FMODB ID: 4968N
Calculation Name: 3AQP-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 3AQP
Chain ID: A
UniProt ID: Q5SKE6
Base Structure: X-ray
Registration Date: 2023-06-22
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 | OptH |
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 | 725 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -16067503.213952 |
---|---|
FMO2-HF: Nuclear repulsion | 15798902.262291 |
FMO2-HF: Total energy | -268600.951661 |
FMO2-MP2: Total energy | -269410.28046 |
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:2:ASP)
Summations of interaction energy for
fragment #1(A:2: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. |
-166.604 | -160.844 | 0.267 | -2.506 | -3.522 | 0.017 |
Interaction energy analysis for fragmet #1(A:2: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 | 4 | LYS | 1 | 0.920 | 0.952 | 3.180 | -57.238 | -52.747 | 0.221 | -2.216 | -2.496 | 0.016 |
4 | A | 5 | ASN | 0 | 0.044 | 0.032 | 3.285 | -11.569 | -10.625 | 0.046 | -0.250 | -0.740 | 0.001 |
5 | A | 6 | LEU | 0 | 0.055 | 0.028 | 4.005 | -5.302 | -4.977 | 0.000 | -0.040 | -0.286 | 0.000 |
6 | A | 7 | THR | 0 | 0.019 | 0.000 | 6.444 | -4.055 | -4.055 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 8 | SER | 0 | 0.011 | 0.007 | 8.862 | -2.720 | -2.720 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 9 | LEU | 0 | -0.011 | 0.007 | 9.717 | -1.772 | -1.772 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 10 | PHE | 0 | 0.032 | 0.011 | 10.568 | -1.920 | -1.920 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 11 | LEU | 0 | 0.031 | 0.032 | 12.333 | -1.460 | -1.460 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 12 | LEU | 0 | 0.006 | 0.033 | 14.702 | -1.302 | -1.302 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 13 | GLY | 0 | 0.051 | 0.026 | 15.100 | -1.011 | -1.011 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 14 | VAL | 0 | 0.038 | -0.009 | 16.018 | -0.942 | -0.942 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 15 | PHE | 0 | -0.023 | -0.015 | 18.190 | -0.870 | -0.870 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 16 | LEU | 0 | 0.008 | 0.005 | 19.629 | -0.746 | -0.746 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 17 | LEU | 0 | -0.027 | 0.000 | 18.719 | -0.679 | -0.679 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 18 | ALA | 0 | 0.001 | 0.019 | 22.326 | -0.617 | -0.617 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 19 | LEU | 0 | 0.021 | -0.010 | 24.434 | -0.573 | -0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 20 | LEU | 0 | 0.000 | -0.005 | 24.008 | -0.442 | -0.442 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 21 | PHE | 0 | -0.078 | -0.062 | 23.685 | -0.435 | -0.435 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 22 | VAL | 0 | -0.056 | -0.004 | 28.204 | -0.352 | -0.352 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 23 | TRP | 0 | -0.042 | -0.020 | 28.433 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 24 | LYS | 1 | 0.878 | 0.966 | 28.124 | -10.637 | -10.637 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 25 | PRO | 0 | 0.013 | 0.002 | 31.079 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 26 | TRP | 0 | 0.007 | -0.014 | 30.749 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 27 | ALA | 0 | 0.025 | 0.031 | 36.643 | -0.214 | -0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 28 | PRO | 0 | 0.054 | 0.031 | 37.779 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 29 | GLU | -1 | -0.925 | -0.975 | 39.665 | 7.027 | 7.027 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 30 | GLU | -1 | -0.887 | -0.953 | 40.257 | 7.530 | 7.530 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 31 | PRO | 0 | -0.045 | -0.010 | 35.686 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 32 | LYS | 1 | 0.930 | 0.975 | 36.232 | -7.719 | -7.719 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 33 | VAL | 0 | -0.131 | -0.074 | 37.061 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 34 | ARG | 1 | 1.014 | 0.996 | 34.384 | -8.662 | -8.662 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 35 | LEU | 0 | 0.072 | 0.048 | 38.323 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 36 | GLY | 0 | 0.033 | 0.014 | 41.368 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 37 | LEU | 0 | 0.010 | 0.003 | 43.822 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 38 | ASP | -1 | -0.908 | -0.969 | 46.694 | 6.481 | 6.481 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 39 | LEU | 0 | -0.047 | -0.023 | 44.077 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 40 | LYS | 1 | 0.965 | 0.997 | 45.917 | -6.766 | -6.766 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 41 | GLY | 0 | -0.019 | -0.025 | 49.618 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 42 | GLY | 0 | 0.043 | 0.120 | 53.302 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 43 | LEU | 0 | 0.000 | 0.006 | 54.846 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 44 | ARG | 1 | 0.877 | 0.927 | 49.543 | -6.102 | -6.102 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 45 | ILE | 0 | -0.026 | -0.036 | 54.763 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 46 | VAL | 0 | 0.026 | 0.001 | 55.498 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 47 | LEU | 0 | -0.043 | -0.024 | 57.296 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 48 | GLU | -1 | -0.928 | -0.995 | 59.197 | 5.287 | 5.287 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 49 | ALA | 0 | 0.018 | 0.028 | 61.695 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 50 | ASP | -1 | -0.961 | -0.984 | 64.311 | 4.691 | 4.691 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 51 | VAL | 0 | 0.041 | 0.026 | 66.342 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 52 | GLU | -1 | -0.991 | -0.984 | 66.307 | 4.669 | 4.669 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 53 | ASN | 0 | -0.070 | -0.033 | 65.631 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 54 | PRO | 0 | 0.023 | 0.013 | 60.704 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 55 | THR | 0 | 0.018 | -0.005 | 61.425 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 56 | LEU | 0 | 0.049 | 0.023 | 54.007 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 57 | ASP | -1 | -0.852 | -0.910 | 58.177 | 5.436 | 5.436 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 58 | ASP | -1 | -0.891 | -1.007 | 59.272 | 5.005 | 5.005 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 59 | LEU | 0 | -0.016 | -0.001 | 56.947 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 60 | GLU | -1 | -0.950 | -0.999 | 53.761 | 5.849 | 5.849 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 61 | LYS | 1 | 0.878 | 1.000 | 57.584 | -4.954 | -4.954 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 62 | ALA | 0 | 0.073 | 0.032 | 60.967 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 63 | ARG | 1 | 0.934 | 0.971 | 51.442 | -5.964 | -5.964 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 64 | THR | 0 | -0.031 | -0.048 | 57.553 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 65 | VAL | 0 | 0.021 | 0.022 | 58.506 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 66 | LEU | 0 | 0.064 | 0.033 | 58.495 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 67 | GLU | -1 | -0.831 | -0.928 | 54.374 | 5.818 | 5.818 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 68 | ASN | 0 | -0.119 | -0.054 | 57.410 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 69 | ARG | 1 | 0.979 | 0.961 | 59.932 | -4.832 | -4.832 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 70 | ILE | 0 | -0.074 | -0.013 | 55.375 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 71 | ASN | 0 | -0.045 | -0.047 | 55.967 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 72 | ALA | 0 | -0.059 | -0.019 | 58.007 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 73 | LEU | 0 | -0.108 | -0.034 | 59.068 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 74 | GLY | 0 | 0.107 | 0.060 | 56.723 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 75 | VAL | 0 | -0.069 | -0.044 | 53.448 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 76 | ALA | 0 | -0.008 | -0.024 | 49.474 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 77 | GLU | -1 | -0.916 | -0.941 | 45.841 | 6.796 | 6.796 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 78 | PRO | 0 | -0.049 | -0.015 | 49.351 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 79 | LEU | 0 | 0.049 | 0.013 | 45.855 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 80 | ILE | 0 | 0.008 | 0.009 | 50.556 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 81 | GLN | 0 | -0.027 | 0.001 | 46.973 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 82 | ILE | 0 | 0.045 | 0.014 | 51.645 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 83 | GLN | 0 | -0.050 | -0.006 | 48.356 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 84 | GLY | 0 | -0.037 | -0.025 | 49.672 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 85 | GLN | 0 | -0.011 | -0.016 | 51.232 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 86 | LYS | 1 | 1.013 | 0.980 | 54.607 | -5.193 | -5.193 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 87 | ARG | 1 | 0.914 | 0.984 | 54.996 | -5.617 | -5.617 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 88 | ILE | 0 | 0.055 | 0.025 | 54.461 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 89 | VAL | 0 | -0.110 | -0.053 | 51.148 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 90 | VAL | 0 | 0.041 | 0.010 | 53.695 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 91 | GLU | -1 | -0.899 | -0.969 | 48.797 | 6.398 | 6.398 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 92 | LEU | 0 | -0.006 | 0.002 | 52.237 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 93 | PRO | 0 | 0.028 | 0.011 | 50.087 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 94 | GLY | 0 | -0.019 | -0.065 | 51.887 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 95 | LEU | 0 | 0.048 | -0.004 | 53.816 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 96 | SER | 0 | -0.025 | -0.011 | 57.540 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 97 | GLN | 0 | 0.116 | 0.040 | 60.567 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 98 | ALA | 0 | -0.035 | -0.007 | 62.667 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 99 | ASP | -1 | -0.863 | -0.956 | 59.726 | 5.216 | 5.216 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 100 | GLN | 0 | -0.022 | -0.012 | 61.010 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 101 | ASP | -1 | -0.969 | -0.995 | 62.208 | 4.656 | 4.656 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 102 | ARG | 1 | 0.976 | 0.975 | 65.139 | -4.820 | -4.820 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 103 | ALA | 0 | 0.050 | 0.045 | 61.500 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 104 | LEU | 0 | -0.001 | 0.004 | 62.630 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 105 | LYS | 1 | 1.001 | 0.998 | 65.073 | -4.446 | -4.446 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 106 | LEU | 0 | -0.072 | -0.061 | 64.031 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 107 | ILE | 0 | -0.008 | 0.031 | 62.724 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 108 | GLY | 0 | -0.034 | -0.019 | 64.681 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 109 | GLN | 0 | -0.099 | -0.029 | 67.742 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 110 | ARG | 1 | 0.951 | 0.973 | 68.468 | -4.219 | -4.219 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 111 | ALA | 0 | 0.035 | 0.024 | 67.691 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 112 | VAL | 0 | -0.049 | -0.033 | 69.313 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 113 | LEU | 0 | 0.022 | 0.041 | 68.300 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 114 | GLU | -1 | -0.940 | -0.986 | 70.657 | 4.255 | 4.255 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 115 | PHE | 0 | 0.051 | 0.014 | 70.383 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 116 | ARG | 0 | -0.090 | 0.111 | 73.512 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 117 | ILE | 0 | -0.002 | -0.003 | 74.473 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 118 | VAL | 0 | 0.046 | 0.038 | 72.940 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 119 | LYS | 1 | 0.865 | 0.959 | 74.842 | -4.096 | -4.096 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 120 | GLU | -1 | -0.922 | -0.970 | 72.501 | 4.374 | 4.374 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 121 | GLY | 0 | 0.083 | 0.028 | 69.234 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 122 | ALA | 0 | -0.100 | -0.063 | 68.528 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 123 | THR | 0 | 0.021 | 0.004 | 62.842 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 124 | GLY | 0 | -0.022 | -0.028 | 63.609 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 125 | THR | 0 | 0.007 | 0.023 | 58.851 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 126 | THR | 0 | -0.010 | -0.006 | 60.817 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 127 | VAL | 0 | 0.043 | 0.012 | 58.531 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 128 | ALA | 0 | -0.032 | 0.000 | 57.499 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 129 | GLN | 0 | 0.037 | 0.003 | 56.551 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 130 | ILE | 0 | 0.002 | 0.015 | 54.515 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 131 | ASN | 0 | -0.082 | -0.050 | 53.105 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 132 | GLN | 0 | 0.022 | 0.022 | 51.425 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 133 | ALA | 0 | -0.023 | -0.010 | 49.726 | 0.163 | 0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 134 | LEU | 0 | -0.012 | -0.002 | 47.883 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 135 | ARG | 1 | 0.853 | 0.952 | 46.073 | -6.068 | -6.068 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 136 | GLU | -1 | -0.954 | -0.964 | 44.894 | 6.776 | 6.776 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 137 | ASN | 0 | -0.074 | -0.054 | 43.880 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 138 | PRO | 0 | 0.003 | 0.000 | 40.717 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 139 | ARG | 1 | 0.882 | 0.932 | 37.636 | -7.914 | -7.914 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 140 | LEU | 0 | 0.029 | 0.012 | 44.003 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 141 | ASN | 0 | 0.024 | 0.009 | 47.423 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 142 | ARG | 1 | 1.010 | 1.027 | 50.158 | -5.996 | -5.996 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 143 | GLU | -1 | -0.862 | -0.926 | 52.849 | 5.813 | 5.813 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 144 | GLU | -1 | -1.018 | -1.029 | 52.822 | 5.749 | 5.749 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 145 | LEU | 0 | 0.021 | -0.011 | 51.435 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 146 | GLU | -1 | -1.013 | -0.993 | 55.600 | 5.468 | 5.468 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 147 | LYS | 1 | 0.832 | 0.924 | 56.956 | -5.628 | -5.628 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 148 | ASP | -1 | -0.843 | -0.915 | 56.644 | 5.511 | 5.511 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 149 | LEU | 0 | -0.100 | -0.038 | 60.133 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 150 | ILE | 0 | -0.095 | 0.004 | 62.143 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 151 | LYS | 1 | 0.911 | 0.963 | 65.760 | -4.677 | -4.677 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 152 | PRO | 0 | 0.022 | -0.001 | 68.173 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 153 | GLU | -1 | -0.884 | -0.964 | 71.492 | 4.438 | 4.438 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 154 | ASP | -1 | -0.966 | -1.015 | 73.793 | 4.029 | 4.029 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 155 | LEU | 0 | 0.002 | -0.059 | 73.363 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 156 | GLY | 0 | -0.036 | -0.017 | 75.892 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 157 | PRO | 0 | 0.035 | 0.027 | 77.472 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 158 | PRO | 0 | 0.044 | -0.067 | 77.360 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 159 | LEU | 0 | -0.029 | -0.005 | 76.492 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 160 | LEU | 0 | -0.066 | -0.041 | 76.358 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 161 | THR | 0 | 0.044 | 0.015 | 75.836 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 162 | GLY | 0 | -0.048 | -0.019 | 74.077 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 163 | ALA | 0 | -0.020 | -0.008 | 73.541 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 164 | ASP | -1 | -0.752 | -0.899 | 74.196 | 4.086 | 4.086 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 165 | LEU | 0 | -0.083 | 0.001 | 70.128 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 166 | ALA | 0 | -0.027 | 0.015 | 73.482 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 167 | ASP | -1 | -0.901 | -0.957 | 68.109 | 4.752 | 4.752 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 168 | ALA | 0 | 0.043 | 0.017 | 66.818 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 169 | ARG | 1 | 0.918 | 0.954 | 63.552 | -4.800 | -4.800 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 170 | ALA | 0 | 0.015 | 0.016 | 60.199 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 171 | VAL | 0 | -0.080 | -0.033 | 61.253 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 172 | PHE | 0 | 0.029 | 0.007 | 55.055 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 173 | ASP | -1 | -0.874 | -0.950 | 60.664 | 4.950 | 4.950 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 174 | GLN | 0 | -0.023 | -0.010 | 61.468 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 175 | PHE | 0 | -0.041 | -0.024 | 60.641 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 176 | GLY | 0 | -0.001 | -0.002 | 56.972 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 177 | ARG | 1 | 0.910 | 0.965 | 57.778 | -5.151 | -5.151 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 178 | PRO | 0 | 0.077 | 0.063 | 56.272 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 179 | GLN | 0 | -0.033 | -0.045 | 59.012 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 180 | VAL | 0 | 0.052 | 0.012 | 61.943 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 181 | SER | 0 | 0.012 | -0.010 | 64.263 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 182 | LEU | 0 | -0.043 | -0.015 | 67.457 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 183 | THR | 0 | -0.007 | 0.028 | 70.240 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 184 | PHE | 0 | 0.022 | -0.032 | 72.637 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 185 | THR | 0 | -0.031 | -0.022 | 75.726 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 186 | PRO | 0 | 0.043 | 0.018 | 78.635 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 187 | GLU | -1 | -0.890 | -0.971 | 81.698 | 3.747 | 3.747 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 188 | GLY | 0 | 0.012 | 0.002 | 79.618 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 189 | ALA | 0 | -0.042 | 0.002 | 78.542 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 190 | LYS | 1 | 0.934 | 0.960 | 79.614 | -3.772 | -3.772 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 191 | LYS | 1 | 0.973 | 1.003 | 80.986 | -3.976 | -3.976 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 192 | PHE | 0 | -0.004 | -0.001 | 73.338 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 193 | GLU | -1 | -0.899 | -0.977 | 78.976 | 3.974 | 3.974 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 194 | GLU | -1 | -0.897 | -0.950 | 80.089 | 3.756 | 3.756 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 195 | VAL | 0 | -0.039 | -0.010 | 79.317 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 196 | THR | 0 | -0.013 | 0.016 | 76.692 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 197 | ARG | 1 | 0.999 | 0.977 | 78.616 | -3.830 | -3.830 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 198 | GLN | 0 | -0.039 | -0.002 | 81.070 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 199 | ASN | 0 | -0.032 | -0.011 | 78.754 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 200 | ILE | 0 | 0.005 | 0.015 | 76.874 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 201 | GLY | 0 | -0.018 | -0.016 | 74.127 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 202 | LYS | 1 | 0.862 | 0.924 | 73.696 | -4.271 | -4.271 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 203 | ARG | 1 | 0.932 | 0.960 | 68.489 | -4.611 | -4.611 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 204 | LEU | 0 | 0.013 | -0.001 | 70.474 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 205 | ALA | 0 | 0.008 | 0.016 | 69.156 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 206 | ILE | 0 | -0.004 | 0.021 | 66.679 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 207 | VAL | 0 | -0.039 | -0.032 | 67.073 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 208 | LEU | 0 | -0.003 | -0.007 | 63.572 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 209 | ASP | -1 | -0.805 | -0.907 | 65.733 | 4.889 | 4.889 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 210 | GLY | 0 | -0.039 | -0.025 | 67.288 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 211 | ARG | 1 | 0.859 | 0.942 | 58.781 | -5.234 | -5.234 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 212 | VAL | 0 | 0.034 | 0.012 | 65.294 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 213 | TYR | 0 | 0.065 | 0.028 | 58.401 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 214 | THR | 0 | 0.010 | -0.026 | 62.648 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 215 | ALA | 0 | 0.107 | 0.015 | 64.835 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 216 | PRO | 0 | -0.056 | 0.016 | 65.678 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 217 | VAL | 0 | -0.021 | -0.004 | 67.336 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 218 | ILE | 0 | -0.033 | 0.012 | 69.966 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 219 | ARG | 1 | 0.957 | 0.977 | 69.948 | -4.597 | -4.597 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 220 | GLN | 0 | -0.005 | -0.030 | 73.085 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 221 | ALA | 0 | 0.027 | 0.027 | 75.332 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 222 | ILE | 0 | -0.055 | -0.018 | 73.401 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 223 | THR | 0 | 0.043 | 0.006 | 76.795 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 224 | GLY | 0 | -0.069 | -0.028 | 77.432 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 225 | GLY | 0 | 0.030 | 0.013 | 77.532 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 226 | GLN | 0 | -0.020 | -0.049 | 72.270 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 227 | ALA | 0 | -0.010 | -0.015 | 71.795 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 228 | VAL | 0 | -0.009 | 0.012 | 68.863 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 229 | ILE | 0 | -0.004 | 0.028 | 62.680 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 230 | GLU | -1 | -0.876 | -0.956 | 65.084 | 4.853 | 4.853 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 231 | GLY | 0 | -0.057 | -0.030 | 62.473 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 232 | LEU | 0 | 0.012 | 0.039 | 57.583 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 233 | SER | 0 | -0.007 | -0.013 | 54.764 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 234 | SER | 0 | 0.045 | 0.017 | 53.528 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 235 | VAL | 0 | 0.036 | 0.012 | 49.841 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 236 | GLU | -1 | -0.920 | -0.971 | 47.168 | 6.614 | 6.614 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 237 | GLU | -1 | -0.836 | -0.935 | 51.327 | 6.112 | 6.112 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 238 | ALA | 0 | 0.029 | 0.029 | 53.707 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 239 | SER | 0 | -0.011 | -0.018 | 53.687 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 240 | GLU | -1 | -0.861 | -0.924 | 54.048 | 5.765 | 5.765 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 241 | ILE | 0 | -0.015 | -0.036 | 55.953 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 242 | ALA | 0 | -0.003 | -0.023 | 59.003 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 243 | LEU | 0 | -0.030 | 0.015 | 56.721 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 244 | VAL | 0 | -0.017 | 0.039 | 59.143 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 245 | LEU | 0 | 0.002 | 0.023 | 61.533 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 246 | ARG | 1 | 0.924 | 0.966 | 60.334 | -5.296 | -5.296 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 247 | SER | 0 | -0.071 | -0.083 | 62.476 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 248 | GLY | 0 | 0.007 | 0.022 | 64.475 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 249 | SER | 0 | -0.050 | -0.036 | 67.436 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 250 | LEU | 0 | -0.070 | -0.025 | 67.303 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 251 | PRO | 0 | 0.017 | 0.028 | 67.243 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 252 | VAL | 0 | 0.012 | -0.005 | 65.112 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 253 | PRO | 0 | -0.022 | 0.011 | 66.095 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 254 | LEU | 0 | 0.003 | -0.022 | 61.448 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 255 | LYS | 1 | 1.009 | 1.013 | 64.673 | -4.826 | -4.826 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 256 | VAL | 0 | -0.001 | 0.011 | 61.756 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 257 | ALA | 0 | -0.071 | -0.014 | 60.001 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 258 | GLU | -1 | -0.771 | -0.910 | 55.933 | 5.593 | 5.593 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 259 | ILE | 0 | -0.038 | 0.005 | 58.034 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 260 | ARG | 1 | 0.821 | 0.932 | 53.552 | -5.756 | -5.756 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 261 | ALA | 0 | 0.063 | 0.046 | 56.574 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 262 | ILE | 0 | -0.042 | -0.013 | 51.594 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 263 | GLY | 0 | 0.066 | 0.039 | 55.634 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 264 | PRO | 0 | 0.023 | 0.005 | 52.173 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 265 | THR | 0 | 0.013 | 0.008 | 51.992 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 266 | LEU | 0 | 0.021 | 0.028 | 52.895 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 267 | GLY | 0 | 0.045 | 0.021 | 49.758 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 268 | GLN | 0 | 0.009 | -0.024 | 48.285 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 269 | ASP | -1 | -0.873 | -0.931 | 48.241 | 6.175 | 6.175 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 270 | ALA | 0 | 0.077 | 0.030 | 47.787 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 271 | ILE | 0 | 0.069 | 0.060 | 43.092 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 272 | GLN | 0 | -0.139 | -0.035 | 44.219 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 273 | ALA | 0 | 0.035 | -0.010 | 44.959 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 274 | GLY | 0 | -0.033 | -0.026 | 43.230 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 275 | ILE | 0 | -0.053 | -0.048 | 39.531 | 0.194 | 0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 276 | ARG | 1 | 0.914 | 0.964 | 40.689 | -6.548 | -6.548 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 277 | SER | 0 | 0.005 | -0.024 | 41.821 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 278 | ALA | 0 | 0.039 | 0.025 | 37.621 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 279 | LEU | 0 | -0.002 | 0.029 | 37.041 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 280 | ILE | 0 | 0.001 | -0.005 | 38.320 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 281 | GLY | 0 | 0.019 | 0.014 | 39.209 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 282 | THR | 0 | -0.045 | -0.039 | 33.595 | 0.257 | 0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 283 | LEU | 0 | 0.016 | 0.017 | 35.076 | 0.235 | 0.235 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 284 | ALA | 0 | 0.054 | 0.033 | 36.253 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 285 | ILE | 0 | 0.051 | 0.014 | 32.851 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 286 | PHE | 0 | 0.050 | 0.007 | 30.059 | 0.196 | 0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 287 | LEU | 0 | -0.066 | -0.038 | 33.379 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 288 | LEU | 0 | 0.001 | 0.004 | 34.962 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 289 | ILE | 0 | -0.060 | -0.008 | 28.261 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 290 | PHE | 0 | -0.062 | -0.010 | 28.530 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 291 | ALA | 0 | -0.032 | -0.010 | 32.095 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 292 | TYR | 0 | -0.047 | -0.009 | 32.281 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 293 | TYR | 0 | -0.088 | -0.089 | 27.889 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 294 | GLY | 0 | 0.070 | 0.019 | 28.444 | 0.366 | 0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 295 | PRO | 0 | 0.017 | -0.004 | 27.815 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 296 | HIS | 0 | 0.108 | 0.041 | 23.472 | 0.330 | 0.330 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 297 | LEU | 0 | -0.009 | 0.014 | 23.434 | 0.285 | 0.285 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 298 | GLY | 0 | 0.091 | 0.024 | 24.967 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 299 | LEU | 0 | 0.011 | 0.003 | 23.970 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 300 | VAL | 0 | -0.005 | -0.003 | 20.536 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 301 | ALA | 0 | 0.033 | 0.009 | 22.756 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 302 | SER | 0 | -0.034 | -0.014 | 24.789 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 303 | LEU | 0 | -0.080 | -0.024 | 21.787 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 304 | GLY | 0 | 0.008 | -0.021 | 22.346 | 0.170 | 0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 305 | LEU | 0 | 0.002 | 0.008 | 23.191 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 306 | LEU | 0 | 0.085 | 0.028 | 26.110 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 307 | TYR | 0 | -0.017 | -0.018 | 17.978 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 308 | THR | 0 | 0.009 | -0.016 | 23.941 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 309 | SER | 0 | -0.044 | -0.013 | 25.264 | -0.305 | -0.305 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 310 | ALA | 0 | -0.040 | -0.030 | 25.099 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 311 | LEU | 0 | -0.062 | -0.023 | 21.398 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 312 | ILE | 0 | -0.009 | 0.004 | 25.298 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 313 | LEU | 0 | -0.039 | -0.020 | 28.540 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 314 | GLY | 0 | 0.005 | 0.009 | 27.287 | -0.194 | -0.194 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 315 | LEU | 0 | -0.055 | -0.030 | 25.012 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 316 | LEU | 0 | -0.025 | -0.010 | 28.421 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 317 | SER | 0 | 0.055 | 0.034 | 30.660 | -0.184 | -0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 318 | GLY | 0 | -0.015 | -0.016 | 28.984 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 319 | LEU | 0 | -0.070 | -0.030 | 28.548 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 320 | GLY | 0 | -0.014 | 0.013 | 31.893 | -0.212 | -0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 321 | ALA | 0 | -0.011 | -0.004 | 35.347 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 322 | THR | 0 | -0.002 | -0.057 | 37.249 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 323 | LEU | 0 | -0.080 | 0.022 | 39.225 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 324 | THR | 0 | 0.017 | 0.049 | 40.499 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 325 | LEU | 0 | 0.105 | 0.020 | 42.878 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 326 | PRO | 0 | -0.010 | -0.010 | 43.204 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 327 | GLY | 0 | 0.056 | -0.010 | 39.681 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 328 | ILE | 0 | 0.045 | -0.015 | 39.256 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 329 | ALA | 0 | 0.009 | 0.004 | 39.652 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 330 | GLY | 0 | 0.038 | -0.008 | 37.736 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 331 | LEU | 0 | 0.069 | 0.065 | 34.942 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 332 | VAL | 0 | 0.122 | 0.061 | 35.487 | 0.215 | 0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 333 | LEU | 0 | -0.033 | -0.001 | 36.155 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 334 | THR | 0 | -0.134 | -0.104 | 31.409 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 335 | LEU | 0 | -0.071 | -0.026 | 32.095 | 0.328 | 0.328 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 336 | GLY | 0 | 0.015 | -0.007 | 32.130 | 0.240 | 0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 337 | ALA | 0 | 0.005 | -0.010 | 32.762 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 338 | ALA | 0 | -0.071 | -0.019 | 28.349 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 339 | VAL | 0 | -0.066 | -0.040 | 27.909 | 0.426 | 0.426 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 340 | ASP | -1 | -0.812 | -0.909 | 28.150 | 10.048 | 10.048 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 341 | GLY | 0 | 0.059 | 0.030 | 26.813 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 342 | ASN | 0 | 0.059 | 0.010 | 23.361 | 0.489 | 0.489 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 343 | VAL | 0 | 0.069 | 0.117 | 25.848 | 0.248 | 0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 344 | LEU | 0 | 0.114 | 0.041 | 27.304 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 345 | SER | 0 | -0.127 | -0.087 | 22.627 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 346 | PHE | 0 | -0.026 | -0.062 | 22.664 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 347 | GLU | -1 | -0.849 | -0.911 | 25.506 | 9.816 | 9.816 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 348 | ARG | 1 | 0.819 | 0.912 | 24.454 | -11.397 | -11.397 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 349 | ILE | 0 | -0.030 | 0.005 | 21.566 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 350 | LYS | 1 | 0.884 | 0.966 | 24.530 | -9.880 | -9.880 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 351 | GLU | -1 | -0.864 | -0.924 | 27.450 | 9.708 | 9.708 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 352 | GLU | -1 | -0.903 | -0.946 | 22.633 | 12.040 | 12.040 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 353 | LEU | 0 | 0.017 | 0.000 | 22.766 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 354 | ARG | 1 | 0.926 | 0.995 | 26.070 | -9.230 | -9.230 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 355 | ALA | 0 | -0.028 | -0.015 | 27.319 | -0.326 | -0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 356 | GLY | 0 | -0.083 | -0.048 | 27.145 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 357 | LYS | 1 | 0.862 | 0.938 | 22.658 | -11.260 | -11.260 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 358 | LYS | 1 | 1.030 | 1.000 | 19.633 | -13.682 | -13.682 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 359 | LEU | 0 | 0.094 | 0.109 | 17.644 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 360 | ARG | 1 | 0.938 | 0.976 | 14.455 | -18.478 | -18.478 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 361 | GLN | 0 | -0.043 | -0.023 | 16.192 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 362 | ALA | 0 | 0.009 | 0.009 | 18.961 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 363 | ILE | 0 | -0.032 | -0.002 | 15.125 | -0.205 | -0.205 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 364 | PRO | 0 | -0.031 | -0.027 | 14.249 | -0.203 | -0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 365 | GLU | -1 | -0.851 | -0.948 | 16.548 | 13.431 | 13.431 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 366 | GLY | 0 | 0.041 | 0.018 | 20.013 | -0.644 | -0.644 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 367 | PHE | 0 | -0.046 | -0.033 | 16.053 | -0.410 | -0.410 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 368 | ARG | 1 | 0.880 | 0.951 | 19.376 | -14.137 | -14.137 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 369 | HIS | 0 | 0.052 | 0.016 | 20.668 | -0.357 | -0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 370 | SER | 0 | -0.034 | -0.008 | 22.879 | -0.482 | -0.482 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 371 | THR | 0 | -0.008 | -0.012 | 19.550 | -0.331 | -0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 372 | LEU | 0 | -0.006 | -0.008 | 22.695 | -0.294 | -0.294 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 373 | THR | 0 | 0.067 | 0.041 | 25.251 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 374 | ILE | 0 | -0.060 | -0.026 | 24.271 | -0.247 | -0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 375 | MET | 0 | 0.042 | 0.025 | 22.843 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 376 | ASP | -1 | -0.794 | -0.884 | 26.593 | 10.105 | 10.105 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 377 | VAL | 0 | -0.004 | -0.028 | 29.705 | -0.310 | -0.310 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 378 | ASN | 0 | 0.004 | -0.046 | 27.715 | -0.351 | -0.351 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 379 | ILE | 0 | 0.026 | 0.011 | 27.280 | -0.209 | -0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 380 | ALA | 0 | 0.000 | 0.010 | 30.833 | -0.281 | -0.281 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 381 | HIS | 1 | 0.825 | 0.934 | 31.382 | -9.484 | -9.484 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 382 | LEU | 0 | 0.016 | 0.030 | 28.712 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 383 | LEU | 0 | -0.020 | 0.006 | 33.305 | -0.204 | -0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 384 | ALA | 0 | 0.049 | 0.004 | 36.095 | -0.219 | -0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 385 | ALA | 0 | -0.053 | -0.029 | 35.095 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 386 | ALA | 0 | -0.018 | -0.010 | 36.264 | -0.177 | -0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 387 | ALA | 0 | 0.035 | 0.025 | 37.787 | -0.167 | -0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 388 | LEU | 0 | -0.012 | -0.003 | 40.741 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 389 | TYR | 0 | -0.033 | -0.013 | 38.738 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 390 | GLN | 0 | -0.039 | -0.015 | 40.832 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 391 | TYR | 0 | -0.105 | -0.057 | 42.848 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 392 | ALA | 0 | 0.032 | 0.018 | 44.339 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 393 | THR | 0 | 0.013 | -0.017 | 45.727 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 394 | GLY | 0 | 0.023 | 0.018 | 46.450 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 395 | PRO | 0 | 0.086 | 0.008 | 44.736 | 0.205 | 0.205 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 396 | VAL | 0 | -0.007 | -0.014 | 43.470 | 0.182 | 0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 397 | ARG | 1 | 0.959 | 0.991 | 42.053 | -6.943 | -6.943 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 398 | GLY | 0 | 0.057 | 0.029 | 39.549 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 399 | PHE | 0 | -0.057 | -0.010 | 38.405 | 0.243 | 0.243 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 400 | ALA | 0 | 0.052 | 0.029 | 37.921 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 401 | VAL | 0 | 0.021 | 0.018 | 34.214 | 0.285 | 0.285 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 402 | ILE | 0 | -0.016 | 0.029 | 33.765 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 403 | LEU | 0 | 0.006 | 0.007 | 33.044 | 0.298 | 0.298 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 404 | ALA | 0 | -0.021 | -0.015 | 32.134 | 0.322 | 0.322 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 405 | ILE | 0 | -0.010 | -0.005 | 28.957 | 0.368 | 0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 406 | GLY | 0 | 0.034 | 0.011 | 28.225 | 0.435 | 0.435 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 407 | VAL | 0 | 0.012 | -0.004 | 27.741 | 0.459 | 0.459 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 408 | VAL | 0 | -0.025 | -0.002 | 24.154 | 0.472 | 0.472 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 409 | ALA | 0 | 0.039 | 0.021 | 23.798 | 0.532 | 0.532 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 410 | SER | 0 | -0.072 | -0.028 | 23.325 | 0.510 | 0.510 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 411 | VAL | 0 | -0.018 | -0.014 | 22.017 | 0.519 | 0.519 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 412 | PHE | 0 | 0.007 | 0.015 | 16.539 | 0.700 | 0.700 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 413 | SER | 0 | 0.005 | -0.017 | 19.285 | 0.925 | 0.925 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 414 | ASN | 0 | 0.016 | 0.008 | 19.075 | 0.930 | 0.930 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 415 | LEU | 0 | -0.027 | -0.027 | 17.264 | 0.617 | 0.617 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 416 | VAL | 0 | -0.034 | 0.010 | 13.909 | 1.264 | 1.264 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 417 | PHE | 0 | 0.075 | 0.036 | 15.335 | 0.848 | 0.848 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 418 | SER | 0 | 0.053 | 0.038 | 16.507 | 0.257 | 0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 419 | ARG | 1 | 0.870 | 0.980 | 15.173 | -15.664 | -15.664 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 420 | HIS | 0 | 0.010 | 0.004 | 11.031 | 1.730 | 1.730 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 421 | LEU | 0 | -0.059 | -0.032 | 13.921 | 0.573 | 0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 422 | LEU | 0 | -0.012 | -0.013 | 16.438 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 423 | GLH | 0 | 0.018 | -0.019 | 11.595 | -0.717 | -0.717 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 424 | ARG | 1 | 0.973 | 0.998 | 10.281 | -22.744 | -22.744 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 425 | LEU | 0 | -0.042 | -0.015 | 13.957 | -0.329 | -0.329 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 426 | ALA | 0 | 0.018 | -0.019 | 16.071 | -0.678 | -0.678 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 427 | ASP | -1 | -0.922 | -0.952 | 11.601 | 21.739 | 21.739 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 428 | ARG | 1 | 0.892 | 0.940 | 15.065 | -15.834 | -15.834 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 429 | GLY | 0 | -0.010 | -0.025 | 17.037 | -0.607 | -0.607 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 430 | GLU | -1 | -0.885 | -0.973 | 19.073 | 13.432 | 13.432 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 431 | ILE | 0 | -0.042 | -0.011 | 20.430 | -0.579 | -0.579 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 432 | ARG | 1 | 0.964 | 0.983 | 23.134 | -10.425 | -10.425 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 433 | PRO | 0 | -0.006 | -0.017 | 24.879 | -0.301 | -0.301 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 434 | PRO | 0 | 0.021 | 0.041 | 27.884 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 435 | MET | 0 | -0.038 | -0.038 | 31.178 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 436 | TRP | 0 | 0.040 | 0.033 | 32.768 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 437 | LEU | 0 | 0.013 | -0.004 | 35.437 | 0.210 | 0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 438 | VAL | 0 | 0.018 | -0.019 | 33.917 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 439 | ASP | -1 | -0.989 | -0.972 | 37.217 | 7.235 | 7.235 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 440 | PRO | 0 | -0.023 | -0.009 | 40.264 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 441 | ARG | 1 | 0.981 | 0.999 | 41.806 | -6.895 | -6.895 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 442 | PHE | 0 | -0.028 | -0.025 | 43.522 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 443 | ASN | 0 | 0.084 | 0.028 | 47.148 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 444 | PHE | 0 | 0.000 | -0.014 | 46.872 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 445 | MET | 0 | 0.004 | 0.014 | 46.013 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 446 | GLY | 0 | -0.002 | 0.011 | 49.053 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 447 | PRO | 0 | -0.042 | -0.041 | 52.198 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 448 | ALA | 0 | 0.088 | 0.069 | 49.895 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 449 | ARG | 1 | 0.970 | 1.023 | 51.558 | -5.604 | -5.604 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 450 | TYR | 0 | 0.045 | 0.016 | 54.397 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 451 | VAL | 0 | 0.031 | 0.022 | 50.932 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 452 | THR | 0 | -0.027 | -0.047 | 51.515 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 453 | ALA | 0 | 0.065 | 0.023 | 53.023 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 454 | ALA | 0 | 0.042 | 0.015 | 56.186 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 455 | THR | 0 | 0.046 | 0.013 | 51.703 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 456 | LEU | 0 | -0.016 | 0.001 | 52.584 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 457 | LEU | 0 | -0.032 | 0.014 | 55.675 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 458 | LEU | 0 | -0.002 | 0.010 | 55.732 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 459 | ALA | 0 | -0.039 | -0.022 | 54.305 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 460 | ALA | 0 | -0.028 | -0.030 | 55.843 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 461 | LEU | 0 | -0.049 | -0.033 | 59.139 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 462 | ALA | 0 | -0.007 | -0.007 | 56.819 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 463 | ALA | 0 | 0.035 | 0.012 | 57.880 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 464 | GLY | 0 | 0.022 | 0.021 | 59.284 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 465 | VAL | 0 | -0.019 | 0.002 | 60.401 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 466 | VAL | 0 | 0.029 | 0.002 | 57.416 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 467 | PHE | 0 | -0.059 | -0.024 | 60.735 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 468 | ALA | 0 | -0.034 | -0.016 | 63.178 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 469 | LYS | 1 | 0.892 | 0.946 | 63.269 | -4.859 | -4.859 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 470 | GLY | 0 | 0.063 | 0.040 | 63.214 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 471 | PHE | 0 | -0.064 | -0.033 | 56.028 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 472 | ASN | 0 | -0.033 | -0.024 | 58.180 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 473 | TYR | 0 | 0.007 | 0.081 | 58.946 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 474 | SER | 0 | 0.014 | -0.007 | 56.342 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 475 | ILE | 0 | 0.053 | 0.089 | 58.145 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 476 | ASP | -1 | -0.869 | -0.934 | 54.307 | 5.767 | 5.767 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 477 | PHE | 0 | -0.021 | -0.043 | 53.183 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 478 | THR | 0 | -0.089 | -0.060 | 57.841 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 479 | GLY | 0 | 0.041 | -0.001 | 61.009 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 480 | GLY | 0 | -0.030 | -0.025 | 62.162 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 481 | THR | 0 | -0.090 | -0.056 | 63.354 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 482 | ALA | 0 | -0.010 | -0.018 | 60.611 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 483 | TYR | 0 | 0.032 | 0.023 | 62.194 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 484 | THR | 0 | 0.013 | 0.018 | 57.188 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 485 | LEU | 0 | -0.017 | -0.007 | 60.429 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 486 | ARG | 1 | 0.966 | 0.999 | 55.915 | -5.478 | -5.478 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 487 | ALA | 0 | 0.011 | -0.028 | 62.009 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 488 | GLU | -1 | -0.861 | -0.943 | 65.086 | 4.683 | 4.683 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 489 | PRO | 0 | -0.021 | -0.036 | 64.461 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 490 | ASN | 0 | -0.022 | -0.009 | 66.494 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 491 | VAL | 0 | -0.021 | 0.004 | 69.231 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 492 | GLU | -1 | -0.874 | -0.956 | 68.745 | 4.639 | 4.639 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 493 | VAL | 0 | 0.072 | 0.012 | 67.349 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 494 | GLU | -1 | -0.943 | -0.976 | 69.961 | 4.263 | 4.263 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 495 | THR | 0 | -0.054 | -0.030 | 73.166 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 496 | LEU | 0 | -0.013 | -0.005 | 68.162 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 497 | ARG | 1 | 0.899 | 0.968 | 71.397 | -4.423 | -4.423 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 498 | ARG | 1 | 0.986 | 0.999 | 74.046 | -4.100 | -4.100 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 499 | PHE | 0 | 0.038 | 0.023 | 73.006 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 500 | LEU | 0 | -0.057 | 0.020 | 70.637 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 501 | GLU | -1 | -0.882 | -0.929 | 74.573 | 4.090 | 4.090 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 502 | GLU | -1 | -1.023 | -1.001 | 77.633 | 3.980 | 3.980 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 503 | LYS | 1 | 0.897 | 0.958 | 75.533 | -4.139 | -4.139 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 504 | GLY | 0 | -0.010 | 0.020 | 77.000 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 505 | PHE | 0 | 0.019 | -0.008 | 73.029 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 506 | PRO | 0 | 0.027 | 0.016 | 73.534 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 507 | GLY | 0 | 0.115 | -0.008 | 73.154 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 508 | LYS | 1 | 0.904 | 0.925 | 73.370 | -4.130 | -4.130 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 509 | GLU | -1 | -0.959 | -0.981 | 72.995 | 4.253 | 4.253 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 510 | ALA | 0 | 0.018 | 0.014 | 69.497 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 511 | VAL | 0 | -0.047 | -0.020 | 64.229 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 512 | ILE | 0 | 0.006 | -0.005 | 64.886 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 513 | THR | 0 | -0.011 | -0.001 | 59.244 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 514 | GLN | 0 | -0.005 | -0.008 | 62.175 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 515 | VAL | 0 | 0.017 | 0.034 | 55.552 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 516 | GLN | 0 | -0.051 | -0.005 | 54.880 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 517 | ALA | 0 | 0.032 | 0.012 | 53.099 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 518 | PRO | 0 | -0.032 | -0.006 | 55.223 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 519 | THR | 0 | 0.012 | -0.014 | 55.097 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 520 | ALA | 0 | -0.020 | -0.006 | 58.354 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 521 | ALA | 0 | -0.033 | -0.018 | 58.302 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 522 | TYR | 0 | 0.000 | -0.035 | 60.407 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 523 | ARG | 1 | 0.919 | 1.022 | 61.103 | -4.762 | -4.762 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 524 | GLU | -1 | -0.861 | -0.945 | 57.494 | 5.529 | 5.529 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 525 | PHE | 0 | -0.004 | 0.003 | 61.205 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 526 | LEU | 0 | -0.013 | 0.011 | 58.268 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 527 | VAL | 0 | 0.005 | 0.013 | 61.824 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 528 | LYS | 1 | 0.873 | 0.953 | 60.308 | -5.152 | -5.152 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 529 | LEU | 0 | 0.004 | -0.007 | 64.686 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 530 | PRO | 0 | 0.070 | 0.041 | 66.496 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 531 | PRO | 0 | 0.041 | 0.012 | 66.621 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 532 | LEU | 0 | -0.049 | -0.011 | 67.571 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 533 | SER | 0 | -0.027 | -0.030 | 68.541 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 534 | ASP | -1 | -0.801 | -0.899 | 68.314 | 4.517 | 4.517 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 535 | GLU | -1 | -0.917 | -0.980 | 69.253 | 4.261 | 4.261 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 536 | ARG | 1 | 0.862 | 0.938 | 71.795 | -4.346 | -4.346 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 537 | ARG | 1 | 0.960 | 1.004 | 62.575 | -4.950 | -4.950 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 538 | LEU | 0 | -0.011 | 0.013 | 67.124 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 539 | GLU | -1 | -0.873 | -0.943 | 69.471 | 4.209 | 4.209 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 540 | LEU | 0 | 0.039 | 0.006 | 68.656 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 541 | GLU | -1 | -0.889 | -0.996 | 64.750 | 4.960 | 4.960 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 542 | ARG | 1 | 0.863 | 0.902 | 68.594 | -4.468 | -4.468 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 543 | LEU | 0 | -0.009 | -0.003 | 70.797 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 544 | PHE | 0 | -0.046 | 0.072 | 67.781 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 545 | ALA | 0 | -0.018 | 0.005 | 68.250 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 546 | SER | 0 | -0.070 | -0.043 | 69.643 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 547 | GLU | -1 | -0.973 | -0.978 | 73.109 | 4.093 | 4.093 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 548 | LEU | 0 | -0.085 | -0.043 | 68.034 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 549 | LYS | 1 | 0.984 | 0.981 | 68.989 | -4.515 | -4.515 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 550 | ALA | 0 | -0.109 | -0.020 | 64.662 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 551 | THR | 0 | 0.037 | 0.011 | 62.225 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 552 | VAL | 0 | 0.058 | -0.020 | 62.509 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 553 | LEU | 0 | -0.140 | 0.000 | 57.501 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 554 | ALA | 0 | -0.025 | -0.037 | 57.128 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 555 | SER | 0 | 0.056 | 0.003 | 59.244 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 556 | GLU | -1 | -0.985 | -0.984 | 56.396 | 5.704 | 5.704 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 557 | THR | 0 | -0.017 | -0.017 | 60.229 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 558 | VAL | 0 | -0.010 | 0.056 | 58.174 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 559 | GLY | 0 | 0.086 | -0.003 | 59.759 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 560 | PRO | 0 | 0.006 | 0.000 | 61.243 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 561 | ALA | 0 | 0.069 | 0.010 | 60.473 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 562 | ILE | 0 | -0.054 | 0.036 | 56.295 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 563 | GLY | 0 | 0.125 | 0.070 | 57.137 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 564 | GLU | -1 | -0.941 | -0.994 | 57.606 | 5.149 | 5.149 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 565 | GLU | -1 | -0.891 | -0.965 | 54.299 | 5.707 | 5.707 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 566 | LEU | 0 | -0.029 | -0.014 | 52.939 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 567 | ARG | 1 | 0.889 | 0.955 | 53.408 | -5.153 | -5.153 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 568 | ARG | 1 | 0.805 | 0.916 | 54.295 | -5.287 | -5.287 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 569 | ASN | 0 | 0.008 | -0.005 | 49.505 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 570 | ALA | 0 | 0.066 | 0.032 | 49.397 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 571 | VAL | 0 | 0.018 | 0.004 | 49.225 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 572 | MET | 0 | -0.020 | 0.006 | 48.026 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 573 | ALA | 0 | 0.095 | 0.041 | 45.259 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 574 | VAL | 0 | 0.025 | 0.018 | 45.062 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 575 | LEU | 0 | 0.015 | -0.001 | 45.700 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 576 | VAL | 0 | 0.020 | 0.026 | 42.737 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 577 | GLY | 0 | 0.004 | 0.024 | 41.581 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 578 | LEU | 0 | -0.071 | -0.034 | 41.709 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 579 | GLY | 0 | 0.032 | 0.010 | 42.623 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 580 | LEU | 0 | -0.086 | -0.062 | 38.721 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 581 | ILE | 0 | -0.006 | -0.019 | 37.789 | 0.192 | 0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 582 | LEU | 0 | 0.016 | 0.003 | 38.433 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 583 | LEU | 0 | 0.029 | 0.041 | 36.856 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 584 | TYR | 0 | 0.035 | 0.011 | 29.939 | 0.213 | 0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 585 | VAL | 0 | -0.011 | 0.020 | 35.562 | 0.177 | 0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 586 | ALA | 0 | 0.023 | -0.013 | 36.988 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 587 | PHE | 0 | -0.099 | -0.019 | 31.342 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 588 | ARG | 1 | 0.785 | 0.895 | 27.201 | -10.235 | -10.235 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 589 | PHE | 0 | -0.107 | -0.070 | 32.975 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 590 | ASP | -1 | -0.872 | -0.911 | 36.946 | 7.420 | 7.420 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 591 | TRP | 0 | 0.097 | 0.049 | 40.403 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 592 | THR | 0 | 0.002 | -0.017 | 42.883 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 593 | PHE | 0 | 0.008 | -0.009 | 38.408 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 594 | GLY | 0 | 0.007 | -0.029 | 40.865 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 595 | VAL | 0 | -0.018 | 0.005 | 41.556 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 596 | ALA | 0 | 0.028 | -0.012 | 43.832 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 597 | SER | 0 | 0.003 | -0.003 | 40.638 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 598 | ILE | 0 | 0.072 | 0.032 | 42.837 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 599 | LEU | 0 | -0.026 | 0.001 | 44.414 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 600 | ALA | 0 | 0.015 | 0.017 | 44.524 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 601 | VAL | 0 | 0.114 | 0.045 | 42.671 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 602 | ALA | 0 | -0.053 | 0.007 | 45.764 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 603 | HIS | 1 | 0.874 | 0.925 | 48.888 | -6.373 | -6.373 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 604 | ASP | -1 | -0.844 | -0.936 | 46.188 | 6.715 | 6.715 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 605 | VAL | 0 | -0.032 | -0.032 | 47.358 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 606 | ALA | 0 | 0.026 | 0.022 | 49.295 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 607 | ILE | 0 | 0.037 | 0.024 | 50.727 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 608 | VAL | 0 | 0.007 | -0.013 | 48.790 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 609 | ALA | 0 | 0.103 | 0.046 | 52.151 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 610 | GLY | 0 | 0.016 | -0.009 | 54.385 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 611 | MET | 0 | -0.106 | 0.008 | 53.133 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 612 | TYR | 0 | 0.009 | -0.025 | 51.429 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 613 | SER | 0 | -0.035 | -0.016 | 56.471 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 614 | LEU | 0 | -0.094 | -0.037 | 59.166 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 615 | LEU | 0 | 0.002 | -0.026 | 55.931 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 616 | GLY | 0 | -0.078 | -0.017 | 59.802 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 617 | LEU | 0 | -0.044 | -0.024 | 55.238 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 618 | GLU | -1 | -0.837 | -1.000 | 55.502 | 5.600 | 5.600 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 619 | PHE | 0 | -0.039 | -0.054 | 53.326 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 620 | SER | 0 | 0.060 | 0.044 | 51.797 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 621 | ILE | 0 | 0.060 | 0.013 | 49.053 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 622 | PRO | 0 | 0.028 | 0.015 | 47.124 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 623 | THR | 0 | 0.062 | 0.058 | 47.134 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 624 | ILE | 0 | 0.015 | 0.026 | 47.128 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 625 | ALA | 0 | 0.026 | -0.001 | 43.799 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 626 | ALA | 0 | 0.024 | -0.012 | 43.884 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 627 | LEU | 0 | 0.055 | 0.017 | 44.259 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 628 | LEU | 0 | -0.008 | -0.015 | 41.657 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 629 | THR | 0 | -0.012 | -0.014 | 40.397 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 630 | ILE | 0 | -0.096 | -0.016 | 40.363 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 631 | VAL | 0 | -0.031 | -0.013 | 40.476 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 632 | GLY | 0 | -0.037 | 0.000 | 37.628 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 633 | TYR | 0 | -0.040 | -0.012 | 34.224 | 0.434 | 0.434 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 634 | SER | 0 | 0.100 | 0.062 | 37.552 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 635 | ILE | 0 | 0.119 | 0.039 | 36.120 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 636 | ASN | 0 | 0.004 | -0.025 | 33.464 | 0.323 | 0.323 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 637 | ASH | 0 | -0.004 | -0.007 | 34.790 | 0.273 | 0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 638 | SER | 0 | 0.067 | 0.003 | 36.752 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 639 | ILE | 0 | -0.083 | 0.043 | 32.030 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 640 | VAL | 0 | -0.021 | 0.006 | 32.036 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 641 | VAL | 0 | -0.041 | -0.008 | 33.580 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 642 | SER | 0 | -0.051 | -0.084 | 35.456 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 643 | ASP | -1 | -0.866 | -0.941 | 29.381 | 10.260 | 10.260 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 644 | ARG | 1 | 0.888 | 0.937 | 30.356 | -9.742 | -9.742 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 645 | ILE | 0 | -0.020 | -0.003 | 33.103 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 646 | ARG | 1 | 0.908 | 0.963 | 33.745 | -8.287 | -8.287 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 647 | GLU | -1 | -0.808 | -0.906 | 29.304 | 10.363 | 10.363 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 648 | ASN | 0 | -0.015 | -0.036 | 32.438 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 649 | GLN | 0 | -0.076 | -0.044 | 35.016 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 650 | LYS | 1 | 0.903 | 0.961 | 32.776 | -9.344 | -9.344 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 651 | LEU | 0 | -0.065 | -0.011 | 31.168 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 652 | LEU | 0 | -0.083 | -0.046 | 34.983 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 653 | ARG | 1 | 0.992 | 0.988 | 38.554 | -7.780 | -7.780 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 654 | HIS | 0 | 0.018 | 0.031 | 39.586 | -0.212 | -0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 655 | LEU | 0 | -0.018 | -0.016 | 41.011 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 656 | PRO | 0 | 0.061 | 0.053 | 44.062 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 657 | TYR | 0 | 0.076 | 0.001 | 44.330 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 658 | ALA | 0 | 0.064 | 0.036 | 44.333 | 0.159 | 0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 659 | GLU | -1 | -0.792 | -0.897 | 45.356 | 6.599 | 6.599 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 660 | LEU | 0 | 0.048 | 0.006 | 39.407 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 661 | VAL | 0 | -0.038 | -0.022 | 41.438 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 662 | ASN | 0 | -0.008 | -0.048 | 41.259 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 663 | ARG | 1 | 0.850 | 0.945 | 37.022 | -7.960 | -7.960 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 664 | SER | 0 | -0.027 | -0.003 | 36.635 | 0.175 | 0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 665 | ILE | 0 | -0.006 | 0.012 | 37.172 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 666 | ASN | 0 | -0.017 | -0.010 | 38.292 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 667 | GLN | 0 | 0.027 | 0.029 | 34.252 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 668 | THR | 0 | -0.014 | -0.013 | 34.232 | 0.250 | 0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 669 | LEU | 0 | -0.003 | 0.018 | 35.299 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 670 | SER | 0 | 0.008 | 0.019 | 33.588 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 671 | ARG | 1 | 0.937 | 0.965 | 27.899 | -10.301 | -10.301 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 672 | THR | 0 | 0.020 | 0.008 | 33.566 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 673 | VAL | 0 | -0.023 | -0.034 | 36.325 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 674 | MET | 0 | 0.042 | 0.040 | 33.893 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 675 | THR | 0 | -0.020 | 0.044 | 33.373 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 676 | SER | 0 | 0.095 | 0.020 | 34.671 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 677 | LEU | 0 | 0.016 | 0.014 | 37.749 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 678 | THR | 0 | -0.042 | -0.072 | 32.731 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 679 | THR | 0 | 0.004 | 0.009 | 35.207 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 680 | LEU | 0 | -0.083 | -0.037 | 36.853 | -0.116 | -0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 681 | LEU | 0 | -0.052 | -0.018 | 36.997 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 682 | PRO | 0 | 0.020 | 0.018 | 36.801 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 683 | ILE | 0 | -0.005 | 0.043 | 39.631 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 684 | LEU | 0 | 0.008 | 0.017 | 42.065 | -0.217 | -0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 685 | ALA | 0 | 0.031 | 0.014 | 42.317 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 686 | LEU | 0 | -0.075 | -0.035 | 42.796 | -0.143 | -0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 687 | LEU | 0 | -0.055 | -0.045 | 44.734 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 688 | PHE | 0 | -0.052 | -0.052 | 47.580 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 689 | LEU | 0 | -0.062 | -0.012 | 45.646 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 690 | GLY | 0 | -0.015 | 0.002 | 47.854 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 691 | GLY | 0 | 0.056 | 0.017 | 48.685 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 692 | SER | 0 | 0.106 | 0.024 | 50.949 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 693 | VAL | 0 | 0.096 | 0.038 | 50.503 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 694 | LEU | 0 | -0.049 | -0.018 | 46.092 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 695 | ARG | 1 | 0.916 | 0.975 | 48.453 | -5.815 | -5.815 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 696 | ASP | -1 | -0.827 | -0.928 | 50.103 | 5.950 | 5.950 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 697 | PHE | 0 | 0.014 | 0.012 | 42.519 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 698 | ALA | 0 | -0.052 | -0.007 | 45.353 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 699 | LEU | 0 | 0.044 | 0.002 | 46.130 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 700 | ALA | 0 | -0.003 | 0.022 | 47.837 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 701 | ILE | 0 | -0.024 | -0.020 | 40.562 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 702 | PHE | 0 | 0.051 | -0.008 | 44.376 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 703 | VAL | 0 | -0.017 | -0.020 | 45.571 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 704 | GLY | 0 | 0.058 | 0.002 | 46.206 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 705 | ILE | 0 | 0.005 | 0.020 | 39.930 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 706 | PHE | 0 | 0.032 | 0.021 | 43.554 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 707 | VAL | 0 | -0.035 | -0.073 | 45.482 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 708 | GLY | 0 | 0.021 | 0.006 | 43.995 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 709 | THR | 0 | -0.090 | -0.027 | 40.843 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 710 | TYR | 0 | 0.003 | 0.030 | 42.948 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 711 | SER | 0 | -0.061 | -0.040 | 45.743 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 712 | SER | 0 | -0.021 | -0.016 | 41.490 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 713 | ILE | 0 | -0.066 | -0.028 | 42.262 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 714 | TYR | 0 | -0.008 | -0.008 | 43.459 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 715 | VAL | 0 | 0.024 | 0.007 | 47.135 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 716 | VAL | 0 | 0.059 | 0.009 | 42.662 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 717 | SER | 0 | -0.012 | -0.005 | 45.206 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 718 | ALA | 0 | -0.016 | -0.012 | 46.004 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 719 | LEU | 0 | -0.063 | 0.018 | 46.518 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 720 | VAL | 0 | -0.003 | -0.001 | 43.782 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 721 | VAL | 0 | -0.060 | -0.030 | 46.897 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 722 | ALA | 0 | 0.004 | -0.003 | 49.816 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 723 | TRP | 0 | -0.007 | -0.004 | 48.818 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 724 | LYS | 1 | 0.891 | 0.954 | 43.142 | -7.045 | -7.045 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 725 | ASN | 0 | -0.073 | -0.015 | 49.785 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 726 | ARG | 1 | 1.019 | 1.026 | 52.582 | -5.460 | -5.460 | 0.000 | 0.000 | 0.000 | 0.000 |