FMODB ID: YZG52
Calculation Name: 3LO7-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 3LO7
Chain ID: A
UniProt ID: P9WKD1
Base Structure: X-ray
Registration Date: 2023-09-19
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 | 421 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -6824578.054338 |
---|---|
FMO2-HF: Nuclear repulsion | 6670276.381125 |
FMO2-HF: Total energy | -154301.673213 |
FMO2-MP2: Total energy | -154755.266652 |
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:45:LEU)
Summations of interaction energy for
fragment #1(A:45:LEU)
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. |
-10.437 | -1.913 | 6.331 | -4.667 | -10.187 | 0.001 |
Interaction energy analysis for fragmet #1(A:45:LEU)
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 | 47 | GLU | -1 | -0.804 | -0.879 | 2.782 | -3.198 | 0.060 | 0.170 | -1.433 | -1.994 | -0.002 |
4 | A | 48 | TYR | 0 | -0.012 | -0.009 | 2.615 | 0.508 | 1.710 | 0.150 | -0.315 | -1.036 | 0.000 |
5 | A | 49 | SER | 0 | -0.091 | -0.056 | 4.361 | 1.145 | 1.360 | -0.001 | -0.027 | -0.187 | 0.000 |
6 | A | 50 | ARG | 1 | 0.991 | 1.001 | 6.134 | 1.877 | 1.877 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 51 | GLN | 0 | -0.038 | -0.013 | 9.132 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 52 | ARG | 1 | 0.779 | 0.873 | 9.848 | 0.602 | 0.602 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 53 | GLY | 0 | 0.034 | 0.027 | 11.961 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 54 | GLN | 0 | -0.018 | -0.024 | 15.553 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 55 | ILE | 0 | 0.020 | 0.024 | 17.266 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 56 | THR | 0 | -0.006 | -0.024 | 20.327 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 57 | ALA | 0 | 0.053 | 0.035 | 23.884 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 58 | GLY | 0 | 0.047 | 0.026 | 27.402 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 59 | GLY | 0 | -0.016 | -0.005 | 28.421 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 60 | GLN | 0 | -0.030 | -0.006 | 27.206 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 61 | LEU | 0 | -0.009 | -0.011 | 21.175 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 62 | LEU | 0 | -0.009 | -0.008 | 22.004 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 63 | ALA | 0 | 0.026 | 0.002 | 16.779 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 64 | TYR | 0 | -0.002 | 0.005 | 16.558 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 65 | SER | 0 | 0.035 | 0.031 | 11.362 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 66 | VAL | 0 | -0.003 | 0.009 | 13.588 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 67 | ALA | 0 | -0.002 | 0.001 | 11.339 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 68 | THR | 0 | -0.050 | -0.049 | 10.050 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 69 | ASP | -1 | -0.895 | -0.948 | 10.059 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 70 | GLY | 0 | -0.006 | 0.011 | 8.334 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 71 | ARG | 1 | 0.955 | 0.962 | 2.371 | -5.882 | -5.281 | 2.444 | -0.611 | -2.434 | 0.005 |
28 | A | 72 | PHE | 0 | -0.056 | -0.021 | 2.308 | -6.216 | -3.159 | 3.569 | -2.263 | -4.364 | -0.002 |
29 | A | 73 | ARG | 1 | 1.048 | 1.014 | 4.588 | 1.019 | 1.210 | -0.001 | -0.018 | -0.172 | 0.000 |
30 | A | 74 | PHE | 0 | 0.001 | 0.023 | 6.778 | 0.336 | 0.336 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 75 | LEU | 0 | -0.024 | 0.000 | 8.778 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 76 | ARG | 1 | 0.745 | 0.824 | 11.307 | 0.253 | 0.253 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 77 | VAL | 0 | 0.019 | 0.008 | 12.852 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 78 | TYR | 0 | 0.007 | -0.042 | 14.742 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 79 | PRO | 0 | -0.017 | -0.003 | 19.443 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 80 | ASN | 0 | -0.009 | -0.009 | 22.729 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 81 | PRO | 0 | 0.017 | 0.012 | 21.490 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 82 | GLU | -1 | -0.885 | -0.942 | 23.122 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 83 | VAL | 0 | -0.001 | 0.029 | 25.704 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 84 | TYR | 0 | 0.036 | 0.006 | 23.987 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 85 | ALA | 0 | 0.047 | 0.056 | 21.967 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 86 | PRO | 0 | -0.044 | -0.021 | 22.346 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 87 | VAL | 0 | -0.025 | -0.009 | 23.437 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 88 | THR | 0 | -0.011 | -0.029 | 18.887 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 89 | GLY | 0 | -0.030 | 0.000 | 18.451 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 90 | PHE | 0 | 0.011 | -0.003 | 13.898 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 91 | TYR | 0 | -0.026 | -0.047 | 6.387 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 92 | SER | 0 | -0.066 | -0.041 | 10.695 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 93 | LEU | 0 | -0.033 | -0.015 | 4.907 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 94 | ARG | 1 | 0.847 | 0.934 | 7.814 | -0.674 | -0.674 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 95 | TYR | 0 | 0.040 | 0.007 | 10.542 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 96 | SER | 0 | 0.037 | 0.037 | 10.422 | -0.131 | -0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 97 | SER | 0 | 0.063 | 0.021 | 11.460 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 98 | THR | 0 | 0.015 | 0.012 | 13.819 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 99 | ALA | 0 | 0.041 | 0.013 | 17.545 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 100 | LEU | 0 | 0.051 | 0.023 | 19.285 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 101 | GLU | -1 | -0.714 | -0.781 | 14.114 | -0.313 | -0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 102 | ARG | 1 | 0.833 | 0.918 | 14.057 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 103 | ALA | 0 | -0.052 | -0.031 | 16.049 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 104 | GLU | -1 | -0.856 | -0.947 | 18.065 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 105 | ASP | -1 | -0.816 | -0.874 | 11.559 | -0.637 | -0.637 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 106 | PRO | 0 | 0.017 | 0.006 | 13.645 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 107 | ILE | 0 | 0.007 | 0.009 | 15.319 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 108 | LEU | 0 | -0.024 | 0.005 | 14.042 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 109 | ASN | 0 | 0.003 | 0.009 | 9.932 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 110 | GLY | 0 | 0.028 | -0.002 | 11.629 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 111 | SER | 0 | -0.105 | -0.054 | 12.804 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 112 | ASP | -1 | -0.806 | -0.881 | 14.731 | -0.268 | -0.268 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 113 | ARG | 1 | 0.997 | 0.980 | 18.121 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 114 | ARG | 1 | 0.824 | 0.890 | 20.949 | 0.274 | 0.274 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 115 | LEU | 0 | -0.068 | 0.003 | 17.353 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 130 | ARG | 1 | 0.855 | 0.910 | 14.467 | 0.370 | 0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 131 | GLY | 0 | 0.015 | 0.022 | 14.128 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 132 | GLY | 0 | 0.015 | 0.004 | 14.975 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 133 | ASN | 0 | -0.005 | -0.015 | 17.435 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 134 | VAL | 0 | -0.006 | -0.010 | 19.202 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 135 | ASP | -1 | -0.839 | -0.889 | 21.747 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 136 | THR | 0 | -0.036 | -0.040 | 24.035 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 137 | THR | 0 | -0.059 | -0.052 | 26.595 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 138 | ILE | 0 | -0.045 | -0.008 | 27.458 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 139 | ASN | 0 | 0.031 | 0.010 | 30.187 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 140 | PRO | 0 | 0.030 | 0.004 | 29.578 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 141 | ARG | 1 | 0.896 | 0.927 | 31.649 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 142 | ILE | 0 | -0.030 | 0.011 | 34.848 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 143 | GLN | 0 | 0.024 | -0.005 | 28.574 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 144 | GLN | 0 | -0.050 | -0.031 | 31.326 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 145 | ALA | 0 | 0.040 | 0.027 | 33.388 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 146 | GLY | 0 | 0.008 | -0.008 | 35.485 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 147 | TRP | 0 | -0.029 | -0.019 | 29.758 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 148 | ASP | -1 | -0.814 | -0.911 | 33.731 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 149 | ALA | 0 | -0.029 | -0.013 | 36.327 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 150 | MET | 0 | -0.033 | -0.011 | 35.307 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 151 | GLN | 0 | -0.015 | -0.003 | 33.055 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 152 | GLN | 0 | -0.002 | -0.008 | 36.736 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 153 | GLY | 0 | -0.036 | -0.011 | 40.222 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 154 | CYS | 0 | -0.105 | -0.030 | 37.315 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 155 | TYR | 0 | -0.046 | -0.030 | 42.833 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 156 | GLY | 0 | 0.037 | 0.034 | 40.557 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 157 | PRO | 0 | 0.003 | -0.004 | 35.503 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 159 | LYS | 1 | 0.816 | 0.910 | 33.993 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 160 | GLY | 0 | 0.033 | 0.007 | 34.493 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 161 | ALA | 0 | -0.054 | -0.030 | 33.740 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 162 | VAL | 0 | 0.035 | 0.013 | 34.013 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 163 | VAL | 0 | -0.024 | 0.003 | 33.434 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 164 | ALA | 0 | 0.016 | 0.005 | 34.876 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 165 | LEU | 0 | 0.007 | 0.008 | 35.143 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 166 | GLU | -1 | -0.724 | -0.821 | 37.279 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 167 | PRO | 0 | -0.015 | -0.008 | 39.183 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 168 | SER | 0 | 0.017 | 0.016 | 41.959 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 169 | THR | 0 | -0.092 | -0.088 | 37.650 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 170 | GLY | 0 | 0.028 | 0.019 | 36.948 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 171 | LYS | 1 | 0.838 | 0.911 | 33.616 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 172 | ILE | 0 | 0.007 | -0.001 | 30.293 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 173 | LEU | 0 | -0.004 | 0.009 | 31.660 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 174 | ALA | 0 | 0.010 | 0.000 | 31.766 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 175 | LEU | 0 | -0.025 | -0.013 | 27.041 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 176 | VAL | 0 | 0.032 | 0.024 | 29.111 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 177 | SER | 0 | -0.004 | 0.002 | 28.522 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 178 | SER | 0 | 0.029 | 0.029 | 29.994 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 179 | PRO | 0 | 0.044 | 0.002 | 30.113 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 180 | SER | 0 | -0.022 | -0.031 | 26.123 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 181 | TYR | 0 | 0.016 | -0.004 | 19.335 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 182 | ASP | -1 | -0.730 | -0.869 | 20.963 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 183 | PRO | 0 | -0.032 | -0.023 | 17.715 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 184 | ASN | 0 | -0.027 | -0.043 | 16.406 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 185 | LEU | 0 | -0.029 | -0.003 | 16.353 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 186 | LEU | 0 | -0.014 | -0.013 | 14.711 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 187 | ALA | 0 | 0.034 | 0.043 | 11.966 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 188 | SER | 0 | 0.031 | 0.019 | 11.775 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 189 | HIS | 1 | 0.858 | 0.911 | 8.142 | -0.287 | -0.287 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 190 | ASN | 0 | 0.042 | 0.033 | 9.666 | 0.278 | 0.278 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 191 | PRO | 0 | 0.032 | 0.013 | 10.541 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 192 | GLU | -1 | -0.823 | -0.905 | 12.623 | 0.368 | 0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 193 | VAL | 0 | -0.017 | -0.005 | 15.747 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 194 | GLN | 0 | 0.002 | -0.002 | 10.582 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 195 | ALA | 0 | -0.007 | -0.003 | 15.792 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 196 | GLN | 0 | -0.009 | -0.016 | 17.836 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 197 | ALA | 0 | -0.027 | -0.007 | 18.675 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 198 | TRP | 0 | 0.012 | 0.001 | 17.745 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 199 | GLN | 0 | -0.060 | -0.045 | 19.900 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 200 | ARG | 1 | 0.945 | 0.977 | 22.400 | -0.248 | -0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 201 | LEU | 0 | -0.049 | -0.032 | 20.734 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 202 | GLY | 0 | 0.012 | 0.003 | 23.679 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 203 | ASP | -1 | -0.846 | -0.898 | 25.087 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 204 | ASN | 0 | -0.056 | -0.016 | 27.728 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 205 | PRO | 0 | 0.052 | 0.012 | 29.641 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 206 | ALA | 0 | -0.036 | -0.010 | 31.800 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 207 | SER | 0 | 0.018 | 0.009 | 28.328 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 208 | PRO | 0 | 0.028 | 0.010 | 25.774 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 209 | LEU | 0 | -0.028 | -0.015 | 20.749 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 210 | THR | 0 | -0.040 | -0.002 | 24.287 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 211 | ASN | 0 | 0.006 | 0.001 | 25.503 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 212 | ARG | 1 | 0.918 | 0.935 | 27.548 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 213 | ALA | 0 | 0.014 | 0.011 | 30.492 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 214 | ILE | 0 | -0.055 | -0.034 | 26.470 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 215 | SER | 0 | 0.008 | 0.004 | 27.516 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 216 | GLU | -1 | -0.838 | -0.891 | 29.888 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 217 | THR | 0 | -0.031 | -0.017 | 33.028 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 218 | TYR | 0 | -0.039 | -0.058 | 34.664 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 219 | PRO | 0 | 0.043 | 0.034 | 39.780 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 220 | PRO | 0 | -0.008 | 0.023 | 43.405 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 221 | GLY | 0 | 0.042 | 0.025 | 44.547 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 222 | SER | 0 | 0.018 | -0.012 | 48.023 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 223 | THR | 0 | -0.038 | -0.011 | 45.511 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 224 | PHE | 0 | 0.063 | 0.028 | 46.337 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 225 | LYS | 1 | 0.870 | 0.929 | 48.624 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 226 | VAL | 0 | -0.002 | 0.018 | 48.643 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 227 | ILE | 0 | 0.007 | 0.010 | 46.575 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 228 | THR | 0 | -0.015 | -0.030 | 50.496 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 229 | THR | 0 | -0.008 | -0.019 | 53.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 230 | ALA | 0 | 0.002 | 0.009 | 52.064 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 231 | ALA | 0 | -0.020 | -0.008 | 53.540 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 232 | ALA | 0 | 0.040 | 0.023 | 55.115 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 233 | LEU | 0 | -0.042 | -0.031 | 56.659 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 234 | ALA | 0 | -0.064 | -0.034 | 55.797 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 235 | ALA | 0 | -0.051 | -0.016 | 57.947 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 236 | GLY | 0 | -0.013 | -0.001 | 60.589 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 237 | ALA | 0 | 0.007 | 0.021 | 61.445 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 238 | THR | 0 | -0.013 | -0.010 | 62.980 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 239 | GLU | -1 | -0.798 | -0.905 | 61.247 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 240 | THR | 0 | -0.005 | -0.019 | 64.140 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 241 | GLU | -1 | -0.882 | -0.914 | 65.235 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 242 | GLN | 0 | -0.011 | -0.007 | 66.273 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 243 | LEU | 0 | -0.014 | -0.008 | 61.796 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 244 | THR | 0 | -0.012 | -0.012 | 64.498 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 245 | ALA | 0 | 0.043 | 0.013 | 64.682 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 246 | ALA | 0 | 0.030 | 0.025 | 66.090 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 247 | PRO | 0 | 0.028 | 0.028 | 63.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 248 | THR | 0 | 0.027 | 0.001 | 62.393 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 249 | ILE | 0 | -0.065 | -0.031 | 61.235 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 250 | PRO | 0 | 0.025 | 0.016 | 62.568 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 258 | LEU | 0 | -0.041 | -0.029 | 55.207 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 259 | GLU | -1 | -0.896 | -0.943 | 57.945 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 260 | ASN | 0 | -0.019 | 0.000 | 57.712 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 261 | TYR | 0 | -0.029 | -0.033 | 51.733 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 262 | GLY | 0 | 0.009 | 0.000 | 56.542 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 263 | GLY | 0 | 0.047 | 0.033 | 58.387 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 264 | ALA | 0 | -0.018 | 0.002 | 61.307 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 265 | PRO | 0 | 0.018 | -0.003 | 62.939 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 266 | CYS | 0 | -0.073 | -0.016 | 57.477 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 267 | GLY | 0 | 0.031 | -0.004 | 63.924 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 268 | ASP | -1 | -0.903 | -0.926 | 67.030 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 269 | GLU | -1 | -0.942 | -0.956 | 69.879 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 270 | PRO | 0 | -0.016 | -0.018 | 70.115 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 271 | THR | 0 | -0.057 | -0.046 | 68.497 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 272 | VAL | 0 | 0.042 | 0.033 | 64.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 273 | SER | 0 | 0.002 | 0.004 | 65.768 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 274 | LEU | 0 | 0.058 | 0.031 | 59.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 275 | ARG | 1 | 0.996 | 0.989 | 60.820 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 276 | GLU | -1 | -0.903 | -0.945 | 60.633 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 277 | ALA | 0 | 0.058 | 0.013 | 60.697 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 278 | PHE | 0 | -0.034 | -0.012 | 52.512 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 279 | VAL | 0 | -0.072 | -0.026 | 56.193 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 280 | LYS | 1 | 0.831 | 0.913 | 57.473 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 281 | SER | 0 | -0.022 | -0.015 | 55.871 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 283 | ASN | 0 | 0.024 | -0.005 | 54.919 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 284 | THR | 0 | 0.001 | -0.002 | 57.598 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 285 | ALA | 0 | 0.049 | 0.030 | 60.732 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 286 | PHE | 0 | 0.020 | -0.015 | 56.251 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 287 | VAL | 0 | -0.022 | 0.014 | 57.471 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 288 | GLN | 0 | 0.015 | 0.007 | 58.860 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 289 | LEU | 0 | 0.023 | 0.017 | 58.290 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 290 | GLY | 0 | 0.038 | 0.019 | 57.242 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 291 | ILE | 0 | -0.058 | -0.041 | 57.930 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 292 | ARG | 1 | 0.790 | 0.889 | 60.433 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 293 | THR | 0 | -0.029 | -0.012 | 57.619 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 294 | GLY | 0 | 0.030 | 0.019 | 59.035 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 295 | ALA | 0 | 0.003 | -0.022 | 54.767 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 296 | ASP | -1 | -0.904 | -0.944 | 54.085 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 297 | ALA | 0 | 0.007 | -0.007 | 54.043 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 298 | LEU | 0 | 0.019 | 0.020 | 51.578 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 299 | ARG | 1 | 0.910 | 0.950 | 49.796 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 300 | SER | 0 | -0.030 | -0.017 | 49.046 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 301 | MET | 0 | -0.003 | 0.007 | 49.597 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 302 | ALA | 0 | 0.023 | 0.005 | 46.507 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 303 | ARG | 1 | 0.959 | 0.982 | 44.958 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 304 | ALA | 0 | -0.031 | 0.004 | 44.817 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 305 | PHE | 0 | -0.029 | -0.037 | 44.721 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 306 | GLY | 0 | -0.058 | -0.029 | 41.056 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 307 | LEU | 0 | -0.033 | -0.011 | 40.374 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 308 | ASP | -1 | -0.839 | -0.913 | 40.980 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 309 | SER | 0 | -0.026 | 0.004 | 39.677 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 310 | PRO | 0 | 0.039 | 0.022 | 34.450 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 311 | PRO | 0 | 0.022 | 0.027 | 32.628 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 312 | ARG | 1 | 0.847 | 0.921 | 32.073 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 313 | PRO | 0 | 0.014 | 0.014 | 26.799 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 314 | THR | 0 | 0.016 | 0.020 | 27.729 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 315 | PRO | 0 | 0.017 | -0.002 | 23.364 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 316 | LEU | 0 | 0.007 | 0.011 | 22.415 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 317 | GLN | 0 | 0.004 | -0.007 | 24.790 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 318 | VAL | 0 | -0.009 | 0.002 | 27.006 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 319 | ALA | 0 | 0.008 | -0.002 | 30.414 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 320 | GLU | -1 | -0.912 | -0.973 | 32.350 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 321 | SER | 0 | 0.012 | 0.011 | 35.670 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 322 | THR | 0 | -0.031 | -0.029 | 38.785 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 323 | VAL | 0 | 0.005 | -0.015 | 41.939 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 324 | GLY | 0 | 0.026 | 0.023 | 44.901 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 325 | PRO | 0 | -0.017 | -0.015 | 46.309 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 326 | ILE | 0 | -0.036 | -0.011 | 49.044 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 327 | PRO | 0 | -0.006 | -0.011 | 51.730 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 328 | ASP | -1 | -0.808 | -0.894 | 54.525 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 329 | SER | 0 | 0.043 | 0.006 | 56.913 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 330 | ALA | 0 | 0.049 | 0.032 | 58.089 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 331 | ALA | 0 | 0.005 | -0.002 | 52.941 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 332 | LEU | 0 | -0.002 | 0.025 | 53.529 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 333 | GLY | 0 | 0.018 | 0.012 | 55.122 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 334 | MET | 0 | -0.031 | -0.024 | 51.860 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 335 | THR | 0 | 0.009 | -0.014 | 49.483 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 336 | SER | 0 | -0.018 | -0.016 | 50.845 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 337 | ILE | 0 | -0.056 | -0.015 | 52.599 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 338 | GLY | 0 | 0.009 | 0.004 | 48.402 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 339 | GLN | 0 | -0.016 | -0.019 | 47.355 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 340 | LYS | 1 | 0.804 | 0.869 | 48.464 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 341 | ASP | -1 | -0.788 | -0.889 | 45.369 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 342 | VAL | 0 | -0.033 | 0.015 | 44.268 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 343 | ALA | 0 | -0.010 | -0.005 | 39.942 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 344 | LEU | 0 | 0.043 | -0.002 | 39.392 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 345 | THR | 0 | 0.009 | 0.025 | 33.595 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 346 | PRO | 0 | 0.003 | -0.011 | 34.627 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 347 | LEU | 0 | -0.002 | 0.006 | 32.176 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 348 | ALA | 0 | 0.048 | 0.034 | 35.673 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 349 | ASN | 0 | -0.001 | -0.023 | 38.367 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 350 | ALA | 0 | -0.022 | -0.010 | 37.857 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 351 | GLU | -1 | -0.832 | -0.948 | 36.970 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 352 | ILE | 0 | -0.036 | 0.020 | 40.280 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 353 | ALA | 0 | 0.019 | 0.004 | 43.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 354 | ALA | 0 | 0.004 | -0.005 | 41.086 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 355 | THR | 0 | -0.021 | -0.012 | 43.125 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 356 | ILE | 0 | -0.058 | -0.023 | 45.045 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 357 | ALA | 0 | -0.001 | 0.007 | 45.395 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 358 | ASN | 0 | -0.042 | -0.021 | 44.578 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 359 | GLY | 0 | 0.040 | 0.022 | 46.915 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 360 | GLY | 0 | 0.007 | -0.003 | 48.763 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 361 | ILE | 0 | -0.068 | -0.033 | 44.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 362 | THR | 0 | 0.052 | 0.013 | 40.326 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 363 | MET | 0 | -0.018 | 0.002 | 39.139 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 364 | ARG | 1 | 0.858 | 0.914 | 30.238 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 365 | PRO | 0 | 0.021 | 0.013 | 33.283 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 366 | TYR | 0 | -0.078 | -0.038 | 30.377 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 367 | LEU | 0 | 0.045 | 0.014 | 25.253 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 368 | VAL | 0 | 0.024 | 0.016 | 23.744 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 369 | GLY | 0 | 0.009 | 0.016 | 26.813 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 370 | SER | 0 | -0.055 | -0.033 | 27.262 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 371 | LEU | 0 | -0.006 | 0.006 | 21.750 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 372 | LYS | 1 | 0.863 | 0.934 | 22.874 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 373 | GLY | 0 | 0.104 | 0.047 | 21.341 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 374 | PRO | 0 | -0.017 | -0.013 | 18.503 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 375 | ASP | -1 | -0.898 | -0.957 | 20.433 | -0.267 | -0.267 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 376 | LEU | 0 | -0.078 | -0.044 | 23.115 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 377 | ALA | 0 | 0.028 | 0.038 | 25.268 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 378 | ASN | 0 | -0.044 | -0.045 | 25.807 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 379 | ILE | 0 | 0.010 | 0.014 | 22.196 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 380 | SER | 0 | -0.015 | -0.019 | 26.213 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 381 | THR | 0 | -0.024 | -0.005 | 27.874 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 382 | THR | 0 | -0.054 | -0.028 | 29.039 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 383 | VAL | 0 | 0.012 | 0.017 | 31.331 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 384 | GLY | 0 | 0.008 | 0.009 | 34.837 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 385 | TYR | 0 | -0.007 | -0.014 | 34.550 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 386 | GLN | 0 | 0.047 | 0.000 | 39.091 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 387 | GLN | 0 | -0.039 | -0.001 | 36.282 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 388 | ARG | 1 | 0.910 | 0.963 | 39.392 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 389 | ARG | 1 | 0.838 | 0.903 | 44.460 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 390 | ALA | 0 | 0.007 | 0.025 | 46.355 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 391 | VAL | 0 | 0.015 | 0.009 | 48.227 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 392 | SER | 0 | 0.031 | 0.019 | 51.662 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 393 | PRO | 0 | 0.052 | 0.013 | 53.593 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 394 | GLN | 0 | 0.046 | 0.013 | 54.582 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 395 | VAL | 0 | 0.036 | 0.027 | 54.025 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 396 | ALA | 0 | 0.010 | 0.011 | 51.519 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 397 | ALA | 0 | 0.015 | 0.019 | 53.167 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 398 | LYS | 1 | 0.921 | 0.947 | 55.837 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 399 | LEU | 0 | -0.017 | -0.018 | 51.585 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 400 | THR | 0 | 0.001 | -0.011 | 52.589 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 401 | GLU | -1 | -0.953 | -0.970 | 53.779 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 402 | LEU | 0 | -0.027 | -0.009 | 55.873 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 403 | MET | 0 | -0.013 | -0.006 | 48.014 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 404 | VAL | 0 | -0.001 | 0.007 | 53.522 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 405 | GLY | 0 | -0.056 | -0.023 | 55.144 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 406 | ALA | 0 | 0.002 | -0.019 | 53.871 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 407 | GLU | -1 | -0.781 | -0.818 | 50.784 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 408 | LYS | 1 | 0.874 | 0.931 | 53.785 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 409 | VAL | 0 | -0.013 | 0.004 | 57.241 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 410 | ALA | 0 | -0.010 | 0.019 | 53.340 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 411 | GLN | 0 | 0.049 | 0.022 | 53.990 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 412 | GLN | 0 | -0.002 | -0.019 | 53.460 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 413 | LYS | 1 | 0.958 | 0.994 | 47.295 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 414 | GLY | 0 | 0.030 | 0.007 | 48.328 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 415 | ALA | 0 | -0.001 | 0.014 | 48.830 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 416 | ILE | 0 | 0.042 | 0.027 | 46.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 417 | PRO | 0 | 0.011 | -0.003 | 50.950 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 418 | GLY | 0 | -0.004 | 0.000 | 53.307 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 419 | VAL | 0 | -0.018 | -0.002 | 48.935 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 420 | GLN | 0 | -0.007 | 0.002 | 52.415 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 421 | ILE | 0 | 0.028 | 0.010 | 47.966 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 422 | ALA | 0 | 0.015 | 0.010 | 49.902 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 423 | SER | 0 | -0.049 | -0.064 | 48.523 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 424 | LYS | 1 | 0.932 | 0.955 | 48.547 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 425 | THR | 0 | -0.003 | 0.010 | 47.964 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 426 | GLY | 0 | -0.036 | -0.037 | 48.094 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 427 | THR | 0 | -0.002 | 0.018 | 47.567 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 428 | ALA | 0 | 0.019 | 0.015 | 44.860 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 429 | GLU | -1 | -0.835 | -0.889 | 45.984 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 430 | HIS | 0 | -0.038 | -0.021 | 42.384 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 431 | GLY | 0 | 0.071 | 0.036 | 43.390 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 432 | THR | 0 | 0.007 | -0.013 | 44.037 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 433 | ASP | -1 | -0.876 | -0.946 | 46.473 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 434 | PRO | 0 | -0.013 | 0.009 | 48.336 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 435 | ARG | 1 | 0.878 | 0.923 | 49.279 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 436 | HIS | 1 | 0.830 | 0.910 | 51.071 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 437 | THR | 0 | 0.001 | 0.020 | 44.535 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 438 | PRO | 0 | 0.010 | 0.004 | 45.620 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 439 | PRO | 0 | 0.021 | 0.011 | 45.489 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 440 | HIS | 0 | 0.061 | 0.041 | 40.642 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 441 | ALA | 0 | -0.009 | 0.003 | 43.531 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 442 | TRP | 0 | -0.013 | -0.006 | 39.367 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 443 | TYR | 0 | -0.037 | -0.046 | 43.397 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 444 | ILE | 0 | -0.011 | 0.011 | 42.584 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 445 | ALA | 0 | 0.012 | -0.007 | 44.091 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 446 | PHE | 0 | 0.000 | -0.001 | 44.286 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 447 | ALA | 0 | 0.031 | 0.029 | 45.816 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 448 | PRO | 0 | 0.056 | 0.017 | 46.148 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 449 | ALA | 0 | -0.031 | -0.019 | 49.743 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 450 | GLN | 0 | -0.003 | -0.018 | 51.526 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 451 | ALA | 0 | -0.016 | 0.000 | 50.563 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 452 | PRO | 0 | -0.001 | 0.021 | 46.495 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 453 | LYS | 1 | 0.840 | 0.906 | 43.529 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 454 | VAL | 0 | 0.011 | 0.013 | 39.863 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 455 | ALA | 0 | 0.008 | 0.005 | 40.881 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 456 | VAL | 0 | -0.033 | -0.019 | 39.639 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 457 | ALA | 0 | 0.000 | 0.004 | 38.811 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 458 | VAL | 0 | -0.018 | -0.001 | 38.466 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 459 | LEU | 0 | -0.024 | 0.002 | 37.033 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 460 | VAL | 0 | 0.022 | 0.000 | 38.396 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 461 | GLU | -1 | -0.754 | -0.889 | 35.704 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 462 | ASN | 0 | -0.095 | -0.060 | 40.056 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 463 | GLY | 0 | 0.033 | 0.020 | 43.295 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 464 | ALA | 0 | -0.064 | -0.017 | 44.494 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 465 | ASP | -1 | -0.759 | -0.843 | 47.954 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 466 | ARG | 1 | 0.938 | 0.955 | 50.900 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 467 | LEU | 0 | -0.013 | -0.003 | 54.318 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 468 | SER | 0 | -0.094 | -0.072 | 52.458 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 469 | ALA | 0 | 0.029 | 0.011 | 55.366 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 470 | THR | 0 | 0.003 | -0.018 | 52.218 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 471 | GLY | 0 | 0.032 | 0.030 | 52.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 472 | GLY | 0 | 0.055 | 0.018 | 48.210 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 473 | ALA | 0 | -0.047 | -0.029 | 47.609 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 474 | LEU | 0 | 0.027 | 0.015 | 44.717 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 475 | ALA | 0 | 0.048 | 0.018 | 43.507 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 476 | ALA | 0 | 0.011 | 0.006 | 44.041 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 477 | PRO | 0 | -0.061 | -0.039 | 45.833 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 478 | ILE | 0 | 0.031 | 0.027 | 39.658 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 479 | GLY | 0 | 0.030 | 0.008 | 41.617 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 480 | ARG | 1 | 0.755 | 0.849 | 42.951 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 481 | ALA | 0 | 0.047 | 0.038 | 41.844 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 482 | VAL | 0 | -0.002 | 0.001 | 37.935 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 483 | ILE | 0 | -0.002 | -0.015 | 40.363 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 484 | GLU | -1 | -0.922 | -0.971 | 43.066 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 485 | ALA | 0 | 0.009 | 0.010 | 38.927 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 486 | ALA | 0 | -0.046 | -0.029 | 39.689 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 487 | LEU | 0 | -0.050 | -0.021 | 40.631 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 488 | GLN | 0 | -0.051 | 0.006 | 41.906 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |