FMODB ID: G59M1
Calculation Name: 5ELP-C-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 5ELP
Chain ID: C
UniProt ID: Q1RS73
Base Structure: X-ray
Registration Date: 2023-09-24
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 | 567 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -11877300.996081 |
---|---|
FMO2-HF: Nuclear repulsion | 11658350.49091 |
FMO2-HF: Total energy | -218950.505171 |
FMO2-MP2: Total energy | -219592.094454 |
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(C:7:TYR)
Summations of interaction energy for
fragment #1(C:7:TYR)
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. |
-16.977 | -9.739 | 1.056 | -3.029 | -5.265 | -0.002 |
Interaction energy analysis for fragmet #1(C:7:TYR)
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 | C | 9 | GLU | -1 | -0.914 | -0.995 | 2.459 | -11.898 | -4.883 | 1.057 | -2.999 | -5.074 | -0.002 |
4 | C | 10 | ASP | -1 | -0.957 | -0.985 | 4.547 | -2.986 | -2.763 | -0.001 | -0.030 | -0.191 | 0.000 |
5 | C | 11 | SER | 0 | 0.013 | 0.048 | 7.028 | 0.609 | 0.609 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | C | 12 | LEU | 0 | -0.055 | -0.053 | 9.642 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | C | 13 | ALA | 0 | -0.013 | 0.008 | 11.096 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | C | 14 | VAL | 0 | -0.022 | -0.004 | 12.546 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | C | 15 | ILE | 0 | 0.010 | -0.021 | 14.822 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | C | 16 | GLY | 0 | -0.011 | 0.012 | 17.132 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | C | 17 | ILE | 0 | -0.051 | -0.040 | 19.687 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | C | 18 | SER | 0 | -0.003 | -0.006 | 22.977 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | C | 19 | CYS | 0 | -0.109 | -0.053 | 26.730 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | C | 20 | GLU | -1 | -0.864 | -0.917 | 28.906 | -0.220 | -0.220 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | C | 21 | PHE | 0 | 0.010 | -0.019 | 27.327 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | C | 22 | PRO | 0 | 0.092 | 0.050 | 33.000 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | C | 23 | GLY | 0 | -0.022 | 0.001 | 34.594 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | C | 24 | ALA | 0 | -0.039 | -0.011 | 31.220 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | C | 25 | LYS | 1 | 0.988 | 0.982 | 33.336 | 0.189 | 0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | C | 26 | ASP | -1 | -0.857 | -0.908 | 28.967 | -0.281 | -0.281 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | C | 27 | HIS | 0 | 0.091 | 0.007 | 22.823 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | C | 28 | TYR | 0 | -0.045 | -0.025 | 22.463 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | C | 29 | GLU | -1 | -0.965 | -0.995 | 26.800 | -0.219 | -0.219 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | C | 30 | PHE | 0 | -0.013 | -0.012 | 25.622 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | C | 31 | TRP | 0 | 0.006 | -0.005 | 22.724 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | C | 32 | ASN | 0 | 0.031 | -0.020 | 26.616 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | C | 33 | ASN | 0 | -0.002 | 0.002 | 29.137 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | C | 34 | ILE | 0 | 0.010 | 0.007 | 25.263 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | C | 35 | LYS | 1 | 0.855 | 0.956 | 25.647 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | C | 36 | GLU | -1 | -0.941 | -0.970 | 28.277 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | C | 37 | GLY | 0 | -0.060 | -0.017 | 31.557 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | C | 38 | LYS | 1 | 0.913 | 0.958 | 33.197 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | C | 39 | GLU | -1 | -0.845 | -0.916 | 34.256 | -0.205 | -0.205 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | C | 40 | SER | 0 | -0.050 | -0.034 | 34.847 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | C | 41 | ILE | 0 | -0.015 | -0.003 | 37.580 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | C | 42 | THR | 0 | -0.131 | -0.120 | 40.215 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | C | 43 | PHE | 0 | 0.048 | -0.014 | 43.354 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | C | 44 | PHE | 0 | -0.004 | -0.003 | 46.736 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | C | 45 | SER | 0 | -0.024 | -0.006 | 50.543 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | C | 46 | LYS | 1 | 0.937 | 0.955 | 53.503 | 0.106 | 0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | C | 47 | GLU | -1 | -1.028 | -1.019 | 56.200 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | C | 48 | GLU | -1 | -0.856 | -0.903 | 53.394 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | C | 49 | LEU | 0 | -0.023 | -0.009 | 54.998 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | C | 61 | HIS | 0 | -0.023 | -0.018 | 56.173 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | C | 62 | PRO | 0 | 0.034 | 0.000 | 56.441 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | C | 63 | GLY | 0 | -0.033 | 0.003 | 56.678 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | C | 64 | PHE | 0 | 0.006 | -0.019 | 52.554 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | C | 65 | VAL | 0 | 0.036 | 0.078 | 51.987 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | C | 66 | PRO | 0 | -0.067 | 0.021 | 47.002 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | C | 67 | ALA | 0 | 0.057 | 0.063 | 46.099 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | C | 68 | LYN | 0 | 2.069 | 1.916 | 43.922 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | C | 69 | SER | 0 | 0.006 | 0.082 | 37.571 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | C | 70 | VAL | 0 | -0.005 | 0.002 | 40.297 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | C | 71 | LEU | 0 | -0.005 | 0.013 | 35.767 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | C | 72 | GLU | -1 | -0.976 | -0.995 | 39.151 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | C | 73 | GLY | 0 | -0.037 | -0.028 | 39.636 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | C | 74 | LYS | 1 | 0.960 | 0.983 | 39.937 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | C | 75 | GLU | -1 | -0.911 | -0.971 | 40.983 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | C | 76 | MET | 0 | -0.109 | -0.042 | 41.588 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | C | 77 | PHE | 0 | 0.001 | -0.010 | 38.874 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | C | 78 | ASP | -1 | -0.783 | -0.911 | 40.148 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | C | 79 | PRO | 0 | 0.016 | 0.015 | 41.477 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | C | 80 | GLY | 0 | 0.022 | 0.003 | 43.509 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | C | 81 | PHE | 0 | -0.051 | -0.011 | 35.476 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | C | 82 | PHE | 0 | 0.010 | -0.007 | 35.367 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | C | 83 | GLY | 0 | -0.028 | 0.001 | 40.543 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | C | 84 | PHE | 0 | -0.032 | -0.015 | 39.903 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | C | 85 | SER | 0 | 0.020 | 0.013 | 45.236 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | C | 86 | PRO | 0 | 0.047 | -0.006 | 47.871 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | C | 87 | LYS | 1 | 0.936 | 0.965 | 49.450 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | C | 88 | ASP | -1 | -0.899 | -0.949 | 46.181 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | C | 89 | ALA | 0 | 0.027 | 0.010 | 44.866 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | C | 90 | GLU | -1 | -0.930 | -0.964 | 45.601 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | C | 91 | TYR | 0 | 0.006 | 0.028 | 47.724 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | C | 92 | MET | 0 | -0.051 | -0.020 | 41.244 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | C | 93 | ASP | -1 | -0.800 | -0.881 | 40.001 | -0.193 | -0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | C | 94 | PRO | 0 | 0.038 | 0.023 | 40.688 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | C | 95 | GLN | 0 | 0.013 | -0.020 | 36.428 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | C | 96 | LEU | 0 | -0.023 | 0.009 | 35.985 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | C | 97 | ARG | 1 | 0.859 | 0.938 | 36.620 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | C | 98 | MET | 0 | 0.034 | 0.006 | 34.360 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | C | 99 | LEU | 0 | 0.005 | 0.003 | 30.525 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | C | 100 | LEU | 0 | -0.003 | 0.076 | 31.829 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | C | 101 | LEU | 0 | -0.025 | -0.010 | 33.086 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | C | 102 | HIS | 0 | 0.052 | 0.018 | 29.467 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | C | 103 | SER | 0 | -0.074 | -0.108 | 28.119 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | C | 104 | TRP | 0 | -0.039 | -0.013 | 28.201 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | C | 105 | LYS | 1 | 0.967 | 0.983 | 28.874 | 0.243 | 0.243 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | C | 106 | ALA | 0 | 0.016 | 0.022 | 24.262 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | C | 107 | ILE | 0 | -0.001 | -0.006 | 23.898 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | C | 108 | GLU | -1 | -0.795 | -0.914 | 24.828 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | C | 109 | ASP | -1 | -0.843 | -0.888 | 22.562 | -0.425 | -0.425 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | C | 110 | ALA | 0 | -0.011 | 0.007 | 20.696 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | C | 111 | GLY | 0 | -0.014 | 0.007 | 20.847 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | C | 112 | TYR | 0 | -0.115 | -0.141 | 18.168 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | C | 113 | ILE | 0 | 0.005 | 0.010 | 24.714 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | C | 114 | SER | 0 | 0.045 | 0.021 | 26.919 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | C | 115 | LYS | 1 | 0.987 | 0.980 | 27.750 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | C | 116 | GLU | -1 | -0.956 | -0.981 | 26.394 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | C | 117 | ILE | 0 | -0.074 | -0.013 | 22.183 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | C | 118 | PRO | 0 | 0.049 | 0.024 | 24.575 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | C | 119 | GLU | -1 | -0.928 | -0.951 | 21.031 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | C | 120 | THR | 0 | -0.003 | -0.015 | 21.467 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | C | 121 | SER | 0 | 0.018 | 0.015 | 21.703 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | C | 122 | VAL | 0 | -0.050 | -0.024 | 23.884 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | C | 123 | TYR | 0 | 0.018 | 0.005 | 22.054 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | C | 124 | MET | 0 | -0.007 | 0.008 | 26.674 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | C | 125 | SER | 0 | -0.039 | -0.014 | 29.054 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | C | 126 | ALA | 0 | 0.029 | -0.005 | 31.174 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | C | 127 | SER | 0 | 0.034 | 0.110 | 34.418 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | C | 128 | THR | 0 | 0.012 | -0.030 | 37.331 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | C | 129 | ASN | 0 | 0.061 | 0.059 | 40.362 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | C | 130 | SER | 0 | -0.003 | -0.008 | 42.849 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | C | 131 | TYR | 0 | 0.015 | -0.015 | 44.166 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | C | 132 | ARG | 1 | 0.959 | 0.974 | 46.125 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | C | 133 | SER | 0 | -0.026 | -0.018 | 48.396 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | C | 134 | LEU | 0 | 0.010 | 0.018 | 48.191 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | C | 135 | LEU | 0 | -0.087 | -0.040 | 49.172 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | C | 136 | PRO | 0 | -0.039 | -0.020 | 53.151 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | C | 137 | GLU | -1 | -0.961 | -0.955 | 54.744 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | C | 147 | ASP | -1 | -0.870 | -0.931 | 58.290 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | C | 148 | GLY | 0 | -0.067 | -0.053 | 58.262 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | C | 149 | TYR | 0 | -0.055 | -0.066 | 59.189 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | C | 150 | VAL | 0 | 0.025 | 0.024 | 57.200 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | C | 151 | SER | 0 | -0.014 | 0.006 | 52.542 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | C | 152 | TRP | 0 | -0.014 | -0.001 | 47.519 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | C | 153 | VAL | 0 | 0.015 | 0.011 | 48.353 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | C | 154 | LEU | 0 | 0.023 | 0.024 | 45.837 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | C | 155 | ALA | 0 | -0.010 | -0.007 | 42.696 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | C | 156 | GLN | 0 | 0.003 | 0.003 | 40.486 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | C | 157 | SER | 0 | 0.062 | 0.022 | 36.198 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | C | 158 | GLY | 0 | 0.035 | 0.015 | 35.273 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | C | 159 | THR | 0 | 0.003 | 0.014 | 35.680 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | C | 160 | ILE | 0 | 0.040 | 0.012 | 33.531 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | C | 161 | PRO | 0 | -0.017 | 0.015 | 30.952 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | C | 162 | THR | 0 | 0.035 | -0.033 | 32.029 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | C | 163 | MET | 0 | -0.024 | 0.004 | 34.120 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | C | 164 | ILE | 0 | 0.032 | 0.008 | 30.337 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | C | 165 | SER | 0 | 0.024 | 0.011 | 30.052 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | C | 166 | HIS | 0 | -0.024 | 0.008 | 31.461 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | C | 167 | LYS | 1 | 0.839 | 0.930 | 34.752 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | C | 168 | LEU | 0 | -0.051 | -0.020 | 28.715 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | C | 169 | GLY | 0 | -0.025 | -0.005 | 30.701 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | C | 170 | LEU | 0 | -0.092 | -0.054 | 26.255 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | C | 171 | LYS | 1 | 0.914 | 0.931 | 27.344 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | C | 172 | GLY | 0 | 0.054 | 0.052 | 24.702 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | C | 173 | PRO | 0 | -0.009 | -0.005 | 24.006 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | C | 174 | SER | 0 | -0.007 | -0.004 | 26.344 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | C | 175 | TYR | 0 | -0.024 | -0.019 | 25.480 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | C | 176 | PHE | 0 | -0.008 | 0.000 | 29.560 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | C | 177 | VAL | 0 | -0.019 | -0.011 | 26.822 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | C | 178 | HIS | 0 | -0.025 | -0.032 | 30.071 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | C | 179 | ALA | 0 | 0.111 | 0.046 | 29.637 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | C | 180 | ASN | 0 | 0.029 | 0.047 | 31.660 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | C | 181 | CYS | 0 | 0.044 | 0.056 | 31.469 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | C | 182 | SER | 0 | 0.005 | 0.003 | 26.821 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | C | 183 | SER | 0 | -0.119 | -0.099 | 27.522 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | C | 184 | SER | 0 | 0.070 | 0.021 | 24.770 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | C | 185 | LEU | 0 | 0.053 | 0.069 | 21.451 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | C | 186 | ILE | 0 | -0.004 | 0.015 | 22.279 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | C | 187 | GLY | 0 | 0.040 | 0.019 | 23.641 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | C | 188 | LEU | 0 | 0.005 | -0.003 | 18.394 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | C | 189 | HIS | 0 | -0.006 | 0.007 | 18.755 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | C | 190 | SER | 0 | -0.032 | -0.019 | 19.876 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | C | 191 | ALA | 0 | 0.021 | 0.000 | 18.998 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | C | 192 | PHE | 0 | -0.057 | -0.020 | 11.689 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | C | 193 | GLN | 0 | -0.004 | -0.007 | 15.638 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | C | 194 | SER | 0 | -0.010 | 0.010 | 17.594 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | C | 195 | LEU | 0 | 0.036 | -0.012 | 14.307 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | C | 196 | GLN | 0 | -0.074 | -0.027 | 10.085 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | C | 197 | SER | 0 | -0.055 | -0.021 | 13.573 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | C | 198 | GLY | 0 | -0.060 | -0.023 | 15.758 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | C | 199 | GLU | -1 | -0.964 | -0.973 | 16.367 | -0.360 | -0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | C | 200 | ALA | 0 | 0.005 | 0.006 | 18.544 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | C | 201 | LYS | 1 | 0.939 | 0.989 | 16.620 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | C | 202 | TYR | 0 | -0.016 | -0.021 | 16.733 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | C | 203 | ALA | 0 | 0.021 | 0.015 | 18.969 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | C | 204 | LEU | 0 | -0.001 | 0.011 | 20.541 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | C | 205 | VAL | 0 | -0.013 | 0.002 | 21.383 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | C | 206 | GLY | 0 | 0.028 | 0.001 | 24.014 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | C | 207 | GLY | 0 | -0.047 | -0.025 | 27.048 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | C | 208 | ALA | 0 | -0.034 | -0.032 | 29.432 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | C | 209 | THR | 0 | -0.072 | -0.092 | 32.913 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | C | 210 | LEU | 0 | 0.063 | 0.026 | 35.950 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | C | 211 | HIS | 0 | -0.006 | -0.015 | 39.158 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | C | 212 | THR | 0 | -0.098 | -0.079 | 42.414 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | C | 213 | GLU | -1 | -0.905 | -0.951 | 45.853 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | C | 214 | SER | 0 | -0.141 | -0.070 | 47.094 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | C | 215 | SER | -1 | -3.236 | -2.499 | 47.442 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | C | 216 | ALA | 0 | 0.536 | -0.238 | 48.982 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | C | 217 | GLY | 0 | -0.076 | -0.047 | 51.448 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | C | 218 | TYR | 0 | 0.032 | 0.085 | 50.323 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | C | 219 | VAL | 0 | -0.131 | -0.160 | 46.854 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | C | 220 | HIS | 0 | -0.012 | -0.050 | 44.960 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | C | 221 | GLN | 0 | 0.012 | -0.024 | 48.519 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | C | 222 | PRO | 0 | -0.007 | 0.023 | 47.615 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | C | 223 | GLY | 0 | 0.005 | 0.006 | 48.156 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | C | 224 | LEU | 0 | -0.039 | -0.021 | 45.067 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | C | 225 | ASN | 0 | -0.017 | -0.013 | 40.339 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | C | 226 | PHE | 0 | 0.026 | 0.023 | 42.877 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | C | 227 | SER | 0 | -0.111 | -0.002 | 41.908 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | C | 228 | SER | 0 | 0.037 | -0.006 | 43.784 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | C | 229 | ASP | -1 | -0.815 | -0.917 | 44.012 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | C | 230 | GLY | 0 | 0.026 | -0.005 | 43.892 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | C | 231 | HIS | 1 | 0.787 | 0.908 | 40.223 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | C | 232 | ILE | 0 | -0.052 | -0.010 | 34.904 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | C | 233 | LYS | 1 | 0.877 | 0.987 | 36.481 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | C | 234 | ALA | 0 | 0.023 | 0.026 | 32.174 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | C | 235 | PHE | 0 | -0.024 | -0.019 | 29.098 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | C | 236 | ASP | -1 | -0.748 | -0.864 | 34.490 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | C | 237 | ALA | 0 | 0.004 | -0.011 | 37.655 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | C | 238 | ASP | -1 | -1.017 | -1.009 | 40.905 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | C | 239 | ALA | 0 | -0.011 | -0.035 | 38.680 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | C | 240 | ASP | -1 | -0.902 | -0.961 | 40.658 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | C | 241 | GLY | 0 | -0.084 | -0.044 | 40.754 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | C | 242 | MET | 0 | -0.045 | -0.011 | 37.353 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | C | 243 | ILE | 0 | 0.067 | 0.024 | 38.748 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | C | 244 | GLY | 0 | 0.018 | 0.009 | 38.148 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | C | 245 | GLY | 0 | 0.049 | 0.017 | 36.547 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | C | 246 | GLU | -1 | -0.870 | -0.943 | 36.748 | -0.195 | -0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | C | 247 | GLY | 0 | 0.012 | -0.019 | 33.132 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | C | 248 | ALA | 0 | -0.027 | -0.008 | 31.632 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | C | 249 | GLY | 0 | -0.011 | 0.005 | 27.868 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | C | 250 | ALA | 0 | -0.015 | -0.020 | 25.884 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | C | 251 | VAL | 0 | -0.004 | -0.005 | 20.447 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | C | 252 | LEU | 0 | 0.000 | -0.004 | 19.965 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | C | 253 | LEU | 0 | -0.039 | -0.026 | 15.946 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | C | 254 | LYS | 1 | 0.810 | 0.908 | 14.060 | 0.609 | 0.609 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | C | 255 | LYS | 1 | 1.012 | 1.027 | 9.202 | 1.027 | 1.027 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | C | 256 | ALA | 0 | 0.033 | 0.015 | 7.350 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | C | 257 | SER | 0 | 0.066 | 0.013 | 5.765 | 0.337 | 0.337 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | C | 258 | ASP | -1 | -0.956 | -0.979 | 7.597 | -0.266 | -0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | C | 259 | ALA | 0 | -0.020 | -0.007 | 10.387 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | C | 260 | VAL | 0 | 0.028 | 0.017 | 6.806 | 0.244 | 0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | C | 261 | LYS | 1 | 0.882 | 0.940 | 7.433 | -0.871 | -0.871 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | C | 262 | ASP | -1 | -0.891 | -0.933 | 11.290 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | C | 263 | GLY | 0 | -0.070 | -0.021 | 12.802 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | C | 264 | ASP | -1 | -0.759 | -0.817 | 13.877 | -0.457 | -0.457 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | C | 265 | HIS | 0 | -0.007 | -0.001 | 13.782 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | C | 266 | ILE | 0 | -0.014 | -0.011 | 9.904 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | C | 267 | TYR | 0 | -0.078 | -0.033 | 13.443 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | C | 268 | ALA | 0 | 0.000 | -0.012 | 12.140 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | C | 269 | LEU | 0 | 0.030 | 0.014 | 6.359 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | C | 270 | LEU | 0 | -0.024 | -0.004 | 10.606 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | C | 271 | ARG | 1 | 0.923 | 0.944 | 6.680 | 2.815 | 2.815 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | C | 272 | GLY | 0 | 0.084 | 0.034 | 10.340 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | C | 273 | ILE | 0 | -0.021 | -0.019 | 13.473 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | C | 274 | GLY | 0 | -0.010 | 0.012 | 17.228 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | C | 275 | VAL | 0 | -0.004 | -0.016 | 19.993 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | C | 276 | ASN | 0 | -0.054 | -0.028 | 23.721 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | C | 277 | ASN | 0 | 0.013 | 0.012 | 26.859 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | C | 278 | ASP | -1 | -0.776 | -0.901 | 30.529 | -0.278 | -0.278 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | C | 279 | GLY | 0 | -0.059 | -0.003 | 32.900 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | C | 280 | ALA | 0 | -0.063 | -0.033 | 35.571 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | C | 281 | ASP | -1 | -0.847 | -0.925 | 36.433 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | C | 282 | LYS | 1 | 0.884 | 0.930 | 39.752 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | C | 283 | VAL | 0 | -0.021 | -0.002 | 38.987 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | C | 284 | GLY | 0 | 0.035 | 0.006 | 40.166 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | C | 285 | PHE | 0 | -0.047 | -0.056 | 38.679 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | C | 286 | TYR | 0 | 0.060 | 0.065 | 38.643 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | C | 287 | ALA | 0 | 0.008 | -0.019 | 37.839 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | C | 288 | PRO | 0 | -0.008 | 0.057 | 33.551 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | C | 289 | SER | 0 | 0.077 | 0.020 | 33.333 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | C | 290 | VAL | 0 | 0.025 | -0.006 | 31.533 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | C | 291 | LYS | 1 | 0.953 | 0.965 | 30.421 | 0.214 | 0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | C | 292 | GLY | 0 | 0.100 | 0.066 | 29.501 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | C | 293 | GLN | 0 | 0.035 | 0.003 | 27.301 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | C | 294 | ALA | 0 | -0.014 | -0.007 | 25.695 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | C | 295 | GLU | -1 | -0.972 | -0.980 | 24.887 | -0.321 | -0.321 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | C | 296 | VAL | 0 | -0.048 | -0.025 | 22.790 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | C | 297 | ILE | 0 | 0.002 | 0.006 | 20.586 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | C | 298 | GLN | 0 | 0.027 | 0.013 | 19.758 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | C | 299 | LYS | 1 | 0.963 | 0.995 | 19.484 | 0.435 | 0.435 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | C | 300 | VAL | 0 | -0.034 | -0.022 | 15.415 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | C | 301 | ILE | 0 | 0.002 | 0.030 | 15.149 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | C | 302 | ASP | -1 | -0.892 | -0.930 | 14.750 | -0.549 | -0.549 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | C | 303 | GLN | 0 | -0.110 | -0.053 | 13.386 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | C | 304 | THR | 0 | -0.092 | -0.068 | 10.953 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | C | 305 | GLY | 0 | 0.040 | 0.011 | 10.379 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | C | 306 | ILE | 0 | -0.092 | -0.030 | 9.752 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | C | 307 | HIS | 0 | 0.199 | 0.090 | 11.753 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | C | 308 | PRO | 0 | 0.097 | 0.025 | 14.359 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | C | 309 | GLU | -1 | -0.965 | -0.973 | 16.211 | -0.313 | -0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | C | 310 | THR | 0 | -0.064 | -0.038 | 11.090 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | C | 311 | ILE | 0 | -0.050 | -0.005 | 13.893 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | C | 312 | ALA | 0 | 0.030 | 0.032 | 16.302 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | C | 313 | TYR | 0 | -0.016 | -0.009 | 18.144 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | C | 314 | VAL | 0 | -0.012 | -0.014 | 19.026 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | C | 315 | GLU | -1 | -0.831 | -0.940 | 21.396 | -0.398 | -0.398 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | C | 316 | ALA | 0 | 0.012 | -0.013 | 23.302 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | C | 317 | HIS | 0 | -0.029 | -0.023 | 26.066 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | C | 318 | GLY | 0 | -0.002 | -0.018 | 28.673 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | C | 319 | THR | 0 | -0.055 | -0.043 | 31.042 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | C | 320 | GLY | 0 | 0.090 | 0.043 | 34.243 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | C | 321 | THR | 0 | -0.073 | -0.043 | 36.519 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | C | 322 | LYS | 1 | 0.981 | 0.985 | 37.833 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | C | 323 | LEU | 0 | -0.013 | -0.022 | 39.122 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | C | 324 | GLY | 0 | 0.013 | -0.009 | 35.794 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | C | 325 | ASP | -1 | -0.743 | -0.875 | 33.162 | -0.262 | -0.262 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | C | 326 | PRO | 0 | 0.007 | -0.013 | 32.821 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | C | 327 | ILE | 0 | -0.071 | -0.012 | 32.672 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | C | 328 | GLU | -1 | -0.737 | -0.869 | 27.611 | -0.370 | -0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | C | 329 | LEU | 0 | 0.055 | 0.025 | 28.670 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | C | 330 | SER | 0 | -0.019 | 0.017 | 29.394 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | C | 331 | ALA | 0 | 0.032 | -0.005 | 28.178 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | C | 332 | LEU | 0 | 0.008 | 0.052 | 22.693 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | C | 333 | GLN | 0 | 0.049 | 0.016 | 24.907 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | C | 334 | SER | 0 | -0.150 | -0.097 | 26.443 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | C | 335 | VAL | 0 | -0.018 | -0.017 | 21.375 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | C | 336 | TYR | 0 | 0.036 | 0.009 | 20.013 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | C | 337 | GLY | 0 | 0.048 | 0.032 | 23.153 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | C | 338 | ARG | 1 | 0.780 | 0.894 | 23.935 | 0.249 | 0.249 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | C | 339 | TYR | 0 | -0.003 | -0.007 | 18.561 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | C | 340 | THR | 0 | -0.291 | -0.195 | 19.849 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | C | 341 | ASP | -1 | -0.687 | -0.821 | 21.041 | -0.307 | -0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | C | 342 | LYS | 1 | 0.800 | 0.900 | 23.346 | 0.173 | 0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | C | 343 | LYS | 1 | 0.964 | 0.959 | 21.876 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | C | 344 | GLN | 0 | 0.059 | 0.060 | 25.389 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | C | 345 | TYR | 0 | -0.106 | -0.036 | 19.248 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | C | 346 | CYS | 0 | -0.099 | -0.036 | 20.045 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | C | 347 | GLY | 0 | 0.043 | 0.044 | 22.332 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | C | 348 | ILE | 0 | 0.006 | 0.000 | 23.181 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | C | 349 | GLY | 0 | 0.046 | -0.002 | 25.685 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | C | 350 | SER | 0 | 0.036 | 0.040 | 26.874 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | C | 351 | VAL | 0 | -0.042 | -0.004 | 26.992 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | C | 352 | LYS | 1 | 0.856 | 0.934 | 28.994 | 0.344 | 0.344 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | C | 353 | THR | 0 | -0.012 | -0.006 | 31.381 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | C | 354 | ASN | 0 | -0.039 | -0.015 | 31.142 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | C | 355 | LEU | 0 | 0.010 | -0.012 | 30.471 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | C | 356 | GLY | 0 | 0.049 | 0.024 | 34.005 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | C | 357 | HIS | 0 | -0.017 | -0.043 | 32.625 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | C | 358 | LEU | 0 | -0.002 | 0.034 | 30.147 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | C | 359 | ASP | -1 | -0.740 | -0.865 | 32.855 | -0.241 | -0.241 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | C | 360 | THR | 0 | -0.047 | -0.043 | 31.885 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | C | 361 | ALA | 0 | 0.006 | 0.012 | 29.502 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | C | 362 | ALA | 0 | -0.033 | -0.017 | 28.809 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | C | 363 | GLY | 0 | 0.006 | -0.017 | 25.719 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | C | 364 | MET | 0 | 0.007 | 0.005 | 22.816 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | C | 365 | ALA | 0 | 0.044 | 0.022 | 24.534 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | C | 366 | GLY | 0 | 0.029 | 0.021 | 24.606 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | C | 367 | CYS | 0 | -0.040 | -0.024 | 19.409 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | C | 368 | ILE | 0 | 0.019 | -0.002 | 20.192 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | C | 369 | LYS | 1 | 0.963 | 1.001 | 21.452 | 0.389 | 0.389 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | C | 370 | VAL | 0 | 0.032 | 0.062 | 17.040 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | C | 371 | VAL | 0 | -0.006 | 0.005 | 16.309 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | C | 372 | MET | 0 | -0.029 | -0.012 | 17.322 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | C | 373 | SER | 0 | -0.085 | -0.094 | 19.195 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | C | 374 | LEU | 0 | -0.028 | -0.018 | 13.048 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | C | 375 | TYR | 0 | -0.022 | 0.000 | 14.939 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | C | 376 | HIS | 1 | 0.836 | 0.916 | 16.253 | 0.503 | 0.503 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | C | 377 | GLN | 0 | -0.024 | 0.005 | 14.971 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | C | 378 | GLU | -1 | -0.862 | -0.938 | 17.616 | -0.315 | -0.315 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | C | 379 | ILE | 0 | -0.017 | -0.015 | 20.721 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | C | 380 | ALA | 0 | -0.036 | -0.016 | 22.730 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | C | 381 | PRO | 0 | -0.004 | 0.006 | 25.773 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | C | 382 | SER | 0 | -0.036 | -0.011 | 29.031 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | C | 383 | ILE | 0 | 0.007 | 0.007 | 30.509 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | C | 384 | ASN | 0 | -0.089 | -0.049 | 34.110 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | C | 385 | TYR | 0 | -0.019 | 0.004 | 34.644 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | C | 386 | LYS | 1 | 0.883 | 0.936 | 36.772 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | C | 387 | GLU | -1 | -0.940 | -0.988 | 38.821 | -0.132 | -0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | C | 388 | PRO | 0 | 0.043 | 0.025 | 36.161 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | C | 389 | ASN | 0 | -0.044 | 0.030 | 36.984 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | C | 390 | PRO | 0 | 0.022 | -0.013 | 37.965 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | C | 391 | ASN | 0 | -0.017 | -0.065 | 38.962 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | C | 392 | LEU | 0 | -0.054 | 0.004 | 33.248 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | C | 393 | HIS | 0 | -0.005 | -0.002 | 34.330 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | C | 394 | LEU | 0 | 0.036 | 0.008 | 31.597 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | C | 395 | GLU | -1 | -0.933 | -0.965 | 31.629 | -0.178 | -0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | C | 396 | ASP | -1 | -0.950 | -0.969 | 32.179 | -0.158 | -0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | C | 397 | SER | 0 | -0.084 | -0.029 | 28.922 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | C | 398 | PRO | 0 | -0.028 | -0.018 | 24.180 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | C | 399 | PHE | 0 | -0.006 | -0.031 | 22.870 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | C | 400 | PHE | 0 | -0.027 | -0.002 | 24.253 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | C | 401 | VAL | 0 | 0.021 | 0.012 | 27.394 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | C | 402 | ALA | 0 | -0.004 | -0.001 | 26.784 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | C | 403 | GLU | -1 | -0.863 | -0.937 | 28.924 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | C | 404 | GLU | -1 | -0.997 | -1.014 | 29.963 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | C | 405 | LYS | 1 | 0.954 | 0.980 | 27.747 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | C | 406 | LYS | 1 | 0.906 | 0.969 | 24.625 | 0.300 | 0.300 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | C | 407 | GLU | -1 | -0.907 | -0.946 | 22.630 | -0.279 | -0.279 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | C | 408 | LEU | 0 | -0.026 | -0.023 | 17.151 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | C | 409 | THR | 0 | 0.057 | 0.023 | 16.635 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | C | 410 | ARG | 1 | 0.911 | 0.957 | 17.172 | 0.230 | 0.230 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | C | 411 | GLU | -1 | -0.923 | -0.952 | 13.132 | -0.587 | -0.587 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | C | 412 | ASN | 0 | -0.061 | -0.040 | 11.583 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | C | 413 | ARG | 1 | 0.905 | 0.966 | 7.809 | 0.613 | 0.613 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | C | 414 | ALA | 0 | 0.043 | 0.024 | 7.643 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | C | 415 | HIS | 0 | 0.036 | 0.015 | 9.599 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | C | 416 | ARG | 1 | 0.868 | 0.922 | 6.948 | 1.792 | 1.792 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | C | 417 | MET | 0 | -0.044 | -0.003 | 12.940 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | C | 418 | ALA | 0 | 0.033 | 0.023 | 15.676 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | C | 419 | LEU | 0 | -0.021 | 0.004 | 18.101 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | C | 420 | SER | 0 | 0.003 | 0.010 | 20.820 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | C | 421 | SER | 0 | -0.030 | 0.001 | 23.827 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | C | 422 | PHE | 0 | 0.024 | 0.000 | 25.777 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | C | 423 | GLY | 0 | -0.034 | -0.013 | 29.414 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | C | 424 | LEU | 0 | 0.056 | 0.004 | 31.813 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | C | 425 | GLY | 0 | -0.048 | -0.015 | 34.480 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | C | 426 | GLY | 0 | 0.084 | 0.062 | 33.048 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | C | 427 | THR | 0 | -0.068 | -0.044 | 28.177 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | C | 428 | ASN | 0 | -0.060 | -0.032 | 26.738 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | C | 429 | THR | 0 | -0.073 | -0.105 | 22.780 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | C | 430 | HIS | 0 | 0.038 | 0.010 | 19.072 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | C | 431 | ALA | 0 | 0.012 | -0.006 | 16.926 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | C | 432 | ILE | 0 | 0.032 | 0.036 | 12.540 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | C | 433 | PHE | 0 | -0.030 | -0.027 | 12.618 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | C | 434 | GLU | -1 | -0.852 | -0.947 | 5.824 | -3.825 | -3.825 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | C | 435 | GLN | 0 | 0.052 | 0.027 | 10.029 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | C | 436 | TYR | 0 | 0.041 | 0.020 | 6.481 | -0.464 | -0.464 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | C | 437 | PRO | 0 | -0.049 | -0.011 | 6.589 | 0.447 | 0.447 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | C | 438 | ASP | -1 | -0.951 | -0.979 | 7.670 | -0.744 | -0.744 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | C | 446 | ALA | 0 | 0.047 | 0.019 | 26.379 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | C | 447 | GLY | 0 | -0.044 | -0.023 | 27.994 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | C | 448 | PRO | 0 | -0.033 | -0.003 | 31.644 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | C | 449 | PHE | 0 | 0.038 | 0.010 | 28.097 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | C | 450 | ILE | 0 | -0.017 | -0.024 | 31.530 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | C | 451 | ILE | 0 | 0.027 | 0.011 | 31.100 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | C | 452 | PRO | 0 | -0.024 | -0.009 | 32.079 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | C | 453 | LEU | 0 | 0.018 | 0.022 | 33.937 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | C | 454 | SER | 0 | -0.007 | -0.016 | 36.139 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | C | 455 | ALA | 0 | -0.012 | -0.004 | 37.285 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | C | 456 | ARG | 1 | 0.967 | 0.995 | 37.434 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | C | 457 | LYS | 1 | 0.959 | 0.985 | 42.116 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | C | 458 | LYS | 1 | 1.033 | 0.997 | 43.376 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | C | 459 | ASP | -1 | -0.862 | -0.931 | 44.679 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | C | 460 | ARG | 1 | 0.838 | 0.909 | 40.551 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | C | 461 | LEU | 0 | 0.045 | 0.027 | 39.030 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | C | 462 | LYS | 1 | 0.871 | 0.950 | 40.430 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | C | 463 | GLU | -1 | -0.905 | -0.953 | 40.552 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | C | 464 | TYR | 0 | 0.018 | 0.004 | 32.095 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | C | 465 | ALA | 0 | 0.010 | 0.007 | 36.339 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | C | 466 | LYS | 1 | 0.941 | 0.980 | 37.583 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | C | 467 | GLN | 0 | 0.032 | 0.016 | 34.147 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | C | 468 | LEU | 0 | -0.001 | 0.013 | 31.639 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | C | 469 | LEU | 0 | -0.007 | -0.025 | 33.406 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | C | 470 | ALA | 0 | -0.044 | -0.025 | 35.382 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | C | 471 | PHE | 0 | 0.016 | -0.011 | 26.168 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | C | 472 | LEU | 0 | -0.030 | -0.020 | 30.325 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | C | 473 | GLU | -1 | -0.927 | -0.956 | 32.155 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | C | 474 | ARG | 1 | 0.858 | 0.935 | 30.363 | 0.177 | 0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | C | 475 | LYS | 1 | 0.963 | 0.983 | 24.665 | 0.242 | 0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | C | 476 | THR | 0 | -0.037 | -0.025 | 29.225 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | C | 477 | ASP | -1 | -0.880 | -0.842 | 25.579 | -0.123 | -0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | C | 478 | THR | 0 | -0.070 | -0.106 | 24.276 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | C | 479 | ASP | -1 | -0.829 | -0.928 | 22.826 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | C | 480 | LEU | 0 | -0.007 | -0.011 | 24.771 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | C | 481 | ALA | 0 | -0.006 | 0.011 | 23.512 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | C | 482 | ASP | -1 | -0.757 | -0.888 | 20.452 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | C | 483 | LEU | 0 | -0.052 | -0.018 | 23.237 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | C | 484 | ALA | 0 | -0.010 | -0.023 | 26.213 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | C | 485 | TYR | 0 | -0.055 | -0.040 | 21.063 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | C | 486 | THR | 0 | 0.033 | 0.009 | 23.494 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | C | 487 | PHE | 0 | 0.013 | 0.019 | 25.249 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | C | 488 | GLN | 0 | -0.060 | -0.021 | 28.368 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | C | 489 | VAL | 0 | -0.051 | -0.014 | 24.216 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | C | 490 | GLY | 0 | 0.039 | 0.014 | 25.801 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | C | 491 | ARG | 1 | 0.820 | 0.886 | 26.468 | 0.215 | 0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | C | 492 | GLU | -1 | -0.907 | -0.942 | 30.186 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | C | 493 | ALA | 0 | -0.031 | -0.009 | 33.118 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | C | 494 | MET | 0 | -0.046 | -0.029 | 35.200 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | C | 495 | GLU | -1 | -0.831 | -0.928 | 38.827 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | C | 496 | GLU | -1 | -0.911 | -0.932 | 42.116 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | C | 497 | ARG | 1 | 0.820 | 0.896 | 39.547 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | C | 498 | ALA | 0 | -0.032 | -0.022 | 39.502 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | C | 499 | ALA | 0 | 0.015 | 0.025 | 37.592 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | C | 500 | PHE | 0 | -0.023 | -0.024 | 36.478 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | C | 501 | ILE | 0 | -0.032 | -0.015 | 36.104 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | C | 502 | THR | 0 | 0.008 | -0.011 | 34.099 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | C | 503 | SER | 0 | 0.027 | 0.007 | 34.917 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | C | 504 | GLY | 0 | 0.081 | 0.036 | 33.030 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | C | 505 | THR | 0 | 0.077 | 0.024 | 30.327 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | C | 506 | ALA | 0 | -0.002 | -0.006 | 33.181 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | C | 507 | GLU | -1 | -0.889 | -0.926 | 36.343 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | C | 508 | LEU | 0 | -0.038 | -0.006 | 32.973 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | C | 509 | LYS | 1 | 0.964 | 0.983 | 34.983 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | C | 510 | ARG | 1 | 0.904 | 0.930 | 37.905 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | C | 511 | GLN | 0 | 0.028 | 0.033 | 38.789 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | C | 512 | LEU | 0 | 0.000 | 0.000 | 35.633 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | C | 513 | ALA | 0 | 0.003 | 0.000 | 40.251 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | C | 514 | ASP | -1 | -0.870 | -0.932 | 42.919 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | C | 515 | PHE | 0 | -0.061 | -0.034 | 42.118 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | C | 516 | ILE | 0 | -0.028 | -0.021 | 40.626 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | C | 517 | ASN | 0 | -0.052 | -0.027 | 44.776 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | C | 518 | ASP | -1 | -0.937 | -0.987 | 47.569 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | C | 519 | LYS | 1 | 0.909 | 0.957 | 48.853 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | C | 520 | PRO | 0 | -0.027 | 0.022 | 46.994 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | C | 521 | ALA | 0 | 0.021 | 0.003 | 49.689 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | C | 522 | VAL | 0 | -0.032 | -0.027 | 46.007 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | C | 523 | THR | 0 | 0.104 | 0.043 | 44.623 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | C | 524 | GLY | 0 | -0.011 | 0.015 | 41.757 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | C | 525 | CYS | 0 | -0.104 | -0.068 | 40.801 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | C | 526 | PHE | 0 | 0.021 | 0.025 | 41.111 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | C | 527 | ARG | 1 | 0.911 | 0.947 | 42.731 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | C | 528 | GLY | 0 | -0.011 | -0.005 | 44.820 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | C | 529 | GLU | -1 | -0.881 | -0.928 | 44.818 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | C | 530 | LYS | 1 | 1.002 | 1.007 | 42.187 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | C | 531 | GLN | 0 | -0.048 | -0.067 | 44.902 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | C | 532 | GLN | 0 | -0.013 | 0.003 | 47.549 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | C | 533 | ALA | 0 | 0.067 | 0.051 | 48.523 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | C | 534 | LYS | 1 | 0.963 | 0.960 | 49.546 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | C | 535 | ASP | -1 | -0.904 | -0.981 | 48.799 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | C | 536 | ILE | 0 | 0.023 | 0.018 | 44.020 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | C | 537 | ALA | 0 | -0.022 | 0.027 | 45.915 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | C | 538 | TRP | 0 | -0.042 | -0.040 | 46.943 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | C | 539 | LEU | 0 | -0.016 | 0.032 | 47.014 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | C | 540 | SER | 0 | -0.145 | -0.092 | 43.354 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | C | 541 | ASP | -1 | -0.929 | -0.984 | 38.847 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | C | 542 | ASP | -1 | -0.904 | -0.942 | 42.183 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | C | 543 | ASP | -1 | -0.981 | -0.986 | 39.036 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | C | 544 | ASP | -1 | -0.879 | -0.943 | 41.456 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | C | 545 | SER | 0 | -0.023 | -0.021 | 38.602 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | C | 546 | ALA | 0 | -0.016 | -0.046 | 39.280 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | C | 547 | GLU | -1 | -0.834 | -0.916 | 38.535 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | C | 548 | LEU | 0 | -0.161 | -0.112 | 40.610 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | C | 549 | ILE | 0 | 0.083 | 0.098 | 37.017 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | C | 550 | GLU | -1 | -0.820 | -0.889 | 35.296 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | C | 551 | LYS | 1 | 0.830 | 0.907 | 36.581 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | C | 552 | TRP | 0 | -0.042 | -0.049 | 37.634 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | C | 553 | LEU | 0 | 0.067 | 0.061 | 30.614 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | C | 554 | ALA | 0 | -0.049 | -0.012 | 33.724 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | C | 555 | LYS | 1 | 0.863 | 0.926 | 34.734 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | C | 556 | GLY | 0 | 0.038 | 0.027 | 34.174 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | C | 557 | LYS | 1 | 0.814 | 0.941 | 34.888 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | C | 558 | GLY | 0 | 0.098 | 0.027 | 36.718 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | C | 559 | PRO | 0 | 0.051 | 0.044 | 37.488 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | C | 560 | LYS | 1 | 0.962 | 0.950 | 40.561 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | C | 561 | LEU | 0 | 0.037 | 0.031 | 34.902 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | C | 562 | CYS | 0 | -0.014 | -0.007 | 38.295 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | C | 563 | GLU | -1 | -0.978 | -0.965 | 39.670 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | C | 564 | MET | 0 | 0.035 | 0.009 | 41.358 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | C | 565 | TRP | 0 | 0.033 | 0.026 | 35.632 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | C | 566 | SER | 0 | -0.100 | -0.051 | 39.887 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | C | 567 | LYS | 1 | 0.843 | 0.941 | 42.289 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | C | 568 | GLY | 0 | 0.035 | -0.030 | 41.633 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | C | 569 | VAL | 0 | -0.045 | -0.038 | 38.505 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | C | 570 | ALA | 0 | 0.095 | 0.090 | 35.929 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | C | 571 | ILE | 0 | 0.075 | 0.060 | 29.772 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | C | 572 | ASN | 0 | -0.040 | -0.038 | 30.565 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | C | 573 | TRP | 0 | 0.052 | 0.000 | 22.997 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | C | 574 | HIS | 0 | -0.028 | -0.051 | 26.985 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | C | 575 | LYS | 1 | 0.814 | 0.847 | 24.775 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | C | 576 | LEU | 0 | 0.144 | 0.110 | 21.583 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | C | 577 | TYR | 0 | 0.053 | 0.035 | 22.331 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | C | 578 | LYS | 1 | 0.835 | 0.913 | 25.089 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | C | 579 | ASP | -1 | -0.912 | -0.967 | 21.030 | 0.251 | 0.251 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | C | 580 | LYS | 1 | 0.922 | 0.974 | 19.211 | -0.249 | -0.249 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | C | 581 | HIS | 0 | -0.043 | 0.028 | 18.778 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | C | 582 | PRO | 0 | -0.070 | -0.014 | 19.313 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | C | 583 | LYS | 1 | 0.932 | 0.972 | 14.036 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | C | 584 | ARG | 1 | 0.911 | 0.952 | 18.387 | 0.247 | 0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | C | 585 | ILE | 0 | 0.031 | 0.003 | 18.871 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | C | 586 | SER | 0 | -0.020 | 0.011 | 21.258 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | C | 587 | LEU | 0 | -0.033 | -0.015 | 22.843 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | C | 588 | PRO | 0 | -0.006 | -0.005 | 26.530 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | C | 589 | VAL | 0 | 0.026 | 0.028 | 27.999 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | C | 590 | TYR | 0 | -0.010 | -0.013 | 30.786 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | C | 591 | PRO | 0 | -0.046 | 0.002 | 34.108 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | C | 592 | PHE | 0 | 0.006 | -0.022 | 34.077 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | C | 593 | ALA | 0 | -0.024 | 0.003 | 38.726 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | C | 594 | LYS | 1 | 0.937 | 0.956 | 41.558 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | C | 595 | GLU | -1 | -0.857 | -0.933 | 43.050 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | C | 596 | PRO | 0 | 0.002 | 0.002 | 45.262 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | C | 597 | TYR | 0 | -0.066 | -0.038 | 46.000 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | C | 598 | TRP | 0 | 0.012 | -0.027 | 44.133 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | C | 599 | PRO | 0 | 0.044 | 0.042 | 48.765 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | C | 600 | LYS | 1 | 0.968 | 0.997 | 51.918 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |