![FMODB](./images/FMODB-Logo_20190201-0_300ppi.png)
FMODB ID: 895MY
Calculation Name: 3EEG-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 3EEG
Chain ID: A
Base Structure: X-ray
Registration Date: 2023-09-21
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 | 271 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 22 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -3666106.959813 |
---|---|
FMO2-HF: Nuclear repulsion | 3561068.480009 |
FMO2-HF: Total energy | -105038.479805 |
FMO2-MP2: Total energy | -105340.888703 |
3D Structure
Ligand structure
![ligand structure](./Kdata/F033281/ligand_interaction/ligand_F033281.png)
Ligand Interaction
![ligand interaction](./Kdata/F033281/ligand_interaction/ligand_interaction_F033281.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:GLY)
Summations of interaction energy for
fragment #1(A:2:GLY)
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. |
-8.783 | -4.974 | 0.858 | -2.514 | -2.153 | -0.017 |
Interaction energy analysis for fragmet #1(A:2:GLY)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | 4 | ARG | 1 | 0.834 | 0.908 | 3.805 | 2.209 | 2.988 | -0.004 | -0.319 | -0.456 | 0.002 |
4 | A | 5 | ILE | 0 | -0.025 | -0.006 | 6.164 | 0.690 | 0.690 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | 6 | PHE | 0 | -0.065 | -0.047 | 8.896 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 7 | VAL | 0 | 0.029 | 0.012 | 12.139 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 8 | PHE | 0 | -0.035 | -0.028 | 14.821 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 9 | ASP | -1 | -0.810 | -0.929 | 18.409 | -0.290 | -0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 10 | THR | 0 | 0.025 | -0.013 | 20.876 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 11 | THR | 0 | 0.012 | 0.000 | 24.183 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 12 | LEU | 0 | -0.035 | -0.006 | 26.052 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 13 | ARG | 1 | 0.757 | 0.893 | 27.505 | 0.220 | 0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 14 | ASP | -1 | -0.824 | -0.934 | 28.021 | -0.190 | -0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 15 | GLY | 0 | -0.036 | -0.005 | 31.091 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 23 | LEU | 0 | -0.003 | -0.012 | 32.220 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 24 | ASN | 0 | 0.060 | 0.031 | 36.621 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 25 | THR | 0 | -0.033 | -0.063 | 36.104 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 26 | GLU | -1 | -0.902 | -0.938 | 35.009 | -0.130 | -0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 27 | GLU | -1 | -0.895 | -0.938 | 34.123 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 28 | LYS | 1 | 0.994 | 0.997 | 31.341 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 29 | ILE | 0 | 0.018 | 0.019 | 29.871 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 30 | ILE | 0 | -0.031 | -0.015 | 29.291 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 31 | VAL | 0 | 0.034 | 0.020 | 27.000 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 32 | ALA | 0 | 0.043 | 0.017 | 25.635 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 33 | LYS | 1 | 0.877 | 0.944 | 24.520 | 0.196 | 0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 34 | ALA | 0 | 0.009 | 0.013 | 24.111 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 35 | LEU | 0 | 0.014 | 0.000 | 21.421 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 36 | ASP | -1 | -0.846 | -0.930 | 20.045 | -0.452 | -0.452 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 37 | GLU | -1 | -0.830 | -0.896 | 19.554 | -0.330 | -0.330 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 38 | LEU | 0 | -0.045 | -0.019 | 17.707 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 39 | GLY | 0 | 0.008 | 0.014 | 15.505 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 40 | VAL | 0 | 0.005 | 0.025 | 14.717 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 41 | ASP | -1 | -0.814 | -0.905 | 12.999 | -1.053 | -1.053 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 42 | VAL | 0 | -0.032 | -0.007 | 16.184 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 43 | ILE | 0 | 0.026 | 0.025 | 19.352 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 44 | GLU | -1 | -0.833 | -0.927 | 22.435 | -0.215 | -0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 45 | ALA | 0 | -0.024 | -0.009 | 25.366 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 46 | GLY | 0 | 0.043 | 0.012 | 28.498 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 47 | PHE | 0 | -0.009 | -0.004 | 30.960 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 48 | PRO | 0 | -0.004 | -0.015 | 32.596 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 49 | VAL | 0 | -0.008 | 0.008 | 35.707 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 50 | SER | 0 | -0.073 | -0.009 | 37.737 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 51 | SER | 0 | 0.013 | -0.026 | 39.473 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 52 | PRO | 0 | 0.045 | 0.006 | 40.012 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 53 | GLY | 0 | 0.033 | 0.018 | 40.483 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 54 | ASP | -1 | -0.839 | -0.898 | 36.032 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 55 | PHE | 0 | -0.004 | 0.004 | 35.546 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 56 | ASN | 0 | -0.014 | -0.018 | 36.066 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 57 | SER | 0 | -0.023 | -0.006 | 34.872 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 58 | VAL | 0 | 0.022 | 0.013 | 30.830 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 59 | VAL | 0 | -0.023 | -0.010 | 31.669 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 60 | GLU | -1 | -0.868 | -0.906 | 33.070 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 61 | ILE | 0 | -0.001 | 0.004 | 27.731 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 62 | THR | 0 | -0.103 | -0.068 | 28.333 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 63 | LYS | 1 | 0.841 | 0.922 | 29.379 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 64 | ALA | 0 | -0.036 | -0.009 | 30.322 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 65 | VAL | 0 | -0.035 | -0.027 | 24.054 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 66 | THR | 0 | -0.045 | -0.036 | 24.588 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 67 | ARG | 1 | 0.808 | 0.921 | 16.617 | 0.562 | 0.562 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 68 | PRO | 0 | -0.038 | 0.002 | 18.843 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 69 | THR | 0 | -0.017 | -0.021 | 18.584 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 70 | ILE | 0 | 0.008 | -0.005 | 21.327 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 71 | CYS | 0 | -0.041 | -0.011 | 23.444 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 72 | ALA | 0 | 0.023 | 0.019 | 25.456 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 73 | LEU | 0 | 0.007 | 0.004 | 28.448 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 74 | THR | 0 | -0.027 | -0.035 | 30.077 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 75 | ARG | 1 | 0.958 | 0.978 | 32.420 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 76 | ALA | 0 | 0.046 | 0.045 | 33.556 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 77 | LYS | 1 | 0.851 | 0.909 | 34.864 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 78 | GLU | -1 | -0.878 | -0.926 | 37.414 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 79 | ALA | 0 | -0.038 | -0.027 | 38.201 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 80 | ASP | -1 | -0.812 | -0.926 | 36.397 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 81 | ILE | 0 | 0.011 | 0.027 | 32.498 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 82 | ASN | 0 | 0.045 | 0.007 | 34.387 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 83 | ILE | 0 | 0.015 | 0.030 | 36.737 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 84 | ALA | 0 | 0.012 | -0.020 | 32.182 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 85 | GLY | 0 | 0.001 | -0.006 | 32.392 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 86 | GLU | -1 | -0.980 | -0.989 | 33.475 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 87 | ALA | 0 | -0.054 | -0.026 | 33.846 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 88 | LEU | 0 | 0.026 | 0.007 | 27.798 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 89 | ARG | 1 | 0.898 | 0.966 | 30.153 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 90 | PHE | 0 | -0.076 | -0.041 | 31.767 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 91 | ALA | 0 | 0.001 | 0.005 | 26.777 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 92 | LYS | 1 | 0.912 | 0.960 | 24.084 | 0.253 | 0.253 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 93 | ARG | 1 | 0.900 | 0.933 | 19.878 | 0.388 | 0.388 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 94 | SER | 0 | 0.033 | 0.013 | 23.291 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 95 | ARG | 1 | 0.911 | 0.940 | 17.700 | 0.447 | 0.447 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 96 | ILE | 0 | 0.024 | 0.032 | 24.935 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 97 | HIS | 1 | 0.915 | 0.969 | 24.639 | 0.240 | 0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 98 | THR | 0 | -0.001 | -0.020 | 26.849 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 99 | GLY | 0 | 0.061 | 0.030 | 28.069 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 100 | ILE | 0 | -0.055 | -0.030 | 30.249 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 101 | GLY | 0 | -0.021 | -0.007 | 31.653 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 102 | SER | 0 | 0.045 | 0.003 | 30.426 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 103 | SER | 0 | 0.005 | 0.021 | 32.516 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 104 | ASP | -1 | -0.814 | -0.917 | 34.269 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 105 | ILE | 0 | -0.046 | -0.032 | 36.069 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 106 | HIS | 0 | -0.024 | -0.019 | 34.749 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 107 | ILE | 0 | -0.051 | -0.026 | 35.456 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 108 | GLU | -1 | -0.941 | -0.959 | 39.030 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 109 | HIS | 0 | -0.021 | -0.006 | 41.453 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 110 | LYS | 1 | 0.947 | 0.958 | 43.598 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 111 | LEU | 0 | -0.058 | -0.029 | 41.171 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 112 | ARG | 1 | 0.831 | 0.911 | 34.773 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 113 | SER | 0 | 0.020 | -0.010 | 41.877 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 114 | THR | 0 | -0.041 | 0.014 | 40.237 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 115 | ARG | 1 | 0.940 | 0.992 | 41.784 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 116 | GLU | -1 | -0.817 | -0.930 | 36.741 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 117 | ASN | 0 | 0.007 | 0.002 | 36.996 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 118 | ILE | 0 | 0.006 | -0.002 | 38.373 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 119 | LEU | 0 | 0.045 | 0.035 | 34.702 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 120 | GLU | -1 | -0.876 | -0.933 | 33.783 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 121 | MET | 0 | -0.077 | -0.046 | 35.344 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 122 | ALA | 0 | 0.012 | 0.004 | 31.258 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 123 | VAL | 0 | 0.032 | 0.017 | 31.312 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 124 | ALA | 0 | -0.039 | -0.025 | 32.512 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 125 | ALA | 0 | 0.005 | 0.001 | 32.406 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 126 | VAL | 0 | 0.018 | 0.013 | 27.554 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 127 | LYS | 1 | 0.964 | 0.981 | 30.283 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 128 | GLN | 0 | -0.023 | -0.021 | 32.009 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 129 | ALA | 0 | 0.037 | 0.015 | 29.764 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 130 | LYS | 1 | 0.863 | 0.933 | 23.846 | 0.234 | 0.234 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 131 | LYS | 1 | 0.856 | 0.930 | 29.154 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 132 | VAL | 0 | -0.045 | -0.013 | 31.480 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 133 | VAL | 0 | 0.015 | 0.012 | 27.365 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 134 | HIS | 0 | -0.057 | 0.006 | 23.448 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 135 | GLU | -1 | -0.804 | -0.873 | 18.638 | -0.476 | -0.476 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 136 | VAL | 0 | -0.018 | -0.016 | 23.190 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 137 | GLU | -1 | -0.833 | -0.912 | 20.707 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 138 | PHE | 0 | -0.013 | -0.005 | 23.552 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 139 | PHE | 0 | 0.009 | -0.007 | 24.521 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 140 | CYS | 0 | -0.032 | -0.010 | 25.801 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 141 | GLU | -1 | -0.844 | -0.942 | 27.746 | -0.126 | -0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 142 | ASP | -1 | -0.791 | -0.915 | 29.600 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 143 | ALA | 0 | 0.062 | 0.058 | 25.892 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 144 | GLY | 0 | 0.013 | -0.005 | 27.055 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 145 | ARG | 1 | 0.830 | 0.900 | 27.929 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 146 | ALA | 0 | -0.028 | 0.004 | 29.591 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 147 | ASP | -1 | -0.756 | -0.869 | 30.667 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 148 | GLN | 0 | 0.016 | -0.014 | 26.232 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 149 | ALA | 0 | 0.059 | 0.033 | 28.182 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 150 | PHE | 0 | -0.056 | -0.033 | 30.060 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 151 | LEU | 0 | -0.001 | -0.006 | 25.423 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 152 | ALA | 0 | 0.012 | -0.001 | 25.772 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 153 | ARG | 1 | 0.981 | 0.999 | 26.823 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 154 | MET | 0 | 0.011 | 0.013 | 28.784 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 155 | VAL | 0 | -0.013 | -0.015 | 22.202 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 156 | GLU | -1 | -0.817 | -0.866 | 25.176 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 157 | ALA | 0 | 0.008 | 0.011 | 26.128 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 158 | VAL | 0 | -0.025 | -0.021 | 25.284 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 159 | ILE | 0 | 0.003 | -0.001 | 20.983 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 160 | GLU | -1 | -0.962 | -0.977 | 24.599 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 161 | ALA | 0 | -0.122 | -0.058 | 27.354 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 162 | GLY | 0 | -0.036 | -0.027 | 25.880 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 163 | ALA | 0 | -0.063 | -0.027 | 24.009 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 164 | ASP | -1 | -0.855 | -0.922 | 19.642 | -0.306 | -0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 165 | VAL | 0 | -0.032 | -0.018 | 17.765 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 166 | VAL | 0 | 0.014 | 0.015 | 19.819 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 167 | ASN | 0 | -0.029 | -0.016 | 20.329 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 168 | ILE | 0 | 0.031 | 0.008 | 21.294 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 169 | PRO | 0 | 0.028 | 0.062 | 22.604 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 170 | ASP | -1 | -0.796 | -0.920 | 24.552 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 171 | THR | 0 | 0.015 | -0.005 | 26.191 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 172 | THR | 0 | -0.063 | -0.028 | 29.169 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 173 | GLY | 0 | 0.077 | 0.039 | 27.728 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 174 | TYR | 0 | -0.095 | -0.047 | 28.803 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 175 | MET | 0 | -0.068 | 0.011 | 25.634 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 176 | LEU | 0 | 0.009 | 0.004 | 26.168 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 177 | PRO | 0 | 0.054 | 0.019 | 20.948 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 178 | TRP | 0 | 0.029 | 0.000 | 21.146 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 179 | GLN | 0 | 0.032 | 0.040 | 22.205 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 180 | TYR | 0 | 0.021 | -0.042 | 19.336 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 181 | GLY | 0 | -0.016 | -0.027 | 18.811 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 182 | GLU | -1 | -0.944 | -0.991 | 19.283 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 183 | ARG | 1 | 0.749 | 0.901 | 21.775 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 184 | ILE | 0 | -0.024 | -0.013 | 16.296 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 185 | LYS | 1 | 0.960 | 0.989 | 17.799 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 186 | TYR | 0 | 0.014 | 0.024 | 18.716 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 187 | LEU | 0 | 0.017 | 0.003 | 20.590 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 188 | MET | 0 | -0.077 | -0.042 | 14.242 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 189 | ASP | -1 | -0.912 | -0.961 | 18.386 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 190 | ASN | 0 | -0.109 | -0.066 | 20.758 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 191 | VAL | 0 | -0.068 | 0.003 | 21.378 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 192 | SER | 0 | -0.037 | -0.071 | 21.983 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 193 | ASN | 0 | -0.025 | -0.032 | 21.540 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 194 | ILE | 0 | 0.005 | 0.000 | 17.370 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 195 | ASP | -1 | -0.892 | -0.935 | 15.947 | -0.126 | -0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 196 | LYS | 1 | 0.796 | 0.902 | 16.011 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 197 | ALA | 0 | 0.019 | 0.003 | 17.189 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 198 | ILE | 0 | -0.046 | 0.000 | 13.489 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 199 | LEU | 0 | 0.069 | 0.033 | 15.692 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 200 | SER | 0 | -0.027 | -0.024 | 15.745 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 201 | ALA | 0 | 0.000 | -0.003 | 16.982 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 202 | HIS | 0 | 0.009 | -0.001 | 18.603 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 203 | CYS | 0 | -0.014 | 0.004 | 20.145 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 204 | HIS | 0 | 0.005 | 0.018 | 23.153 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 205 | ASN | 0 | 0.035 | 0.014 | 25.557 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 206 | ASP | -1 | -0.777 | -0.863 | 27.054 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 207 | LEU | 0 | -0.023 | -0.011 | 28.896 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 208 | GLY | 0 | -0.046 | -0.019 | 27.462 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 209 | LEU | 0 | -0.033 | -0.020 | 24.289 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 210 | ALA | 0 | 0.060 | 0.025 | 22.640 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 211 | THR | 0 | -0.015 | -0.038 | 17.765 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 212 | ALA | 0 | -0.008 | -0.016 | 18.033 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 213 | ASN | 0 | 0.036 | 0.016 | 18.875 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 214 | SER | 0 | 0.033 | 0.005 | 16.573 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 215 | LEU | 0 | -0.017 | -0.010 | 13.372 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 216 | ALA | 0 | -0.004 | 0.013 | 14.243 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 217 | ALA | 0 | 0.034 | 0.024 | 15.835 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 218 | LEU | 0 | -0.055 | -0.029 | 10.850 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 219 | GLN | 0 | -0.036 | -0.027 | 11.106 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 220 | ASN | 0 | -0.077 | -0.042 | 12.312 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 221 | GLY | 0 | -0.012 | 0.004 | 11.881 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 222 | ALA | 0 | -0.003 | 0.016 | 12.622 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 223 | ARG | 1 | 0.914 | 0.935 | 8.845 | 1.005 | 1.005 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 224 | GLN | 0 | -0.016 | -0.016 | 11.618 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 225 | VAL | 0 | 0.019 | 0.009 | 13.280 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 226 | GLU | -1 | -0.918 | -0.941 | 15.872 | -0.315 | -0.315 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 227 | CYS | 0 | -0.092 | -0.037 | 17.926 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 228 | THR | 0 | 0.002 | 0.002 | 20.694 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 229 | ILE | 0 | 0.059 | 0.024 | 22.669 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 230 | ASN | 0 | -0.082 | -0.064 | 23.619 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 231 | GLY | 0 | 0.037 | 0.019 | 23.929 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 232 | ILE | 0 | -0.033 | 0.001 | 24.989 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 233 | GLY | 0 | 0.026 | -0.002 | 27.489 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 234 | GLU | -1 | -0.955 | -0.963 | 29.902 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 235 | ARG | 1 | 0.777 | 0.863 | 31.026 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 236 | ALA | 0 | -0.002 | 0.005 | 31.084 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 237 | GLY | 0 | 0.019 | 0.029 | 28.707 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 238 | ASN | 0 | -0.037 | -0.026 | 24.140 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 239 | THR | 0 | 0.023 | 0.002 | 18.784 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 240 | ALA | 0 | 0.067 | 0.026 | 21.588 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 241 | LEU | 0 | 0.006 | 0.001 | 16.697 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 242 | GLU | -1 | -0.771 | -0.902 | 17.221 | -0.306 | -0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 243 | GLU | -1 | -0.888 | -0.920 | 17.648 | -0.191 | -0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 244 | VAL | 0 | 0.023 | 0.009 | 13.771 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 245 | VAL | 0 | 0.004 | 0.007 | 12.731 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 246 | MET | 0 | -0.010 | -0.009 | 12.624 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 247 | ALA | 0 | -0.015 | -0.003 | 14.521 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 248 | MET | 0 | -0.009 | -0.021 | 9.179 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 249 | GLU | -1 | -0.862 | -0.936 | 9.401 | -0.684 | -0.684 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 250 | CYS | 0 | -0.108 | -0.056 | 10.698 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 251 | HIS | 0 | -0.023 | -0.005 | 11.332 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 252 | LYS | 1 | 0.888 | 0.963 | 6.391 | 0.413 | 0.413 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 253 | GLU | -1 | -0.948 | -0.972 | 6.901 | 0.872 | 0.872 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 254 | THR | 0 | -0.035 | -0.012 | 8.474 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 255 | LEU | 0 | -0.033 | -0.013 | 8.296 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 256 | GLY | 0 | 0.012 | 0.021 | 4.441 | 0.117 | 0.155 | -0.001 | -0.017 | -0.020 | 0.000 |
249 | A | 257 | LEU | 0 | -0.061 | -0.050 | 3.467 | -1.360 | -0.582 | 0.081 | -0.505 | -0.354 | -0.003 |
250 | A | 258 | GLU | -1 | -0.917 | -0.957 | 2.841 | -11.183 | -8.948 | 0.783 | -1.672 | -1.345 | -0.016 |
251 | A | 259 | THR | 0 | 0.083 | 0.015 | 5.262 | 0.160 | 0.139 | -0.001 | -0.001 | 0.022 | 0.000 |
252 | A | 260 | GLY | 0 | -0.076 | -0.017 | 8.783 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 261 | ILE | 0 | 0.034 | 0.020 | 10.693 | 0.169 | 0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 262 | ASN | 0 | -0.057 | -0.034 | 12.677 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 263 | HIS | 0 | 0.065 | 0.003 | 10.532 | 0.106 | 0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 264 | LYS | 1 | 0.944 | 0.986 | 15.736 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 265 | LYS | 1 | 0.787 | 0.871 | 18.922 | 0.346 | 0.346 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 266 | LEU | 0 | 0.071 | 0.027 | 16.696 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 267 | VAL | 0 | 0.059 | 0.027 | 19.941 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 268 | PRO | 0 | -0.029 | -0.007 | 22.844 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 269 | ILE | 0 | 0.011 | 0.010 | 21.191 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 270 | SER | 0 | 0.006 | 0.010 | 22.816 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 271 | HIS | 0 | -0.042 | -0.030 | 24.641 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 272 | LEU | 0 | -0.021 | 0.001 | 27.539 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 273 | VAL | 0 | 0.042 | 0.014 | 25.770 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 274 | SER | 0 | 0.028 | -0.001 | 28.253 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 275 | THR | 0 | -0.032 | -0.010 | 29.820 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 276 | LEU | 0 | -0.078 | -0.027 | 31.668 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 277 | MET | 0 | -0.077 | -0.046 | 30.080 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 278 | ARG | 1 | 0.871 | 0.946 | 33.354 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 279 | MET | 0 | 0.001 | 0.035 | 28.070 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |