FMODB ID: 177VZ
Calculation Name: 4UJ6-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 4UJ6
Chain ID: A
UniProt ID: O68840
Base Structure: X-ray
Registration Date: 2023-06-21
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 | 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 | 720 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -13052228.4259 |
---|---|
FMO2-HF: Nuclear repulsion | 12786309.509003 |
FMO2-HF: Total energy | -265918.916897 |
FMO2-MP2: Total energy | -266711.432277 |
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:31:ALA)
Summations of interaction energy for
fragment #1(A:31:ALA)
IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
-9.673 | -8.886 | 10.382 | -5.857 | -5.312 | -0.03 |
Interaction energy analysis for fragmet #1(A:31:ALA)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | 33 | ASP | -1 | -0.808 | -0.861 | 1.916 | -11.992 | -12.429 | 8.032 | -3.997 | -3.598 | -0.027 |
4 | A | 34 | VAL | 0 | 0.050 | 0.005 | 4.157 | -0.931 | -0.900 | -0.001 | -0.009 | -0.021 | 0.000 |
5 | A | 35 | ALA | 0 | -0.017 | 0.006 | 6.212 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 36 | THR | 0 | -0.004 | -0.036 | 2.158 | 0.133 | 1.163 | 2.353 | -1.818 | -1.565 | -0.003 |
7 | A | 37 | VAL | 0 | 0.015 | 0.012 | 4.685 | 0.558 | 0.647 | -0.001 | -0.018 | -0.070 | 0.000 |
8 | A | 38 | VAL | 0 | -0.009 | -0.010 | 6.197 | 0.393 | 0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 39 | SER | 0 | -0.034 | -0.006 | 7.566 | 0.248 | 0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 40 | GLN | 0 | 0.038 | 0.010 | 4.187 | 0.110 | 0.184 | -0.001 | -0.015 | -0.058 | 0.000 |
11 | A | 41 | ALA | 0 | -0.003 | 0.004 | 8.662 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 42 | LYS | 1 | 0.803 | 0.885 | 11.394 | 0.598 | 0.598 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 43 | ALA | 0 | -0.001 | 0.018 | 11.704 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 44 | GLN | 0 | 0.059 | 0.019 | 11.409 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 45 | MET | 0 | -0.037 | -0.008 | 14.205 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 46 | LYS | 1 | 0.880 | 0.953 | 16.592 | 0.374 | 0.374 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 47 | GLU | -1 | -0.859 | -0.926 | 16.338 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 48 | ALA | 0 | -0.011 | 0.009 | 18.383 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 49 | TYR | 0 | -0.011 | -0.018 | 20.684 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 50 | TYR | 0 | -0.005 | 0.007 | 18.417 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 51 | THR | 0 | 0.012 | -0.006 | 21.417 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 52 | TYR | 0 | -0.035 | -0.022 | 23.809 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 53 | SER | 0 | -0.036 | -0.033 | 25.429 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 54 | HIS | 0 | 0.031 | 0.032 | 23.577 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 55 | THR | 0 | 0.011 | 0.003 | 26.979 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 56 | VAL | 0 | -0.007 | 0.011 | 28.977 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 57 | THR | 0 | -0.103 | -0.069 | 30.207 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 58 | GLU | -1 | -0.913 | -0.963 | 27.403 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 59 | THR | 0 | -0.070 | -0.048 | 30.930 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 60 | GLY | 0 | 0.016 | 0.021 | 33.714 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 61 | GLN | 0 | -0.073 | -0.039 | 33.714 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 62 | PHE | 0 | 0.018 | -0.012 | 32.081 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 63 | PRO | 0 | 0.015 | 0.020 | 27.553 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 64 | ASP | -1 | -0.776 | -0.895 | 28.447 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 65 | ILE | 0 | -0.008 | -0.010 | 28.098 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 66 | LYS | 1 | 0.886 | 0.938 | 26.904 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 67 | ASP | -1 | -0.848 | -0.915 | 23.937 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 68 | VAL | 0 | -0.001 | -0.001 | 23.084 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 69 | TYR | 0 | 0.014 | 0.000 | 23.921 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 70 | ALA | 0 | -0.017 | 0.001 | 21.006 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 71 | ALA | 0 | 0.028 | 0.014 | 19.077 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 72 | TYR | 0 | 0.025 | 0.007 | 19.173 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 73 | ASN | 0 | -0.036 | -0.036 | 20.589 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 74 | LYS | 1 | 0.959 | 0.987 | 12.814 | 0.275 | 0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 75 | ALA | 0 | 0.003 | 0.009 | 15.571 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 76 | LYS | 1 | 0.876 | 0.946 | 16.299 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 77 | GLN | 0 | -0.010 | 0.001 | 15.161 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 78 | ALA | 0 | -0.015 | -0.007 | 11.909 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 79 | TYR | 0 | 0.043 | 0.010 | 12.431 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 80 | ALA | 0 | 0.016 | 0.012 | 14.746 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 81 | ASN | 0 | -0.013 | -0.004 | 8.853 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 82 | ALA | 0 | 0.016 | 0.002 | 10.669 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 83 | VAL | 0 | 0.023 | 0.009 | 11.599 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 84 | ALA | 0 | 0.008 | 0.016 | 14.089 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 85 | VAL | 0 | -0.013 | -0.014 | 8.305 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 86 | VAL | 0 | -0.016 | -0.010 | 11.750 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 87 | ASN | 0 | -0.053 | -0.046 | 13.043 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 88 | LYS | 1 | 0.920 | 0.972 | 13.199 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 89 | ALA | 0 | -0.026 | -0.001 | 11.098 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 90 | GLY | 0 | 0.009 | 0.017 | 13.166 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 91 | GLY | 0 | 0.021 | -0.001 | 15.457 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 92 | ALA | 0 | 0.022 | -0.003 | 17.773 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 93 | LYS | 1 | 0.944 | 0.970 | 11.930 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 94 | LYS | 1 | 0.866 | 0.946 | 15.689 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 95 | ASP | -1 | -0.758 | -0.891 | 16.654 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 96 | ALA | 0 | 0.007 | 0.017 | 17.476 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 97 | TYR | 0 | 0.033 | -0.010 | 10.811 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 98 | LEU | 0 | -0.018 | -0.003 | 15.605 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 99 | ALA | 0 | 0.040 | 0.024 | 17.938 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 100 | ASP | -1 | -0.824 | -0.894 | 16.529 | -0.382 | -0.382 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 101 | LEU | 0 | -0.019 | -0.024 | 12.545 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 102 | GLN | 0 | -0.031 | -0.020 | 16.724 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 103 | ALA | 0 | 0.045 | 0.032 | 20.249 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 104 | ILE | 0 | -0.052 | -0.020 | 16.807 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 105 | TYR | 0 | 0.050 | 0.002 | 18.881 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 106 | GLU | -1 | -0.816 | -0.891 | 20.324 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 107 | THR | 0 | -0.045 | -0.021 | 22.938 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 108 | TYR | 0 | -0.028 | -0.025 | 20.800 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 109 | VAL | 0 | -0.005 | -0.003 | 19.862 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 110 | PHE | 0 | -0.018 | -0.030 | 22.906 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 111 | LYS | 1 | 0.824 | 0.903 | 24.738 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 112 | ALA | 0 | 0.018 | 0.014 | 27.559 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 113 | ASN | 0 | -0.003 | -0.005 | 30.873 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 114 | PRO | 0 | -0.006 | 0.016 | 30.141 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 115 | LYS | 1 | 0.890 | 0.923 | 30.995 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 116 | SER | 0 | 0.025 | -0.002 | 32.167 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 117 | GLY | 0 | 0.005 | 0.004 | 30.242 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 118 | GLU | -1 | -0.777 | -0.851 | 27.478 | -0.134 | -0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 119 | ALA | 0 | 0.012 | -0.002 | 26.090 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 120 | ARG | 1 | 0.856 | 0.952 | 25.476 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 121 | VAL | 0 | 0.008 | 0.013 | 22.665 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 122 | ALA | 0 | 0.015 | 0.012 | 25.983 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 123 | THR | 0 | -0.017 | -0.025 | 27.894 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 124 | TYR | 0 | 0.014 | 0.012 | 28.823 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 125 | ILE | 0 | -0.010 | -0.005 | 26.307 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 126 | ASP | -1 | -0.778 | -0.883 | 30.759 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 127 | ALA | 0 | -0.021 | -0.011 | 33.758 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 128 | TYR | 0 | 0.033 | 0.016 | 33.177 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 129 | ASN | 0 | 0.001 | 0.002 | 32.689 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 130 | TYR | 0 | -0.067 | -0.055 | 36.288 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 131 | ALA | 0 | 0.015 | 0.007 | 38.470 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 132 | THR | 0 | 0.023 | -0.010 | 37.344 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 133 | LYS | 1 | 0.908 | 0.958 | 40.142 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 134 | LEU | 0 | -0.024 | -0.011 | 42.151 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 135 | ASP | -1 | -0.768 | -0.872 | 43.185 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 136 | LYS | 1 | 0.809 | 0.912 | 43.522 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 137 | MET | 0 | -0.016 | -0.013 | 45.293 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 138 | ARG | 1 | 0.801 | 0.885 | 47.145 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 139 | GLN | 0 | -0.031 | -0.024 | 45.490 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 140 | GLU | -1 | -0.823 | -0.900 | 47.873 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 141 | LEU | 0 | -0.010 | -0.006 | 51.550 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 142 | LYS | 1 | 0.816 | 0.886 | 53.347 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 143 | ALA | 0 | 0.024 | 0.012 | 53.695 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 144 | ALA | 0 | -0.018 | -0.009 | 55.585 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 145 | VAL | 0 | -0.039 | -0.024 | 57.753 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 146 | ASP | -1 | -0.838 | -0.897 | 57.528 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 147 | ALA | 0 | -0.031 | -0.018 | 59.670 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 148 | LYS | 1 | 0.845 | 0.930 | 61.374 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 149 | ASP | -1 | -0.802 | -0.879 | 60.072 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 150 | LEU | 0 | 0.056 | 0.027 | 60.884 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 151 | LYS | 1 | 0.970 | 0.984 | 60.690 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 152 | LYS | 1 | 0.834 | 0.906 | 55.307 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 153 | ALA | 0 | 0.042 | 0.019 | 56.922 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 154 | GLU | -1 | -0.769 | -0.850 | 57.633 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 155 | GLU | -1 | -0.895 | -0.937 | 54.309 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 156 | LEU | 0 | -0.017 | -0.014 | 51.476 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 157 | TYR | 0 | 0.060 | 0.032 | 52.937 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 158 | HIS | 0 | -0.019 | -0.010 | 54.203 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 159 | LYS | 1 | 0.861 | 0.925 | 49.904 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 160 | ILE | 0 | 0.025 | 0.009 | 49.264 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 161 | SER | 0 | -0.004 | -0.013 | 49.741 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 162 | TYR | 0 | -0.004 | 0.010 | 45.794 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 163 | GLU | -1 | -0.795 | -0.888 | 43.838 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 164 | LEU | 0 | -0.025 | 0.005 | 45.718 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 165 | LYS | 1 | 0.975 | 1.006 | 47.789 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 166 | THR | 0 | -0.039 | -0.032 | 46.196 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 167 | ARG | 1 | 0.801 | 0.858 | 39.282 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 168 | THR | 0 | -0.026 | -0.001 | 41.437 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 169 | VAL | 0 | 0.038 | 0.014 | 39.508 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 170 | ILE | 0 | -0.023 | -0.003 | 36.118 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 171 | LEU | 0 | 0.012 | 0.000 | 36.390 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 172 | ASP | -1 | -0.767 | -0.863 | 37.176 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 173 | ARG | 1 | 0.817 | 0.925 | 33.635 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 174 | VAL | 0 | -0.012 | 0.006 | 32.346 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 175 | TYR | 0 | 0.026 | 0.018 | 29.000 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 176 | GLY | 0 | 0.057 | 0.030 | 30.966 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 177 | GLN | 0 | -0.041 | -0.035 | 32.722 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 178 | SER | 0 | 0.084 | 0.044 | 33.797 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 179 | THR | 0 | 0.018 | 0.012 | 31.482 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 180 | ARG | 1 | 0.828 | 0.903 | 34.703 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 181 | GLU | -1 | -0.866 | -0.934 | 37.170 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 182 | LEU | 0 | 0.046 | 0.044 | 35.649 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 183 | LEU | 0 | -0.026 | 0.000 | 34.801 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 184 | ARG | 1 | 0.782 | 0.850 | 39.005 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 185 | SER | 0 | 0.005 | -0.014 | 42.364 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 186 | THR | 0 | -0.054 | -0.032 | 39.889 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 187 | PHE | 0 | -0.005 | 0.000 | 37.848 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 188 | LYS | 1 | 0.809 | 0.903 | 43.481 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 189 | ALA | 0 | 0.019 | 0.017 | 45.448 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 190 | ASP | -1 | -0.773 | -0.887 | 48.055 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 191 | ALA | 0 | 0.021 | 0.011 | 47.487 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 192 | GLN | 0 | -0.009 | -0.008 | 49.039 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 193 | ALA | 0 | 0.034 | 0.025 | 51.334 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 194 | LEU | 0 | -0.038 | -0.015 | 52.945 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 195 | ARG | 1 | 0.897 | 0.934 | 53.219 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 196 | ASP | -1 | -0.845 | -0.924 | 54.054 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 197 | ARG | 1 | 0.821 | 0.905 | 54.643 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 198 | LEU | 0 | 0.039 | 0.019 | 58.116 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 199 | ILE | 0 | -0.032 | -0.005 | 58.506 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 200 | TYR | 0 | 0.019 | 0.016 | 61.331 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 201 | ASP | -1 | -0.770 | -0.860 | 63.108 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 202 | ILE | 0 | 0.043 | 0.018 | 59.653 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 203 | THR | 0 | -0.021 | -0.020 | 62.953 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 204 | VAL | 0 | -0.003 | -0.010 | 64.987 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 205 | ALA | 0 | 0.007 | 0.006 | 64.720 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 206 | MET | 0 | -0.052 | -0.017 | 61.497 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 207 | LYS | 1 | 0.843 | 0.929 | 65.848 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 208 | ALA | 0 | 0.040 | 0.014 | 68.940 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 209 | ARG | 1 | 0.841 | 0.896 | 63.456 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 210 | GLU | -1 | -0.791 | -0.870 | 68.475 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 211 | ALA | 0 | -0.003 | -0.011 | 70.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 212 | GLN | 0 | -0.020 | -0.018 | 73.292 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 213 | ASP | -1 | -0.890 | -0.958 | 69.897 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 214 | ALA | 0 | -0.088 | -0.046 | 73.216 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 215 | VAL | 0 | -0.011 | -0.002 | 74.981 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 216 | LYS | 1 | 0.917 | 0.982 | 74.520 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 217 | ALA | 0 | -0.047 | -0.021 | 74.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 218 | GLY | 0 | 0.019 | 0.008 | 76.899 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 219 | ASN | 0 | -0.007 | -0.013 | 74.779 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 220 | LEU | 0 | 0.086 | 0.028 | 77.258 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 221 | ASP | -1 | -0.845 | -0.895 | 77.925 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 222 | LYS | 1 | 0.824 | 0.916 | 69.212 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 223 | ALA | 0 | 0.035 | 0.005 | 73.959 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 224 | LYS | 1 | 0.852 | 0.915 | 76.222 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 225 | ALA | 0 | 0.070 | 0.046 | 74.020 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 226 | ALA | 0 | -0.045 | -0.031 | 71.853 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 227 | LEU | 0 | 0.011 | -0.004 | 72.581 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 228 | ASP | -1 | -0.854 | -0.931 | 75.306 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 229 | GLN | 0 | -0.047 | -0.022 | 67.536 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 230 | VAL | 0 | 0.009 | 0.006 | 71.058 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 231 | ASN | 0 | -0.039 | -0.029 | 72.345 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 232 | GLN | 0 | -0.010 | 0.015 | 71.321 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 233 | TYR | 0 | -0.069 | -0.064 | 67.990 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 234 | VAL | 0 | 0.054 | 0.023 | 70.201 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 235 | SER | 0 | -0.027 | -0.020 | 72.087 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 236 | LYS | 1 | 0.879 | 0.953 | 68.211 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 237 | VAL | 0 | -0.021 | 0.020 | 66.940 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 238 | THR | 0 | -0.013 | -0.040 | 62.937 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 239 | ASP | -1 | -0.878 | -0.966 | 66.317 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 240 | ALA | 0 | -0.034 | -0.003 | 63.179 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 241 | PHE | 0 | 0.073 | 0.013 | 61.008 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 242 | LYS | 1 | 0.873 | 0.962 | 67.140 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 243 | ALA | 0 | 0.028 | 0.012 | 70.340 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 244 | GLU | -1 | -0.903 | -0.947 | 67.620 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 245 | LEU | 0 | -0.013 | -0.011 | 66.511 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 246 | GLN | 0 | -0.003 | -0.004 | 70.907 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 247 | LYS | 1 | 0.935 | 0.986 | 74.507 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 248 | ALA | 0 | -0.004 | -0.003 | 71.794 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 249 | ALA | 0 | 0.021 | 0.004 | 73.715 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 250 | GLN | 0 | -0.046 | -0.023 | 75.136 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 251 | ASP | -1 | -0.819 | -0.929 | 76.562 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 252 | ALA | 0 | -0.014 | 0.005 | 74.801 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 253 | LYS | 1 | 0.873 | 0.928 | 76.942 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 254 | ALA | 0 | -0.007 | -0.007 | 79.958 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 255 | ALA | 0 | -0.006 | -0.004 | 79.300 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 256 | TYR | 0 | -0.009 | 0.003 | 79.825 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 257 | GLU | -1 | -0.860 | -0.934 | 81.722 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 258 | ALA | 0 | -0.041 | -0.012 | 84.886 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 259 | ALA | 0 | -0.045 | -0.028 | 82.790 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 260 | LEU | 0 | -0.004 | 0.017 | 84.871 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 261 | THR | 0 | -0.013 | -0.033 | 86.226 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 262 | PRO | 0 | -0.061 | -0.010 | 88.587 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 263 | LYS | 1 | 0.895 | 0.923 | 91.029 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 264 | VAL | 0 | 0.021 | 0.007 | 93.910 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 265 | GLU | -1 | -0.893 | -0.925 | 94.845 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 266 | SER | 0 | -0.058 | -0.034 | 97.569 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 267 | VAL | 0 | 0.016 | -0.003 | 100.761 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 268 | SER | 0 | 0.012 | -0.002 | 104.186 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 269 | ALA | 0 | -0.005 | 0.009 | 107.461 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 270 | ILE | 0 | -0.043 | 0.003 | 111.133 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 271 | ASP | -1 | -0.762 | -0.860 | 113.684 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 272 | SER | 0 | 0.029 | 0.022 | 115.602 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 273 | THR | 0 | -0.070 | -0.045 | 116.874 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 274 | SER | 0 | -0.017 | -0.026 | 113.694 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 275 | PHE | 0 | 0.028 | 0.006 | 106.042 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 276 | LYS | 1 | 0.967 | 0.997 | 106.130 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 277 | VAL | 0 | 0.007 | 0.001 | 102.223 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 278 | THR | 0 | -0.026 | -0.025 | 101.378 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 279 | PHE | 0 | 0.023 | 0.007 | 98.077 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 280 | THR | 0 | 0.020 | 0.016 | 92.638 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 281 | LYS | 1 | 0.858 | 0.940 | 88.941 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 282 | PRO | 0 | -0.008 | -0.008 | 95.838 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 283 | VAL | 0 | -0.024 | -0.003 | 98.048 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 284 | ASP | -1 | -0.844 | -0.922 | 99.205 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 285 | LYS | 1 | 0.898 | 0.930 | 101.038 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 286 | ALA | 0 | -0.013 | 0.009 | 102.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 287 | THR | 0 | -0.078 | -0.041 | 99.349 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 288 | ALA | 0 | 0.022 | 0.014 | 102.596 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 289 | ILE | 0 | 0.031 | 0.016 | 104.475 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 290 | PRO | 0 | 0.044 | 0.000 | 106.285 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 291 | LYS | 1 | 0.865 | 0.926 | 102.483 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 292 | ASN | 0 | -0.028 | 0.002 | 101.232 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 293 | PHE | 0 | 0.021 | 0.015 | 102.311 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 294 | SER | 0 | -0.010 | -0.009 | 103.753 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 295 | ILE | 0 | -0.005 | 0.011 | 104.653 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 296 | THR | 0 | 0.054 | 0.021 | 105.180 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 297 | LEU | 0 | -0.017 | 0.002 | 107.428 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 298 | LYS | 1 | 0.840 | 0.895 | 101.197 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 299 | GLY | 0 | -0.002 | 0.000 | 104.913 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 300 | THR | 0 | -0.062 | -0.020 | 105.904 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 301 | GLU | -1 | -0.891 | -0.946 | 107.181 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 302 | THR | 0 | -0.033 | -0.026 | 108.620 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 303 | LYS | 1 | 0.895 | 0.947 | 106.805 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 304 | LEU | 0 | -0.020 | 0.006 | 110.316 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 305 | TYR | 0 | 0.011 | -0.011 | 109.805 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 306 | PRO | 0 | -0.023 | -0.004 | 108.567 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 307 | LYS | 1 | 0.934 | 0.965 | 111.777 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 308 | SER | 0 | -0.004 | -0.021 | 113.277 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 309 | VAL | 0 | -0.045 | -0.022 | 107.125 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 310 | GLU | -1 | -0.923 | -0.945 | 110.539 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 311 | VAL | 0 | -0.033 | -0.019 | 104.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 312 | SER | 0 | 0.001 | -0.015 | 106.194 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 313 | GLU | -1 | -0.882 | -0.941 | 106.826 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 314 | SER | 0 | 0.004 | -0.007 | 103.292 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 315 | GLY | 0 | 0.040 | 0.017 | 102.413 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 316 | LEU | 0 | 0.043 | 0.025 | 98.617 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 317 | THR | 0 | -0.083 | -0.043 | 101.593 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 318 | ALA | 0 | 0.031 | 0.028 | 104.476 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 319 | THR | 0 | 0.038 | 0.030 | 107.126 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 320 | VAL | 0 | 0.014 | 0.003 | 107.166 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 321 | THR | 0 | 0.001 | 0.001 | 110.560 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 322 | LEU | 0 | -0.017 | 0.001 | 111.154 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 323 | TYR | 0 | -0.020 | -0.019 | 114.840 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 324 | ASP | -1 | -0.853 | -0.920 | 115.283 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 325 | THR | 0 | -0.060 | -0.040 | 117.632 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 326 | LEU | 0 | -0.055 | -0.015 | 112.308 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 327 | VAL | 0 | -0.001 | -0.011 | 115.288 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 328 | ASP | -1 | -0.825 | -0.934 | 115.164 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 329 | GLY | 0 | 0.016 | 0.013 | 113.545 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 330 | LYS | 1 | 0.873 | 0.957 | 111.584 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 331 | THR | 0 | -0.009 | -0.021 | 105.013 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 332 | TYR | 0 | 0.018 | 0.012 | 107.489 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 333 | THR | 0 | 0.009 | 0.005 | 102.387 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 334 | VAL | 0 | -0.025 | -0.019 | 103.077 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 335 | VAL | 0 | 0.013 | 0.009 | 98.958 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 336 | THR | 0 | 0.005 | -0.005 | 98.910 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 337 | SER | 0 | -0.009 | -0.009 | 97.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 338 | GLY | 0 | 0.038 | 0.014 | 96.843 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 339 | LEU | 0 | -0.015 | 0.004 | 97.992 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 340 | LYS | 1 | 0.881 | 0.938 | 94.829 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 341 | ASP | -1 | -0.813 | -0.916 | 92.894 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 342 | THR | 0 | -0.047 | -0.017 | 95.851 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 343 | ALA | 0 | -0.028 | -0.019 | 95.538 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 344 | GLY | 0 | 0.026 | 0.018 | 92.227 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 345 | LYS | 1 | 0.943 | 0.962 | 84.727 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 346 | GLU | -1 | -0.908 | -0.962 | 91.330 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 347 | PHE | 0 | -0.040 | -0.019 | 91.785 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 348 | GLU | -1 | -0.888 | -0.911 | 88.195 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 349 | THR | 0 | -0.043 | -0.032 | 92.106 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 350 | SER | 0 | -0.016 | 0.002 | 93.605 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 351 | THR | 0 | -0.012 | -0.022 | 95.740 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 352 | ASN | 0 | -0.001 | 0.019 | 97.304 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 353 | GLU | -1 | -0.799 | -0.885 | 99.956 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 354 | PHE | 0 | -0.001 | 0.007 | 102.924 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 355 | THR | 0 | 0.029 | 0.012 | 106.144 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 356 | TYR | 0 | 0.007 | 0.015 | 108.989 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 357 | ASN | 0 | -0.031 | -0.031 | 111.094 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 358 | LYS | 1 | 0.966 | 0.996 | 114.654 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 359 | PRO | 0 | -0.018 | 0.007 | 117.334 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 360 | VAL | 0 | 0.001 | -0.018 | 118.908 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 361 | PRO | 0 | -0.030 | -0.025 | 122.099 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 362 | ALA | 0 | -0.018 | -0.002 | 123.768 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 363 | SER | 0 | -0.031 | -0.010 | 124.317 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 364 | ILE | 0 | 0.022 | 0.014 | 124.913 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 365 | THR | 0 | -0.059 | -0.037 | 124.801 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 366 | PHE | 0 | 0.043 | 0.020 | 125.410 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 367 | ASN | 0 | -0.015 | 0.006 | 121.282 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 368 | PHE | 0 | 0.011 | 0.016 | 120.760 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 369 | ASN | 0 | 0.000 | 0.002 | 126.174 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 370 | LYS | 1 | 0.817 | 0.896 | 126.258 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 371 | LEU | 0 | 0.022 | 0.014 | 127.701 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 372 | PRO | 0 | 0.074 | 0.034 | 125.087 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 373 | GLU | -1 | -0.847 | -0.890 | 127.885 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 374 | ASP | -1 | -0.779 | -0.879 | 126.475 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 375 | SER | 0 | -0.043 | -0.023 | 128.850 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 376 | ALA | 0 | -0.053 | -0.047 | 127.706 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 377 | VAL | 0 | 0.043 | 0.028 | 127.013 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 378 | ASP | -1 | -0.758 | -0.847 | 123.133 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 379 | LEU | 0 | 0.045 | 0.014 | 125.146 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 380 | THR | 0 | -0.085 | -0.074 | 123.054 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 381 | LYS | 1 | 0.921 | 0.970 | 116.994 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 382 | TYR | 0 | 0.000 | -0.002 | 121.603 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 383 | VAL | 0 | -0.020 | 0.004 | 123.495 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 384 | THR | 0 | -0.004 | -0.017 | 119.928 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 385 | VAL | 0 | 0.000 | -0.005 | 121.142 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 386 | LYS | 1 | 0.947 | 0.975 | 120.192 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 387 | ASP | -1 | -0.709 | -0.836 | 117.804 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 388 | ALA | 0 | -0.007 | -0.023 | 121.139 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 389 | ALA | 0 | -0.051 | -0.012 | 117.813 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 390 | GLY | 0 | 0.014 | 0.010 | 119.113 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 391 | ASN | 0 | -0.106 | -0.060 | 114.473 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 392 | VAL | 0 | 0.003 | -0.009 | 114.693 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 393 | ILE | 0 | -0.023 | -0.004 | 115.655 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 394 | LYS | 1 | 0.923 | 0.951 | 110.200 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 395 | SER | 0 | -0.025 | -0.018 | 115.153 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 396 | GLY | 0 | 0.043 | 0.018 | 117.329 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 397 | PHE | 0 | -0.064 | -0.032 | 118.637 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 398 | GLU | -1 | -0.825 | -0.905 | 122.446 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 399 | LEU | 0 | -0.049 | -0.029 | 124.702 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 400 | GLU | -1 | -0.856 | -0.911 | 127.537 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 401 | PHE | 0 | 0.024 | -0.012 | 126.953 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 402 | THR | 0 | -0.026 | -0.014 | 133.051 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 403 | SER | 0 | -0.017 | -0.028 | 135.451 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 404 | SER | 0 | -0.022 | -0.025 | 137.479 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 405 | GLU | -1 | -0.770 | -0.849 | 136.372 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 406 | LYS | 1 | 0.897 | 0.934 | 137.011 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 407 | LEU | 0 | 0.029 | 0.033 | 132.690 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 408 | THR | 0 | -0.015 | -0.017 | 130.932 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 409 | GLN | 0 | 0.014 | -0.009 | 126.686 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 410 | GLY | 0 | 0.029 | 0.024 | 129.843 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 411 | LYS | 1 | 0.815 | 0.900 | 123.278 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 412 | PHE | 0 | -0.007 | 0.007 | 124.411 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 413 | ILE | 0 | 0.007 | -0.002 | 129.769 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 414 | ASN | 0 | 0.030 | 0.035 | 131.483 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 415 | THR | 0 | -0.031 | -0.045 | 131.061 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 416 | THR | 0 | 0.020 | -0.004 | 133.398 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 417 | GLY | 0 | -0.008 | 0.000 | 134.528 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 418 | LYS | 1 | 0.779 | 0.895 | 136.009 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 419 | LYS | 1 | 0.868 | 0.914 | 134.689 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 420 | SER | 0 | -0.010 | -0.006 | 136.259 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 421 | VAL | 0 | -0.028 | 0.001 | 134.047 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 422 | ILE | 0 | 0.006 | 0.000 | 136.763 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 423 | VAL | 0 | -0.007 | 0.008 | 131.744 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 424 | ASN | 0 | -0.020 | -0.006 | 134.109 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 425 | ALA | 0 | 0.048 | 0.025 | 129.247 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 426 | THR | 0 | 0.027 | 0.003 | 130.797 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 427 | VAL | 0 | 0.014 | -0.001 | 126.051 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 428 | LYS | 1 | 0.790 | 0.892 | 128.509 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 429 | GLY | 0 | -0.022 | -0.001 | 128.845 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 430 | THR | 0 | -0.031 | -0.019 | 127.731 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 431 | ASN | 0 | 0.005 | 0.010 | 130.947 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 432 | VAL | 0 | -0.017 | 0.001 | 127.196 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 433 | THR | 0 | 0.024 | 0.010 | 130.215 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 434 | THR | 0 | -0.033 | -0.028 | 129.503 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 435 | GLY | 0 | 0.003 | 0.014 | 132.001 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 436 | ASN | 0 | -0.013 | -0.012 | 135.087 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 437 | VAL | 0 | 0.011 | 0.013 | 132.318 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 438 | ILE | 0 | -0.009 | -0.007 | 135.492 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 439 | LEU | 0 | -0.020 | 0.003 | 130.583 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 440 | ALA | 0 | 0.017 | 0.002 | 132.637 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 441 | VAL | 0 | -0.047 | -0.022 | 132.088 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 442 | GLU | -1 | -0.828 | -0.899 | 127.916 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 443 | ASP | -1 | -0.773 | -0.875 | 127.948 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 444 | GLU | -1 | -0.851 | -0.894 | 122.735 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 445 | LYS | 1 | 0.829 | 0.904 | 123.574 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 446 | ALA | 0 | 0.010 | 0.011 | 118.683 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 447 | ALA | 0 | -0.023 | -0.008 | 119.086 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 448 | GLU | -1 | -0.805 | -0.881 | 112.295 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 449 | VAL | 0 | 0.035 | 0.024 | 111.061 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 450 | SER | 0 | 0.038 | 0.023 | 109.710 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 451 | GLU | -1 | -0.922 | -0.961 | 105.889 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 452 | LEU | 0 | 0.018 | -0.001 | 106.202 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 453 | LYS | 1 | 0.830 | 0.919 | 101.612 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 454 | LEU | 0 | 0.017 | 0.014 | 99.693 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 455 | THR | 0 | -0.006 | -0.026 | 100.365 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 456 | LYS | 1 | 0.870 | 0.922 | 97.397 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 457 | ASP | -1 | -0.805 | -0.894 | 98.862 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 458 | ASN | 0 | -0.062 | -0.030 | 99.753 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 459 | LYS | 1 | 0.822 | 0.921 | 95.152 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 460 | GLU | -1 | -0.873 | -0.946 | 97.544 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 461 | VAL | 0 | -0.064 | -0.034 | 95.396 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 462 | VAL | 0 | 0.018 | 0.017 | 91.530 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 463 | THR | 0 | -0.066 | -0.027 | 89.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 464 | LEU | 0 | 0.037 | 0.027 | 92.726 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 465 | TYR | 0 | 0.013 | 0.012 | 87.406 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 466 | ALA | 0 | 0.050 | 0.020 | 94.162 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 467 | ASN | 0 | -0.033 | -0.016 | 91.582 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 468 | GLY | 0 | 0.029 | 0.027 | 95.467 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 469 | ASN | 0 | -0.087 | -0.055 | 91.915 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 470 | ALA | 0 | 0.044 | 0.011 | 94.275 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 471 | PHE | 0 | -0.028 | -0.027 | 88.274 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 472 | ASP | -1 | -0.705 | -0.844 | 90.292 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 473 | LYS | 1 | 0.817 | 0.876 | 89.259 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 474 | ASP | -1 | -0.874 | -0.908 | 86.701 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 475 | GLY | 0 | 0.010 | 0.006 | 86.141 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 476 | ASN | 0 | -0.082 | -0.051 | 86.823 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 477 | GLN | 0 | 0.005 | 0.008 | 88.619 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 478 | ILE | 0 | 0.007 | 0.021 | 90.977 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 479 | SER | 0 | -0.012 | -0.007 | 91.871 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 480 | SER | 0 | -0.032 | -0.011 | 94.783 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 481 | GLY | 0 | 0.070 | 0.034 | 98.463 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 482 | THR | 0 | 0.028 | 0.009 | 101.142 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 483 | LEU | 0 | -0.034 | -0.013 | 99.394 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 484 | THR | 0 | 0.010 | -0.002 | 102.606 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 485 | LEU | 0 | -0.014 | -0.005 | 104.420 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 486 | THR | 0 | -0.049 | -0.008 | 105.398 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 487 | ALA | 0 | 0.053 | 0.011 | 107.136 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 488 | LYS | 1 | 0.798 | 0.913 | 107.763 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 489 | PHE | 0 | 0.044 | 0.005 | 111.650 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 490 | LYS | 1 | 0.765 | 0.878 | 110.935 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 491 | ASP | -1 | -0.657 | -0.826 | 116.291 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 492 | GLN | 0 | -0.071 | -0.069 | 119.217 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 493 | TYR | 0 | -0.125 | -0.079 | 120.815 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 494 | GLY | 0 | -0.012 | 0.005 | 116.663 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 495 | ASN | 0 | -0.100 | -0.064 | 115.488 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 496 | GLU | -1 | -0.836 | -0.911 | 110.640 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 497 | LEU | 0 | -0.009 | -0.001 | 115.040 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 498 | THR | 0 | -0.008 | -0.007 | 114.808 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 499 | GLY | 0 | 0.001 | -0.017 | 116.837 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 500 | LYS | 1 | 0.813 | 0.917 | 117.765 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 501 | VAL | 0 | -0.009 | -0.011 | 116.638 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 502 | ALA | 0 | 0.037 | 0.018 | 113.529 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 503 | GLY | 0 | -0.020 | -0.017 | 115.500 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 504 | THR | 0 | -0.097 | -0.040 | 117.232 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 505 | ASP | -1 | -0.818 | -0.894 | 119.294 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 506 | TYR | 0 | -0.048 | -0.019 | 113.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 507 | THR | 0 | -0.036 | -0.015 | 115.856 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 508 | PHE | 0 | -0.012 | -0.013 | 109.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 509 | GLU | -1 | -0.803 | -0.899 | 112.120 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 510 | SER | 0 | -0.018 | -0.023 | 107.467 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 511 | LEU | 0 | -0.022 | -0.022 | 109.156 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 512 | ASN | 0 | 0.007 | -0.008 | 105.684 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 513 | PRO | 0 | 0.025 | -0.001 | 106.370 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 514 | GLU | -1 | -0.902 | -0.933 | 105.560 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 515 | VAL | 0 | -0.035 | 0.002 | 100.676 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 516 | LEU | 0 | 0.016 | -0.016 | 101.297 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 517 | VAL | 0 | 0.019 | 0.033 | 104.385 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 518 | VAL | 0 | -0.026 | -0.026 | 106.771 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 519 | ALA | 0 | 0.007 | 0.022 | 109.153 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 520 | PRO | 0 | 0.025 | 0.008 | 112.057 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 521 | ASP | -1 | -0.771 | -0.892 | 111.582 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 522 | GLY | 0 | 0.025 | 0.009 | 109.971 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 523 | SER | 0 | -0.058 | -0.045 | 107.413 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 524 | VAL | 0 | -0.025 | -0.016 | 103.303 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 525 | THR | 0 | -0.021 | -0.014 | 103.314 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 526 | PRO | 0 | -0.026 | -0.020 | 99.271 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 527 | ILE | 0 | -0.031 | 0.005 | 101.766 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 528 | VAL | 0 | -0.008 | -0.005 | 99.012 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 529 | PRO | 0 | -0.040 | -0.011 | 94.799 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 530 | GLY | 0 | 0.030 | 0.008 | 96.918 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 531 | THR | 0 | -0.064 | -0.049 | 97.665 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 532 | ALA | 0 | 0.030 | 0.040 | 100.248 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 533 | LEU | 0 | -0.015 | 0.002 | 103.657 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 534 | VAL | 0 | 0.010 | 0.009 | 105.311 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 535 | LYS | 1 | 0.918 | 0.963 | 107.886 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 536 | VAL | 0 | 0.007 | 0.015 | 110.668 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 537 | LYS | 1 | 0.841 | 0.900 | 113.018 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 538 | TYR | 0 | 0.006 | -0.011 | 116.833 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 539 | GLY | 0 | 0.021 | 0.019 | 119.376 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 540 | GLU | -1 | -0.907 | -0.977 | 120.395 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 541 | VAL | 0 | -0.064 | -0.002 | 116.848 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 542 | THR | 0 | -0.021 | -0.014 | 114.975 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 543 | LYS | 1 | 0.871 | 0.941 | 107.528 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 544 | THR | 0 | 0.002 | -0.013 | 108.101 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 545 | ILE | 0 | -0.003 | 0.000 | 102.914 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 546 | PRO | 0 | -0.010 | 0.009 | 101.063 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 547 | VAL | 0 | 0.013 | -0.003 | 100.171 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 548 | THR | 0 | -0.015 | -0.004 | 95.722 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 549 | VAL | 0 | -0.014 | 0.000 | 96.274 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 550 | LYS | 1 | 0.913 | 0.954 | 88.410 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 551 | ALA | 0 | 0.055 | 0.011 | 90.356 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 552 | ASN | 0 | 0.047 | 0.024 | 90.209 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 553 | PRO | 0 | -0.009 | 0.030 | 85.898 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 554 | VAL | 0 | -0.008 | -0.023 | 84.922 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 555 | LEU | 0 | -0.052 | -0.013 | 77.921 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 556 | GLU | -1 | -0.812 | -0.889 | 78.817 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 557 | THR | 0 | -0.047 | -0.040 | 73.497 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 558 | ILE | 0 | 0.010 | 0.006 | 72.087 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 559 | ALA | 0 | 0.003 | 0.012 | 70.158 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 560 | VAL | 0 | -0.017 | -0.020 | 65.461 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 561 | ASP | -1 | -0.823 | -0.886 | 64.301 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 562 | SER | 0 | 0.008 | -0.001 | 59.645 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 563 | THR | 0 | 0.029 | 0.014 | 58.288 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 564 | GLY | 0 | -0.029 | -0.018 | 58.662 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 565 | VAL | 0 | -0.041 | -0.010 | 57.896 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 566 | SER | 0 | 0.027 | 0.020 | 52.639 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 567 | VAL | 0 | -0.041 | -0.009 | 54.312 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 568 | ALA | 0 | 0.072 | 0.036 | 51.280 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 569 | LYS | 1 | 0.884 | 0.918 | 52.864 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 570 | GLY | 0 | -0.054 | -0.024 | 53.912 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 571 | GLN | 0 | -0.057 | -0.017 | 53.334 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 572 | LYS | 1 | 0.919 | 0.950 | 56.747 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 573 | ALA | 0 | -0.003 | -0.001 | 57.770 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 574 | THR | 0 | -0.023 | -0.016 | 59.613 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 575 | PHE | 0 | -0.016 | 0.004 | 61.731 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 576 | LYS | 1 | 0.859 | 0.896 | 64.203 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 577 | VAL | 0 | -0.002 | 0.003 | 67.557 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 578 | THR | 0 | -0.006 | -0.014 | 70.402 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 579 | LEU | 0 | 0.010 | 0.022 | 73.029 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 580 | LYS | 1 | 0.828 | 0.912 | 73.481 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 581 | ASP | -1 | -0.739 | -0.874 | 78.149 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 582 | GLN | 0 | 0.030 | -0.006 | 80.548 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 583 | TYR | 0 | -0.093 | -0.059 | 82.585 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 584 | GLY | 0 | -0.010 | 0.013 | 78.549 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 585 | ASN | 0 | -0.073 | -0.040 | 78.455 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 586 | LYS | 1 | 0.835 | 0.884 | 76.516 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 587 | PHE | 0 | 0.030 | 0.021 | 79.801 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 588 | THR | 0 | -0.022 | -0.032 | 80.145 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 589 | GLY | 0 | 0.014 | -0.002 | 80.660 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 590 | ASN | 0 | -0.004 | 0.015 | 79.695 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 591 | VAL | 0 | -0.020 | 0.002 | 73.859 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 592 | ASN | 0 | -0.030 | -0.005 | 75.528 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 593 | VAL | 0 | 0.046 | 0.012 | 69.270 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 594 | THR | 0 | -0.022 | -0.012 | 70.389 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 595 | SER | 0 | -0.022 | -0.018 | 65.113 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 596 | ASP | -1 | -0.805 | -0.904 | 65.584 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 597 | LYS | 1 | 0.879 | 0.931 | 60.309 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 598 | THR | 0 | 0.054 | 0.024 | 63.816 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 599 | GLU | -1 | -0.871 | -0.942 | 62.588 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 600 | THR | 0 | -0.035 | 0.000 | 58.349 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 601 | ALA | 0 | 0.022 | 0.000 | 59.347 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 602 | THR | 0 | 0.023 | 0.041 | 61.699 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 603 | VAL | 0 | -0.013 | -0.012 | 64.266 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 604 | SER | 0 | -0.027 | 0.004 | 66.866 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 605 | VAL | 0 | 0.031 | -0.001 | 68.764 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 606 | SER | 0 | 0.006 | 0.009 | 71.138 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 607 | ASN | 0 | 0.017 | -0.014 | 72.666 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 608 | SER | 0 | 0.010 | 0.006 | 75.772 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 609 | GLY | 0 | 0.020 | 0.033 | 75.998 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 610 | ILE | 0 | -0.054 | -0.029 | 76.785 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 611 | GLY | 0 | 0.064 | 0.039 | 79.693 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 612 | GLN | 0 | 0.027 | 0.027 | 77.274 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 613 | SER | 0 | 0.034 | 0.004 | 77.825 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 614 | GLU | -1 | -0.855 | -0.902 | 72.809 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 615 | TYR | 0 | -0.003 | -0.003 | 72.572 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 616 | THR | 0 | -0.003 | -0.016 | 67.538 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 617 | VAL | 0 | 0.007 | 0.019 | 66.157 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 618 | THR | 0 | -0.014 | -0.017 | 63.459 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 619 | VAL | 0 | -0.006 | -0.003 | 61.153 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 620 | ASN | 0 | 0.020 | 0.001 | 60.581 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 621 | GLY | 0 | 0.062 | 0.039 | 57.429 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 622 | VAL | 0 | -0.049 | -0.018 | 58.295 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 623 | ALA | 0 | -0.022 | -0.023 | 56.314 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 624 | GLU | -1 | -0.830 | -0.909 | 49.581 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 625 | GLY | 0 | 0.029 | 0.024 | 53.925 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 626 | SER | 0 | -0.050 | -0.045 | 54.808 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 627 | THR | 0 | -0.038 | -0.011 | 57.529 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 628 | THR | 0 | -0.034 | -0.015 | 60.860 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 629 | ILE | 0 | -0.009 | 0.009 | 63.489 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 630 | THR | 0 | -0.018 | -0.010 | 66.083 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 631 | ILE | 0 | 0.022 | 0.001 | 67.533 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 632 | LYS | 1 | 0.847 | 0.914 | 71.741 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 633 | SER | 0 | 0.001 | -0.025 | 75.450 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 634 | GLY | 0 | 0.028 | 0.014 | 78.531 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 635 | THR | 0 | -0.017 | -0.017 | 81.206 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 636 | LYS | 1 | 0.788 | 0.909 | 77.143 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 637 | GLU | -1 | -0.778 | -0.896 | 72.559 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 638 | VAL | 0 | -0.025 | 0.004 | 68.257 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 639 | LYS | 1 | 0.829 | 0.903 | 66.373 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 640 | VAL | 0 | 0.028 | 0.023 | 62.430 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 641 | PRO | 0 | 0.016 | 0.020 | 58.935 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 642 | VAL | 0 | -0.007 | -0.012 | 59.090 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 643 | ASN | 0 | -0.009 | -0.001 | 53.399 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 644 | VAL | 0 | -0.008 | -0.015 | 54.492 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 645 | VAL | 0 | 0.035 | 0.023 | 48.203 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 646 | ALA | 0 | -0.015 | -0.020 | 48.118 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 647 | GLY | 0 | -0.021 | -0.005 | 47.596 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 648 | GLY | 0 | 0.004 | 0.003 | 44.011 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 649 | PRO | 0 | -0.008 | -0.025 | 41.005 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 650 | VAL | 0 | -0.019 | -0.003 | 42.912 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 651 | ALA | 0 | -0.010 | -0.006 | 39.491 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 652 | ASN | 0 | -0.077 | -0.038 | 40.468 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 653 | TYR | 0 | 0.069 | 0.027 | 43.085 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 654 | GLN | 0 | -0.054 | -0.019 | 45.119 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 655 | ILE | 0 | 0.043 | 0.029 | 48.336 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 656 | LYS | 1 | 0.926 | 0.954 | 50.755 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 657 | VAL | 0 | 0.081 | 0.046 | 53.648 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 658 | LEU | 0 | -0.076 | -0.027 | 56.824 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 676 | VAL | 0 | 0.042 | 0.023 | 59.939 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 677 | GLN | 0 | -0.032 | -0.025 | 61.506 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 678 | LEU | 0 | -0.024 | -0.012 | 54.432 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 679 | LYS | 1 | 0.812 | 0.880 | 55.948 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 680 | VAL | 0 | -0.011 | -0.018 | 49.995 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 681 | TYR | 0 | 0.032 | 0.024 | 51.009 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 682 | ALA | 0 | 0.005 | 0.002 | 47.992 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 683 | VAL | 0 | -0.023 | -0.013 | 45.436 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 684 | ASP | -1 | -0.677 | -0.814 | 43.865 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 685 | ALA | 0 | -0.015 | -0.027 | 39.200 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 686 | ASN | 0 | -0.085 | -0.036 | 40.808 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 687 | GLY | 0 | -0.009 | 0.003 | 43.352 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 688 | ASN | 0 | -0.061 | -0.038 | 45.699 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 689 | ILE | 0 | -0.016 | -0.015 | 48.148 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 690 | VAL | 0 | -0.025 | -0.007 | 47.496 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 691 | GLY | 0 | 0.077 | 0.040 | 49.711 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 692 | ASP | -1 | -0.847 | -0.899 | 52.263 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 693 | ILE | 0 | 0.031 | 0.034 | 48.793 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 694 | THR | 0 | -0.057 | -0.049 | 52.958 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 695 | ASN | 0 | 0.008 | 0.013 | 55.511 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 696 | ASP | -1 | -0.884 | -0.951 | 52.696 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 697 | VAL | 0 | -0.030 | -0.007 | 50.884 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 698 | THR | 0 | -0.029 | 0.002 | 52.749 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 699 | ILE | 0 | -0.015 | -0.007 | 53.196 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 700 | THR | 0 | -0.035 | -0.019 | 52.899 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 701 | SER | 0 | 0.031 | -0.029 | 54.726 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 702 | GLU | -1 | -0.867 | -0.902 | 50.713 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 703 | ALA | 0 | -0.050 | -0.025 | 53.137 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 704 | THR | 0 | -0.038 | -0.015 | 55.200 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 705 | ASP | -1 | -0.787 | -0.870 | 58.511 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 706 | THR | 0 | -0.014 | -0.031 | 61.877 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 707 | ASN | 0 | -0.094 | -0.057 | 64.598 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 708 | GLY | 0 | -0.020 | 0.000 | 61.926 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 709 | VAL | 0 | -0.071 | -0.020 | 60.833 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 710 | ILE | 0 | -0.031 | -0.020 | 60.924 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 711 | VAL | 0 | -0.059 | -0.040 | 60.841 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 712 | ASN | 0 | -0.007 | 0.008 | 62.013 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 713 | ALA | 0 | 0.004 | -0.009 | 60.360 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 714 | SER | 0 | -0.030 | -0.004 | 61.833 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 715 | LYS | 1 | 0.873 | 0.939 | 58.894 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 716 | SER | 0 | 0.010 | 0.012 | 61.994 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 717 | THR | 0 | 0.035 | 0.003 | 63.380 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 718 | ALA | 0 | 0.030 | 0.030 | 65.205 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 719 | ASN | 0 | -0.051 | -0.039 | 66.299 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 720 | GLY | 0 | 0.034 | 0.023 | 64.577 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 721 | ASP | -1 | -0.854 | -0.897 | 60.969 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 722 | THR | 0 | -0.016 | -0.018 | 59.548 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 723 | VAL | 0 | -0.038 | -0.021 | 59.595 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 724 | TYR | 0 | -0.007 | -0.028 | 57.039 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 725 | VAL | 0 | -0.022 | -0.020 | 60.214 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 726 | ILE | 0 | -0.031 | -0.016 | 58.897 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 727 | THR | 0 | -0.033 | -0.029 | 63.035 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 728 | ASP | -1 | -0.890 | -0.941 | 64.891 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 729 | ASN | 0 | 0.004 | 0.015 | 67.157 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 737 | GLU | -1 | -0.741 | -0.836 | 57.159 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 738 | THR | 0 | -0.079 | -0.084 | 51.942 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 739 | LEU | 0 | 0.007 | 0.023 | 53.758 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 740 | THR | 0 | -0.015 | -0.026 | 48.857 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 741 | VAL | 0 | -0.026 | -0.006 | 49.880 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 742 | LYS | 1 | 0.870 | 0.910 | 46.370 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 743 | LEU | 0 | 0.061 | 0.031 | 46.633 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 744 | GLY | 0 | 0.042 | 0.027 | 47.471 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 745 | THR | 0 | 0.027 | -0.002 | 44.669 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 746 | VAL | 0 | 0.018 | 0.031 | 42.601 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 747 | THR | 0 | -0.020 | -0.015 | 43.896 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 748 | LEU | 0 | -0.023 | -0.006 | 43.922 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 749 | GLY | 0 | -0.006 | -0.008 | 45.370 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 750 | THR | 0 | 0.016 | 0.013 | 46.699 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 751 | VAL | 0 | -0.041 | -0.030 | 49.347 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 752 | ASP | -1 | -0.791 | -0.881 | 51.855 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 753 | VAL | 0 | -0.037 | -0.025 | 54.311 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 754 | GLH | 0 | -0.036 | -0.016 | 58.164 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 755 | VAL | 0 | 0.042 | -0.001 | 60.696 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 756 | ILE | 0 | -0.008 | -0.007 | 60.210 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 757 | ASP | -1 | -0.869 | -0.899 | 61.901 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 758 | THR | 0 | 0.013 | -0.022 | 63.471 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 759 | THR | 0 | 0.009 | 0.009 | 63.041 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 760 | LEU | 0 | 0.051 | 0.043 | 62.499 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 761 | LYS | 1 | 0.779 | 0.882 | 59.556 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 762 | ALA | 0 | 0.042 | 0.015 | 56.764 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 763 | THR | 0 | -0.095 | -0.046 | 52.609 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 764 | VAL | 0 | -0.015 | -0.001 | 48.494 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 765 | VAL | 0 | 0.010 | 0.021 | 45.966 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 766 | THR | 0 | -0.056 | -0.035 | 44.385 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 767 | LYS | 1 | 0.948 | 0.977 | 36.723 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 768 | LYS | 1 | 0.936 | 0.973 | 39.368 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 769 | ALA | 0 | -0.046 | -0.034 | 36.099 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 770 | ASP | -1 | -0.818 | -0.882 | 35.095 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 771 | LEU | 0 | -0.043 | -0.031 | 28.170 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 772 | ILE | 0 | -0.080 | -0.034 | 28.812 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 773 | GLU | -1 | -0.813 | -0.865 | 32.762 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 774 | LEU | 0 | -0.081 | -0.071 | 36.122 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |