![FMODB](./images/FMODB-Logo_20190201-0_300ppi.png)
FMODB ID: N2N4Q
Calculation Name: 3B43-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 3B43
Chain ID: A
UniProt ID: Q8WZ42
Base Structure: X-ray
Registration Date: 2023-09-27
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptH |
Protonation | MOE:Protonate 3D |
Complement | MOE:Structure Preparation |
Water | No |
Procedure | Auto-FMO protocol ver. 2.20220422 |
FMO calculation
FMO method | FMO2-MP2/6-31G(d) |
---|---|
Fragmentation | Auto |
Number of fragment | 568 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -7403564.604273 |
---|---|
FMO2-HF: Nuclear repulsion | 7182359.946312 |
FMO2-HF: Total energy | -221204.657961 |
FMO2-MP2: Total energy | -221847.065165 |
3D Structure
Ligand structure
![ligand structure](./Kdata/F040607/ligand_interaction/ligand_F040607.png)
Ligand Interaction
![ligand interaction](./Kdata/F040607/ligand_interaction/ligand_interaction_F040607.png)
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:ALA)
Summations of interaction energy for
fragment #1(A:-2:ALA)
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. |
11.366 | -9.186 | 8.807 | 17.256 | -5.512 | -0.043 |
Interaction energy analysis for fragmet #1(A:-2:ALA)
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 | 0 | GLU | -1 | -0.878 | -0.965 | 1.837 | 10.590 | -10.722 | 8.790 | 17.531 | -5.009 | -0.042 |
4 | A | 1 | PRO | 0 | -0.002 | 0.027 | 4.201 | 0.525 | 0.667 | 0.000 | -0.029 | -0.113 | 0.000 |
5 | A | 2 | PRO | 0 | -0.030 | -0.008 | 6.885 | -0.224 | -0.224 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 3 | TYR | 0 | 0.031 | 0.010 | 4.935 | 0.416 | 0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 4 | PHE | 0 | -0.018 | -0.024 | 9.703 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 5 | ILE | 0 | -0.050 | -0.007 | 9.840 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 6 | GLU | -1 | -0.914 | -0.958 | 12.881 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 7 | PRO | 0 | 0.008 | 0.007 | 16.474 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 8 | LEU | 0 | -0.014 | -0.013 | 18.033 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 9 | GLU | -1 | -0.916 | -0.959 | 21.282 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 10 | HIS | 0 | -0.060 | -0.035 | 24.270 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 11 | VAL | 0 | 0.021 | 0.011 | 27.898 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 12 | GLU | -1 | -0.900 | -0.956 | 29.847 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 13 | ALA | 0 | -0.023 | -0.018 | 33.014 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 14 | ALA | 0 | -0.010 | -0.007 | 34.653 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 15 | ILE | 0 | 0.067 | 0.014 | 37.649 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 16 | GLY | 0 | -0.046 | -0.013 | 39.614 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 17 | GLU | -1 | -0.975 | -0.995 | 37.247 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 18 | PRO | 0 | -0.038 | -0.010 | 32.995 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 19 | ILE | 0 | 0.041 | 0.023 | 29.736 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 20 | THR | 0 | -0.075 | -0.055 | 26.053 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 21 | LEU | 0 | 0.040 | 0.028 | 24.527 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 22 | GLN | 0 | -0.036 | -0.055 | 20.358 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 23 | CYS | 0 | 0.035 | 0.053 | 17.017 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 24 | LYS | 1 | 0.980 | 0.983 | 13.131 | 0.140 | 0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 25 | VAL | 0 | -0.057 | -0.049 | 10.695 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 26 | ASP | -1 | -0.841 | -0.907 | 6.351 | -0.661 | -0.661 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 27 | GLY | 0 | 0.007 | -0.003 | 4.314 | -0.012 | 0.021 | -0.001 | -0.007 | -0.025 | 0.000 |
31 | A | 28 | THR | 0 | -0.062 | -0.035 | 3.628 | 0.501 | 1.046 | 0.019 | -0.233 | -0.332 | -0.001 |
32 | A | 29 | PRO | 0 | 0.004 | -0.012 | 4.890 | -0.120 | -0.080 | -0.001 | -0.006 | -0.033 | 0.000 |
33 | A | 30 | GLU | -1 | -0.919 | -0.947 | 7.983 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 31 | ILE | 0 | -0.017 | -0.002 | 7.935 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 32 | ARG | 1 | 0.889 | 0.929 | 11.766 | 0.135 | 0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 33 | ILE | 0 | 0.040 | 0.020 | 15.360 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 34 | ALA | 0 | -0.092 | -0.042 | 17.370 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 35 | TRP | 0 | 0.099 | 0.034 | 20.527 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 36 | TYR | 0 | -0.024 | -0.022 | 21.276 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 37 | LYS | 1 | 0.867 | 0.933 | 25.857 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 38 | GLU | -1 | -0.808 | -0.882 | 25.902 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 39 | HIS | 0 | -0.026 | 0.027 | 27.490 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 40 | THR | 0 | -0.030 | -0.045 | 28.751 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 41 | LYS | 1 | 0.925 | 0.987 | 23.337 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 42 | LEU | 0 | 0.002 | 0.003 | 26.387 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 43 | ARG | 1 | 0.910 | 0.957 | 26.123 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 44 | SER | 0 | 0.058 | 0.010 | 27.120 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 45 | ALA | 0 | -0.001 | -0.008 | 28.932 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 46 | PRO | 0 | -0.006 | 0.000 | 32.208 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 47 | ALA | 0 | 0.049 | 0.029 | 34.080 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 48 | TYR | 0 | 0.024 | 0.025 | 28.606 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 49 | LYS | 1 | 0.929 | 0.959 | 28.106 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 50 | MET | 0 | -0.007 | 0.003 | 23.229 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 51 | GLN | 0 | -0.067 | -0.036 | 21.577 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 52 | PHE | 0 | 0.035 | 0.000 | 12.098 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 53 | LYS | 1 | 1.010 | 1.027 | 16.822 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 54 | ASN | 0 | -0.013 | -0.007 | 14.623 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 55 | ASN | 0 | 0.061 | 0.030 | 9.145 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 56 | VAL | 0 | -0.016 | 0.013 | 12.930 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 57 | ALA | 0 | -0.018 | 0.009 | 16.280 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 58 | SER | 0 | -0.004 | -0.025 | 18.054 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 59 | LEU | 0 | -0.056 | -0.007 | 21.795 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 60 | VAL | 0 | -0.012 | -0.017 | 24.897 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 61 | ILE | 0 | 0.006 | 0.016 | 28.091 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 62 | ASN | 0 | -0.003 | -0.026 | 31.259 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 63 | LYS | 1 | 0.906 | 0.949 | 33.890 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 64 | VAL | 0 | -0.005 | 0.032 | 33.989 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 65 | ASP | -1 | -0.847 | -0.904 | 36.477 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 66 | HIS | 0 | 0.018 | -0.006 | 37.667 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 67 | SER | 0 | -0.087 | -0.042 | 37.515 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 68 | ASP | -1 | -0.804 | -0.919 | 33.366 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 69 | VAL | 0 | 0.004 | 0.016 | 33.018 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 70 | GLY | 0 | -0.017 | -0.009 | 32.852 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 71 | GLH | 0 | -0.056 | -0.054 | 26.623 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 72 | TYR | 0 | -0.053 | -0.054 | 25.581 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 73 | THR | 0 | 0.027 | -0.013 | 21.239 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 74 | CYS | 0 | -0.081 | -0.029 | 18.253 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 75 | LYS | 1 | 0.904 | 0.937 | 16.873 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 76 | ALA | 0 | 0.020 | 0.026 | 12.591 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 77 | GLU | -1 | -0.875 | -0.956 | 13.140 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 78 | ASN | 0 | 0.050 | 0.024 | 6.916 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 79 | SER | 0 | -0.011 | -0.017 | 10.102 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 80 | VAL | 0 | -0.038 | -0.003 | 6.454 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 81 | GLY | 0 | 0.009 | -0.010 | 9.844 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 82 | ALA | 0 | -0.018 | -0.021 | 11.750 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 83 | VAL | 0 | -0.004 | 0.032 | 11.230 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 84 | ALA | 0 | -0.001 | -0.035 | 14.014 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 85 | SER | 0 | -0.010 | 0.024 | 17.360 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 86 | SER | 0 | 0.030 | 0.011 | 19.189 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 87 | ALA | 0 | 0.007 | 0.030 | 22.968 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 88 | VAL | 0 | 0.003 | -0.005 | 25.514 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 89 | LEU | 0 | -0.022 | 0.027 | 29.185 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 90 | VAL | 0 | 0.042 | -0.009 | 31.242 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 91 | ILE | 0 | 0.014 | 0.019 | 34.714 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 92 | LYS | 1 | 0.904 | 0.960 | 35.122 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 93 | GLU | -1 | -0.912 | -0.951 | 38.961 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 94 | ARG | 1 | 0.908 | 0.963 | 41.700 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 95 | LYS | 1 | 0.975 | 0.957 | 44.192 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 96 | LEU | 0 | -0.007 | 0.002 | 46.203 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 97 | PRO | 0 | 0.032 | 0.028 | 49.595 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 98 | PRO | 0 | -0.018 | 0.015 | 52.418 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 99 | SER | 0 | 0.006 | -0.004 | 52.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 100 | PHE | 0 | 0.000 | 0.005 | 54.226 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 101 | ALA | 0 | -0.027 | -0.005 | 52.406 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 102 | ARG | 1 | 0.912 | 0.931 | 51.831 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 103 | LYS | 1 | 0.863 | 0.939 | 56.113 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 104 | LEU | 0 | 0.003 | 0.005 | 59.620 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 105 | LYS | 1 | 0.953 | 0.971 | 60.264 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 106 | ASP | -1 | -0.841 | -0.910 | 63.617 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 107 | VAL | 0 | 0.017 | 0.012 | 66.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 108 | HIS | 0 | -0.114 | -0.077 | 69.428 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 109 | GLU | -1 | -0.823 | -0.899 | 71.636 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 110 | THR | 0 | -0.030 | -0.021 | 74.193 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 111 | LEU | 0 | 0.000 | -0.012 | 77.776 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 112 | GLY | 0 | -0.012 | 0.005 | 80.735 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 113 | PHE | 0 | -0.073 | -0.033 | 76.910 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 114 | PRO | 0 | 0.024 | 0.019 | 73.423 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 115 | VAL | 0 | -0.022 | -0.013 | 71.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 116 | ALA | 0 | 0.022 | -0.002 | 67.756 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 117 | PHE | 0 | -0.016 | 0.005 | 66.305 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 118 | GLU | -1 | -0.881 | -0.970 | 60.572 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 119 | CYS | 0 | -0.116 | -0.028 | 59.431 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 120 | ARG | 1 | 0.975 | 0.995 | 51.988 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 121 | ILE | 0 | 0.002 | -0.004 | 55.686 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 122 | ASN | 0 | -0.009 | -0.006 | 50.415 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 123 | GLY | 0 | 0.046 | 0.011 | 51.446 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 124 | SER | 0 | -0.054 | -0.025 | 49.904 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 125 | GLU | -1 | -0.870 | -0.912 | 52.183 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 126 | PRO | 0 | -0.044 | -0.037 | 54.447 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 127 | LEU | 0 | -0.005 | -0.006 | 54.824 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 128 | GLN | 0 | -0.005 | 0.004 | 58.568 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 129 | VAL | 0 | 0.014 | -0.005 | 61.420 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 130 | SER | 0 | -0.033 | 0.000 | 63.814 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 131 | TRP | 0 | 0.078 | 0.019 | 64.523 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 132 | TYR | 0 | 0.008 | 0.001 | 68.248 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 133 | LYS | 1 | 0.917 | 0.975 | 71.555 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 134 | ASP | -1 | -0.922 | -0.956 | 74.211 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 135 | GLY | 0 | -0.054 | -0.037 | 73.629 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 136 | GLU | -1 | -0.893 | -0.937 | 75.352 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 137 | LEU | 0 | -0.080 | -0.045 | 71.019 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 138 | LEU | 0 | -0.057 | -0.025 | 72.302 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 139 | LYS | 1 | 0.931 | 0.951 | 72.953 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 140 | ASP | -1 | -0.799 | -0.876 | 71.680 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 141 | ASP | -1 | -0.862 | -0.940 | 74.693 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 142 | ALA | 0 | -0.067 | -0.036 | 77.130 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 143 | ASN | 0 | -0.017 | -0.016 | 78.291 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 144 | LEU | 0 | -0.028 | 0.014 | 72.553 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 145 | GLN | 0 | 0.037 | 0.001 | 71.176 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 146 | THR | 0 | -0.058 | -0.034 | 67.662 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 147 | SER | 0 | -0.039 | -0.005 | 64.076 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 148 | PHE | 0 | 0.007 | -0.031 | 57.939 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 149 | ILE | 0 | 0.043 | 0.028 | 58.271 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 150 | HIS | 0 | 0.001 | 0.018 | 54.471 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 151 | ASN | 0 | -0.038 | -0.034 | 52.923 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 152 | VAL | 0 | -0.016 | -0.017 | 55.668 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 153 | ALA | 0 | 0.017 | 0.017 | 58.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 154 | THR | 0 | -0.005 | -0.010 | 61.769 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 155 | LEU | 0 | -0.002 | 0.003 | 64.819 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 156 | GLN | 0 | -0.028 | -0.018 | 68.477 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 157 | ILE | 0 | -0.016 | -0.005 | 70.919 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 158 | LEU | 0 | -0.020 | 0.004 | 74.208 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 159 | GLN | 0 | 0.000 | 0.000 | 76.493 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 160 | THR | 0 | -0.033 | -0.021 | 76.001 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 161 | ASP | -1 | -0.789 | -0.900 | 79.080 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 162 | GLN | 0 | 0.018 | -0.004 | 80.775 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 163 | SER | 0 | -0.033 | -0.013 | 81.567 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 164 | HIS | 0 | 0.022 | 0.015 | 76.909 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 165 | VAL | 0 | 0.019 | 0.037 | 76.642 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 166 | GLY | 0 | 0.042 | 0.026 | 75.931 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 167 | GLN | 0 | -0.069 | -0.044 | 69.892 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 168 | TYR | 0 | 0.006 | -0.025 | 69.850 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 169 | ASN | 0 | -0.054 | -0.054 | 67.538 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 170 | CYS | 0 | 0.015 | 0.028 | 63.243 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 171 | SER | 0 | 0.026 | 0.007 | 63.002 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 172 | ALA | 0 | 0.000 | 0.006 | 59.257 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 173 | SER | 0 | 0.000 | -0.035 | 59.658 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 174 | ASN | 0 | 0.054 | 0.040 | 53.518 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 175 | PRO | 0 | 0.002 | -0.012 | 55.901 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 176 | LEU | 0 | -0.078 | -0.028 | 51.132 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 177 | GLY | 0 | -0.009 | -0.007 | 55.129 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 178 | THR | 0 | 0.026 | -0.012 | 57.185 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 179 | ALA | 0 | -0.043 | -0.003 | 57.011 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 180 | SER | 0 | -0.009 | -0.028 | 59.051 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 181 | SER | 0 | 0.017 | 0.029 | 60.837 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 182 | SER | 0 | 0.019 | 0.027 | 62.757 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 183 | ALA | 0 | -0.029 | -0.011 | 65.434 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 184 | LYS | 1 | 0.899 | 0.946 | 67.592 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 185 | LEU | 0 | 0.037 | 0.040 | 70.742 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 186 | THR | 0 | -0.031 | -0.010 | 73.185 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 187 | LEU | 0 | 0.004 | -0.005 | 75.310 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 188 | SER | 0 | 0.005 | 0.005 | 77.280 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 189 | GLU | -1 | -0.907 | -0.955 | 79.897 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 190 | HIS | 0 | -0.011 | 0.000 | 81.349 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 191 | GLU | -1 | -0.928 | -0.971 | 82.015 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 192 | VAL | 0 | -0.061 | -0.017 | 81.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 193 | PRO | 0 | 0.004 | 0.012 | 79.750 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 194 | PRO | 0 | -0.040 | -0.026 | 83.090 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 195 | PHE | 0 | 0.005 | 0.015 | 83.404 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 196 | PHE | 0 | -0.009 | -0.012 | 85.432 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 197 | ASP | -1 | -0.866 | -0.921 | 87.013 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 198 | LEU | 0 | -0.008 | 0.006 | 88.164 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 199 | LYS | 1 | 0.963 | 0.973 | 84.012 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 200 | PRO | 0 | -0.006 | 0.005 | 90.548 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 201 | VAL | 0 | 0.008 | -0.010 | 92.561 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 202 | SER | 0 | -0.023 | -0.021 | 92.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 203 | VAL | 0 | -0.031 | 0.008 | 95.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 204 | ASP | -1 | -0.858 | -0.923 | 97.833 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 205 | LEU | 0 | -0.021 | 0.000 | 100.391 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 206 | ALA | 0 | 0.042 | 0.018 | 103.844 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 207 | LEU | 0 | -0.028 | -0.032 | 106.948 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 208 | GLY | 0 | -0.074 | -0.036 | 108.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 209 | GLU | -1 | -0.905 | -0.949 | 108.933 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 210 | SER | 0 | -0.010 | 0.005 | 107.640 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 211 | GLY | 0 | 0.026 | -0.003 | 104.200 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 212 | THR | 0 | -0.096 | -0.065 | 101.049 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 213 | PHE | 0 | -0.005 | 0.018 | 96.754 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 214 | LYS | 1 | 0.970 | 0.958 | 97.244 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 215 | CYS | 0 | -0.055 | -0.011 | 92.419 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 216 | HIS | 0 | -0.011 | -0.021 | 92.121 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 217 | VAL | 0 | -0.016 | 0.005 | 88.879 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 218 | THR | 0 | 0.020 | 0.018 | 87.552 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 219 | GLY | 0 | 0.086 | 0.020 | 86.670 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 220 | THR | 0 | -0.012 | 0.002 | 86.782 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 221 | ALA | 0 | -0.008 | 0.029 | 88.528 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 222 | PRO | 0 | 0.013 | -0.008 | 91.389 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 223 | ILE | 0 | 0.018 | -0.005 | 89.527 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 224 | LYS | 1 | 0.909 | 0.963 | 92.011 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 225 | ILE | 0 | 0.007 | 0.000 | 92.358 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 226 | THR | 0 | -0.057 | -0.032 | 93.791 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 227 | TRP | 0 | 0.122 | 0.033 | 94.079 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 228 | ALA | 0 | 0.003 | -0.021 | 93.070 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 229 | LYS | 1 | 0.891 | 0.978 | 94.116 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 230 | ASP | -1 | -0.874 | -0.946 | 93.855 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 231 | ASN | 0 | -0.049 | -0.022 | 89.135 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 232 | ARG | 1 | 0.976 | 0.985 | 92.737 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 233 | GLU | -1 | -0.965 | -0.978 | 95.810 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 234 | ILE | 0 | -0.037 | 0.001 | 96.812 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 235 | ARG | 1 | 0.955 | 0.967 | 99.721 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 236 | PRO | 0 | -0.007 | -0.013 | 102.604 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 237 | GLY | 0 | 0.023 | 0.015 | 105.792 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 238 | GLY | 0 | -0.002 | 0.008 | 107.678 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 239 | ASN | 0 | -0.004 | -0.006 | 106.440 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 240 | TYR | 0 | -0.009 | -0.001 | 102.685 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 241 | LYS | 1 | 0.945 | 0.984 | 104.991 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 242 | MET | 0 | -0.023 | -0.011 | 98.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 243 | THR | 0 | -0.020 | -0.007 | 102.222 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 244 | LEU | 0 | -0.006 | -0.017 | 96.379 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 245 | VAL | 0 | -0.031 | 0.003 | 100.381 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 246 | GLU | -1 | -0.895 | -0.950 | 98.273 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 247 | ASN | 0 | -0.045 | -0.024 | 92.220 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 248 | THR | 0 | 0.012 | 0.030 | 94.801 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 249 | ALA | 0 | 0.026 | 0.008 | 95.890 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 250 | THR | 0 | -0.045 | -0.050 | 97.677 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 251 | LEU | 0 | -0.039 | 0.016 | 99.057 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 252 | THR | 0 | -0.016 | -0.020 | 100.845 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 253 | VAL | 0 | 0.012 | 0.011 | 102.286 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 254 | LEU | 0 | -0.041 | -0.030 | 105.070 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 255 | LYS | 1 | 0.985 | 0.980 | 108.863 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 256 | VAL | 0 | 0.012 | 0.026 | 105.275 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 257 | THR | 0 | -0.014 | -0.007 | 106.814 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 258 | LYS | 1 | 0.982 | 0.963 | 105.271 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 259 | GLY | 0 | -0.022 | 0.002 | 103.108 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 260 | ASP | -1 | -0.806 | -0.888 | 102.492 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 261 | ALA | 0 | 0.038 | 0.051 | 99.378 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 262 | GLY | 0 | -0.002 | 0.010 | 95.763 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 263 | GLN | 0 | -0.007 | 0.000 | 88.996 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 264 | TYR | 0 | -0.093 | -0.086 | 93.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 265 | THR | 0 | 0.034 | 0.023 | 89.166 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 266 | CYS | 0 | -0.097 | -0.030 | 91.474 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 267 | TYR | 0 | 0.025 | 0.004 | 87.507 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 268 | ALA | 0 | 0.060 | 0.031 | 88.706 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 269 | SER | 0 | -0.079 | -0.076 | 87.606 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 270 | ASN | 0 | 0.022 | 0.019 | 85.766 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 271 | VAL | 0 | 0.041 | 0.010 | 84.515 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 272 | ALA | 0 | 0.038 | 0.033 | 81.460 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 273 | GLY | 0 | 0.003 | 0.003 | 81.323 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 274 | LYS | 1 | 0.875 | 0.914 | 82.801 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 275 | ASP | -1 | -0.781 | -0.876 | 83.181 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 276 | SER | 0 | -0.084 | -0.055 | 85.124 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 277 | CYS | 0 | -0.047 | -0.005 | 86.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 278 | SER | 0 | 0.040 | -0.008 | 88.471 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 279 | ALA | 0 | -0.027 | 0.010 | 90.289 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 280 | GLN | 0 | 0.031 | -0.023 | 92.126 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 281 | LEU | 0 | -0.009 | 0.017 | 94.896 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 282 | GLY | 0 | 0.050 | 0.018 | 98.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 283 | VAL | 0 | -0.032 | -0.016 | 99.363 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 284 | GLN | 0 | 0.011 | 0.008 | 102.621 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 285 | GLU | -1 | -0.938 | -0.986 | 103.005 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 286 | PRO | 0 | -0.019 | 0.008 | 106.285 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 287 | PRO | 0 | 0.011 | -0.004 | 107.398 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 288 | ARG | 1 | 0.935 | 0.977 | 106.051 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 289 | PHE | 0 | 0.000 | -0.017 | 109.959 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 290 | ILE | 0 | -0.089 | -0.031 | 106.444 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 291 | LYS | 1 | 0.947 | 0.958 | 110.426 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 292 | LYS | 1 | 0.978 | 0.985 | 112.285 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 293 | LEU | 0 | 0.015 | 0.020 | 114.200 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 294 | GLU | -1 | -0.887 | -0.933 | 116.919 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 295 | PRO | 0 | 0.010 | 0.005 | 119.959 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 296 | SER | 0 | 0.000 | 0.003 | 123.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 297 | ARG | 1 | 0.884 | 0.953 | 116.691 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 298 | ILE | 0 | -0.040 | -0.025 | 123.945 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 299 | VAL | 0 | -0.030 | -0.004 | 120.755 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 300 | LYS | 1 | 0.947 | 0.997 | 123.821 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 301 | GLN | 0 | -0.002 | 0.001 | 123.565 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 302 | ASP | -1 | -0.972 | -0.994 | 121.673 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 303 | GLU | -1 | -0.928 | -0.987 | 119.487 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 304 | HIS | 0 | -0.027 | -0.026 | 114.585 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 305 | THR | 0 | -0.006 | 0.008 | 115.928 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 306 | ARG | 1 | 0.910 | 0.964 | 106.872 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 307 | TYR | 0 | 0.001 | 0.015 | 113.675 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 308 | GLU | -1 | -0.885 | -0.948 | 108.370 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 309 | CYS | 0 | -0.029 | 0.005 | 110.204 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 310 | LYS | 1 | 0.892 | 0.967 | 104.289 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 311 | ILE | 0 | 0.033 | 0.010 | 106.854 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 312 | GLY | 0 | 0.025 | 0.001 | 104.728 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 313 | GLY | 0 | -0.013 | 0.001 | 104.069 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 314 | SER | 0 | 0.012 | 0.016 | 101.909 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 315 | PRO | 0 | 0.013 | -0.001 | 97.697 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 316 | GLU | -1 | -0.945 | -0.963 | 97.318 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 317 | ILE | 0 | -0.016 | 0.001 | 100.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 318 | LYS | 1 | 0.925 | 0.952 | 102.822 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 319 | VAL | 0 | -0.002 | 0.004 | 105.832 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 320 | LEU | 0 | -0.020 | 0.003 | 108.479 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 321 | TRP | 0 | 0.032 | -0.003 | 109.718 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 322 | TYR | 0 | 0.020 | -0.001 | 114.130 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 323 | LYS | 1 | 0.919 | 0.972 | 117.637 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 324 | ASP | -1 | -0.850 | -0.924 | 120.173 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 325 | GLU | -1 | -0.923 | -0.978 | 120.867 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 326 | THR | 0 | -0.063 | -0.020 | 119.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 327 | GLU | -1 | -0.986 | -0.995 | 111.391 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 328 | ILE | 0 | -0.044 | -0.016 | 113.136 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 329 | GLN | 0 | -0.012 | -0.014 | 110.993 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 330 | GLU | -1 | -0.765 | -0.889 | 106.200 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 331 | SER | 0 | -0.041 | -0.022 | 109.178 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 332 | SER | 0 | -0.075 | -0.050 | 110.342 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 333 | LYS | 1 | 0.888 | 0.954 | 111.485 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 334 | PHE | 0 | 0.025 | -0.004 | 113.431 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 335 | ARG | 1 | 0.912 | 0.980 | 105.418 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 336 | MET | 0 | 0.011 | 0.002 | 107.811 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 337 | SER | 0 | -0.036 | -0.029 | 102.947 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 338 | PHE | 0 | -0.024 | -0.001 | 103.112 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 339 | VAL | 0 | 0.027 | 0.011 | 99.267 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 340 | GLU | -1 | -0.921 | -0.958 | 95.944 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 341 | SER | 0 | -0.042 | -0.036 | 100.259 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 342 | VAL | 0 | -0.026 | 0.001 | 103.249 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 343 | ALA | 0 | -0.003 | 0.005 | 105.276 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 344 | VAL | 0 | -0.024 | -0.020 | 107.009 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 345 | LEU | 0 | 0.012 | 0.011 | 108.967 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 346 | GLU | -1 | -0.926 | -0.975 | 109.938 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 347 | MET | 0 | -0.013 | -0.002 | 111.888 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 348 | TYR | 0 | 0.003 | 0.001 | 108.533 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 349 | ASN | 0 | -0.013 | -0.012 | 115.300 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 350 | LEU | 0 | 0.028 | 0.033 | 118.346 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 351 | SER | 0 | 0.071 | 0.011 | 120.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 352 | VAL | 0 | 0.041 | 0.019 | 124.437 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 353 | GLU | -1 | -0.987 | -0.981 | 121.954 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 354 | ASP | -1 | -0.850 | -0.938 | 121.188 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 355 | SER | 0 | -0.054 | -0.032 | 123.064 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 356 | GLY | 0 | 0.007 | 0.008 | 124.900 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 357 | ASP | -1 | -0.874 | -0.940 | 123.965 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 358 | TYR | 0 | -0.013 | -0.021 | 118.005 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 359 | THR | 0 | 0.017 | 0.025 | 117.686 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 360 | CYS | 0 | -0.074 | -0.020 | 112.229 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 361 | GLU | -1 | -0.823 | -0.927 | 113.062 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 362 | ALA | 0 | 0.004 | -0.008 | 108.495 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 363 | HIS | 0 | -0.028 | -0.019 | 108.089 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 364 | ASN | 0 | 0.009 | -0.027 | 104.765 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 365 | ALA | 0 | 0.019 | 0.015 | 103.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 366 | ALA | 0 | -0.011 | -0.006 | 105.127 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 367 | GLY | 0 | -0.010 | -0.010 | 108.542 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 368 | SER | 0 | 0.003 | -0.010 | 110.077 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 369 | ALA | 0 | -0.031 | 0.023 | 112.328 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 370 | SER | 0 | 0.054 | 0.014 | 113.725 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 371 | SER | 0 | -0.064 | -0.033 | 115.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 372 | SER | 0 | 0.029 | 0.004 | 117.408 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 373 | THR | 0 | -0.105 | -0.062 | 119.237 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 374 | SER | 0 | -0.012 | -0.004 | 121.594 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 375 | LEU | 0 | 0.002 | 0.012 | 120.604 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 376 | LYS | 1 | 0.969 | 0.953 | 124.005 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 377 | VAL | 0 | -0.015 | 0.022 | 123.060 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 378 | LYS | 1 | 0.862 | 0.945 | 126.167 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 379 | GLU | -1 | -0.899 | -0.963 | 128.312 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 380 | PRO | 0 | -0.005 | -0.019 | 128.951 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 381 | PRO | 0 | -0.055 | -0.009 | 131.746 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 382 | VAL | 0 | 0.035 | 0.020 | 133.114 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 383 | PHE | 0 | -0.030 | -0.023 | 136.152 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 384 | ARG | 1 | 0.885 | 0.950 | 134.101 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 385 | LYS | 1 | 0.912 | 0.972 | 139.778 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 386 | LYS | 1 | 0.955 | 0.980 | 142.280 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 387 | PRO | 0 | -0.008 | -0.010 | 143.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 388 | HIS | 0 | -0.018 | -0.009 | 146.760 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 389 | PRO | 0 | -0.028 | -0.012 | 148.799 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 390 | VAL | 0 | 0.030 | 0.025 | 151.659 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 391 | GLU | -1 | -0.929 | -0.958 | 155.195 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 392 | THR | 0 | -0.014 | -0.006 | 158.073 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 393 | LEU | 0 | 0.033 | 0.026 | 161.230 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 394 | LYS | 1 | 0.938 | 0.949 | 164.339 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 395 | GLY | 0 | -0.044 | -0.009 | 166.169 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 396 | ALA | 0 | 0.013 | 0.012 | 164.006 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 397 | ASP | -1 | -0.831 | -0.925 | 161.889 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 398 | VAL | 0 | -0.025 | -0.010 | 156.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 399 | HIS | 0 | -0.049 | -0.036 | 154.094 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 400 | LEU | 0 | 0.013 | 0.020 | 150.471 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 401 | GLU | -1 | -0.929 | -0.986 | 149.248 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 402 | CYS | 0 | -0.068 | -0.027 | 139.523 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 403 | GLU | -1 | -0.847 | -0.914 | 143.015 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 404 | LEU | 0 | -0.035 | -0.012 | 139.058 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 405 | GLN | 0 | 0.028 | -0.013 | 135.173 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 406 | GLY | 0 | 0.058 | 0.026 | 134.257 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 407 | THR | 0 | -0.020 | 0.011 | 132.574 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 408 | PRO | 0 | 0.028 | 0.050 | 134.814 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 409 | PRO | 0 | -0.001 | -0.019 | 136.639 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 410 | PHE | 0 | 0.018 | 0.000 | 136.260 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 411 | GLN | 0 | -0.025 | -0.016 | 138.934 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 412 | VAL | 0 | -0.014 | 0.000 | 140.891 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 413 | SER | 0 | -0.038 | -0.008 | 142.735 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 414 | TRP | 0 | 0.069 | 0.020 | 144.967 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 415 | HIS | 0 | -0.023 | -0.027 | 143.753 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 416 | LYS | 1 | 0.891 | 0.959 | 147.940 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 417 | ASP | -1 | -0.828 | -0.906 | 148.960 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 418 | LYS | 1 | 0.870 | 0.921 | 142.842 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 419 | ARG | 1 | 0.940 | 0.984 | 147.243 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 420 | GLU | -1 | -0.888 | -0.935 | 146.599 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 421 | LEU | 0 | -0.048 | -0.013 | 149.238 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 422 | ARG | 1 | 0.936 | 0.953 | 149.768 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 423 | SER | 0 | 0.032 | 0.013 | 153.226 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 424 | GLY | 0 | 0.003 | 0.025 | 155.462 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 425 | LYS | 1 | 0.916 | 0.935 | 158.780 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 426 | LYS | 1 | 0.847 | 0.939 | 159.168 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 427 | TYR | 0 | 0.045 | 0.023 | 155.084 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 428 | LYS | 1 | 0.917 | 0.966 | 156.430 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 429 | ILE | 0 | 0.024 | 0.002 | 149.537 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 430 | MET | 0 | -0.063 | -0.027 | 151.284 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 431 | SER | 0 | -0.004 | -0.016 | 145.981 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 432 | GLU | -1 | -0.882 | -0.931 | 147.022 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 433 | ASN | 0 | -0.047 | -0.024 | 143.236 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 434 | PHE | 0 | -0.022 | -0.013 | 137.852 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 435 | LEU | 0 | 0.026 | 0.017 | 143.090 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 436 | THR | 0 | -0.019 | 0.007 | 144.114 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 437 | SER | 0 | 0.070 | 0.028 | 147.253 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 438 | ILE | 0 | -0.027 | -0.006 | 150.409 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 439 | HIS | 0 | -0.003 | 0.010 | 153.160 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 440 | ILE | 0 | -0.021 | -0.007 | 154.619 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 441 | LEU | 0 | -0.022 | -0.003 | 158.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 442 | ASN | 0 | -0.089 | -0.053 | 162.186 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 443 | VAL | 0 | 0.025 | 0.031 | 160.330 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 444 | ASP | -1 | -0.874 | -0.954 | 162.178 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 445 | SER | 0 | -0.014 | -0.045 | 161.646 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 446 | ALA | 0 | -0.019 | 0.009 | 159.389 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 447 | ASP | -1 | -0.795 | -0.914 | 157.482 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 448 | ILE | 0 | -0.050 | -0.011 | 156.461 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 449 | GLY | 0 | 0.020 | 0.012 | 153.696 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 450 | GLU | -1 | -0.946 | -0.975 | 146.552 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 451 | TYR | 0 | -0.014 | -0.010 | 149.415 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 452 | GLN | 0 | -0.012 | -0.017 | 144.186 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 453 | CYS | 0 | -0.002 | 0.005 | 144.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 454 | LYS | 1 | 0.983 | 1.007 | 135.698 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 455 | ALA | 0 | 0.046 | 0.033 | 139.629 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 456 | SER | 0 | -0.010 | -0.036 | 135.474 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 457 | ASN | 0 | 0.020 | 0.000 | 133.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 458 | ASP | -1 | -0.893 | -0.956 | 130.763 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 459 | VAL | 0 | -0.041 | 0.000 | 128.202 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 460 | GLY | 0 | 0.031 | 0.017 | 129.159 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 461 | SER | 0 | -0.089 | -0.081 | 131.353 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 462 | ASP | -1 | -0.812 | -0.895 | 133.963 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 463 | THR | 0 | -0.070 | -0.048 | 136.683 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 465 | VAL | 0 | -0.019 | -0.025 | 142.357 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 466 | GLY | 0 | 0.057 | 0.037 | 145.044 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 467 | SER | 0 | -0.021 | -0.013 | 148.617 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 468 | ILE | 0 | 0.032 | 0.023 | 151.320 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 469 | THR | 0 | 0.036 | 0.014 | 154.221 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 470 | LEU | 0 | -0.034 | -0.021 | 156.811 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 471 | LYS | 1 | 0.932 | 0.972 | 160.582 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 472 | ALA | 0 | -0.002 | 0.004 | 162.464 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 473 | PRO | 0 | 0.004 | 0.005 | 164.420 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 474 | PRO | 0 | 0.018 | 0.021 | 167.375 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 475 | ARG | 1 | 0.901 | 0.950 | 168.387 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 476 | PHE | 0 | -0.002 | 0.009 | 169.970 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 477 | VAL | 0 | -0.006 | 0.011 | 166.614 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 478 | LYS | 1 | 0.881 | 0.939 | 167.211 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 479 | LYS | 1 | 0.964 | 0.969 | 172.661 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 480 | LEU | 0 | 0.005 | -0.006 | 176.007 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 481 | SER | 0 | -0.021 | -0.009 | 178.130 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 482 | ASP | -1 | -0.883 | -0.941 | 180.068 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 483 | ILE | 0 | -0.028 | -0.020 | 179.447 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 484 | SER | 0 | 0.003 | -0.006 | 183.736 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 485 | THR | 0 | -0.006 | 0.017 | 183.125 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 486 | VAL | 0 | 0.021 | 0.010 | 186.276 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 487 | VAL | 0 | 0.046 | 0.011 | 187.427 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 488 | GLY | 0 | -0.037 | -0.007 | 187.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 489 | GLU | -1 | -0.975 | -0.983 | 182.867 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 490 | GLU | -1 | -0.942 | -0.963 | 177.656 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 491 | VAL | 0 | -0.039 | -0.018 | 180.575 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 492 | GLN | 0 | 0.008 | -0.018 | 172.994 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 493 | LEU | 0 | -0.011 | 0.026 | 177.303 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 494 | GLN | 0 | 0.023 | -0.015 | 171.688 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 495 | ALA | 0 | 0.004 | 0.013 | 173.264 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 496 | THR | 0 | -0.005 | -0.014 | 167.875 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 497 | ILE | 0 | -0.039 | -0.020 | 167.671 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 498 | GLU | -1 | -0.896 | -0.948 | 164.210 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 499 | GLY | 0 | -0.011 | -0.016 | 164.109 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 500 | ALA | 0 | -0.047 | -0.030 | 162.322 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 501 | GLU | -1 | -0.835 | -0.935 | 157.738 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 502 | PRO | 0 | -0.048 | -0.004 | 161.930 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 503 | ILE | 0 | -0.034 | -0.022 | 164.651 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 504 | SER | 0 | -0.025 | -0.018 | 167.792 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 505 | VAL | 0 | -0.042 | -0.014 | 171.147 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 506 | ALA | 0 | -0.001 | 0.008 | 173.742 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 507 | TRP | 0 | 0.055 | 0.017 | 175.459 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 508 | PHE | 0 | 0.019 | 0.004 | 180.044 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 509 | LYS | 1 | 0.925 | 0.965 | 183.711 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 510 | ASP | -1 | -0.902 | -0.952 | 186.971 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 511 | LYS | 1 | 0.868 | 0.917 | 187.754 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 512 | GLY | 0 | 0.029 | 0.037 | 187.703 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 513 | GLU | -1 | -0.916 | -0.977 | 183.431 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 514 | ILE | 0 | -0.061 | -0.006 | 181.834 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 515 | VAL | 0 | -0.010 | -0.006 | 180.988 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 516 | ARG | 1 | 0.895 | 0.912 | 173.335 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 517 | GLU | -1 | -0.841 | -0.903 | 179.496 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 518 | SER | 0 | -0.025 | -0.023 | 178.628 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 519 | ASP | -1 | -0.868 | -0.914 | 180.566 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 520 | ASN | 0 | -0.086 | -0.062 | 181.405 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 521 | ILE | 0 | -0.057 | 0.018 | 179.913 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 522 | TRP | 0 | -0.011 | -0.001 | 174.120 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 523 | ILE | 0 | -0.043 | -0.013 | 175.307 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 524 | SER | 0 | -0.016 | -0.016 | 170.582 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 525 | TYR | 0 | 0.019 | -0.023 | 165.795 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 526 | SER | 0 | 0.004 | 0.010 | 164.706 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 527 | GLU | -1 | -0.950 | -0.965 | 160.141 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 528 | ASN | 0 | -0.024 | -0.003 | 161.604 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 529 | ILE | 0 | 0.010 | 0.001 | 165.624 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 530 | ALA | 0 | -0.010 | 0.008 | 168.748 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 531 | THR | 0 | 0.001 | -0.022 | 171.580 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 532 | LEU | 0 | -0.039 | 0.008 | 174.273 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 533 | GLN | 0 | -0.025 | -0.023 | 174.449 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 534 | PHE | 0 | 0.031 | -0.005 | 177.878 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 535 | SER | 0 | 0.035 | 0.010 | 178.748 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 536 | ARG | 1 | 0.978 | 0.971 | 180.175 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 537 | ALA | 0 | -0.009 | 0.023 | 183.896 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 538 | GLU | -1 | -0.912 | -0.980 | 186.117 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 539 | PRO | 0 | 0.088 | 0.035 | 189.882 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 540 | ALA | 0 | 0.036 | 0.035 | 191.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 541 | ASN | 0 | -0.095 | -0.050 | 186.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 542 | ALA | 0 | 0.037 | 0.006 | 187.861 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 543 | GLY | 0 | -0.016 | -0.012 | 189.020 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 544 | LYS | 1 | 0.924 | 0.963 | 187.340 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 545 | TYR | 0 | 0.067 | 0.035 | 182.636 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 546 | THR | 0 | -0.060 | -0.024 | 181.445 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 547 | CYS | 0 | -0.005 | 0.016 | 175.993 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 548 | GLN | 0 | 0.009 | -0.014 | 177.031 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 549 | ILE | 0 | 0.004 | 0.017 | 171.436 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 550 | LYS | 1 | 0.958 | 0.959 | 172.159 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 551 | ASN | 0 | 0.041 | 0.024 | 166.419 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 552 | GLU | -1 | -0.877 | -0.953 | 165.041 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 553 | ALA | 0 | -0.044 | -0.029 | 166.698 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 554 | GLY | 0 | -0.026 | -0.017 | 168.767 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 555 | THR | 0 | -0.014 | -0.015 | 172.095 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 556 | GLN | 0 | -0.045 | -0.021 | 173.749 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 557 | GLU | -1 | -0.898 | -0.973 | 176.017 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 558 | CYS | 0 | -0.069 | 0.011 | 177.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 559 | PHE | 0 | 0.000 | -0.004 | 179.939 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 560 | ALA | 0 | 0.055 | 0.017 | 181.521 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 561 | THR | 0 | -0.038 | -0.018 | 183.485 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 562 | LEU | 0 | -0.019 | 0.019 | 184.225 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 563 | SER | 0 | -0.025 | -0.033 | 186.590 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 564 | VAL | 0 | -0.002 | -0.001 | 188.424 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 565 | LEU | 0 | -0.024 | -0.001 | 190.456 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 566 | GLU | -1 | -0.957 | -0.977 | 192.358 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |