FMODB ID: 7MJ4K
Calculation Name: 1NL3-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 1NL3
Chain ID: A
UniProt ID: P9WGP5
Base Structure: X-ray
Registration Date: 2023-09-26
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptHSide |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Auto-FMO protocol ver. 2.20220422 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 839 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -21696976.317343 |
---|---|
FMO2-HF: Nuclear repulsion | 21364531.814836 |
FMO2-HF: Total energy | -332444.502507 |
FMO2-MP2: Total energy | -333416.559927 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(A:-15:ASP)
Summations of interaction energy for
fragment #1(A:-15:ASP)
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. |
147.939 | 144.366 | 18.352 | -8.923 | -5.855 | 0.053 |
Interaction energy analysis for fragmet #1(A:-15:ASP)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | -13 | PRO | 0 | 0.014 | 0.006 | 3.799 | 0.634 | 2.954 | -0.045 | -1.096 | -1.179 | 0.003 |
4 | A | -12 | ASP | -1 | -0.749 | -0.875 | 7.157 | 25.980 | 25.980 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | -11 | LEU | 0 | -0.017 | -0.007 | 10.017 | -2.692 | -2.692 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | -10 | GLY | 0 | -0.002 | -0.004 | 13.077 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | -9 | THR | 0 | -0.013 | 0.016 | 11.244 | -0.531 | -0.531 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | -8 | LEU | 0 | 0.006 | 0.013 | 13.928 | 0.288 | 0.288 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | -7 | VAL | 0 | 0.034 | 0.012 | 13.330 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | -6 | PRO | 0 | -0.075 | -0.032 | 11.061 | 1.120 | 1.120 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | -5 | ARG | 1 | 0.939 | 0.956 | 7.394 | -23.970 | -23.970 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | -4 | GLY | 0 | 0.083 | 0.035 | 5.093 | -0.743 | -0.710 | -0.001 | -0.005 | -0.026 | 0.000 |
13 | A | -3 | SER | 0 | 0.028 | -0.009 | 1.722 | -24.155 | -30.298 | 18.398 | -7.753 | -4.503 | 0.050 |
14 | A | -2 | MET | 0 | -0.054 | -0.017 | 4.338 | -4.818 | -4.601 | 0.000 | -0.069 | -0.147 | 0.000 |
15 | A | -1 | ALA | 0 | 0.039 | 0.021 | 7.857 | -3.803 | -3.803 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 0 | ASP | -1 | -0.764 | -0.850 | 7.275 | 30.531 | 30.531 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 1 | ILE | 0 | -0.003 | 0.000 | 7.446 | -3.902 | -3.902 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 2 | LEU | 0 | -0.061 | -0.036 | 10.573 | -3.137 | -3.137 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 3 | SER | 0 | 0.063 | 0.022 | 12.234 | -2.441 | -2.441 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 4 | LYS | 1 | 0.795 | 0.877 | 9.948 | -31.458 | -31.458 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 5 | LEU | 0 | -0.065 | -0.042 | 14.356 | -1.732 | -1.732 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 6 | LEU | 0 | -0.008 | 0.013 | 16.431 | -1.368 | -1.368 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 7 | ARG | 1 | 0.954 | 0.968 | 18.612 | -15.679 | -15.679 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 8 | LEU | 0 | -0.046 | -0.020 | 18.623 | -0.679 | -0.679 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 9 | GLY | 0 | 0.005 | 0.011 | 21.726 | -0.348 | -0.348 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 10 | GLU | -1 | -0.782 | -0.875 | 20.120 | 14.414 | 14.414 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 11 | GLY | 0 | -0.006 | -0.006 | 21.794 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 12 | ARG | 1 | 0.804 | 0.886 | 17.092 | -16.400 | -16.400 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 13 | MET | 0 | 0.085 | 0.045 | 14.357 | -0.312 | -0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 14 | VAL | 0 | 0.049 | 0.027 | 17.957 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 15 | LYS | 1 | 0.872 | 0.934 | 20.341 | -14.623 | -14.623 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 16 | ARG | 1 | 0.757 | 0.848 | 12.364 | -23.181 | -23.181 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 17 | LEU | 0 | 0.017 | 0.018 | 18.071 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 18 | LYS | 1 | 0.854 | 0.896 | 20.145 | -12.098 | -12.098 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 19 | LYS | 1 | 0.944 | 0.970 | 19.319 | -15.836 | -15.836 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 20 | VAL | 0 | -0.001 | 0.005 | 17.633 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 21 | ALA | 0 | -0.007 | -0.006 | 20.708 | -0.390 | -0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 22 | ASP | -1 | -0.783 | -0.880 | 24.179 | 11.593 | 11.593 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 23 | TYR | 0 | 0.006 | 0.001 | 22.416 | -0.246 | -0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 24 | VAL | 0 | 0.032 | 0.035 | 23.111 | -0.305 | -0.305 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 25 | GLY | 0 | -0.004 | 0.009 | 25.558 | -0.430 | -0.430 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 26 | THR | 0 | -0.150 | -0.095 | 26.901 | -0.380 | -0.380 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 27 | LEU | 0 | 0.011 | 0.001 | 24.622 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 28 | SER | 0 | -0.062 | -0.048 | 29.162 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 29 | ASP | -1 | -0.799 | -0.886 | 32.241 | 8.534 | 8.534 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 30 | ASP | -1 | -0.907 | -0.956 | 31.284 | 9.445 | 9.445 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 31 | VAL | 0 | -0.025 | -0.017 | 30.415 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 32 | GLU | -1 | -0.893 | -0.906 | 33.480 | 8.439 | 8.439 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 33 | LYS | 1 | 0.734 | 0.851 | 35.429 | -9.052 | -9.052 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 34 | LEU | 0 | -0.052 | 0.008 | 32.953 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 35 | THR | 0 | -0.034 | -0.049 | 37.636 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 36 | ASP | -1 | -0.785 | -0.897 | 38.009 | 7.877 | 7.877 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 37 | ALA | 0 | -0.053 | -0.029 | 37.623 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 38 | GLU | -1 | -0.832 | -0.901 | 36.141 | 8.127 | 8.127 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 39 | LEU | 0 | -0.017 | 0.011 | 32.502 | 0.299 | 0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 40 | ARG | 1 | 0.940 | 0.973 | 32.819 | -7.966 | -7.966 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 41 | ALA | 0 | 0.000 | 0.004 | 32.847 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 42 | LYS | 1 | 0.830 | 0.910 | 27.450 | -10.473 | -10.473 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 43 | THR | 0 | 0.006 | -0.003 | 28.136 | 0.519 | 0.519 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 44 | ASP | -1 | -0.887 | -0.948 | 27.661 | 9.764 | 9.764 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 45 | GLU | -1 | -0.933 | -0.939 | 27.054 | 10.924 | 10.924 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 46 | PHE | 0 | 0.043 | 0.002 | 23.848 | 0.338 | 0.338 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 47 | LYS | 1 | 0.966 | 0.975 | 23.233 | -9.692 | -9.692 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 48 | ARG | 1 | 0.890 | 0.951 | 23.739 | -9.680 | -9.680 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 49 | ARG | 1 | 0.683 | 0.783 | 21.651 | -12.659 | -12.659 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 50 | LEU | 0 | -0.036 | -0.006 | 18.176 | 0.606 | 0.606 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 51 | ALA | 0 | -0.021 | -0.002 | 19.194 | 0.450 | 0.450 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 52 | ASP | -1 | -0.871 | -0.916 | 21.232 | 12.231 | 12.231 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 53 | GLN | 0 | 0.038 | -0.003 | 19.155 | 0.556 | 0.556 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 54 | LYS | 1 | 0.799 | 0.903 | 19.217 | -11.484 | -11.484 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 55 | ASN | 0 | -0.073 | -0.039 | 19.548 | 0.548 | 0.548 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 56 | PRO | 0 | 0.024 | 0.029 | 15.294 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 57 | GLU | -1 | -0.775 | -0.851 | 16.079 | 14.693 | 14.693 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 58 | THR | 0 | -0.039 | -0.058 | 11.411 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 59 | LEU | 0 | 0.050 | 0.006 | 14.835 | -0.419 | -0.419 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 60 | ASP | -1 | -0.866 | -0.938 | 11.529 | 21.884 | 21.884 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 61 | ASP | -1 | -0.843 | -0.876 | 14.287 | 19.804 | 19.804 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 62 | LEU | 0 | 0.067 | 0.040 | 16.668 | -0.748 | -0.748 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 63 | LEU | 0 | -0.047 | 0.005 | 17.643 | -0.658 | -0.658 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 64 | PRO | 0 | -0.043 | -0.039 | 18.997 | -0.682 | -0.682 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 65 | GLU | -1 | -0.751 | -0.870 | 22.238 | 11.561 | 11.561 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 66 | ALA | 0 | 0.037 | 0.024 | 22.782 | -0.532 | -0.532 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 67 | PHE | 0 | -0.003 | -0.025 | 21.268 | -0.357 | -0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 68 | ALA | 0 | 0.009 | 0.019 | 25.237 | -0.465 | -0.465 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 69 | VAL | 0 | 0.032 | 0.004 | 27.726 | -0.443 | -0.443 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 70 | ALA | 0 | 0.010 | 0.007 | 27.722 | -0.359 | -0.359 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 71 | ARG | 1 | 0.719 | 0.824 | 29.195 | -10.679 | -10.679 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 72 | GLU | -1 | -0.768 | -0.891 | 30.888 | 8.326 | 8.326 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 73 | ALA | 0 | 0.019 | 0.017 | 32.796 | -0.319 | -0.319 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 74 | ALA | 0 | 0.040 | 0.014 | 33.195 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 75 | TRP | 0 | -0.072 | -0.028 | 35.045 | -0.272 | -0.272 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 76 | ARG | 1 | 0.773 | 0.864 | 37.312 | -8.397 | -8.397 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 77 | VAL | 0 | -0.034 | -0.013 | 37.461 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 78 | LEU | 0 | -0.071 | -0.053 | 36.332 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 79 | ASP | -1 | -0.832 | -0.887 | 39.900 | 7.069 | 7.069 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 80 | GLN | 0 | -0.068 | -0.040 | 37.163 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 81 | ARG | 1 | 0.933 | 0.964 | 33.037 | -9.044 | -9.044 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 82 | PRO | 0 | -0.031 | 0.002 | 30.644 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 83 | PHE | 0 | 0.088 | 0.045 | 32.013 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 84 | ASP | -1 | -0.792 | -0.892 | 28.902 | 10.679 | 10.679 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 85 | VAL | 0 | -0.023 | -0.017 | 27.477 | 0.530 | 0.530 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 86 | GLN | 0 | 0.028 | 0.010 | 27.331 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 87 | VAL | 0 | 0.020 | 0.024 | 24.322 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 88 | MET | 0 | -0.069 | -0.031 | 23.085 | 0.434 | 0.434 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 89 | GLY | 0 | 0.013 | 0.000 | 22.298 | 0.664 | 0.664 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 90 | ALA | 0 | 0.035 | 0.020 | 22.936 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 91 | ALA | 0 | 0.003 | 0.007 | 18.963 | 0.491 | 0.491 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 92 | ALA | 0 | -0.005 | -0.021 | 18.507 | 0.842 | 0.842 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 93 | LEU | 0 | 0.002 | -0.002 | 18.739 | 0.583 | 0.583 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 94 | HIS | 0 | 0.033 | 0.032 | 14.928 | -0.734 | -0.734 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 95 | LEU | 0 | -0.064 | -0.041 | 12.976 | 0.640 | 0.640 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 96 | GLY | 0 | 0.003 | 0.025 | 14.612 | 1.118 | 1.118 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 97 | ASN | 0 | -0.092 | -0.034 | 15.684 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 98 | VAL | 0 | 0.031 | 0.005 | 18.832 | -0.661 | -0.661 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 99 | ALA | 0 | -0.004 | 0.005 | 22.510 | 0.263 | 0.263 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 100 | GLU | -1 | -0.736 | -0.871 | 24.005 | 10.532 | 10.532 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 101 | MET | 0 | -0.020 | -0.007 | 26.790 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 102 | LYS | 1 | 0.833 | 0.907 | 29.501 | -10.400 | -10.400 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 103 | THR | 0 | 0.046 | 0.006 | 33.096 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 104 | GLY | 0 | 0.055 | 0.029 | 35.987 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 105 | GLU | -1 | -0.884 | -0.947 | 32.113 | 9.226 | 9.226 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 106 | GLY | 0 | 0.019 | 0.017 | 33.030 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 107 | LYS | 1 | 0.736 | 0.835 | 30.491 | -9.344 | -9.344 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 108 | THR | 0 | 0.092 | 0.029 | 30.301 | 0.330 | 0.330 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 109 | LEU | 0 | 0.067 | 0.048 | 32.116 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 110 | THR | 0 | -0.018 | -0.015 | 26.818 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 111 | CYS | 0 | -0.031 | -0.023 | 26.505 | 0.329 | 0.329 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 112 | VAL | 0 | 0.023 | 0.019 | 26.719 | 0.264 | 0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 113 | LEU | 0 | 0.022 | 0.011 | 24.943 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 114 | PRO | 0 | -0.048 | -0.010 | 21.741 | 0.275 | 0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 115 | ALA | 0 | 0.047 | 0.025 | 22.353 | 0.424 | 0.424 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 116 | TYR | 0 | 0.041 | 0.000 | 24.853 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 117 | LEU | 0 | -0.035 | -0.013 | 18.510 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 118 | ASN | 0 | -0.041 | -0.055 | 18.323 | 0.872 | 0.872 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 119 | ALA | 0 | 0.029 | 0.027 | 21.070 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 120 | LEU | 0 | -0.049 | -0.015 | 22.298 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 121 | ALA | 0 | -0.051 | -0.023 | 19.473 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 122 | GLY | 0 | 0.015 | 0.017 | 21.278 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 123 | ASN | 0 | -0.018 | -0.016 | 19.739 | -0.627 | -0.627 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 124 | GLY | 0 | 0.031 | 0.038 | 23.577 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 125 | VAL | 0 | -0.056 | -0.029 | 23.158 | 0.561 | 0.561 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 126 | HIS | 0 | 0.063 | 0.049 | 25.025 | -0.259 | -0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 127 | ILE | 0 | -0.034 | -0.016 | 26.260 | 0.413 | 0.413 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 128 | VAL | 0 | 0.008 | 0.002 | 27.604 | -0.337 | -0.337 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 129 | THR | 0 | -0.016 | -0.010 | 30.250 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 130 | VAL | 0 | 0.051 | 0.008 | 33.444 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 131 | ASN | 0 | -0.022 | -0.011 | 35.915 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 132 | ASP | -1 | -0.711 | -0.860 | 38.169 | 7.815 | 7.815 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 133 | TYR | 0 | -0.039 | -0.012 | 40.048 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 134 | LEU | 0 | -0.007 | -0.022 | 37.363 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 135 | ALA | 0 | -0.001 | 0.028 | 35.925 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 136 | LYS | 1 | 0.924 | 0.931 | 36.895 | -6.953 | -6.953 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 137 | ARG | 1 | 0.831 | 0.912 | 38.035 | -7.882 | -7.882 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 138 | ASP | -1 | -0.820 | -0.913 | 34.751 | 8.514 | 8.514 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 139 | SER | 0 | -0.017 | -0.005 | 35.058 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 140 | GLU | -1 | -0.749 | -0.855 | 36.088 | 7.251 | 7.251 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 141 | TRP | 0 | -0.017 | -0.019 | 37.908 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 142 | MET | 0 | -0.028 | -0.013 | 33.352 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 143 | GLY | 0 | 0.004 | 0.007 | 34.517 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 144 | ARG | 1 | 0.831 | 0.913 | 35.530 | -7.518 | -7.518 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 145 | VAL | 0 | 0.005 | -0.003 | 32.549 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 146 | HIS | 0 | 0.011 | -0.002 | 28.506 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 147 | ARG | 1 | 0.927 | 0.992 | 32.729 | -7.932 | -7.932 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 148 | PHE | 0 | -0.024 | 0.000 | 35.102 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 149 | LEU | 0 | -0.016 | -0.004 | 29.982 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 150 | GLY | 0 | -0.038 | -0.004 | 32.147 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 151 | LEU | 0 | -0.070 | -0.019 | 27.944 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 152 | GLN | 0 | 0.008 | -0.005 | 32.062 | -0.328 | -0.328 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 153 | VAL | 0 | -0.044 | -0.030 | 32.129 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 154 | GLY | 0 | 0.032 | 0.021 | 33.222 | -0.267 | -0.267 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 155 | VAL | 0 | -0.025 | -0.023 | 34.314 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 156 | ILE | 0 | -0.019 | 0.010 | 33.149 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 157 | LEU | 0 | -0.029 | -0.036 | 36.931 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 158 | ALA | 0 | 0.028 | -0.001 | 39.980 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 159 | THR | 0 | -0.098 | -0.057 | 41.684 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 160 | MET | 0 | -0.054 | 0.017 | 38.860 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 161 | THR | 0 | 0.024 | -0.025 | 42.328 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 162 | PRO | 0 | 0.028 | -0.003 | 39.754 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 163 | ASP | -1 | -0.801 | -0.892 | 39.178 | 7.332 | 7.332 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 164 | GLU | -1 | -0.872 | -0.897 | 40.223 | 6.985 | 6.985 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 165 | ARG | 1 | 0.745 | 0.842 | 36.460 | -7.684 | -7.684 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 166 | ARG | 1 | 0.846 | 0.923 | 35.277 | -7.585 | -7.585 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 167 | VAL | 0 | -0.010 | -0.002 | 34.930 | 0.222 | 0.222 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 168 | ALA | 0 | -0.009 | 0.000 | 35.208 | 0.192 | 0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 169 | TYR | 0 | -0.037 | -0.060 | 30.413 | 0.430 | 0.430 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 170 | ASN | 0 | -0.013 | -0.004 | 30.481 | 0.555 | 0.555 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 171 | ALA | 0 | -0.047 | 0.005 | 31.331 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 172 | ASP | -1 | -0.842 | -0.908 | 28.218 | 10.232 | 10.232 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 173 | ILE | 0 | -0.062 | -0.033 | 27.253 | 0.424 | 0.424 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 174 | THR | 0 | 0.012 | 0.013 | 29.059 | -0.264 | -0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 175 | TYR | 0 | -0.009 | -0.011 | 30.171 | 0.340 | 0.340 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 176 | GLY | 0 | 0.094 | 0.024 | 32.612 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 177 | THR | 0 | 0.007 | 0.031 | 32.804 | 0.267 | 0.267 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 178 | ASN | 0 | -0.008 | -0.042 | 31.366 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 179 | ASN | 0 | -0.017 | -0.005 | 32.288 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 180 | GLU | -1 | -0.761 | -0.873 | 35.407 | 7.886 | 7.886 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 181 | PHE | 0 | -0.013 | -0.002 | 29.837 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 182 | GLY | 0 | 0.043 | 0.010 | 31.132 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 183 | PHE | 0 | -0.013 | -0.020 | 32.089 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 184 | ASP | -1 | -0.730 | -0.806 | 33.428 | 8.227 | 8.227 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 185 | TYR | 0 | 0.023 | 0.022 | 27.574 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 186 | LEU | 0 | -0.057 | -0.035 | 31.623 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 187 | ARG | 1 | 0.872 | 0.900 | 34.121 | -8.065 | -8.065 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 188 | ASP | -1 | -0.719 | -0.846 | 32.014 | 8.880 | 8.880 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 189 | ASN | 0 | -0.072 | -0.041 | 29.954 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 190 | MET | 0 | -0.046 | -0.033 | 33.759 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 191 | ALA | 0 | -0.021 | 0.018 | 36.396 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 192 | HIS | 0 | 0.002 | -0.015 | 38.158 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 193 | SER | 0 | -0.033 | -0.046 | 39.240 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 194 | LEU | 0 | 0.041 | 0.022 | 32.519 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 195 | ASP | -1 | -0.928 | -0.961 | 35.829 | 7.710 | 7.710 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 196 | ASP | -1 | -0.899 | -0.929 | 38.394 | 7.330 | 7.330 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 197 | LEU | 0 | -0.061 | -0.010 | 31.845 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 198 | VAL | 0 | -0.077 | -0.043 | 34.011 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 199 | GLN | 0 | -0.039 | -0.008 | 29.303 | 0.442 | 0.442 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 200 | ARG | 1 | 0.881 | 0.931 | 26.651 | -10.464 | -10.464 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 201 | GLY | 0 | 0.024 | 0.021 | 24.326 | 0.343 | 0.343 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 202 | HIS | 1 | 0.794 | 0.884 | 22.495 | -11.604 | -11.604 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 203 | HIS | 0 | 0.067 | 0.053 | 19.795 | 0.649 | 0.649 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 204 | TYR | 0 | -0.027 | -0.044 | 19.042 | 0.643 | 0.643 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 205 | ALA | 0 | 0.027 | 0.026 | 20.994 | -0.638 | -0.638 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 206 | ILE | 0 | -0.045 | -0.013 | 22.520 | 0.513 | 0.513 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 207 | VAL | 0 | 0.028 | -0.010 | 24.650 | -0.507 | -0.507 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 208 | ASP | -1 | -0.761 | -0.889 | 26.924 | 9.994 | 9.994 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 209 | GLU | -1 | -0.877 | -0.927 | 29.839 | 8.815 | 8.815 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 210 | VAL | 0 | 0.058 | 0.026 | 25.051 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 211 | ASP | -1 | -0.824 | -0.877 | 28.505 | 9.699 | 9.699 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 212 | SER | 0 | -0.023 | -0.018 | 30.367 | -0.255 | -0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 213 | ILE | 0 | 0.023 | 0.016 | 29.724 | -0.169 | -0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 214 | LEU | 0 | 0.012 | 0.015 | 24.471 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 215 | ILE | 0 | -0.024 | -0.003 | 27.034 | 0.159 | 0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 216 | ASP | -1 | -0.841 | -0.893 | 30.584 | 8.843 | 8.843 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 217 | GLU | -1 | -0.841 | -0.916 | 33.495 | 8.570 | 8.570 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 218 | ALA | 0 | 0.011 | 0.015 | 30.231 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 219 | ARG | 1 | 0.771 | 0.870 | 32.251 | -8.282 | -8.282 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 220 | THR | 0 | -0.017 | 0.000 | 35.183 | -0.180 | -0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 221 | PRO | 0 | -0.017 | -0.008 | 34.358 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 222 | LEU | 0 | -0.007 | 0.025 | 32.530 | -0.170 | -0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 223 | ILE | 0 | 0.020 | -0.013 | 36.048 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 224 | ILE | 0 | 0.018 | 0.016 | 37.834 | -0.143 | -0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 225 | SER | 0 | 0.011 | -0.002 | 40.668 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 226 | GLY | 0 | -0.009 | -0.007 | 43.888 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 227 | PRO | 0 | 0.007 | 0.021 | 46.767 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 228 | ALA | 0 | 0.006 | -0.013 | 47.803 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 229 | ASP | -1 | -0.993 | -0.988 | 48.354 | 6.178 | 6.178 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 230 | GLY | 0 | -0.010 | 0.009 | 50.528 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 231 | ALA | 0 | 0.047 | 0.038 | 51.486 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 232 | SER | 0 | 0.016 | -0.016 | 53.564 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 233 | ASN | 0 | 0.000 | 0.007 | 56.340 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 234 | TRP | 0 | 0.079 | 0.038 | 54.725 | -0.116 | -0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 235 | TYR | 0 | 0.030 | 0.012 | 50.895 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 236 | THR | 0 | -0.041 | -0.026 | 57.645 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 237 | GLU | -1 | -0.805 | -0.908 | 60.950 | 4.776 | 4.776 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 238 | PHE | 0 | 0.025 | -0.001 | 57.651 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 239 | ALA | 0 | -0.022 | -0.003 | 61.033 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 240 | ARG | 1 | 0.793 | 0.890 | 62.522 | -4.756 | -4.756 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 241 | LEU | 0 | -0.005 | -0.011 | 62.555 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 242 | ALA | 0 | 0.028 | 0.021 | 62.142 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 243 | PRO | 0 | -0.057 | -0.029 | 64.169 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 244 | LEU | 0 | -0.052 | -0.018 | 67.651 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 245 | MET | 0 | -0.029 | 0.021 | 62.878 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 246 | GLU | -1 | -0.939 | -0.990 | 67.757 | 4.351 | 4.351 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 247 | LYS | 1 | 0.821 | 0.902 | 65.235 | -4.751 | -4.751 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 248 | ASP | -1 | -0.859 | -0.916 | 66.239 | 4.658 | 4.658 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 249 | VAL | 0 | -0.051 | -0.011 | 67.700 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 250 | HIS | 0 | 0.009 | -0.001 | 65.677 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 251 | TYR | 0 | -0.027 | -0.032 | 61.710 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 252 | GLU | -1 | -0.870 | -0.918 | 61.701 | 4.966 | 4.966 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 253 | VAL | 0 | -0.037 | -0.025 | 59.995 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 254 | ASP | -1 | -0.727 | -0.862 | 56.602 | 5.531 | 5.531 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 255 | LEU | 0 | -0.063 | -0.064 | 57.501 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 256 | ARG | 1 | 0.857 | 0.934 | 56.752 | -5.241 | -5.241 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 257 | LYS | 1 | 0.983 | 0.998 | 51.528 | -5.950 | -5.950 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 258 | ARG | 1 | 0.807 | 0.915 | 52.348 | -5.507 | -5.507 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 259 | THR | 0 | 0.050 | 0.028 | 52.812 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 260 | VAL | 0 | -0.023 | -0.020 | 54.936 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 261 | GLY | 0 | 0.047 | 0.033 | 56.036 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 262 | VAL | 0 | -0.042 | -0.025 | 58.057 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 263 | HIS | 0 | 0.047 | 0.011 | 60.272 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 264 | GLU | -1 | -0.821 | -0.919 | 62.715 | 4.984 | 4.984 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 265 | LYS | 1 | 0.959 | 0.992 | 63.940 | -4.432 | -4.432 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 266 | GLY | 0 | 0.017 | -0.005 | 64.142 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 267 | VAL | 0 | -0.034 | -0.015 | 59.908 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 268 | GLU | -1 | -0.840 | -0.916 | 62.351 | 4.590 | 4.590 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 269 | PHE | 0 | -0.067 | -0.034 | 65.374 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 270 | VAL | 0 | -0.024 | -0.038 | 60.659 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 271 | GLU | -1 | -0.826 | -0.922 | 60.512 | 5.134 | 5.134 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 272 | ASP | -1 | -0.905 | -0.948 | 63.839 | 4.539 | 4.539 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 273 | GLN | 0 | -0.158 | -0.080 | 65.916 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 274 | LEU | 0 | -0.061 | -0.027 | 60.578 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 275 | GLY | 0 | -0.068 | -0.013 | 64.533 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 276 | ILE | 0 | -0.128 | -0.062 | 59.929 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 277 | ASP | -1 | -0.912 | -0.956 | 61.558 | 4.819 | 4.819 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 278 | ASN | 0 | 0.016 | 0.004 | 55.969 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 279 | LEU | 0 | -0.014 | -0.009 | 56.659 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 280 | TYR | 0 | -0.043 | -0.026 | 49.566 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 281 | GLU | -1 | -0.757 | -0.871 | 53.291 | 5.289 | 5.289 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 282 | ALA | 0 | -0.008 | 0.013 | 55.190 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 283 | ALA | 0 | 0.033 | -0.003 | 50.536 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 284 | ASN | 0 | -0.012 | -0.008 | 47.629 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 285 | SER | 0 | 0.000 | 0.003 | 50.104 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 286 | PRO | 0 | 0.004 | 0.039 | 49.138 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 287 | LEU | 0 | 0.024 | -0.015 | 51.489 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 288 | VAL | 0 | 0.017 | 0.022 | 52.485 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 289 | SER | 0 | 0.003 | -0.014 | 48.974 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 290 | TYR | 0 | -0.032 | -0.024 | 50.526 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 291 | LEU | 0 | 0.036 | 0.037 | 54.576 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 292 | ASN | 0 | 0.008 | -0.007 | 53.601 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 293 | ASN | 0 | 0.020 | -0.012 | 50.690 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 294 | ALA | 0 | 0.028 | 0.029 | 54.932 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 295 | LEU | 0 | 0.012 | 0.015 | 58.524 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 296 | LYS | 1 | 0.927 | 0.970 | 51.277 | -6.100 | -6.100 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 297 | ALA | 0 | -0.016 | -0.006 | 57.345 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 298 | LYS | 1 | 0.756 | 0.878 | 58.483 | -4.839 | -4.839 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 299 | GLU | -1 | -0.836 | -0.904 | 60.744 | 4.844 | 4.844 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 300 | LEU | 0 | -0.085 | -0.034 | 55.942 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 301 | PHE | 0 | -0.006 | 0.003 | 52.882 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 302 | SER | 0 | -0.044 | -0.033 | 58.903 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 303 | ARG | 1 | 0.892 | 0.944 | 61.330 | -4.788 | -4.788 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 304 | ASP | -1 | -0.984 | -1.014 | 62.840 | 4.800 | 4.800 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 305 | LYS | 1 | 0.839 | 0.929 | 61.489 | -4.956 | -4.956 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 306 | ASP | -1 | -0.804 | -0.897 | 56.887 | 5.521 | 5.521 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 307 | TYR | 0 | -0.043 | -0.046 | 57.047 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 308 | ILE | 0 | -0.011 | 0.005 | 58.868 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 309 | VAL | 0 | 0.046 | 0.025 | 60.205 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 310 | ARG | 1 | 0.798 | 0.891 | 61.563 | -5.043 | -5.043 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 311 | ASP | -1 | -0.902 | -0.962 | 61.811 | 4.897 | 4.897 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 312 | GLY | 0 | 0.023 | 0.022 | 61.647 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 313 | GLU | -1 | -0.856 | -0.905 | 55.982 | 5.683 | 5.683 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 314 | VAL | 0 | 0.014 | 0.006 | 55.935 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 315 | LEU | 0 | -0.047 | -0.032 | 55.665 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 316 | ILE | 0 | 0.066 | 0.035 | 51.373 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 317 | VAL | 0 | -0.051 | -0.032 | 55.398 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 318 | ASP | -1 | -0.887 | -0.932 | 55.237 | 5.795 | 5.795 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 319 | GLU | -1 | -0.892 | -0.941 | 56.242 | 5.401 | 5.401 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 320 | PHE | 0 | -0.066 | -0.048 | 58.169 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 321 | THR | 0 | -0.072 | -0.032 | 57.018 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 322 | GLY | 0 | 0.000 | 0.003 | 59.468 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 323 | ARG | 1 | 0.907 | 0.955 | 53.502 | -5.850 | -5.850 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 324 | VAL | 0 | 0.050 | 0.009 | 56.349 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 325 | LEU | 0 | -0.061 | -0.013 | 51.530 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 326 | ILE | 0 | 0.020 | 0.006 | 52.126 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 327 | GLY | 0 | -0.040 | -0.021 | 49.052 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 328 | ARG | 1 | 0.899 | 0.941 | 47.049 | -6.543 | -6.543 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 329 | ARG | 1 | 0.920 | 0.956 | 47.898 | -6.400 | -6.400 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 330 | TYR | 0 | 0.014 | -0.003 | 48.778 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 331 | ASN | 0 | 0.035 | 0.016 | 44.418 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 332 | GLU | -1 | -0.889 | -0.956 | 44.640 | 6.764 | 6.764 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 333 | GLY | 0 | 0.054 | 0.037 | 46.975 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 334 | MET | 0 | -0.036 | -0.014 | 50.055 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 335 | HIS | 0 | -0.070 | -0.010 | 51.092 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 336 | GLN | 0 | 0.074 | 0.021 | 49.311 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 337 | ALA | 0 | -0.028 | 0.003 | 54.137 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 338 | ILE | 0 | -0.020 | -0.017 | 55.051 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 339 | GLU | -1 | -0.860 | -0.953 | 55.048 | 5.625 | 5.625 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 340 | ALA | 0 | 0.005 | 0.001 | 58.394 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 341 | LYS | 1 | 0.838 | 0.923 | 60.182 | -5.248 | -5.248 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 342 | GLU | -1 | -0.880 | -0.909 | 61.648 | 4.872 | 4.872 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 343 | HIS | 0 | -0.076 | -0.032 | 63.581 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 344 | VAL | 0 | -0.052 | -0.016 | 59.862 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 345 | GLU | -1 | -0.959 | -0.977 | 61.555 | 4.951 | 4.951 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 346 | ILE | 0 | 0.007 | 0.000 | 55.114 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 347 | LYS | 1 | 0.834 | 0.911 | 56.617 | -5.540 | -5.540 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 348 | ALA | 0 | -0.001 | 0.001 | 54.757 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 349 | GLU | -1 | -0.905 | -0.951 | 50.595 | 5.874 | 5.874 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 350 | ASN | 0 | -0.070 | -0.054 | 48.110 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 351 | GLN | 0 | -0.027 | -0.030 | 43.186 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 352 | THR | 0 | -0.079 | -0.088 | 38.784 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 353 | LEU | 0 | -0.057 | -0.016 | 40.821 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 354 | ALA | 0 | 0.037 | 0.011 | 35.655 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 355 | THR | 0 | 0.025 | 0.001 | 34.434 | -0.177 | -0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 356 | ILE | 0 | -0.052 | -0.006 | 27.576 | 0.242 | 0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 357 | THR | 0 | -0.021 | -0.023 | 29.425 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 358 | LEU | 0 | 0.076 | 0.033 | 29.447 | 0.276 | 0.276 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 359 | GLN | 0 | -0.001 | -0.006 | 26.188 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 360 | ASN | 0 | -0.019 | -0.045 | 24.866 | 0.966 | 0.966 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 361 | TYR | 0 | -0.018 | 0.011 | 25.095 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 362 | PHE | 0 | 0.019 | -0.030 | 24.022 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 363 | ARG | 1 | 0.762 | 0.854 | 20.788 | -12.482 | -12.482 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 364 | LEU | 0 | -0.088 | -0.026 | 19.964 | 0.516 | 0.516 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 365 | TYR | 0 | -0.056 | -0.039 | 20.286 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 366 | ASP | -1 | -0.882 | -0.917 | 15.369 | 16.136 | 16.136 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 367 | LYS | 1 | 0.768 | 0.873 | 14.800 | -16.373 | -16.373 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 368 | LEU | 0 | 0.008 | -0.004 | 16.912 | -0.970 | -0.970 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 369 | ALA | 0 | 0.005 | 0.002 | 18.773 | 0.683 | 0.683 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 370 | GLY | 0 | 0.011 | 0.002 | 21.210 | -0.570 | -0.570 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 371 | MET | 0 | -0.021 | 0.002 | 24.618 | 0.249 | 0.249 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 372 | THR | 0 | -0.021 | -0.038 | 27.414 | -0.390 | -0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 373 | GLY | 0 | 0.045 | 0.041 | 29.577 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 374 | THR | 0 | -0.121 | -0.070 | 31.325 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 375 | ALA | 0 | 0.070 | 0.028 | 26.130 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 376 | GLN | 0 | -0.074 | -0.041 | 23.987 | 0.299 | 0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 377 | THR | 0 | -0.080 | -0.062 | 27.384 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 378 | GLU | -1 | -0.764 | -0.870 | 27.734 | 9.829 | 9.829 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 379 | ALA | 0 | -0.018 | 0.000 | 23.313 | 0.352 | 0.352 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 380 | ALA | 0 | -0.039 | -0.025 | 23.131 | 0.551 | 0.551 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 381 | GLU | -1 | -0.757 | -0.876 | 23.428 | 11.094 | 11.094 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 382 | LEU | 0 | 0.024 | 0.004 | 22.766 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 383 | HIS | 0 | -0.009 | 0.008 | 15.907 | 0.312 | 0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 384 | GLU | -1 | -0.931 | -0.992 | 19.256 | 15.305 | 15.305 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 385 | ILE | 0 | -0.034 | 0.004 | 20.863 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 386 | TYR | 0 | -0.004 | -0.032 | 20.468 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 387 | LYS | 1 | 0.813 | 0.936 | 15.191 | -16.127 | -16.127 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 388 | LEU | 0 | 0.041 | 0.041 | 16.440 | 0.581 | 0.581 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 389 | GLY | 0 | 0.003 | 0.001 | 18.041 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 390 | VAL | 0 | -0.002 | -0.013 | 18.890 | -0.490 | -0.490 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 391 | VAL | 0 | -0.005 | 0.003 | 19.178 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 392 | SER | 0 | -0.019 | -0.009 | 21.948 | -0.335 | -0.335 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 393 | ILE | 0 | -0.073 | -0.021 | 23.023 | 0.276 | 0.276 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 394 | PRO | 0 | -0.035 | -0.014 | 26.317 | -0.324 | -0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 395 | THR | 0 | -0.007 | -0.030 | 29.254 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 396 | ASN | 0 | -0.068 | -0.036 | 32.473 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 397 | MET | 0 | -0.001 | 0.019 | 34.129 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 398 | PRO | 0 | -0.016 | -0.010 | 36.597 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 399 | MET | 0 | -0.028 | 0.000 | 37.023 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 400 | ILE | 0 | 0.019 | -0.001 | 38.961 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 401 | ARG | 1 | 0.792 | 0.872 | 38.949 | -8.043 | -8.043 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 402 | GLU | -1 | -0.920 | -0.965 | 43.187 | 6.965 | 6.965 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 403 | ASP | -1 | -0.847 | -0.867 | 41.359 | 7.606 | 7.606 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 404 | GLN | 0 | -0.026 | -0.025 | 44.788 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 405 | SER | 0 | -0.004 | -0.012 | 47.131 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 406 | ASP | -1 | -0.826 | -0.929 | 47.016 | 6.892 | 6.892 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 407 | LEU | 0 | 0.030 | 0.043 | 49.731 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 408 | ILE | 0 | -0.042 | -0.018 | 50.808 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 409 | TYR | 0 | 0.033 | 0.011 | 54.467 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 410 | LYS | 1 | 0.827 | 0.899 | 57.463 | -4.942 | -4.942 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 411 | THR | 0 | 0.015 | -0.010 | 60.030 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 412 | GLU | -1 | -0.765 | -0.878 | 57.318 | 5.651 | 5.651 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 413 | GLU | -1 | -0.955 | -0.982 | 59.491 | 4.919 | 4.919 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 414 | ALA | 0 | 0.009 | 0.007 | 61.633 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 415 | LYS | 1 | 0.820 | 0.905 | 53.546 | -5.979 | -5.979 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 416 | TYR | 0 | -0.058 | -0.038 | 54.673 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 417 | ILE | 0 | 0.004 | 0.008 | 59.524 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 418 | ALA | 0 | 0.024 | 0.025 | 58.849 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 419 | VAL | 0 | -0.005 | 0.002 | 55.291 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 420 | VAL | 0 | -0.031 | -0.026 | 57.769 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 421 | ASP | -1 | -0.808 | -0.885 | 60.520 | 4.979 | 4.979 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 422 | ASP | -1 | -0.737 | -0.797 | 55.542 | 5.815 | 5.815 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 423 | VAL | 0 | -0.003 | -0.020 | 55.867 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 424 | ALA | 0 | -0.072 | -0.039 | 58.314 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 425 | GLU | -1 | -0.873 | -0.940 | 61.001 | 5.196 | 5.196 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 426 | ARG | 1 | 0.743 | 0.835 | 53.344 | -6.003 | -6.003 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 427 | TYR | 0 | 0.005 | 0.013 | 58.593 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 428 | ALA | 0 | -0.045 | -0.022 | 60.084 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 429 | LYS | 1 | 0.832 | 0.914 | 59.484 | -5.402 | -5.402 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 430 | GLY | 0 | -0.008 | 0.008 | 59.041 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 431 | GLN | 0 | 0.031 | 0.022 | 51.794 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 432 | PRO | 0 | -0.007 | 0.029 | 51.200 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 433 | VAL | 0 | 0.007 | -0.013 | 51.979 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 434 | LEU | 0 | -0.018 | -0.004 | 46.674 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 435 | ILE | 0 | 0.002 | -0.009 | 49.892 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 436 | GLY | 0 | -0.007 | 0.013 | 48.059 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 437 | THR | 0 | -0.028 | -0.029 | 49.049 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 438 | THR | 0 | 0.025 | 0.004 | 47.069 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 439 | SER | 0 | 0.066 | 0.039 | 48.764 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 440 | VAL | 0 | 0.078 | 0.061 | 51.187 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 441 | GLU | -1 | -0.886 | -0.931 | 53.375 | 5.513 | 5.513 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 442 | ARG | 1 | 0.856 | 0.917 | 53.941 | -5.727 | -5.727 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 443 | SER | 0 | 0.059 | 0.019 | 52.452 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 444 | GLU | -1 | -0.861 | -0.946 | 54.982 | 5.545 | 5.545 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 445 | TYR | 0 | -0.124 | -0.062 | 58.329 | -0.116 | -0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 446 | LEU | 0 | 0.048 | 0.012 | 55.623 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 447 | SER | 0 | 0.030 | 0.047 | 58.610 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 448 | ARG | 1 | 0.916 | 0.951 | 59.968 | -5.235 | -5.235 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 449 | GLN | 0 | 0.015 | 0.013 | 62.027 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 450 | PHE | 0 | 0.060 | 0.032 | 56.612 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 451 | THR | 0 | 0.024 | 0.011 | 62.535 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 452 | LYS | 1 | 0.818 | 0.907 | 65.196 | -4.720 | -4.720 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 453 | ARG | 1 | 0.851 | 0.887 | 65.049 | -5.041 | -5.041 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 454 | ARG | 1 | 0.874 | 0.945 | 66.767 | -4.564 | -4.564 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 455 | ILE | 0 | 0.048 | 0.059 | 60.386 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 456 | PRO | 0 | -0.019 | 0.012 | 61.664 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 457 | HIS | 1 | 0.835 | 0.898 | 57.349 | -5.304 | -5.304 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 458 | ASN | 0 | 0.035 | 0.009 | 54.450 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 459 | VAL | 0 | -0.008 | 0.005 | 53.876 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 460 | LEU | 0 | 0.009 | 0.015 | 48.382 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 461 | ASN | 0 | -0.029 | -0.060 | 50.391 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 462 | ALA | 0 | -0.005 | 0.005 | 45.425 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 463 | LYS | 1 | 0.854 | 0.946 | 46.669 | -6.284 | -6.284 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 464 | TYR | 0 | 0.013 | -0.006 | 48.486 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 465 | HIS | 0 | 0.053 | 0.018 | 43.993 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 466 | GLU | -1 | -0.847 | -0.915 | 46.310 | 6.585 | 6.585 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 467 | GLN | 0 | 0.002 | -0.003 | 47.590 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 468 | GLU | -1 | -0.797 | -0.915 | 47.901 | 6.437 | 6.437 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 469 | ALA | 0 | -0.020 | 0.000 | 45.205 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 470 | THR | 0 | 0.030 | 0.005 | 46.861 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 471 | ILE | 0 | -0.048 | -0.016 | 49.972 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 472 | ILE | 0 | -0.013 | -0.009 | 44.933 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 473 | ALA | 0 | -0.014 | 0.010 | 47.223 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 474 | VAL | 0 | 0.004 | -0.004 | 48.184 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 475 | ALA | 0 | -0.036 | -0.014 | 49.201 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 476 | GLY | 0 | 0.019 | -0.003 | 49.447 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 477 | ARG | 1 | 0.932 | 0.993 | 50.434 | -5.845 | -5.845 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 478 | ARG | 1 | 0.857 | 0.879 | 53.711 | -5.433 | -5.433 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 479 | GLY | 0 | -0.042 | -0.021 | 56.580 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 480 | GLY | 0 | -0.017 | 0.008 | 54.274 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 481 | VAL | 0 | 0.044 | 0.009 | 54.832 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 482 | THR | 0 | -0.040 | -0.021 | 50.265 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 483 | VAL | 0 | -0.039 | -0.018 | 52.030 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 484 | ALA | 0 | 0.039 | 0.019 | 47.229 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 485 | THR | 0 | -0.053 | -0.030 | 48.379 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 486 | ASN | 0 | -0.026 | -0.031 | 44.339 | 0.210 | 0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 487 | MET | 0 | -0.041 | -0.032 | 39.708 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 488 | ALA | 0 | -0.030 | 0.019 | 43.076 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 489 | GLY | 0 | 0.087 | 0.033 | 44.528 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 490 | ARG | 1 | 0.835 | 0.900 | 36.244 | -8.479 | -8.479 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 491 | GLY | 0 | 0.082 | 0.034 | 38.013 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 492 | THR | 0 | -0.015 | 0.017 | 38.936 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 493 | ASP | -1 | -0.831 | -0.920 | 39.016 | 8.113 | 8.113 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 494 | ILE | 0 | 0.017 | 0.000 | 41.980 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 495 | VAL | 0 | -0.028 | -0.008 | 43.235 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 496 | LEU | 0 | 0.008 | 0.014 | 45.640 | -0.185 | -0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 497 | GLY | 0 | -0.013 | -0.007 | 48.428 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 498 | GLY | 0 | -0.033 | -0.016 | 49.614 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 499 | ASN | 0 | -0.063 | -0.032 | 43.073 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 500 | VAL | 0 | 0.070 | 0.016 | 46.558 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 501 | ASP | -1 | -0.849 | -0.920 | 41.583 | 7.399 | 7.399 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 502 | PHE | 0 | -0.005 | -0.013 | 44.534 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 503 | LEU | 0 | -0.002 | -0.021 | 45.928 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 504 | THR | 0 | -0.009 | -0.006 | 47.044 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 505 | ASP | -1 | -0.740 | -0.827 | 45.261 | 6.832 | 6.832 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 506 | GLN | 0 | -0.082 | -0.030 | 47.383 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 507 | ARG | 1 | 0.784 | 0.858 | 50.139 | -5.908 | -5.908 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 508 | LEU | 0 | -0.052 | -0.025 | 47.606 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 509 | ARG | 1 | 0.835 | 0.889 | 43.378 | -6.977 | -6.977 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 510 | GLU | -1 | -0.933 | -0.951 | 50.880 | 5.691 | 5.691 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 511 | ARG | 1 | 0.741 | 0.856 | 53.782 | -5.919 | -5.919 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 512 | GLY | 0 | -0.024 | -0.007 | 53.402 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 513 | LEU | 0 | -0.021 | 0.005 | 49.700 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 514 | ASP | -1 | -0.810 | -0.930 | 45.325 | 6.881 | 6.881 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 515 | PRO | 0 | -0.041 | -0.017 | 42.071 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 516 | VAL | 0 | -0.063 | -0.035 | 40.514 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 517 | GLU | -1 | -0.911 | -0.959 | 43.124 | 6.638 | 6.638 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 518 | THR | 0 | -0.025 | -0.010 | 46.763 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 519 | PRO | 0 | 0.003 | 0.013 | 42.915 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 520 | GLU | -1 | -0.948 | -0.982 | 44.946 | 6.559 | 6.559 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 521 | GLU | -1 | -0.922 | -0.973 | 46.607 | 6.008 | 6.008 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 522 | TYR | 0 | -0.066 | -0.069 | 43.985 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 523 | GLU | -1 | -0.765 | -0.882 | 41.979 | 7.423 | 7.423 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 524 | ALA | 0 | -0.029 | -0.011 | 45.526 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 525 | ALA | 0 | 0.003 | 0.004 | 48.726 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 526 | TRP | 0 | -0.016 | -0.009 | 42.888 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 527 | HIS | 1 | 0.781 | 0.865 | 42.497 | -7.190 | -7.190 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 528 | SER | 0 | -0.016 | 0.001 | 47.617 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 529 | GLU | -1 | -0.830 | -0.893 | 50.236 | 5.759 | 5.759 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 530 | LEU | 0 | 0.040 | 0.030 | 44.242 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 531 | PRO | 0 | -0.029 | -0.025 | 48.722 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 532 | ILE | 0 | -0.023 | 0.000 | 50.469 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 533 | VAL | 0 | 0.016 | 0.011 | 50.227 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 534 | LYS | 1 | 0.911 | 0.950 | 43.670 | -7.133 | -7.133 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 535 | GLU | -1 | -0.937 | -0.946 | 50.537 | 5.832 | 5.832 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 536 | GLU | -1 | -0.882 | -0.926 | 53.916 | 5.634 | 5.634 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 537 | ALA | 0 | -0.022 | 0.009 | 51.196 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 538 | SER | 0 | 0.026 | -0.014 | 50.968 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 539 | LYS | 1 | 0.853 | 0.913 | 52.483 | -5.460 | -5.460 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 540 | GLU | -1 | -0.876 | -0.959 | 54.521 | 5.690 | 5.690 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 541 | ALA | 0 | 0.053 | 0.029 | 49.981 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 542 | LYS | 1 | 0.864 | 0.930 | 50.842 | -6.143 | -6.143 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 543 | GLU | -1 | -0.735 | -0.823 | 53.531 | 5.391 | 5.391 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 544 | VAL | 0 | -0.013 | 0.003 | 50.829 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 545 | ILE | 0 | -0.030 | -0.021 | 48.281 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 546 | GLU | -1 | -0.941 | -0.969 | 51.503 | 5.874 | 5.874 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 547 | ALA | 0 | -0.090 | -0.033 | 54.761 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 548 | GLY | 0 | -0.001 | 0.004 | 52.090 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 549 | GLY | 0 | 0.007 | 0.011 | 48.811 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 550 | LEU | 0 | -0.057 | -0.032 | 45.735 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 551 | TYR | 0 | -0.007 | -0.008 | 48.326 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 552 | VAL | 0 | -0.051 | -0.029 | 44.984 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 553 | LEU | 0 | 0.023 | 0.021 | 48.134 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 554 | GLY | 0 | 0.004 | -0.013 | 48.072 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 555 | THR | 0 | 0.000 | 0.006 | 48.938 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 556 | GLU | -1 | -0.775 | -0.903 | 49.546 | 6.094 | 6.094 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 557 | ARG | 1 | 0.772 | 0.880 | 43.506 | -7.142 | -7.142 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 558 | HIS | 1 | 0.874 | 0.919 | 42.146 | -7.309 | -7.309 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 559 | GLU | -1 | -0.781 | -0.886 | 40.999 | 7.472 | 7.472 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 560 | SER | 0 | 0.055 | 0.010 | 36.820 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 561 | ARG | 1 | 0.866 | 0.926 | 37.901 | -8.083 | -8.083 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 562 | ARG | 1 | 0.720 | 0.830 | 32.403 | -9.616 | -9.616 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 563 | ILE | 0 | 0.046 | 0.024 | 36.301 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 564 | ASP | -1 | -0.766 | -0.871 | 38.815 | 7.349 | 7.349 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 565 | ASN | 0 | 0.013 | -0.005 | 35.934 | -0.368 | -0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 566 | GLN | 0 | 0.030 | 0.026 | 34.393 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 567 | LEU | 0 | 0.000 | 0.005 | 38.440 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 568 | ARG | 1 | 0.888 | 0.950 | 40.991 | -7.409 | -7.409 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 569 | GLY | 0 | -0.030 | -0.010 | 38.690 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 570 | ARG | 1 | 0.827 | 0.923 | 39.695 | -7.370 | -7.370 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 571 | SER | 0 | -0.036 | -0.034 | 42.060 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 572 | GLY | 0 | 0.042 | 0.019 | 41.796 | 0.180 | 0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 573 | ARG | 1 | 0.871 | 0.949 | 39.227 | -7.615 | -7.615 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 574 | GLN | 0 | 0.006 | 0.000 | 35.513 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 575 | GLY | 0 | 0.015 | 0.019 | 39.595 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 576 | ASP | -1 | -0.916 | -0.960 | 41.438 | 7.035 | 7.035 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 577 | PRO | 0 | -0.008 | -0.007 | 44.182 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 578 | GLY | 0 | 0.066 | 0.016 | 46.124 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 579 | GLU | -1 | -0.833 | -0.859 | 46.947 | 6.258 | 6.258 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 580 | SER | 0 | -0.063 | -0.066 | 44.350 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 581 | ARG | 1 | 0.933 | 0.976 | 47.079 | -6.266 | -6.266 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 582 | PHE | 0 | -0.076 | -0.018 | 44.205 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 583 | TYR | 0 | -0.019 | -0.045 | 49.274 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 584 | LEU | 0 | -0.031 | -0.017 | 48.118 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 585 | SER | 0 | 0.016 | -0.020 | 52.556 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 586 | LEU | 0 | -0.044 | -0.022 | 54.014 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 587 | GLY | 0 | 0.002 | 0.002 | 55.836 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 588 | ASP | -1 | -0.781 | -0.861 | 51.793 | 6.101 | 6.101 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 589 | GLU | -1 | -0.936 | -0.976 | 50.050 | 6.352 | 6.352 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 590 | LEU | 0 | 0.007 | 0.004 | 45.679 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 591 | MET | 0 | 0.012 | 0.005 | 49.450 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 592 | ARG | 1 | 0.843 | 0.911 | 51.850 | -5.765 | -5.765 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 593 | ARG | 1 | 0.851 | 0.944 | 44.723 | -6.997 | -6.997 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 594 | PHE | 0 | -0.012 | -0.001 | 45.602 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 595 | ASN | 0 | 0.006 | -0.006 | 51.621 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 596 | GLY | 0 | 0.027 | 0.011 | 53.999 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 597 | ALA | 0 | 0.079 | 0.034 | 55.357 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 598 | ALA | 0 | -0.009 | -0.001 | 57.533 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 599 | LEU | 0 | -0.040 | -0.026 | 54.085 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 600 | GLU | -1 | -0.787 | -0.899 | 58.492 | 5.091 | 5.091 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 601 | THR | 0 | -0.034 | -0.011 | 61.203 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 602 | LEU | 0 | -0.084 | -0.046 | 59.518 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 603 | LEU | 0 | 0.034 | -0.005 | 58.915 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 604 | THR | 0 | 0.034 | 0.028 | 62.910 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 605 | ARG | 1 | 0.910 | 0.969 | 64.210 | -5.080 | -5.080 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 606 | LEU | 0 | -0.069 | -0.028 | 62.787 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 607 | ASN | 0 | -0.061 | -0.029 | 66.836 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 608 | LEU | 0 | -0.012 | 0.015 | 61.148 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 609 | PRO | 0 | 0.036 | 0.003 | 65.709 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 610 | ASP | -1 | -0.831 | -0.909 | 64.085 | 5.080 | 5.080 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 611 | ASP | -1 | -0.909 | -0.962 | 62.596 | 5.050 | 5.050 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 612 | VAL | 0 | -0.020 | -0.002 | 61.570 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 613 | PRO | 0 | -0.033 | -0.013 | 56.768 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 614 | ILE | 0 | -0.045 | -0.024 | 55.761 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 615 | GLU | -1 | -0.895 | -0.934 | 52.888 | 6.308 | 6.308 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 616 | ALA | 0 | 0.027 | -0.006 | 53.811 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 617 | LYS | 1 | 0.953 | 0.966 | 48.391 | -6.567 | -6.567 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 618 | MET | 0 | -0.035 | -0.022 | 50.176 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 619 | VAL | 0 | 0.105 | 0.053 | 51.786 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 620 | THR | 0 | 0.024 | 0.012 | 47.039 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 621 | ARG | 1 | 0.917 | 0.957 | 46.618 | -6.509 | -6.509 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 622 | ALA | 0 | 0.001 | 0.003 | 46.929 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 623 | ILE | 0 | 0.067 | 0.027 | 46.896 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 624 | LYS | 1 | 0.871 | 0.942 | 38.638 | -8.115 | -8.115 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 625 | SER | 0 | 0.009 | 0.014 | 43.256 | 0.223 | 0.223 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 626 | ALA | 0 | 0.046 | 0.043 | 44.252 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 627 | GLN | 0 | -0.029 | -0.022 | 41.148 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 628 | THR | 0 | -0.054 | -0.052 | 38.515 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 629 | GLN | 0 | -0.028 | -0.014 | 39.712 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 630 | VAL | 0 | 0.005 | 0.021 | 41.225 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 631 | GLU | -1 | -0.792 | -0.897 | 36.578 | 8.599 | 8.599 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 632 | GLN | 0 | -0.002 | -0.012 | 34.847 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 633 | GLN | 0 | -0.003 | -0.002 | 37.012 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 634 | ASN | 0 | -0.019 | -0.012 | 36.779 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 635 | PHE | 0 | -0.013 | -0.008 | 29.219 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 636 | GLU | -1 | -0.833 | -0.905 | 33.262 | 9.632 | 9.632 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 637 | VAL | 0 | -0.008 | 0.015 | 35.129 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 638 | ARG | 1 | 0.842 | 0.918 | 30.598 | -9.841 | -9.841 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 639 | LYS | 1 | 0.821 | 0.901 | 29.826 | -9.764 | -9.764 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 640 | ASN | 0 | -0.068 | -0.053 | 31.681 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 641 | VAL | 0 | 0.020 | 0.018 | 32.678 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 642 | LEU | 0 | -0.006 | 0.005 | 25.745 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 643 | LYS | 1 | 0.918 | 0.952 | 29.717 | -9.188 | -9.188 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 644 | TYR | 0 | 0.003 | 0.002 | 30.904 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 645 | ASP | -1 | -0.742 | -0.821 | 29.851 | 9.900 | 9.900 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 646 | GLU | -1 | -0.802 | -0.873 | 25.308 | 11.986 | 11.986 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 647 | VAL | 0 | -0.020 | -0.007 | 28.639 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 648 | MET | 0 | 0.052 | 0.029 | 31.099 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 649 | ASN | 0 | -0.038 | -0.016 | 25.147 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 650 | GLN | 0 | -0.032 | -0.030 | 23.484 | 0.306 | 0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 651 | GLN | 0 | 0.029 | 0.033 | 27.626 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 652 | ARG | 1 | 0.884 | 0.923 | 28.979 | -9.848 | -9.848 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 653 | LYS | 1 | 0.877 | 0.968 | 22.839 | -12.262 | -12.262 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 654 | VAL | 0 | 0.004 | 0.007 | 27.619 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 655 | ILE | 0 | 0.044 | 0.024 | 29.181 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 656 | TYR | 0 | -0.015 | -0.029 | 29.223 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 657 | ALA | 0 | -0.055 | -0.024 | 27.078 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 658 | GLU | -1 | -0.824 | -0.887 | 28.896 | 9.075 | 9.075 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 659 | ARG | 1 | 0.796 | 0.872 | 32.307 | -8.265 | -8.265 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 660 | ARG | 1 | 0.857 | 0.931 | 25.884 | -10.541 | -10.541 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 661 | ARG | 1 | 0.861 | 0.904 | 29.386 | -9.480 | -9.480 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 662 | ILE | 0 | -0.053 | -0.015 | 32.044 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 663 | LEU | 0 | -0.043 | -0.023 | 34.254 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 664 | GLU | -1 | -0.978 | -0.984 | 29.464 | 9.807 | 9.807 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 665 | GLY | 0 | -0.040 | -0.016 | 33.881 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 666 | GLU | -1 | -0.839 | -0.908 | 30.815 | 9.329 | 9.329 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 667 | ASN | 0 | -0.034 | -0.028 | 34.478 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 668 | LEU | 0 | 0.033 | -0.008 | 34.746 | 0.182 | 0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 669 | LYS | 1 | 0.877 | 0.956 | 37.169 | -6.986 | -6.986 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 670 | ASP | -1 | -0.905 | -0.964 | 35.321 | 8.131 | 8.131 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 671 | GLN | 0 | 0.022 | 0.021 | 32.758 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 672 | ALA | 0 | -0.004 | 0.005 | 36.637 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 673 | LEU | 0 | 0.021 | 0.001 | 40.317 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 674 | ASP | -1 | -0.858 | -0.907 | 36.316 | 8.219 | 8.219 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 675 | MET | 0 | 0.009 | 0.016 | 36.890 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 676 | VAL | 0 | -0.007 | 0.002 | 40.371 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 677 | ARG | 1 | 0.826 | 0.897 | 37.806 | -8.021 | -8.021 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 678 | ASP | -1 | -0.867 | -0.912 | 38.651 | 7.873 | 7.873 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 679 | VAL | 0 | -0.003 | -0.007 | 41.179 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 680 | ILE | 0 | -0.007 | 0.001 | 44.289 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 681 | THR | 0 | -0.038 | -0.054 | 42.372 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 682 | ALA | 0 | 0.006 | 0.015 | 43.323 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 683 | TYR | 0 | -0.071 | -0.063 | 45.177 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 684 | VAL | 0 | -0.005 | -0.010 | 48.117 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 685 | ASP | -1 | -0.954 | -0.972 | 45.288 | 6.863 | 6.863 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 686 | GLY | 0 | -0.013 | -0.001 | 47.605 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 687 | ALA | 0 | -0.083 | -0.046 | 49.669 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 688 | THR | 0 | -0.073 | -0.037 | 51.236 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 689 | GLY | 0 | 0.068 | 0.052 | 49.770 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 690 | GLU | -1 | -1.006 | -1.018 | 50.681 | 6.051 | 6.051 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 691 | GLY | 0 | 0.060 | 0.056 | 53.352 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 692 | TYR | 0 | -0.164 | -0.096 | 51.564 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 693 | ALA | 0 | 0.006 | 0.002 | 56.213 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 694 | GLU | -1 | -0.924 | -0.957 | 58.869 | 5.105 | 5.105 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 695 | ASP | -1 | -1.002 | -1.009 | 59.085 | 5.206 | 5.206 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 696 | TRP | 0 | -0.056 | -0.033 | 53.914 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 697 | ASP | -1 | -0.810 | -0.897 | 57.738 | 5.154 | 5.154 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 698 | LEU | 0 | -0.009 | -0.027 | 57.284 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 699 | ASP | -1 | -0.887 | -0.938 | 58.958 | 5.006 | 5.006 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 700 | ALA | 0 | -0.012 | -0.006 | 57.916 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 701 | LEU | 0 | -0.017 | -0.006 | 51.969 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 702 | TRP | 0 | 0.017 | 0.003 | 54.898 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 703 | THR | 0 | -0.030 | -0.020 | 56.975 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 704 | ALA | 0 | -0.010 | -0.002 | 53.784 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 705 | LEU | 0 | 0.005 | 0.005 | 50.257 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 706 | LYS | 1 | 0.836 | 0.910 | 53.364 | -5.083 | -5.083 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 707 | THR | 0 | -0.073 | -0.027 | 53.434 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 708 | LEU | 0 | -0.034 | -0.005 | 48.275 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 709 | TYR | 0 | -0.007 | -0.028 | 50.947 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | A | 710 | PRO | 0 | 0.026 | 0.013 | 53.050 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | A | 711 | VAL | 0 | -0.046 | -0.018 | 54.285 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | A | 712 | GLY | 0 | -0.024 | -0.005 | 55.906 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | A | 713 | ILE | 0 | -0.088 | -0.058 | 54.907 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | A | 714 | THR | 0 | -0.013 | -0.024 | 58.625 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | A | 715 | ALA | 0 | 0.086 | 0.043 | 59.330 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | A | 716 | ASP | -1 | -0.869 | -0.932 | 60.307 | 4.850 | 4.850 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | A | 717 | SER | 0 | -0.125 | -0.043 | 60.628 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | A | 718 | LEU | 0 | -0.057 | -0.030 | 55.831 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | A | 719 | THR | 0 | -0.058 | -0.013 | 59.631 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | A | 732 | ARG | 1 | 0.827 | 0.897 | 51.623 | -6.082 | -6.082 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | A | 733 | GLU | -1 | -0.798 | -0.900 | 48.248 | 6.229 | 6.229 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | A | 734 | GLU | -1 | -0.944 | -0.978 | 49.581 | 6.349 | 6.349 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | A | 735 | LEU | 0 | 0.016 | 0.000 | 51.338 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | A | 736 | LEU | 0 | 0.068 | 0.046 | 44.706 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | A | 737 | GLU | -1 | -0.818 | -0.902 | 46.636 | 6.566 | 6.566 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | A | 738 | ALA | 0 | -0.061 | -0.021 | 48.723 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | A | 739 | LEU | 0 | 0.038 | 0.004 | 50.816 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | A | 740 | LEU | 0 | 0.013 | 0.021 | 44.089 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | A | 741 | LYS | 1 | 0.846 | 0.916 | 48.043 | -6.299 | -6.299 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | A | 742 | ASP | -1 | -0.752 | -0.848 | 49.459 | 5.688 | 5.688 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | A | 743 | ALA | 0 | 0.042 | 0.023 | 48.287 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
748 | A | 744 | GLU | -1 | -0.924 | -0.966 | 44.232 | 6.985 | 6.985 | 0.000 | 0.000 | 0.000 | 0.000 |
749 | A | 745 | ARG | 1 | 0.798 | 0.878 | 47.895 | -5.727 | -5.727 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | A | 746 | ALA | 0 | -0.027 | -0.016 | 51.138 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | A | 747 | TYR | 0 | 0.025 | -0.018 | 43.760 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | A | 748 | ALA | 0 | -0.039 | -0.018 | 48.701 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | A | 749 | ALA | 0 | -0.057 | -0.021 | 49.622 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | A | 750 | ARG | 1 | 0.848 | 0.901 | 50.102 | -5.944 | -5.944 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | A | 751 | GLU | -1 | -0.771 | -0.880 | 45.393 | 6.758 | 6.758 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | A | 752 | ALA | 0 | -0.013 | -0.003 | 49.540 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | A | 753 | GLU | -1 | -0.847 | -0.913 | 52.532 | 5.542 | 5.542 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | A | 754 | LEU | 0 | 0.004 | -0.005 | 49.596 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | A | 755 | GLU | -1 | -0.925 | -0.938 | 48.414 | 6.261 | 6.261 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | A | 756 | GLU | -1 | -0.970 | -0.984 | 52.003 | 5.210 | 5.210 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | A | 757 | ILE | 0 | -0.074 | -0.019 | 54.569 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | A | 758 | ALA | 0 | -0.087 | -0.064 | 51.474 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | A | 759 | GLY | 0 | -0.012 | 0.001 | 51.763 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | A | 760 | GLU | -1 | -1.023 | -1.022 | 47.238 | 6.357 | 6.357 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | A | 761 | GLY | 0 | 0.026 | 0.005 | 45.211 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | A | 762 | ALA | 0 | -0.011 | -0.007 | 45.061 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | A | 763 | MET | 0 | 0.005 | 0.020 | 45.677 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | A | 764 | ARG | 1 | 0.746 | 0.860 | 40.401 | -6.956 | -6.956 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | A | 765 | GLN | 0 | -0.015 | -0.012 | 42.162 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | A | 766 | LEU | 0 | 0.027 | 0.016 | 44.083 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | A | 767 | GLU | -1 | -0.737 | -0.851 | 41.033 | 7.238 | 7.238 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | A | 768 | ARG | 1 | 0.820 | 0.910 | 38.059 | -7.491 | -7.491 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | A | 769 | ASN | 0 | 0.009 | 0.001 | 40.995 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | A | 770 | VAL | 0 | 0.032 | 0.031 | 43.854 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | A | 771 | LEU | 0 | 0.042 | 0.020 | 37.898 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | A | 772 | LEU | 0 | -0.013 | -0.004 | 37.753 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | A | 773 | ASN | 0 | -0.059 | -0.054 | 40.354 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | A | 774 | VAL | 0 | 0.025 | 0.031 | 42.230 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | A | 775 | ILE | 0 | 0.023 | -0.006 | 36.259 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | A | 776 | ASP | -1 | -0.805 | -0.889 | 39.498 | 7.590 | 7.590 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | A | 777 | ARG | 1 | 0.724 | 0.847 | 40.970 | -6.601 | -6.601 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | A | 778 | LYS | 1 | 0.892 | 0.954 | 41.462 | -6.887 | -6.887 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | A | 779 | TRP | 0 | -0.008 | -0.018 | 34.116 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | A | 780 | ARG | 1 | 0.902 | 0.954 | 39.833 | -7.021 | -7.021 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | A | 781 | GLU | -1 | -0.790 | -0.884 | 42.183 | 6.564 | 6.564 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | A | 782 | HIS | 0 | 0.011 | -0.001 | 36.640 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | A | 783 | LEU | 0 | -0.065 | -0.029 | 36.979 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | A | 784 | TYR | 0 | 0.027 | 0.029 | 40.701 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | A | 785 | GLU | -1 | -0.762 | -0.864 | 43.347 | 6.473 | 6.473 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | A | 786 | MET | 0 | -0.050 | -0.027 | 36.642 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | A | 787 | ASP | -1 | -0.832 | -0.880 | 41.027 | 7.381 | 7.381 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | A | 788 | TYR | 0 | -0.040 | -0.020 | 42.875 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | A | 789 | LEU | 0 | -0.063 | -0.028 | 39.706 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | A | 790 | LYS | 1 | 0.870 | 0.921 | 38.080 | -7.631 | -7.631 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | A | 791 | GLU | -1 | -0.884 | -0.928 | 41.216 | 7.189 | 7.189 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | A | 792 | GLY | 0 | 0.022 | 0.009 | 44.389 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | A | 793 | ILE | 0 | -0.010 | 0.007 | 40.150 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | A | 794 | GLY | 0 | -0.019 | -0.012 | 43.245 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | A | 795 | LEU | 0 | -0.038 | -0.021 | 44.026 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | A | 796 | ARG | 1 | 0.746 | 0.836 | 43.561 | -7.312 | -7.312 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | A | 797 | ALA | 0 | -0.024 | -0.020 | 43.452 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | A | 798 | MET | 0 | 0.020 | 0.019 | 44.692 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | A | 799 | ALA | 0 | -0.036 | -0.045 | 44.905 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | A | 800 | GLN | 0 | -0.061 | -0.031 | 41.850 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | A | 801 | ARG | 1 | 0.930 | 0.976 | 41.052 | -7.674 | -7.674 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | A | 802 | ASP | -1 | -0.865 | -0.935 | 35.147 | 8.994 | 8.994 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | A | 803 | PRO | 0 | 0.008 | 0.009 | 38.537 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | A | 804 | LEU | 0 | 0.010 | 0.011 | 31.682 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | A | 805 | VAL | 0 | 0.026 | 0.010 | 34.070 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | A | 806 | GLU | -1 | -0.836 | -0.904 | 35.970 | 7.499 | 7.499 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | A | 807 | TYR | 0 | 0.016 | 0.001 | 34.535 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | A | 808 | GLN | 0 | -0.010 | -0.009 | 29.976 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | A | 809 | ARG | 1 | 0.800 | 0.894 | 35.122 | -7.661 | -7.661 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | A | 810 | GLU | -1 | -0.702 | -0.810 | 37.099 | 7.204 | 7.204 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | A | 811 | GLY | 0 | 0.052 | 0.029 | 37.026 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | A | 812 | TYR | 0 | -0.061 | -0.054 | 29.662 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | A | 813 | ASP | -1 | -0.900 | -0.946 | 35.493 | 7.979 | 7.979 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | A | 814 | MET | 0 | -0.013 | -0.001 | 38.689 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | A | 815 | PHE | 0 | -0.007 | -0.005 | 31.971 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | A | 816 | MET | 0 | -0.004 | -0.011 | 31.901 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | A | 817 | ALA | 0 | 0.057 | 0.037 | 37.154 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | A | 818 | MET | 0 | -0.067 | -0.026 | 36.284 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | A | 819 | LEU | 0 | -0.008 | -0.016 | 33.335 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | A | 820 | ASP | -1 | -0.841 | -0.908 | 37.992 | 7.787 | 7.787 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | A | 821 | GLY | 0 | 0.014 | 0.004 | 40.646 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | A | 822 | MET | 0 | -0.052 | -0.013 | 36.198 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | A | 823 | LYS | 1 | 0.814 | 0.909 | 37.082 | -8.117 | -8.117 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | A | 824 | GLU | -1 | -0.854 | -0.914 | 41.312 | 6.453 | 6.453 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | A | 825 | GLU | -1 | -0.679 | -0.832 | 44.989 | 6.484 | 6.484 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | A | 826 | SER | 0 | -0.020 | -0.017 | 42.207 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | A | 827 | VAL | 0 | 0.000 | -0.005 | 43.884 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | A | 828 | GLY | 0 | 0.053 | 0.031 | 46.058 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | A | 829 | PHE | 0 | -0.020 | -0.018 | 47.071 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | A | 830 | LEU | 0 | -0.025 | -0.002 | 43.166 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | A | 831 | PHE | 0 | -0.047 | -0.026 | 47.832 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | A | 832 | ASN | 0 | -0.003 | -0.019 | 50.879 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | A | 833 | VAL | 0 | -0.093 | -0.005 | 49.852 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | A | 834 | THR | 0 | -0.009 | -0.027 | 52.856 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | A | 835 | VAL | 0 | -0.046 | -0.016 | 52.343 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |