FMODB ID: 52Y8Z
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 | 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 | 725 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -16063671.199856 |
---|---|
FMO2-HF: Nuclear repulsion | 15795057.257653 |
FMO2-HF: Total energy | -268613.942203 |
FMO2-MP2: Total energy | -269421.273817 |
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. |
-169.055 | -163.148 | 0.179 | -2.582 | -3.505 | 0.016 |
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 | 0.925 | 0.960 | 3.414 | -58.587 | -54.134 | 0.091 | -2.201 | -2.343 | 0.015 |
4 | A | 5 | ASN | 0 | 0.048 | 0.028 | 3.239 | -11.696 | -10.566 | 0.088 | -0.338 | -0.880 | 0.001 |
5 | A | 6 | LEU | 0 | 0.055 | 0.029 | 4.019 | -5.532 | -5.208 | 0.000 | -0.043 | -0.282 | 0.000 |
6 | A | 7 | THR | 0 | 0.020 | -0.001 | 6.434 | -4.074 | -4.074 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 8 | SER | 0 | -0.007 | -0.001 | 8.848 | -2.660 | -2.660 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 9 | LEU | 0 | 0.009 | 0.013 | 9.699 | -1.814 | -1.814 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 10 | PHE | 0 | 0.028 | 0.014 | 10.553 | -1.894 | -1.894 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 11 | LEU | 0 | 0.019 | 0.023 | 12.326 | -1.450 | -1.450 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 12 | LEU | 0 | 0.020 | 0.031 | 14.529 | -1.297 | -1.297 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 13 | GLY | 0 | 0.047 | 0.027 | 15.085 | -1.011 | -1.011 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 14 | VAL | 0 | 0.012 | -0.012 | 15.861 | -0.958 | -0.958 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 15 | PHE | 0 | -0.013 | -0.010 | 18.186 | -0.880 | -0.880 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 16 | LEU | 0 | 0.014 | 0.003 | 19.743 | -0.711 | -0.711 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 17 | LEU | 0 | -0.015 | 0.001 | 18.841 | -0.700 | -0.700 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 18 | ALA | 0 | 0.003 | 0.020 | 22.322 | -0.625 | -0.625 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 19 | LEU | 0 | 0.020 | -0.002 | 24.474 | -0.557 | -0.557 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 20 | LEU | 0 | -0.012 | -0.015 | 24.050 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 21 | PHE | 0 | -0.032 | -0.038 | 23.938 | -0.461 | -0.461 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 22 | VAL | 0 | -0.036 | 0.000 | 28.203 | -0.342 | -0.342 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 23 | TRP | 0 | -0.053 | -0.029 | 28.543 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 24 | LYS | 1 | 0.852 | 0.952 | 27.438 | -10.816 | -10.816 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 25 | PRO | 0 | 0.018 | -0.001 | 31.093 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 26 | TRP | 0 | 0.001 | -0.002 | 30.652 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 27 | ALA | 0 | 0.013 | 0.019 | 36.637 | -0.215 | -0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 28 | PRO | 0 | 0.052 | 0.032 | 37.775 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 29 | GLU | -1 | -0.884 | -0.940 | 39.658 | 7.015 | 7.015 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 30 | GLU | -1 | -0.843 | -0.942 | 39.960 | 7.624 | 7.624 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 31 | PRO | 0 | -0.019 | 0.005 | 35.485 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 32 | LYS | 1 | 0.929 | 0.972 | 36.229 | -7.666 | -7.666 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 33 | VAL | 0 | -0.124 | -0.071 | 37.054 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 34 | ARG | 1 | 1.004 | 0.994 | 34.161 | -8.743 | -8.743 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 35 | LEU | 0 | 0.066 | 0.048 | 38.323 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 36 | GLY | 0 | 0.047 | 0.028 | 41.372 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 37 | LEU | 0 | 0.001 | 0.005 | 43.824 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 38 | ASP | -1 | -0.858 | -0.947 | 46.699 | 6.570 | 6.570 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 39 | LEU | 0 | -0.034 | -0.037 | 44.054 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 40 | LYS | 1 | 0.886 | 0.945 | 45.577 | -6.811 | -6.811 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 41 | GLY | 0 | -0.020 | -0.023 | 49.617 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 42 | GLY | 0 | 0.042 | 0.117 | 53.302 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 43 | LEU | 0 | -0.007 | 0.001 | 54.850 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 44 | ARG | 1 | 0.831 | 0.924 | 49.871 | -6.101 | -6.101 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 45 | ILE | 0 | -0.017 | -0.022 | 54.847 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 46 | VAL | 0 | 0.022 | -0.005 | 55.373 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 47 | LEU | 0 | -0.029 | -0.022 | 57.839 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 48 | GLU | -1 | -0.889 | -0.958 | 59.276 | 5.304 | 5.304 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 49 | ALA | 0 | 0.042 | 0.029 | 61.774 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 50 | ASP | -1 | -0.877 | -0.935 | 64.384 | 4.700 | 4.700 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 51 | VAL | 0 | 0.029 | 0.016 | 66.418 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 52 | GLU | -1 | -0.942 | -0.959 | 66.385 | 4.699 | 4.699 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 53 | ASN | 0 | -0.063 | -0.031 | 65.651 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 54 | PRO | 0 | 0.033 | 0.022 | 60.766 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 55 | THR | 0 | -0.022 | -0.030 | 61.426 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 56 | LEU | 0 | 0.075 | 0.043 | 54.465 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 57 | ASP | -1 | -0.829 | -0.893 | 58.235 | 5.393 | 5.393 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 58 | ASP | -1 | -0.804 | -0.928 | 59.320 | 4.925 | 4.925 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 59 | LEU | 0 | -0.007 | -0.003 | 57.210 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 60 | GLU | -1 | -0.849 | -0.922 | 53.556 | 5.913 | 5.913 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 61 | LYS | 1 | 0.797 | 0.923 | 57.635 | -4.905 | -4.905 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 62 | ALA | 0 | 0.051 | 0.027 | 61.089 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 63 | ARG | 1 | 0.821 | 0.883 | 52.786 | -5.888 | -5.888 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 64 | THR | 0 | 0.004 | -0.016 | 57.588 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 65 | VAL | 0 | -0.004 | 0.009 | 58.548 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 66 | LEU | 0 | 0.017 | 0.015 | 58.644 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 67 | GLU | -1 | -0.785 | -0.865 | 54.501 | 5.799 | 5.799 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 68 | ASN | 0 | -0.028 | -0.032 | 57.453 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 69 | ARG | 1 | 0.949 | 0.967 | 59.946 | -4.827 | -4.827 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 70 | ILE | 0 | -0.058 | -0.028 | 55.795 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 71 | ASN | 0 | -0.044 | -0.039 | 56.099 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 72 | ALA | 0 | -0.058 | -0.026 | 58.017 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 73 | LEU | 0 | -0.100 | -0.032 | 58.994 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 74 | GLY | 0 | 0.080 | 0.046 | 56.728 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 75 | VAL | 0 | -0.069 | -0.046 | 53.436 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 76 | ALA | 0 | -0.014 | -0.026 | 49.527 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 77 | GLU | -1 | -0.895 | -0.935 | 45.982 | 6.739 | 6.739 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 78 | PRO | 0 | -0.068 | -0.017 | 49.359 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 79 | LEU | 0 | 0.055 | 0.018 | 45.982 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 80 | ILE | 0 | 0.015 | 0.009 | 50.616 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 81 | GLN | 0 | -0.031 | -0.003 | 46.683 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 82 | ILE | 0 | 0.010 | 0.008 | 51.708 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 83 | GLN | 0 | -0.048 | -0.003 | 48.779 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 84 | GLY | 0 | -0.027 | -0.021 | 49.744 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 85 | GLN | 0 | -0.005 | -0.013 | 51.311 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 86 | LYS | 1 | 0.968 | 0.965 | 54.682 | -5.131 | -5.131 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 87 | ARG | 1 | 0.802 | 0.901 | 55.052 | -5.588 | -5.588 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 88 | ILE | 0 | 0.047 | 0.017 | 54.538 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 89 | VAL | 0 | -0.084 | -0.047 | 51.248 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 90 | VAL | 0 | 0.036 | 0.003 | 53.765 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 91 | GLU | -1 | -0.851 | -0.917 | 48.852 | 6.389 | 6.389 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 92 | LEU | 0 | 0.009 | 0.007 | 52.247 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 93 | PRO | 0 | 0.029 | 0.013 | 49.948 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 94 | GLY | 0 | -0.022 | -0.066 | 51.887 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 95 | LEU | 0 | 0.047 | -0.009 | 53.817 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 96 | SER | 0 | -0.044 | -0.028 | 57.542 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 97 | GLN | 0 | 0.077 | 0.037 | 60.567 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 98 | ALA | 0 | -0.028 | -0.001 | 62.668 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 99 | ASP | -1 | -0.806 | -0.907 | 60.634 | 5.136 | 5.136 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 100 | GLN | 0 | -0.009 | -0.018 | 60.750 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 101 | ASP | -1 | -0.935 | -0.969 | 62.212 | 4.637 | 4.637 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 102 | ARG | 1 | 0.949 | 0.954 | 64.253 | -4.873 | -4.873 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 103 | ALA | 0 | 0.047 | 0.041 | 61.460 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 104 | LEU | 0 | 0.020 | 0.008 | 62.525 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 105 | LYS | 1 | 0.980 | 0.989 | 65.103 | -4.436 | -4.436 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 106 | LEU | 0 | -0.053 | -0.039 | 64.026 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 107 | ILE | 0 | -0.018 | 0.007 | 62.497 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 108 | GLY | 0 | -0.030 | -0.011 | 64.744 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 109 | GLN | 0 | -0.072 | -0.019 | 67.795 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 110 | ARG | 1 | 0.937 | 0.968 | 68.525 | -4.214 | -4.214 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 111 | ALA | 0 | 0.043 | 0.021 | 67.494 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 112 | VAL | 0 | -0.059 | -0.032 | 69.369 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 113 | LEU | 0 | 0.024 | 0.039 | 68.214 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 114 | GLU | -1 | -0.860 | -0.935 | 70.687 | 4.229 | 4.229 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 115 | PHE | 0 | 0.055 | 0.022 | 70.790 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 116 | ARG | 0 | -0.110 | -0.041 | 73.496 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 117 | ILE | 0 | -0.004 | 0.000 | 74.489 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 118 | VAL | 0 | 0.025 | 0.026 | 71.811 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 119 | LYS | 1 | 0.801 | 0.896 | 75.138 | -4.072 | -4.072 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 120 | GLU | -1 | -0.791 | -0.896 | 72.484 | 4.426 | 4.426 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 121 | GLY | 0 | 0.096 | 0.052 | 69.204 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 122 | ALA | 0 | -0.102 | -0.065 | 68.539 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 123 | THR | 0 | 0.047 | 0.014 | 63.092 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 124 | GLY | 0 | -0.035 | -0.017 | 63.620 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 125 | THR | 0 | 0.044 | 0.023 | 58.607 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 126 | THR | 0 | -0.022 | -0.013 | 60.863 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 127 | VAL | 0 | 0.062 | 0.031 | 58.315 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 128 | ALA | 0 | -0.027 | 0.001 | 57.516 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 129 | GLN | 0 | 0.005 | -0.015 | 56.570 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 130 | ILE | 0 | 0.018 | 0.017 | 54.231 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 131 | ASN | 0 | -0.067 | -0.046 | 53.111 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 132 | GLN | 0 | 0.003 | 0.012 | 51.175 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 133 | ALA | 0 | -0.011 | -0.005 | 49.745 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 134 | LEU | 0 | -0.003 | 0.005 | 47.899 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 135 | ARG | 1 | 0.836 | 0.913 | 46.090 | -6.108 | -6.108 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 136 | GLU | -1 | -0.933 | -0.961 | 44.914 | 6.688 | 6.688 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 137 | ASN | 0 | -0.102 | -0.060 | 43.876 | 0.309 | 0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 138 | PRO | 0 | 0.010 | 0.001 | 40.963 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 139 | ARG | 1 | 0.840 | 0.924 | 38.194 | -7.801 | -7.801 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 140 | LEU | 0 | 0.059 | 0.028 | 44.013 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 141 | ASN | 0 | -0.065 | -0.039 | 47.432 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 142 | ARG | 1 | 0.927 | 0.953 | 50.165 | -5.968 | -5.968 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 143 | GLU | -1 | -0.803 | -0.881 | 51.989 | 6.005 | 6.005 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 144 | GLU | -1 | -0.873 | -0.943 | 52.788 | 5.677 | 5.677 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 145 | LEU | 0 | 0.013 | 0.004 | 51.824 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 146 | GLU | -1 | -0.997 | -1.002 | 55.609 | 5.490 | 5.490 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 147 | LYS | 1 | 0.739 | 0.855 | 56.046 | -5.746 | -5.746 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 148 | ASP | -1 | -0.916 | -0.947 | 56.708 | 5.502 | 5.502 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 149 | LEU | 0 | -0.107 | -0.044 | 60.141 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 150 | ILE | 0 | -0.077 | -0.005 | 62.154 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 151 | LYS | 1 | 0.826 | 0.878 | 65.771 | -4.589 | -4.589 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 152 | PRO | 0 | -0.007 | 0.008 | 68.183 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 153 | GLU | -1 | -0.815 | -0.895 | 71.502 | 4.459 | 4.459 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 154 | ASP | -1 | -0.905 | -0.962 | 73.801 | 4.018 | 4.018 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 155 | LEU | 0 | 0.016 | -0.001 | 72.736 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 156 | GLY | 0 | 0.032 | 0.006 | 75.903 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 157 | PRO | 0 | -0.028 | 0.002 | 78.198 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 158 | PRO | 0 | 0.036 | 0.008 | 77.350 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 159 | LEU | 0 | -0.035 | -0.011 | 76.735 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 160 | LEU | 0 | -0.054 | -0.040 | 76.633 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 161 | THR | 0 | -0.017 | -0.017 | 75.855 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 162 | GLY | 0 | -0.008 | 0.001 | 74.112 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 163 | ALA | 0 | -0.012 | -0.003 | 73.571 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 164 | ASP | -1 | -0.677 | -0.848 | 74.226 | 4.060 | 4.060 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 165 | LEU | 0 | -0.077 | -0.003 | 69.980 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 166 | ALA | 0 | -0.017 | 0.014 | 73.547 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 167 | ASP | -1 | -0.813 | -0.889 | 68.209 | 4.750 | 4.750 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 168 | ALA | 0 | 0.054 | 0.029 | 67.046 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 169 | ARG | 1 | 0.809 | 0.879 | 63.582 | -4.732 | -4.732 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 170 | ALA | 0 | 0.021 | 0.015 | 60.158 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 171 | VAL | 0 | -0.080 | -0.034 | 61.267 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 172 | PHE | 0 | 0.026 | 0.007 | 54.958 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 173 | ASP | -1 | -0.865 | -0.943 | 60.662 | 4.925 | 4.925 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 174 | GLN | 0 | -0.030 | -0.017 | 61.456 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 175 | PHE | 0 | -0.036 | -0.022 | 60.611 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 176 | GLY | 0 | -0.004 | -0.001 | 56.950 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 177 | ARG | 1 | 0.955 | 0.978 | 57.753 | -5.108 | -5.108 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 178 | PRO | 0 | 0.037 | 0.055 | 56.617 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 179 | GLN | 0 | -0.042 | -0.050 | 59.005 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 180 | VAL | 0 | 0.035 | 0.009 | 61.773 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 181 | SER | 0 | 0.022 | -0.005 | 64.269 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 182 | LEU | 0 | -0.029 | -0.004 | 67.572 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 183 | THR | 0 | -0.007 | 0.030 | 70.255 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 184 | PHE | 0 | -0.001 | -0.027 | 72.695 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 185 | THR | 0 | -0.001 | -0.013 | 75.747 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 186 | PRO | 0 | 0.083 | 0.038 | 78.662 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 187 | GLU | -1 | -0.839 | -0.920 | 81.720 | 3.752 | 3.752 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 188 | GLY | 0 | 0.045 | 0.016 | 79.641 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 189 | ALA | 0 | -0.057 | -0.005 | 78.629 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 190 | LYS | 1 | 0.813 | 0.878 | 79.629 | -3.781 | -3.781 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 191 | LYS | 1 | 0.806 | 0.908 | 79.134 | -4.052 | -4.052 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 192 | PHE | 0 | 0.020 | 0.002 | 73.508 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 193 | GLU | -1 | -0.812 | -0.884 | 78.981 | 3.959 | 3.959 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 194 | GLU | -1 | -0.844 | -0.926 | 80.092 | 3.747 | 3.747 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 195 | VAL | 0 | -0.029 | -0.005 | 79.294 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 196 | THR | 0 | 0.001 | 0.005 | 76.560 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 197 | ARG | 1 | 0.833 | 0.884 | 78.612 | -3.840 | -3.840 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 198 | GLN | 0 | -0.036 | -0.003 | 81.059 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 199 | ASN | 0 | -0.071 | -0.031 | 78.845 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 200 | ILE | 0 | 0.022 | 0.028 | 76.821 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 201 | GLY | 0 | -0.020 | -0.011 | 74.142 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 202 | LYS | 1 | 0.821 | 0.901 | 73.715 | -4.254 | -4.254 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 203 | ARG | 1 | 0.849 | 0.916 | 68.613 | -4.587 | -4.587 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 204 | LEU | 0 | 0.007 | -0.010 | 70.477 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 205 | ALA | 0 | 0.006 | 0.009 | 69.170 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 206 | ILE | 0 | -0.009 | 0.019 | 66.922 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 207 | VAL | 0 | -0.048 | -0.037 | 67.091 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 208 | LEU | 0 | 0.017 | 0.005 | 63.529 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 209 | ASP | -1 | -0.790 | -0.894 | 65.678 | 4.871 | 4.871 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 210 | GLY | 0 | -0.039 | -0.026 | 67.301 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 211 | ARG | 1 | 0.878 | 0.943 | 58.835 | -5.250 | -5.250 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 212 | VAL | 0 | 0.019 | 0.006 | 65.329 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 213 | TYR | 0 | 0.056 | 0.029 | 57.821 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 214 | THR | 0 | 0.029 | -0.011 | 62.596 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 215 | ALA | 0 | 0.028 | -0.013 | 64.854 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 216 | PRO | 0 | -0.018 | 0.025 | 65.634 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 217 | VAL | 0 | -0.030 | -0.007 | 67.357 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 218 | ILE | 0 | -0.023 | 0.003 | 69.987 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 219 | ARG | 1 | 0.952 | 0.978 | 70.479 | -4.579 | -4.579 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 220 | GLN | 0 | -0.008 | -0.019 | 73.064 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 221 | ALA | 0 | 0.030 | 0.021 | 75.320 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 222 | ILE | 0 | -0.027 | -0.014 | 73.296 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 223 | THR | 0 | 0.038 | -0.009 | 76.792 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 224 | GLY | 0 | -0.067 | -0.024 | 77.435 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 225 | GLY | 0 | 0.027 | 0.014 | 77.543 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 226 | GLN | 0 | -0.024 | -0.055 | 72.200 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 227 | ALA | 0 | -0.014 | -0.014 | 71.770 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 228 | VAL | 0 | 0.010 | 0.020 | 68.839 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 229 | ILE | 0 | -0.001 | 0.018 | 62.907 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 230 | GLU | -1 | -0.866 | -0.945 | 65.275 | 4.796 | 4.796 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 231 | GLY | 0 | -0.047 | -0.030 | 62.454 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 232 | LEU | 0 | 0.009 | 0.025 | 57.897 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 233 | SER | 0 | 0.014 | -0.001 | 54.363 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 234 | SER | 0 | -0.012 | -0.005 | 53.517 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 235 | VAL | 0 | 0.023 | 0.006 | 49.755 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 236 | GLU | -1 | -0.914 | -0.960 | 47.072 | 6.605 | 6.605 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 237 | GLU | -1 | -0.824 | -0.923 | 50.975 | 6.134 | 6.134 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 238 | ALA | 0 | 0.030 | 0.037 | 53.717 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 239 | SER | 0 | 0.004 | -0.016 | 53.501 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 240 | GLU | -1 | -0.845 | -0.896 | 54.059 | 5.738 | 5.738 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 241 | ILE | 0 | 0.012 | -0.004 | 55.975 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 242 | ALA | 0 | -0.010 | -0.019 | 59.032 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 243 | LEU | 0 | -0.049 | 0.004 | 56.707 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 244 | VAL | 0 | 0.030 | 0.004 | 59.228 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 245 | LEU | 0 | -0.028 | 0.006 | 61.559 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 246 | ARG | 1 | 0.890 | 0.939 | 60.048 | -5.328 | -5.328 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 247 | SER | 0 | -0.080 | -0.059 | 62.431 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 248 | GLY | 0 | 0.015 | 0.021 | 64.514 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 249 | SER | 0 | -0.052 | -0.036 | 67.472 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 250 | LEU | 0 | -0.052 | -0.018 | 67.614 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 251 | PRO | 0 | 0.025 | 0.034 | 67.292 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 252 | VAL | 0 | -0.010 | -0.017 | 65.155 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 253 | PRO | 0 | -0.022 | 0.015 | 66.154 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 254 | LEU | 0 | 0.001 | -0.021 | 61.380 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 255 | LYS | 1 | 0.898 | 0.947 | 64.744 | -4.762 | -4.762 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 256 | VAL | 0 | 0.018 | 0.014 | 62.079 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 257 | ALA | 0 | -0.069 | -0.019 | 60.139 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 258 | GLU | -1 | -0.792 | -0.901 | 55.960 | 5.590 | 5.590 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 259 | ILE | 0 | -0.026 | 0.001 | 58.164 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 260 | ARG | 1 | 0.784 | 0.859 | 53.524 | -5.797 | -5.797 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 261 | ALA | 0 | 0.033 | 0.037 | 56.638 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 262 | ILE | 0 | -0.041 | -0.024 | 51.580 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 263 | GLY | 0 | 0.073 | 0.047 | 55.635 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 264 | PRO | 0 | 0.029 | 0.007 | 52.073 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 265 | THR | 0 | -0.001 | 0.006 | 51.987 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 266 | LEU | 0 | 0.044 | 0.033 | 52.888 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 267 | GLY | 0 | 0.041 | 0.021 | 49.756 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 268 | GLN | 0 | 0.003 | -0.013 | 48.280 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 269 | ASP | -1 | -0.843 | -0.905 | 48.232 | 6.119 | 6.119 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 270 | ALA | 0 | 0.076 | 0.030 | 47.693 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 271 | ILE | 0 | 0.042 | 0.031 | 41.723 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 272 | GLN | 0 | -0.063 | -0.008 | 44.210 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 273 | ALA | 0 | 0.019 | -0.004 | 44.956 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 274 | GLY | 0 | -0.039 | -0.025 | 43.232 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 275 | ILE | 0 | -0.051 | -0.046 | 39.262 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 276 | ARG | 1 | 0.908 | 0.952 | 40.689 | -6.558 | -6.558 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 277 | SER | 0 | 0.058 | 0.014 | 41.821 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 278 | ALA | 0 | -0.015 | 0.001 | 37.448 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 279 | LEU | 0 | 0.003 | 0.034 | 37.094 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 280 | ILE | 0 | 0.006 | -0.003 | 38.320 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 281 | GLY | 0 | 0.029 | 0.016 | 39.214 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 282 | THR | 0 | -0.051 | -0.047 | 33.320 | 0.245 | 0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 283 | LEU | 0 | 0.010 | 0.016 | 35.076 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 284 | ALA | 0 | 0.045 | 0.033 | 36.253 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 285 | ILE | 0 | 0.041 | 0.025 | 32.710 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 286 | PHE | 0 | 0.049 | 0.011 | 29.868 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 287 | LEU | 0 | -0.079 | -0.042 | 33.379 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 288 | LEU | 0 | 0.014 | 0.007 | 34.747 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 289 | ILE | 0 | -0.031 | -0.030 | 28.369 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 290 | PHE | 0 | -0.037 | 0.004 | 28.579 | 0.163 | 0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 291 | ALA | 0 | -0.038 | -0.013 | 32.037 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 292 | TYR | 0 | -0.059 | -0.032 | 32.719 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 293 | TYR | 0 | -0.085 | -0.102 | 27.990 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 294 | GLY | 0 | 0.062 | 0.021 | 28.341 | 0.373 | 0.373 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 295 | PRO | 0 | 0.008 | -0.009 | 27.903 | 0.238 | 0.238 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 296 | HIS | 0 | 0.094 | 0.038 | 23.408 | 0.238 | 0.238 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 297 | LEU | 0 | -0.001 | 0.011 | 22.898 | 0.304 | 0.304 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 298 | GLY | 0 | 0.061 | 0.045 | 24.863 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 299 | LEU | 0 | 0.029 | 0.010 | 24.440 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 300 | VAL | 0 | -0.025 | -0.011 | 20.223 | 0.219 | 0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 301 | ALA | 0 | 0.043 | 0.017 | 22.756 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 302 | SER | 0 | -0.033 | -0.017 | 24.789 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 303 | LEU | 0 | -0.075 | -0.028 | 22.033 | -0.072 | -0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 304 | GLY | 0 | 0.010 | -0.001 | 22.297 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 305 | LEU | 0 | 0.017 | 0.018 | 23.191 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 306 | LEU | 0 | 0.045 | 0.023 | 26.141 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 307 | TYR | 0 | -0.032 | -0.023 | 18.070 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 308 | THR | 0 | -0.010 | -0.021 | 23.941 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 309 | SER | 0 | -0.028 | -0.014 | 25.264 | -0.296 | -0.296 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 310 | ALA | 0 | -0.031 | -0.023 | 25.333 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 311 | LEU | 0 | -0.050 | -0.032 | 21.436 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 312 | ILE | 0 | 0.010 | 0.007 | 25.294 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 313 | LEU | 0 | -0.044 | -0.021 | 28.540 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 314 | GLY | 0 | 0.011 | 0.013 | 27.284 | -0.198 | -0.198 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 315 | LEU | 0 | -0.050 | -0.032 | 24.841 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 316 | LEU | 0 | -0.024 | -0.010 | 28.426 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 317 | SER | 0 | 0.050 | 0.036 | 30.798 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 318 | GLY | 0 | -0.013 | -0.022 | 28.991 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 319 | LEU | 0 | -0.060 | -0.031 | 28.676 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 320 | GLY | 0 | -0.017 | 0.011 | 31.939 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 321 | ALA | 0 | -0.018 | -0.011 | 35.357 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 322 | THR | 0 | -0.007 | -0.049 | 37.304 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 323 | LEU | 0 | -0.056 | -0.004 | 38.301 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 324 | THR | 0 | -0.016 | 0.017 | 40.502 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 325 | LEU | 0 | 0.068 | 0.016 | 42.893 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 326 | PRO | 0 | -0.027 | -0.028 | 43.767 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 327 | GLY | 0 | 0.062 | 0.030 | 39.742 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 328 | ILE | 0 | 0.010 | -0.012 | 39.275 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 329 | ALA | 0 | -0.004 | 0.002 | 39.652 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 330 | GLY | 0 | 0.050 | -0.001 | 37.823 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 331 | LEU | 0 | 0.050 | 0.038 | 34.688 | 0.232 | 0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 332 | VAL | 0 | 0.112 | 0.065 | 35.487 | 0.213 | 0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 333 | LEU | 0 | -0.019 | 0.005 | 36.233 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 334 | THR | 0 | -0.117 | -0.070 | 31.346 | 0.235 | 0.235 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 335 | LEU | 0 | -0.056 | -0.026 | 32.052 | 0.341 | 0.341 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 336 | GLY | 0 | 0.018 | -0.006 | 32.130 | 0.248 | 0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 337 | ALA | 0 | -0.009 | -0.005 | 32.794 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 338 | ALA | 0 | -0.065 | -0.022 | 28.299 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 339 | VAL | 0 | -0.056 | -0.035 | 27.909 | 0.416 | 0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 340 | ASP | -1 | -0.853 | -0.935 | 28.150 | 9.976 | 9.976 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 341 | GLY | 0 | 0.083 | 0.047 | 26.872 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 342 | ASN | 0 | -0.003 | -0.032 | 23.027 | 0.481 | 0.481 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 343 | VAL | 0 | 0.023 | 0.042 | 25.848 | 0.222 | 0.222 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 344 | LEU | 0 | 0.074 | 0.040 | 27.478 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 345 | SER | 0 | -0.007 | -0.006 | 22.660 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 346 | PHE | 0 | -0.042 | -0.033 | 22.060 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 347 | GLU | -1 | -0.772 | -0.822 | 25.410 | 9.769 | 9.769 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 348 | ARG | 1 | 0.767 | 0.865 | 24.902 | -11.441 | -11.441 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 349 | ILE | 0 | -0.032 | -0.021 | 20.893 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 350 | LYS | 1 | 0.865 | 0.939 | 24.440 | -9.828 | -9.828 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 351 | GLU | -1 | -0.827 | -0.893 | 27.359 | 9.758 | 9.758 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 352 | GLU | -1 | -0.834 | -0.913 | 23.027 | 11.793 | 11.793 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 353 | LEU | 0 | 0.019 | 0.013 | 22.780 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 354 | ARG | 1 | 0.925 | 0.992 | 25.986 | -9.304 | -9.304 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 355 | ALA | 0 | -0.015 | -0.008 | 27.186 | -0.336 | -0.336 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 356 | GLY | 0 | -0.050 | -0.030 | 27.071 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 357 | LYS | 1 | 0.798 | 0.898 | 22.653 | -11.121 | -11.121 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 358 | LYS | 1 | 1.035 | 1.010 | 19.697 | -13.638 | -13.638 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 359 | LEU | 0 | 0.087 | 0.061 | 18.030 | 0.237 | 0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 360 | ARG | 1 | 0.969 | 0.992 | 14.156 | -18.921 | -18.921 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 361 | GLN | 0 | -0.076 | -0.046 | 16.115 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 362 | ALA | 0 | -0.010 | -0.005 | 18.889 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 363 | ILE | 0 | 0.008 | -0.003 | 15.043 | -0.351 | -0.351 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 364 | PRO | 0 | -0.023 | -0.019 | 14.214 | -0.217 | -0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 365 | GLU | -1 | -0.774 | -0.887 | 16.630 | 13.811 | 13.811 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 366 | GLY | 0 | 0.027 | 0.022 | 20.091 | -0.637 | -0.637 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 367 | PHE | 0 | -0.043 | -0.019 | 16.667 | -0.416 | -0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 368 | ARG | 1 | 0.824 | 0.901 | 19.447 | -14.181 | -14.181 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 369 | HIS | 0 | 0.043 | 0.020 | 20.734 | -0.384 | -0.384 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 370 | SER | 0 | -0.036 | -0.015 | 23.086 | -0.505 | -0.505 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 371 | THR | 0 | -0.013 | -0.015 | 19.567 | -0.401 | -0.401 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 372 | LEU | 0 | 0.027 | 0.015 | 22.755 | -0.270 | -0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 373 | THR | 0 | 0.045 | 0.034 | 25.327 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 374 | ILE | 0 | -0.053 | -0.015 | 24.415 | -0.270 | -0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 375 | MET | 0 | 0.037 | 0.013 | 22.892 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 376 | ASP | -1 | -0.752 | -0.849 | 26.753 | 10.038 | 10.038 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 377 | VAL | 0 | -0.009 | -0.008 | 29.926 | -0.295 | -0.295 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 378 | ASN | 0 | -0.015 | -0.021 | 28.172 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 379 | ILE | 0 | 0.009 | 0.012 | 27.542 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 380 | ALA | 0 | 0.002 | 0.011 | 30.980 | -0.283 | -0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 381 | HIS | 1 | 0.877 | 0.926 | 32.011 | -9.520 | -9.520 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 382 | LEU | 0 | 0.010 | 0.021 | 28.721 | -0.204 | -0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 383 | LEU | 0 | -0.011 | 0.009 | 33.442 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 384 | ALA | 0 | 0.042 | 0.003 | 36.232 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 385 | ALA | 0 | -0.049 | -0.028 | 35.129 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 386 | ALA | 0 | -0.001 | -0.008 | 36.221 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 387 | ALA | 0 | 0.039 | 0.027 | 37.911 | -0.169 | -0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 388 | LEU | 0 | 0.006 | -0.005 | 40.809 | -0.195 | -0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 389 | TYR | 0 | -0.014 | -0.005 | 38.845 | -0.177 | -0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 390 | GLN | 0 | -0.031 | -0.011 | 40.948 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 391 | TYR | 0 | -0.084 | -0.052 | 42.960 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 392 | ALA | 0 | 0.042 | 0.027 | 44.426 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 393 | THR | 0 | -0.003 | -0.026 | 45.834 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 394 | GLY | 0 | 0.045 | 0.034 | 46.568 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 395 | PRO | 0 | 0.055 | 0.007 | 44.840 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 396 | VAL | 0 | 0.021 | 0.005 | 43.581 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 397 | ARG | 1 | 0.912 | 0.970 | 41.844 | -6.925 | -6.925 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 398 | GLY | 0 | 0.051 | 0.025 | 39.652 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 399 | PHE | 0 | -0.057 | -0.023 | 38.516 | 0.250 | 0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 400 | ALA | 0 | 0.043 | 0.025 | 38.042 | 0.209 | 0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 401 | VAL | 0 | 0.021 | 0.018 | 34.274 | 0.282 | 0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 402 | ILE | 0 | 0.000 | 0.013 | 33.881 | 0.310 | 0.310 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 403 | LEU | 0 | 0.007 | 0.022 | 33.164 | 0.307 | 0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 404 | ALA | 0 | -0.015 | -0.012 | 32.178 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 405 | ILE | 0 | -0.013 | -0.008 | 28.759 | 0.366 | 0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 406 | GLY | 0 | 0.036 | 0.007 | 28.344 | 0.432 | 0.432 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 407 | VAL | 0 | -0.006 | -0.008 | 27.871 | 0.456 | 0.456 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 408 | VAL | 0 | -0.024 | 0.000 | 24.253 | 0.466 | 0.466 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 409 | ALA | 0 | 0.042 | 0.025 | 23.905 | 0.526 | 0.526 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 410 | SER | 0 | -0.070 | -0.041 | 23.433 | 0.533 | 0.533 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 411 | VAL | 0 | -0.003 | -0.008 | 22.225 | 0.541 | 0.541 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 412 | PHE | 0 | 0.001 | -0.002 | 16.310 | 0.736 | 0.736 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 413 | SER | 0 | 0.016 | -0.001 | 19.425 | 0.918 | 0.918 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 414 | ASN | 0 | -0.011 | 0.000 | 19.075 | 0.864 | 0.864 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 415 | LEU | 0 | -0.028 | -0.024 | 17.513 | 0.636 | 0.636 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 416 | VAL | 0 | -0.026 | 0.006 | 13.628 | 1.264 | 1.264 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 417 | PHE | 0 | 0.077 | 0.038 | 15.335 | 0.855 | 0.855 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 418 | SER | 0 | 0.054 | 0.040 | 16.507 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 419 | ARG | 1 | 0.902 | 0.978 | 15.394 | -15.296 | -15.296 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 420 | HIS | 0 | 0.045 | 0.022 | 10.788 | 1.943 | 1.943 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 421 | LEU | 0 | -0.045 | -0.021 | 13.921 | 0.576 | 0.576 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 422 | LEU | 0 | -0.008 | -0.010 | 16.438 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 423 | GLH | 0 | -0.081 | -0.075 | 11.497 | -1.047 | -1.047 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 424 | ARG | 1 | 0.924 | 0.968 | 10.021 | -23.597 | -23.597 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 425 | LEU | 0 | -0.038 | -0.013 | 13.853 | -0.344 | -0.344 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 426 | ALA | 0 | 0.016 | -0.004 | 15.667 | -0.670 | -0.670 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 427 | ASP | -1 | -0.878 | -0.897 | 11.687 | 22.163 | 22.163 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 428 | ARG | 1 | 0.911 | 0.948 | 14.973 | -15.875 | -15.875 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 429 | GLY | 0 | -0.007 | -0.016 | 16.946 | -0.616 | -0.616 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 430 | GLU | -1 | -0.890 | -0.944 | 18.989 | 13.679 | 13.679 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 431 | ILE | 0 | -0.035 | -0.020 | 20.338 | -0.574 | -0.574 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 432 | ARG | 1 | 0.963 | 0.982 | 23.037 | -10.654 | -10.654 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 433 | PRO | 0 | 0.001 | -0.005 | 24.940 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 434 | PRO | 0 | 0.011 | 0.025 | 27.784 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 435 | MET | 0 | -0.035 | -0.031 | 31.057 | 0.159 | 0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 436 | TRP | 0 | 0.041 | 0.027 | 32.672 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 437 | LEU | 0 | -0.002 | -0.008 | 35.343 | 0.202 | 0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 438 | VAL | 0 | 0.019 | -0.008 | 33.786 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 439 | ASP | -1 | -0.866 | -0.912 | 37.127 | 7.181 | 7.181 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 440 | PRO | 0 | -0.010 | 0.017 | 40.177 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 441 | ARG | 1 | 0.868 | 0.921 | 41.783 | -6.974 | -6.974 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 442 | PHE | 0 | -0.020 | -0.027 | 43.558 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 443 | ASN | 0 | 0.076 | 0.029 | 47.230 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 444 | PHE | 0 | -0.007 | -0.012 | 46.913 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 445 | MET | 0 | 0.034 | 0.022 | 46.753 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 446 | GLY | 0 | -0.004 | 0.013 | 49.130 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 447 | PRO | 0 | -0.033 | -0.037 | 52.558 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 448 | ALA | 0 | 0.074 | 0.065 | 49.917 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 449 | ARG | 1 | 0.953 | 0.993 | 51.630 | -5.594 | -5.594 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 450 | TYR | 0 | 0.047 | 0.018 | 54.467 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 451 | VAL | 0 | 0.037 | 0.020 | 51.178 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 452 | THR | 0 | -0.010 | -0.012 | 51.451 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 453 | ALA | 0 | 0.045 | 0.017 | 53.090 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 454 | ALA | 0 | 0.042 | 0.024 | 56.419 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 455 | THR | 0 | 0.025 | 0.012 | 51.448 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 456 | LEU | 0 | 0.011 | 0.008 | 52.624 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 457 | LEU | 0 | -0.028 | 0.010 | 55.737 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 458 | LEU | 0 | -0.006 | 0.007 | 55.803 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 459 | ALA | 0 | -0.029 | -0.023 | 54.282 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 460 | ALA | 0 | -0.025 | -0.029 | 56.009 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 461 | LEU | 0 | -0.036 | -0.034 | 59.304 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 462 | ALA | 0 | -0.025 | -0.014 | 56.927 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 463 | ALA | 0 | 0.034 | 0.012 | 58.015 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 464 | GLY | 0 | 0.020 | 0.020 | 59.442 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 465 | VAL | 0 | -0.011 | 0.001 | 60.710 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 466 | VAL | 0 | 0.004 | 0.004 | 57.533 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 467 | PHE | 0 | -0.026 | -0.018 | 60.888 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 468 | ALA | 0 | -0.033 | -0.017 | 63.330 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 469 | LYS | 1 | 0.891 | 0.948 | 63.443 | -4.888 | -4.888 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 470 | GLY | 0 | 0.061 | 0.038 | 63.361 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 471 | PHE | 0 | -0.054 | -0.036 | 55.563 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 472 | ASN | 0 | -0.041 | -0.023 | 58.236 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 473 | TYR | 0 | 0.043 | 0.044 | 59.074 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 474 | SER | 0 | 0.023 | 0.025 | 56.622 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 475 | ILE | 0 | 0.069 | 0.050 | 58.275 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 476 | ASP | -1 | -0.856 | -0.930 | 54.166 | 5.803 | 5.803 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 477 | PHE | 0 | -0.032 | -0.031 | 52.856 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 478 | THR | 0 | -0.086 | -0.047 | 57.964 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 479 | GLY | 0 | 0.056 | 0.000 | 61.098 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 480 | GLY | 0 | -0.051 | -0.021 | 62.278 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 481 | THR | 0 | -0.054 | -0.034 | 63.465 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 482 | ALA | 0 | -0.010 | -0.010 | 60.777 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 483 | TYR | 0 | 0.043 | 0.022 | 62.303 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 484 | THR | 0 | 0.001 | 0.007 | 57.081 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 485 | LEU | 0 | -0.015 | 0.021 | 60.429 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 486 | ARG | 1 | 0.767 | 0.886 | 55.260 | -5.567 | -5.567 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 487 | ALA | 0 | 0.027 | -0.012 | 62.009 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 488 | GLU | -1 | -0.756 | -0.865 | 65.086 | 4.680 | 4.680 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 489 | PRO | 0 | 0.000 | -0.006 | 64.549 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 490 | ASN | 0 | -0.039 | -0.023 | 66.494 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 491 | VAL | 0 | -0.020 | 0.000 | 69.265 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 492 | GLU | -1 | -0.751 | -0.870 | 68.745 | 4.730 | 4.730 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 493 | VAL | 0 | 0.051 | 0.019 | 67.251 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 494 | GLU | -1 | -0.937 | -0.972 | 69.961 | 4.253 | 4.253 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 495 | THR | 0 | -0.066 | -0.040 | 73.171 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 496 | LEU | 0 | -0.012 | -0.012 | 67.899 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 497 | ARG | 1 | 0.876 | 0.943 | 71.171 | -4.449 | -4.449 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 498 | ARG | 1 | 0.976 | 0.993 | 74.061 | -4.121 | -4.121 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 499 | PHE | 0 | 0.061 | 0.032 | 73.297 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 500 | LEU | 0 | -0.033 | 0.001 | 70.295 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 501 | GLU | -1 | -0.864 | -0.922 | 74.629 | 4.081 | 4.081 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 502 | GLU | -1 | -0.978 | -0.971 | 77.746 | 4.016 | 4.016 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 503 | LYS | 1 | 0.832 | 0.921 | 75.494 | -4.166 | -4.166 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 504 | GLY | 0 | -0.020 | 0.014 | 77.110 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 505 | PHE | 0 | -0.014 | -0.020 | 73.124 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 506 | PRO | 0 | 0.027 | 0.013 | 73.804 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 507 | GLY | 0 | 0.093 | 0.005 | 73.274 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 508 | LYS | 1 | 0.922 | 0.958 | 73.497 | -4.079 | -4.079 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 509 | GLU | -1 | -0.985 | -0.989 | 73.134 | 4.249 | 4.249 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 510 | ALA | 0 | 0.016 | 0.017 | 69.629 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 511 | VAL | 0 | -0.034 | -0.020 | 64.378 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 512 | ILE | 0 | -0.012 | -0.005 | 65.043 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 513 | THR | 0 | -0.003 | 0.002 | 59.449 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 514 | GLN | 0 | 0.006 | -0.006 | 62.175 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 515 | VAL | 0 | 0.008 | 0.003 | 55.783 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 516 | GLN | 0 | -0.036 | 0.009 | 54.423 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 517 | ALA | 0 | 0.039 | 0.015 | 52.990 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 518 | PRO | 0 | -0.023 | -0.001 | 55.107 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 519 | THR | 0 | 0.005 | -0.016 | 55.222 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 520 | ALA | 0 | -0.019 | -0.004 | 58.536 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 521 | ALA | 0 | -0.037 | -0.017 | 58.465 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 522 | TYR | 0 | -0.014 | -0.051 | 60.527 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 523 | ARG | 1 | 0.824 | 0.930 | 61.103 | -4.738 | -4.738 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 524 | GLU | -1 | -0.803 | -0.899 | 56.881 | 5.576 | 5.576 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 525 | PHE | 0 | 0.006 | 0.008 | 61.205 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 526 | LEU | 0 | -0.040 | -0.007 | 57.992 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 527 | VAL | 0 | 0.014 | 0.021 | 61.832 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 528 | LYS | 1 | 0.834 | 0.918 | 59.548 | -5.236 | -5.236 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 529 | LEU | 0 | 0.031 | 0.003 | 64.807 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 530 | PRO | 0 | 0.069 | 0.044 | 66.613 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 531 | PRO | 0 | 0.046 | 0.013 | 66.645 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 532 | LEU | 0 | -0.072 | -0.017 | 67.674 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 533 | SER | 0 | -0.018 | -0.006 | 68.641 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 534 | ASP | -1 | -0.816 | -0.929 | 68.254 | 4.535 | 4.535 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 535 | GLU | -1 | -0.928 | -0.967 | 69.346 | 4.246 | 4.246 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 536 | ARG | 1 | 0.889 | 0.946 | 72.076 | -4.322 | -4.322 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 537 | ARG | 1 | 0.860 | 0.946 | 62.695 | -4.967 | -4.967 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 538 | LEU | 0 | 0.003 | 0.014 | 66.765 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 539 | GLU | -1 | -0.894 | -0.932 | 69.475 | 4.210 | 4.210 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 540 | LEU | 0 | 0.020 | 0.011 | 69.324 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 541 | GLU | -1 | -0.846 | -0.932 | 65.019 | 4.900 | 4.900 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 542 | ARG | 1 | 0.891 | 0.935 | 68.595 | -4.521 | -4.521 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 543 | LEU | 0 | -0.005 | 0.015 | 70.797 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 544 | PHE | 0 | -0.032 | -0.018 | 68.164 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 545 | ALA | 0 | -0.013 | 0.008 | 68.052 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 546 | SER | 0 | -0.071 | -0.051 | 69.638 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 547 | GLU | -1 | -0.946 | -0.976 | 73.116 | 4.098 | 4.098 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 548 | LEU | 0 | -0.114 | -0.053 | 68.210 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 549 | LYS | 1 | 0.902 | 0.922 | 68.660 | -4.563 | -4.563 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 550 | ALA | 0 | -0.102 | -0.025 | 64.689 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 551 | THR | 0 | 0.039 | 0.016 | 62.273 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 552 | VAL | 0 | 0.044 | 0.004 | 62.547 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 553 | LEU | 0 | -0.077 | -0.034 | 56.984 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 554 | ALA | 0 | -0.037 | -0.044 | 57.097 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 555 | SER | 0 | 0.056 | -0.001 | 59.245 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 556 | GLU | -1 | -0.960 | -0.964 | 56.622 | 5.713 | 5.713 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 557 | THR | 0 | 0.008 | -0.012 | 60.333 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 558 | VAL | 0 | 0.000 | 0.043 | 57.864 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 559 | GLY | 0 | 0.065 | 0.034 | 59.855 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 560 | PRO | 0 | -0.018 | -0.015 | 61.352 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 561 | ALA | 0 | 0.035 | 0.001 | 60.606 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 562 | ILE | 0 | 0.015 | 0.038 | 56.090 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 563 | GLY | 0 | 0.121 | 0.069 | 57.248 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 564 | GLU | -1 | -0.774 | -0.870 | 57.725 | 5.249 | 5.249 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 565 | GLU | -1 | -0.825 | -0.903 | 54.489 | 5.669 | 5.669 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 566 | LEU | 0 | -0.025 | -0.025 | 52.415 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 567 | ARG | 1 | 0.828 | 0.900 | 53.530 | -5.135 | -5.135 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 568 | ARG | 1 | 0.733 | 0.856 | 54.422 | -5.246 | -5.246 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 569 | ASN | 0 | -0.027 | -0.016 | 49.606 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 570 | ALA | 0 | 0.055 | 0.026 | 49.512 | 0.140 | 0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 571 | VAL | 0 | 0.028 | 0.005 | 49.357 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 572 | MET | 0 | -0.017 | 0.013 | 48.221 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 573 | ALA | 0 | 0.083 | 0.044 | 45.375 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 574 | VAL | 0 | 0.002 | 0.007 | 45.197 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 575 | LEU | 0 | 0.029 | 0.014 | 45.841 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 576 | VAL | 0 | 0.015 | 0.020 | 42.951 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 577 | GLY | 0 | 0.018 | 0.029 | 41.721 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 578 | LEU | 0 | -0.084 | -0.048 | 41.854 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 579 | GLY | 0 | 0.028 | 0.009 | 42.772 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 580 | LEU | 0 | -0.085 | -0.064 | 38.728 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 581 | ILE | 0 | -0.010 | -0.017 | 37.513 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 582 | LEU | 0 | 0.007 | 0.009 | 38.584 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 583 | LEU | 0 | 0.033 | 0.033 | 37.476 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 584 | TYR | 0 | 0.030 | -0.007 | 29.990 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 585 | VAL | 0 | -0.006 | -0.001 | 35.714 | 0.173 | 0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 586 | ALA | 0 | 0.017 | -0.010 | 37.145 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 587 | PHE | 0 | -0.086 | -0.020 | 31.356 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 588 | ARG | 1 | 0.733 | 0.872 | 28.859 | -9.995 | -9.995 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 589 | PHE | 0 | -0.112 | -0.076 | 33.019 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 590 | ASP | -1 | -0.802 | -0.866 | 37.045 | 7.561 | 7.561 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 591 | TRP | 0 | 0.082 | 0.048 | 40.475 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 592 | THR | 0 | -0.011 | -0.011 | 43.038 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 593 | PHE | 0 | 0.003 | -0.011 | 38.961 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 594 | GLY | 0 | 0.018 | -0.009 | 40.972 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 595 | VAL | 0 | -0.020 | -0.008 | 41.715 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 596 | ALA | 0 | 0.003 | -0.002 | 43.912 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 597 | SER | 0 | -0.005 | -0.002 | 40.858 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 598 | ILE | 0 | 0.067 | 0.027 | 42.962 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 599 | LEU | 0 | 0.002 | 0.012 | 44.576 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 600 | ALA | 0 | 0.029 | 0.024 | 44.681 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 601 | VAL | 0 | 0.086 | 0.038 | 42.596 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 602 | ALA | 0 | -0.032 | 0.009 | 45.927 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 603 | HIS | 1 | 0.816 | 0.880 | 48.918 | -6.410 | -6.410 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 604 | ASP | -1 | -0.785 | -0.894 | 45.420 | 6.750 | 6.750 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 605 | VAL | 0 | -0.043 | -0.039 | 47.225 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 606 | ALA | 0 | 0.045 | 0.031 | 49.453 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 607 | ILE | 0 | 0.026 | 0.022 | 50.869 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 608 | VAL | 0 | 0.017 | 0.009 | 48.875 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 609 | ALA | 0 | 0.082 | 0.045 | 52.307 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 610 | GLY | 0 | 0.018 | 0.007 | 54.539 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 611 | MET | 0 | -0.075 | -0.014 | 53.610 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 612 | TYR | 0 | -0.019 | -0.029 | 51.436 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 613 | SER | 0 | -0.042 | -0.037 | 56.622 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 614 | LEU | 0 | -0.092 | -0.039 | 59.299 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 615 | LEU | 0 | -0.029 | -0.030 | 55.806 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 616 | GLY | 0 | -0.065 | -0.018 | 59.893 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 617 | LEU | 0 | -0.046 | -0.020 | 55.198 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 618 | GLU | -1 | -0.833 | -0.940 | 55.658 | 5.598 | 5.598 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 619 | PHE | 0 | -0.054 | -0.043 | 53.562 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 620 | SER | 0 | 0.051 | 0.036 | 52.726 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 621 | ILE | 0 | 0.054 | 0.008 | 49.146 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 622 | PRO | 0 | 0.009 | 0.007 | 47.253 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 623 | THR | 0 | 0.044 | 0.050 | 47.268 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 624 | ILE | 0 | 0.034 | 0.031 | 47.474 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 625 | ALA | 0 | 0.018 | 0.005 | 43.753 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 626 | ALA | 0 | 0.030 | 0.002 | 44.024 | 0.162 | 0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 627 | LEU | 0 | 0.048 | 0.014 | 44.406 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 628 | LEU | 0 | -0.004 | -0.011 | 42.023 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 629 | THR | 0 | -0.019 | -0.020 | 39.743 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 630 | ILE | 0 | -0.118 | -0.029 | 40.513 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 631 | VAL | 0 | 0.002 | -0.006 | 40.980 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 632 | GLY | 0 | -0.037 | -0.002 | 37.774 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 633 | TYR | 0 | -0.057 | -0.029 | 34.455 | 0.424 | 0.424 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 634 | SER | 0 | 0.053 | 0.033 | 37.716 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 635 | ILE | 0 | 0.060 | 0.019 | 36.586 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 636 | ASN | 0 | 0.046 | 0.020 | 33.685 | 0.287 | 0.287 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 637 | ASH | 0 | 0.000 | 0.016 | 34.852 | 0.256 | 0.256 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 638 | SER | 0 | 0.065 | 0.009 | 36.819 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 639 | ILE | 0 | -0.108 | -0.024 | 32.347 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 640 | VAL | 0 | 0.024 | 0.013 | 31.815 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 641 | VAL | 0 | -0.061 | -0.026 | 33.647 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 642 | SER | 0 | -0.010 | -0.043 | 35.597 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 643 | ASP | -1 | -0.870 | -0.939 | 29.447 | 10.208 | 10.208 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 644 | ARG | 1 | 0.815 | 0.896 | 30.087 | -9.762 | -9.762 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 645 | ILE | 0 | -0.019 | -0.003 | 33.172 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 646 | ARG | 1 | 0.840 | 0.906 | 33.780 | -8.218 | -8.218 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 647 | GLU | -1 | -0.793 | -0.891 | 29.256 | 10.229 | 10.229 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 648 | ASN | 0 | -0.013 | -0.027 | 32.501 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 649 | GLN | 0 | -0.048 | -0.024 | 35.084 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 650 | LYS | 1 | 0.895 | 0.944 | 32.913 | -9.329 | -9.329 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 651 | LEU | 0 | -0.052 | -0.007 | 31.604 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 652 | LEU | 0 | -0.061 | -0.033 | 35.047 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 653 | ARG | 1 | 0.987 | 0.982 | 38.620 | -7.834 | -7.834 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 654 | HIS | 0 | 0.017 | 0.019 | 39.789 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 655 | LEU | 0 | -0.012 | -0.005 | 40.549 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 656 | PRO | 0 | 0.063 | 0.042 | 44.131 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 657 | TYR | 0 | 0.046 | 0.006 | 44.382 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 658 | ALA | 0 | 0.055 | 0.033 | 44.402 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 659 | GLU | -1 | -0.810 | -0.903 | 45.428 | 6.559 | 6.559 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 660 | LEU | 0 | 0.012 | -0.009 | 39.397 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 661 | VAL | 0 | -0.012 | -0.014 | 41.512 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 662 | ASN | 0 | -0.022 | -0.048 | 41.333 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 663 | ARG | 1 | 0.850 | 0.952 | 37.458 | -7.918 | -7.918 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 664 | SER | 0 | -0.033 | -0.003 | 36.862 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 665 | ILE | 0 | 0.020 | 0.009 | 37.249 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 666 | ASN | 0 | -0.010 | -0.003 | 38.370 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 667 | GLN | 0 | 0.001 | 0.007 | 33.396 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 668 | THR | 0 | -0.002 | -0.013 | 34.309 | 0.233 | 0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 669 | LEU | 0 | -0.004 | 0.009 | 35.376 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 670 | SER | 0 | -0.014 | -0.003 | 33.757 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 671 | ARG | 1 | 0.952 | 0.975 | 27.834 | -10.320 | -10.320 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 672 | THR | 0 | 0.023 | 0.001 | 33.644 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 673 | VAL | 0 | -0.022 | -0.033 | 36.399 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 674 | MET | 0 | 0.015 | 0.017 | 33.638 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 675 | THR | 0 | -0.035 | 0.016 | 33.193 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 676 | SER | 0 | 0.088 | 0.032 | 34.671 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 677 | LEU | 0 | 0.017 | 0.011 | 38.066 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 678 | THR | 0 | -0.003 | -0.035 | 32.594 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 679 | THR | 0 | -0.006 | 0.003 | 35.277 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 680 | LEU | 0 | -0.095 | -0.040 | 36.853 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 681 | LEU | 0 | -0.022 | -0.014 | 37.620 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 682 | PRO | 0 | 0.005 | 0.006 | 36.466 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 683 | ILE | 0 | -0.004 | 0.023 | 39.631 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 684 | LEU | 0 | 0.028 | 0.037 | 42.065 | -0.204 | -0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 685 | ALA | 0 | 0.017 | -0.005 | 42.278 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 686 | LEU | 0 | -0.016 | -0.026 | 42.607 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 687 | LEU | 0 | -0.077 | -0.050 | 44.734 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 688 | PHE | 0 | -0.044 | -0.045 | 47.574 | -0.171 | -0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 689 | LEU | 0 | -0.059 | -0.020 | 45.827 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 690 | GLY | 0 | -0.018 | 0.004 | 47.854 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 691 | GLY | 0 | 0.054 | 0.015 | 48.685 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 692 | SER | 0 | 0.081 | 0.034 | 50.949 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 693 | VAL | 0 | 0.067 | 0.032 | 50.156 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 694 | LEU | 0 | -0.037 | -0.015 | 45.581 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 695 | ARG | 1 | 0.896 | 0.957 | 48.453 | -5.759 | -5.759 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 696 | ASP | -1 | -0.829 | -0.917 | 50.103 | 5.884 | 5.884 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 697 | PHE | 0 | 0.017 | 0.000 | 42.431 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 698 | ALA | 0 | -0.048 | -0.020 | 45.372 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 699 | LEU | 0 | 0.047 | 0.021 | 46.130 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 700 | ALA | 0 | -0.006 | 0.016 | 48.096 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 701 | ILE | 0 | 0.002 | -0.014 | 40.393 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 702 | PHE | 0 | 0.023 | -0.003 | 44.472 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 703 | VAL | 0 | 0.001 | -0.006 | 45.571 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 704 | GLY | 0 | 0.046 | 0.015 | 46.464 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 705 | ILE | 0 | 0.018 | 0.019 | 39.219 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 706 | PHE | 0 | 0.036 | 0.024 | 43.671 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 707 | VAL | 0 | -0.011 | -0.020 | 45.482 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 708 | GLY | 0 | -0.002 | -0.002 | 44.164 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 709 | THR | 0 | -0.075 | -0.020 | 40.826 | 0.159 | 0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 710 | TYR | 0 | 0.016 | 0.006 | 43.017 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 711 | SER | 0 | -0.080 | -0.053 | 45.814 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 712 | SER | 0 | -0.008 | -0.011 | 41.548 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 713 | ILE | 0 | -0.051 | -0.028 | 42.148 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 714 | TYR | 0 | -0.012 | -0.013 | 43.529 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 715 | VAL | 0 | 0.023 | 0.010 | 47.206 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 716 | VAL | 0 | 0.038 | 0.024 | 42.171 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 717 | SER | 0 | -0.027 | -0.015 | 45.099 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 718 | ALA | 0 | 0.021 | 0.003 | 46.072 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 719 | LEU | 0 | -0.060 | -0.017 | 47.306 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 720 | VAL | 0 | 0.008 | -0.001 | 43.662 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 721 | VAL | 0 | -0.053 | -0.024 | 46.958 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 722 | ALA | 0 | 0.008 | 0.000 | 49.879 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 723 | TRP | 0 | -0.001 | -0.006 | 48.849 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 724 | LYS | 1 | 0.911 | 0.965 | 43.059 | -7.063 | -7.063 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 725 | ASN | 0 | -0.080 | -0.018 | 49.843 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 726 | ARG | 1 | 1.017 | 1.024 | 52.419 | -5.463 | -5.463 | 0.000 | 0.000 | 0.000 | 0.000 |