FMODB ID: Z676N
Calculation Name: 5CQ9-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 5CQ9
Chain ID: A
UniProt ID: Q8ZQC8
Base Structure: X-ray
Registration Date: 2023-06-22
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | OptAll |
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. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -3851496.593397 |
---|---|
FMO2-HF: Nuclear repulsion | 3736177.206333 |
FMO2-HF: Total energy | -115319.387064 |
FMO2-MP2: Total energy | -115647.982367 |
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:36:VAL)
Summations of interaction energy for
fragment #1(A:36:VAL)
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. |
-7.797 | -1.259 | 6.684 | -4.164 | -9.06 | -0.027 |
Interaction energy analysis for fragmet #1(A:36:VAL)
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 | 38 | ASP | -1 | -0.924 | -0.974 | 3.890 | -3.224 | -0.653 | -0.008 | -1.278 | -1.286 | -0.002 |
4 | A | 39 | ARG | 1 | 1.028 | 1.027 | 2.342 | 0.085 | 0.786 | 2.129 | -0.813 | -2.018 | 0.003 |
5 | A | 40 | PHE | 0 | 0.053 | 0.013 | 2.311 | -4.546 | -1.422 | 4.560 | -2.042 | -5.642 | -0.028 |
6 | A | 41 | LYS | 1 | 0.871 | 0.952 | 4.022 | -0.036 | 0.106 | 0.003 | -0.031 | -0.114 | 0.000 |
7 | A | 42 | ASP | -1 | -0.845 | -0.903 | 6.544 | -0.229 | -0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 43 | CYS | 0 | -0.039 | -0.024 | 6.351 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 44 | PHE | 0 | 0.002 | -0.002 | 7.606 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 45 | ARG | 1 | 0.770 | 0.883 | 9.466 | 0.317 | 0.317 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 46 | THR | 0 | 0.071 | 0.032 | 11.827 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 47 | HIS | 0 | 0.045 | 0.030 | 15.238 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 48 | LYS | 1 | 0.953 | 0.960 | 16.653 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 49 | LYS | 1 | 0.938 | 0.966 | 19.645 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 50 | GLN | 0 | -0.021 | -0.011 | 20.280 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 51 | GLU | -1 | -0.791 | -0.904 | 20.749 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 52 | VAL | 0 | -0.050 | -0.018 | 23.618 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 53 | LEU | 0 | -0.026 | -0.014 | 25.592 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 54 | GLU | -1 | -0.921 | -0.969 | 25.229 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 55 | VAL | 0 | 0.039 | 0.017 | 27.612 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 56 | LEU | 0 | -0.049 | -0.015 | 29.378 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 57 | TYR | 0 | 0.011 | 0.002 | 31.214 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 58 | THR | 0 | 0.040 | 0.017 | 31.517 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 59 | LEU | 0 | -0.073 | -0.034 | 33.440 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 60 | ILE | 0 | -0.035 | -0.021 | 34.843 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 61 | HIS | 0 | -0.035 | -0.008 | 35.862 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 62 | GLY | 0 | -0.069 | -0.021 | 38.898 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 76 | THR | 0 | 0.005 | -0.018 | 41.158 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 77 | GLY | 0 | -0.032 | -0.012 | 42.121 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 78 | MET | 0 | 0.027 | 0.018 | 42.864 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 79 | GLU | -1 | -0.817 | -0.915 | 43.925 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 80 | LYS | 1 | 0.806 | 0.892 | 36.295 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 81 | ILE | 0 | -0.022 | -0.003 | 40.372 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 82 | HIS | 0 | 0.061 | 0.040 | 42.177 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 83 | ALA | 0 | 0.025 | 0.021 | 40.839 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 84 | PHE | 0 | -0.010 | -0.005 | 33.795 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 85 | THR | 0 | -0.016 | -0.021 | 39.020 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 86 | GLN | 0 | -0.015 | -0.012 | 41.547 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 87 | LEU | 0 | -0.052 | -0.031 | 34.922 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 88 | LYS | 1 | 0.858 | 0.938 | 37.273 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 89 | GLU | -1 | -0.889 | -0.945 | 38.734 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 90 | TYR | 0 | -0.004 | 0.000 | 40.341 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 91 | ALA | 0 | -0.031 | -0.023 | 36.444 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 92 | ASN | 0 | -0.011 | 0.001 | 38.282 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 93 | PRO | 0 | 0.085 | 0.044 | 38.483 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 94 | SER | 0 | -0.021 | -0.005 | 35.257 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 95 | GLN | 0 | -0.057 | -0.022 | 31.074 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 96 | GLN | 0 | -0.006 | -0.017 | 34.684 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 97 | ASP | -1 | -0.932 | -0.974 | 35.178 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 98 | ARG | 1 | 0.760 | 0.867 | 27.163 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 99 | PHE | 0 | -0.002 | 0.010 | 31.603 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 100 | VAL | 0 | 0.004 | -0.002 | 32.530 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 101 | MET | 0 | -0.026 | -0.009 | 34.733 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 102 | ARG | 1 | 0.855 | 0.925 | 31.603 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 103 | PHE | 0 | 0.015 | 0.016 | 36.818 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 104 | ASP | -1 | -0.825 | -0.896 | 33.995 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 105 | MET | 0 | -0.001 | -0.014 | 32.701 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 106 | ASN | 0 | -0.061 | -0.029 | 36.139 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 107 | GLN | 0 | -0.011 | -0.012 | 38.369 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 108 | THR | 0 | -0.028 | -0.019 | 37.446 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 109 | GLN | 0 | -0.075 | -0.053 | 34.175 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 110 | VAL | 0 | 0.059 | 0.053 | 37.499 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 111 | LEU | 0 | -0.054 | -0.040 | 31.893 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 112 | PHE | 0 | 0.051 | 0.026 | 33.596 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 113 | GLU | -1 | -0.823 | -0.915 | 29.904 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 114 | ILE | 0 | 0.044 | 0.029 | 28.614 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 115 | ASP | -1 | -0.865 | -0.915 | 25.929 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 116 | GLY | 0 | 0.005 | 0.009 | 26.133 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 117 | LYS | 1 | 0.782 | 0.885 | 22.155 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 118 | VAL | 0 | 0.025 | 0.017 | 26.067 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 119 | ILE | 0 | -0.053 | -0.024 | 27.265 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 120 | ASP | -1 | -0.762 | -0.849 | 29.603 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 121 | LYS | 1 | 0.856 | 0.913 | 30.945 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 122 | CYS | 0 | -0.019 | -0.013 | 35.036 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 123 | ASN | 0 | -0.039 | -0.001 | 38.071 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 124 | LEU | 0 | 0.066 | 0.046 | 39.982 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 125 | HIS | 0 | 0.054 | 0.025 | 41.535 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 126 | ARG | 1 | 0.977 | 0.976 | 41.375 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 127 | LEU | 0 | -0.002 | 0.006 | 42.975 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 128 | LEU | 0 | -0.010 | 0.001 | 45.027 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 129 | ASN | 0 | -0.075 | -0.040 | 47.656 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 130 | VAL | 0 | 0.006 | -0.013 | 47.909 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 131 | SER | 0 | 0.067 | 0.039 | 46.919 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 132 | GLU | -1 | -0.896 | -0.966 | 42.712 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 133 | ASN | 0 | -0.085 | -0.056 | 44.275 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 134 | CYS | 0 | -0.016 | 0.002 | 46.533 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 135 | ILE | 0 | -0.033 | -0.005 | 46.551 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 136 | PHE | 0 | 0.016 | -0.004 | 45.603 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 137 | LYS | 1 | 0.772 | 0.867 | 47.318 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 138 | VAL | 0 | 0.032 | 0.008 | 44.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 139 | MET | 0 | -0.059 | -0.001 | 45.117 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 140 | GLU | -1 | -0.863 | -0.932 | 45.407 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 141 | GLU | -1 | -0.939 | -0.984 | 41.100 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 142 | ASP | -1 | -0.882 | -0.947 | 44.885 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 143 | GLU | -1 | -0.819 | -0.918 | 47.962 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 144 | GLU | -1 | -0.832 | -0.912 | 40.548 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 145 | GLU | -1 | -0.875 | -0.951 | 44.650 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 146 | LEU | 0 | -0.034 | -0.010 | 45.695 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 147 | PHE | 0 | 0.034 | -0.005 | 44.526 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 148 | LEU | 0 | 0.016 | 0.003 | 41.430 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 149 | LYS | 1 | 0.847 | 0.928 | 45.289 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 150 | ILE | 0 | 0.007 | 0.004 | 48.045 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 151 | CYS | 0 | -0.037 | -0.027 | 45.804 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 152 | ILE | 0 | -0.030 | -0.011 | 44.743 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 153 | LYS | 1 | 0.796 | 0.899 | 47.093 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 154 | TYR | 0 | -0.008 | -0.029 | 49.458 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 155 | GLY | 0 | 0.018 | 0.008 | 47.024 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 156 | GLU | -1 | -0.870 | -0.935 | 48.035 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 157 | LYS | 1 | 0.788 | 0.881 | 50.214 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 158 | ILE | 0 | -0.011 | -0.006 | 49.061 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 159 | SER | 0 | -0.060 | -0.042 | 47.650 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 160 | ARG | 1 | 0.876 | 0.946 | 49.717 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 161 | TYR | 0 | -0.040 | -0.020 | 52.708 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 162 | PRO | 0 | 0.072 | 0.038 | 52.430 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 163 | GLU | -1 | -0.880 | -0.951 | 54.832 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 164 | LEU | 0 | -0.055 | -0.036 | 56.309 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 165 | LEU | 0 | -0.058 | -0.021 | 53.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 166 | GLU | -1 | -0.893 | -0.912 | 57.805 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 167 | GLY | 0 | -0.007 | -0.005 | 61.371 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 168 | PHE | 0 | -0.049 | -0.038 | 62.790 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 169 | ALA | 0 | 0.119 | 0.057 | 57.278 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 170 | ASN | 0 | -0.027 | -0.010 | 58.176 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 171 | LYS | 1 | 0.882 | 0.935 | 60.049 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 172 | LEU | 0 | 0.014 | 0.016 | 52.903 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 173 | LYS | 1 | 0.905 | 0.959 | 56.386 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 174 | ASP | -1 | -0.881 | -0.952 | 57.357 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 175 | ALA | 0 | -0.007 | -0.001 | 58.163 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 176 | VAL | 0 | -0.027 | -0.005 | 53.636 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 177 | ASN | 0 | -0.071 | -0.067 | 56.607 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 178 | GLU | -1 | -0.852 | -0.927 | 59.266 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 179 | ASP | -1 | -0.800 | -0.880 | 56.260 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 180 | ASP | -1 | -0.726 | -0.847 | 58.670 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 181 | ASP | -1 | -0.826 | -0.889 | 54.406 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 182 | VAL | 0 | -0.039 | -0.018 | 53.627 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 183 | LYS | 1 | 0.782 | 0.886 | 55.727 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 184 | ASP | -1 | -0.801 | -0.872 | 57.510 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 185 | GLU | -1 | -0.827 | -0.901 | 51.258 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 186 | VAL | 0 | 0.014 | 0.001 | 54.608 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 187 | TYR | 0 | 0.014 | 0.000 | 56.168 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 188 | LYS | 1 | 0.821 | 0.908 | 52.666 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 189 | LEU | 0 | 0.006 | 0.031 | 51.526 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 190 | MET | 0 | -0.005 | 0.001 | 55.048 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 191 | ARG | 1 | 0.749 | 0.862 | 57.761 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 192 | SER | 0 | -0.007 | -0.010 | 56.997 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 193 | GLY | 0 | -0.030 | -0.010 | 59.627 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 194 | GLU | -1 | -0.788 | -0.856 | 63.241 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 195 | ASP | -1 | -0.846 | -0.933 | 64.069 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 196 | ARG | 1 | 0.726 | 0.804 | 61.097 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 197 | LYS | 1 | 0.781 | 0.880 | 63.762 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 198 | MET | 0 | -0.041 | 0.007 | 68.473 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 199 | GLU | -1 | -0.973 | -0.986 | 71.290 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 200 | CYS | 0 | -0.046 | 0.004 | 72.568 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 201 | VAL | 0 | 0.015 | 0.017 | 74.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 202 | GLU | -1 | -0.805 | -0.877 | 76.433 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 203 | TRP | 0 | -0.015 | -0.015 | 76.273 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 204 | ASN | 0 | -0.015 | -0.016 | 79.369 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 205 | GLY | 0 | -0.015 | -0.014 | 80.954 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 206 | THR | 0 | -0.051 | -0.011 | 78.010 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 207 | LEU | 0 | -0.017 | 0.000 | 74.891 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 208 | THR | 0 | -0.006 | -0.020 | 78.868 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 209 | GLU | -1 | -0.808 | -0.920 | 78.295 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 210 | GLU | -1 | -0.884 | -0.938 | 75.415 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 211 | GLU | -1 | -0.757 | -0.837 | 74.319 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 212 | LYS | 1 | 0.837 | 0.906 | 73.376 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 213 | ASN | 0 | -0.009 | -0.005 | 73.261 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 214 | LYS | 1 | 0.807 | 0.897 | 70.407 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 215 | LEU | 0 | 0.032 | 0.018 | 68.880 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 216 | ARG | 1 | 0.817 | 0.915 | 68.790 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 217 | CYS | 0 | -0.063 | 0.003 | 63.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 218 | LEU | 0 | 0.055 | 0.034 | 63.864 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 219 | GLN | 0 | -0.063 | -0.041 | 65.184 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 220 | MET | 0 | 0.024 | 0.017 | 62.283 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 221 | GLY | 0 | -0.011 | 0.007 | 65.928 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 222 | SER | 0 | -0.054 | -0.024 | 68.684 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 223 | PHE | 0 | 0.030 | -0.002 | 70.895 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 224 | ASN | 0 | -0.012 | 0.005 | 72.788 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 225 | ILE | 0 | 0.084 | 0.053 | 72.984 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 226 | THR | 0 | 0.014 | 0.014 | 73.646 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 227 | THR | 0 | -0.029 | -0.014 | 68.519 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 228 | GLN | 0 | -0.052 | -0.028 | 68.548 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 229 | PHE | 0 | 0.065 | 0.014 | 66.900 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 230 | PHE | 0 | 0.000 | 0.009 | 63.515 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 231 | LYS | 1 | 0.860 | 0.932 | 60.440 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 232 | ILE | 0 | -0.028 | -0.004 | 60.980 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 233 | GLY | 0 | 0.046 | 0.027 | 60.161 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 234 | TYR | 0 | -0.062 | -0.097 | 61.238 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 235 | TRP | 0 | 0.012 | 0.010 | 56.592 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 236 | GLU | -1 | -0.781 | -0.850 | 61.646 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 237 | LEU | 0 | 0.012 | 0.024 | 58.368 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 238 | GLU | -1 | -0.967 | -0.997 | 60.647 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 239 | GLY | 0 | -0.008 | 0.007 | 64.499 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 240 | GLU | -1 | -0.951 | -0.978 | 61.893 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 241 | VAL | 0 | 0.027 | 0.007 | 64.855 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 242 | LEU | 0 | -0.022 | 0.014 | 58.935 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 243 | PHE | 0 | 0.047 | 0.000 | 61.800 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 244 | ASP | -1 | -0.752 | -0.870 | 57.171 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 245 | MET | 0 | -0.091 | -0.030 | 58.378 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 246 | VAL | 0 | 0.025 | 0.003 | 56.102 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 247 | HIS | 0 | 0.043 | 0.018 | 49.555 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 248 | PRO | 0 | -0.007 | 0.000 | 52.597 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 249 | THR | 0 | 0.022 | 0.000 | 47.835 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 250 | LEU | 0 | 0.025 | 0.018 | 50.199 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 251 | SER | 0 | -0.022 | -0.012 | 52.756 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 252 | TYR | 0 | -0.046 | -0.020 | 51.529 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 253 | LEU | 0 | -0.018 | -0.003 | 49.180 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 254 | LEU | 0 | 0.014 | 0.029 | 52.907 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 255 | GLN | 0 | 0.021 | 0.008 | 56.093 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 256 | ALA | 0 | -0.054 | -0.032 | 56.705 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 257 | TYR | 0 | 0.002 | 0.022 | 48.394 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 258 | LYS | 1 | 0.835 | 0.902 | 53.634 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 259 | PRO | 0 | -0.002 | 0.027 | 51.120 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 260 | SER | 0 | -0.025 | -0.033 | 50.958 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 261 | LEU | 0 | -0.031 | -0.018 | 45.493 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 262 | SER | 0 | -0.006 | -0.015 | 48.074 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 263 | SER | 0 | -0.022 | -0.023 | 50.446 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 264 | ASP | -1 | -0.853 | -0.924 | 52.434 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 265 | LEU | 0 | -0.005 | 0.039 | 50.401 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 266 | ILE | 0 | 0.014 | -0.005 | 53.041 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 267 | GLU | -1 | -0.885 | -0.940 | 47.504 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 268 | THR | 0 | 0.026 | 0.001 | 52.089 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 269 | ASN | 0 | -0.016 | -0.005 | 54.020 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 270 | THR | 0 | 0.005 | -0.011 | 53.147 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 271 | MET | 0 | 0.008 | 0.022 | 50.960 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 272 | LEU | 0 | 0.023 | 0.017 | 53.907 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 273 | PHE | 0 | -0.034 | -0.021 | 56.933 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 274 | SER | 0 | 0.054 | 0.021 | 52.165 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 275 | ASP | -1 | -0.866 | -0.917 | 54.839 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 276 | VAL | 0 | -0.075 | -0.035 | 56.748 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 277 | LEU | 0 | -0.029 | -0.018 | 56.406 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 278 | ASN | 0 | 0.011 | -0.006 | 52.079 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 279 | LYS | 1 | 0.945 | 0.998 | 55.963 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 280 | ASP | -1 | -0.797 | -0.898 | 59.277 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 281 | TYR | 0 | 0.015 | -0.005 | 54.451 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 282 | ASP | -1 | -0.795 | -0.886 | 55.314 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 283 | ASP | -1 | -0.887 | -0.965 | 58.082 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 284 | TYR | 0 | -0.096 | -0.076 | 59.755 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 285 | GLN | 0 | -0.008 | -0.024 | 56.329 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 286 | ASN | 0 | -0.085 | -0.046 | 59.575 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 287 | ASN | 0 | -0.069 | -0.050 | 61.452 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 288 | LYS | 1 | 0.866 | 0.940 | 58.712 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 289 | ARG | 1 | 0.896 | 0.944 | 63.462 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 290 | GLU | -1 | -0.816 | -0.881 | 65.468 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 291 | ILE | 0 | 0.025 | 0.015 | 65.142 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 292 | ASP | -1 | -0.719 | -0.837 | 63.037 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 293 | ALA | 0 | -0.103 | -0.050 | 66.580 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 294 | ILE | 0 | -0.020 | -0.005 | 69.890 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 295 | LEU | 0 | 0.006 | 0.005 | 65.680 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 296 | ARG | 1 | 0.862 | 0.921 | 64.785 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 297 | ARG | 1 | 0.807 | 0.889 | 70.161 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 298 | ILE | 0 | -0.012 | 0.016 | 72.360 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 299 | TYR | 0 | 0.018 | -0.021 | 67.263 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 300 | ARG | 1 | 0.742 | 0.834 | 68.694 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 301 | SER | 0 | -0.070 | -0.048 | 73.680 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 302 | HIS | 0 | -0.040 | -0.014 | 74.237 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 303 | ASN | 0 | -0.010 | -0.015 | 74.061 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 304 | ASN | 0 | 0.010 | 0.023 | 69.854 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 305 | THR | 0 | 0.012 | 0.027 | 69.238 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 306 | LEU | 0 | -0.011 | -0.019 | 66.735 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 307 | PHE | 0 | 0.045 | 0.017 | 69.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 308 | ILE | 0 | -0.050 | -0.020 | 70.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 309 | SER | 0 | 0.011 | -0.020 | 73.853 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 310 | GLU | -1 | -0.920 | -0.987 | 76.497 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 311 | LYS | 1 | 0.905 | 0.946 | 79.572 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 312 | SER | 0 | -0.006 | -0.011 | 79.675 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 313 | SER | 0 | -0.056 | -0.001 | 76.434 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 314 | CYS | 0 | 0.012 | -0.037 | 72.536 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 315 | ARG | 1 | 0.864 | 0.921 | 69.315 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 316 | ASN | 0 | -0.004 | -0.010 | 68.139 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 317 | MET | 0 | -0.003 | 0.018 | 65.726 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 318 | LEU | 0 | 0.019 | 0.012 | 59.793 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 319 | ILE | 0 | -0.057 | -0.009 | 58.110 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |