.643 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
999 | L | 339 | HOH | 0 | 0.006 | -0.003 | 76.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1000 | L | 340 | HOH | 0 | -0.016 | -0.025 | 55.550 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1001 | L | 341 | HOH | 0 | -0.012 | -0.011 | 51.052 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1002 | L | 342 | HOH | 0 | -0.043 | -0.030 | 100.575 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1003 | L | 343 | HOH | 0 | -0.018 | -0.022 | 94.066 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1004 | L | 344 | HOH | 0 | 0.012 | 0.003 | 44.991 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1005 | L | 345 | HOH | 0 | -0.013 | -0.008 | 58.363 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1006 | L | 346 | HOH | 0 | -0.006 | -0.009 | 91.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1007 | L | 347 | HOH | 0 | -0.005 | -0.010 | 65.316 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1008 | L | 348 | HOH | 0 | -0.008 | -0.012 | 67.561 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1009 | L | 349 | HOH | 0 | -0.050 | -0.044 | 55.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1010 | L | 350 | HOH | 0 | 0.011 | 0.000 | 64.089 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1011 | L | 351 | HOH | 0 | -0.010 | -0.041 | 73.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1012 | L | 352 | HOH | 0 | -0.017 | -0.017 | 67.859 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1013 | L | 353 | HOH | 0 | -0.042 | -0.032 | 55.656 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1014 | L | 354 | HOH | 0 | -0.047 | -0.042 | 79.774 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1015 | L | 355 | HOH | 0 | 0.023 | 0.016 | 53.630 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1016 | L | 356 | HOH | 0 | -0.038 | -0.031 | 94.305 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1017 | L | 357 | HOH | 0 | -0.008 | -0.007 | 82.422 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1018 | L | 358 | HOH | 0 | -0.017 | -0.029 | 98.501 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1019 | L | 359 | HOH | 0 | -0.059 | -0.051 | 86.895 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1020 | L | 360 | HOH | 0 | -0.014 | -0.015 | 101.195 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1021 | L | 361 | HOH | 0 | -0.013 | -0.016 | 100.526 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1022 | L | 362 | HOH | 0 | -0.013 | -0.016 | 51.525 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1023 | L | 363 | HOH | 0 | -0.006 | -0.008 | 85.200 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1024 | L | 364 | HOH | 0 | -0.017 | -0.019 | 80.611 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1025 | L | 365 | HOH | 0 | -0.018 | -0.013 | 91.517 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1026 | L | 366 | HOH | 0 | -0.004 | -0.009 | 69.611 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1027 | L | 367 | HOH | 0 | 0.020 | 0.004 | 77.078 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1028 | L | 368 | HOH | 0 | -0.005 | -0.016 | 82.546 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1029 | L | 369 | HOH | 0 | -0.003 | 0.002 | 98.105 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1030 | L | 370 | HOH | 0 | -0.035 | -0.034 | 69.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1031 | L | 371 | HOH | 0 | -0.025 | -0.046 | 79.086 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1032 | L | 372 | HOH | 0 | 0.032 | 0.016 | 78.614 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1033 | L | 373 | HOH | 0 | -0.040 | -0.039 | 58.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1034 | L | 374 | HOH | 0 | 0.012 | -0.004 | 84.120 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1035 | L | 375 | HOH | 0 | -0.038 | -0.030 | 53.155 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1036 | L | 376 | HOH | 0 | 0.007 | -0.020 | 103.598 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1037 | L | 377 | HOH | 0 | 0.025 | 0.015 | 75.480 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1038 | L | 378 | HOH | 0 | -0.028 | -0.041 | 52.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1039 | L | 379 | HOH | 0 | -0.019 | -0.015 | 67.332 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1040 | L | 380 | HOH | 0 | 0.008 | -0.006 | 97.789 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1041 | L | 381 | HOH | 0 | -0.001 | 0.003 | 87.288 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1042 | L | 382 | HOH | 0 | 0.024 | 0.016 | 65.782 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1043 | L | 383 | HOH | 0 | 0.056 | 0.040 | 88.256 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1044 | L | 384 | HOH | 0 | 0.013 | 0.000 | 81.617 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1045 | L | 385 | HOH | 0 | -0.005 | -0.003 | 53.165 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1046 | L | 386 | HOH | 0 | -0.007 | -0.011 | 46.702 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1047 | L | 387 | HOH | 0 | -0.015 | -0.015 | 98.128 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1048 | L | 388 | HOH | 0 | -0.015 | -0.027 | 72.401 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1049 | L | 389 | HOH | 0 | -0.008 | -0.015 | 98.349 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1050 | L | 390 | HOH | 0 | -0.008 | -0.009 | 84.072 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1051 | L | 391 | HOH | 0 | -0.006 | -0.009 | 86.099 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1052 | L | 392 | HOH | 0 | -0.041 | -0.040 | 86.097 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1053 | L | 393 | HOH | 0 | 0.006 | 0.003 | 71.160 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1054 | L | 394 | HOH | 0 | -0.012 | -0.011 | 79.948 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1055 | L | 395 | HOH | 0 | -0.001 | -0.009 | 60.129 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1056 | L | 396 | HOH | 0 | 0.031 | 0.013 | 98.711 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1057 | L | 397 | HOH | 0 | 0.001 | -0.005 | 96.495 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1058 | L | 398 | HOH | 0 | 0.010 | 0.000 | 50.035 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1059 | L | 399 | HOH | 0 | 0.016 | 0.007 | 103.004 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1060 | L | 400 | HOH | 0 | -0.023 | -0.027 | 101.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1061 | L | 401 | HOH | 0 | 0.024 | 0.018 | 85.597 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1062 | L | 402 | HOH | 0 | -0.010 | -0.012 | 87.377 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1063 | L | 403 | HOH | 0 | -0.057 | -0.053 | 90.832 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1064 | L | 404 | HOH | 0 | -0.023 | -0.024 | 81.688 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1065 | L | 405 | HOH | 0 | -0.014 | -0.019 | 92.990 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1066 | L | 406 | HOH | 0 | 0.026 | 0.002 | 51.325 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1067 | L | 407 | HOH | 0 | -0.013 | -0.007 | 79.317 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1068 | L | 408 | HOH | 0 | -0.039 | -0.035 | 75.406 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1069 | L | 409 | HOH | 0 | -0.003 | -0.011 | 98.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1070 | L | 410 | HOH | 0 | -0.031 | -0.030 | 67.562 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1071 | L | 411 | HOH | 0 | -0.012 | -0.005 | 78.660 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1072 | L | 412 | HOH | 0 | 0.027 | 0.012 | 54.239 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1073 | L | 413 | HOH | 0 | 0.028 | 0.012 | 59.404 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1074 | L | 414 | HOH | 0 | -0.048 | -0.046 | 72.942 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1075 | L | 415 | HOH | 0 | -0.013 | -0.015 | 93.769 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1076 | L | 416 | HOH | 0 | 0.002 | -0.002 | 99.186 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1077 | L | 417 | HOH | 0 | -0.009 | -0.006 | 78.481 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1078 | L | 418 | HOH | 0 | 0.023 | 0.000 | 86.986 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1079 | L | 419 | HOH | 0 | 0.030 | 0.027 | 71.363 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1080 | L | 420 | HOH | 0 | 0.003 | -0.005 | 78.491 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1081 | L | 421 | HOH | 0 | -0.004 | -0.011 | 49.283 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1082 | L | 422 | HOH | 0 | 0.003 | -0.007 | 66.988 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1083 | L | 423 | HOH | 0 | 0.008 | -0.003 | 73.011 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1084 | L | 424 | HOH | 0 | 0.015 | 0.001 | 91.320 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1085 | L | 425 | HOH | 0 | -0.022 | -0.018 | 99.972 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1086 | L | 426 | HOH | 0 | 0.006 | -0.009 | 99.799 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1087 | L | 427 | HOH | 0 | -0.026 | -0.025 | 85.393 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1088 | L | 428 | HOH | 0 | -0.015 | -0.013 | 79.346 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1089 | L | 429 | HOH | 0 | -0.020 | -0.016 | 84.422 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1090 | L | 430 | HOH | 0 | -0.003 | -0.016 | 77.579 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1091 | L | 431 | HOH | 0 | 0.017 | 0.000 | 102.405 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1092 | L | 432 | HOH | 0 | -0.009 | -0.013 | 97.191 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1093 | L | 433 | HOH | 0 | -0.003 | -0.001 | 69.661 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1094 | L | 434 | HOH | 0 | -0.015 | -0.017 | 81.468 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1095 | L | 435 | HOH | 0 | -0.017 | -0.012 | 60.482 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1096 | L | 436 | HOH | 0 | 0.026 | 0.011 | 42.577 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1097 | L | 437 | HOH | 0 | 0.030 | 0.017 | 79.081 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1098 | L | 438 | HOH | 0 | -0.014 | -0.020 | 84.372 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1099 | L | 439 | HOH | 0 | -0.010 | -0.009 | 70.672 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1100 | L | 440 | HOH | 0 | 0.003 | 0.000 | 51.398 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1101 | L | 441 | HOH | 0 | -0.032 | -0.030 | 85.066 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1102 | L | 442 | HOH | 0 | -0.014 | -0.004 | 66.228 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1103 | L | 443 | HOH | 0 | -0.020 | -0.009 | 82.583 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1104 | L | 444 | HOH | 0 | -0.001 | -0.008 | 99.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1105 | L | 445 | HOH | 0 | -0.021 | -0.017 | 68.970 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1106 | L | 446 | HOH | 0 | -0.002 | -0.003 | 65.213 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1107 | L | 447 | HOH | 0 | -0.026 | -0.022 | 83.228 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1108 | L | 448 | HOH | 0 | -0.020 | -0.033 | 76.205 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1109 | L | 449 | HOH | 0 | -0.010 | -0.019 | 80.969 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1110 | L | 450 | HOH | 0 | -0.030 | -0.027 | 76.667 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1111 | L | 451 | HOH | 0 | 0.011 | -0.008 | 100.341 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1112 | L | 452 | HOH | 0 | 0.035 | 0.027 | 88.235 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1113 | L | 453 | HOH | 0 | -0.023 | -0.021 | 62.265 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1114 | L | 454 | HOH | 0 | -0.012 | -0.005 | 101.636 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1115 | L | 455 | HOH | 0 | -0.041 | -0.033 | 71.299 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
1116 | L | 456 | HOH | 0 | 0.010 | 0.003 | 73.656 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |