![FMODB](./images/FMODB-Logo_20190201-0_300ppi.png)
FMODB ID: NNJRQ
Calculation Name: 4F88-1-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 4F88
Chain ID: 1
UniProt ID: Q7Y3F3
Base Structure: X-ray
Registration Date: 2023-09-23
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 | OptHSide |
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 | 442 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -7470547.111709 |
---|---|
FMO2-HF: Nuclear repulsion | 7300198.513616 |
FMO2-HF: Total energy | -170348.598094 |
FMO2-MP2: Total energy | -170842.496183 |
3D Structure
Ligand structure
![ligand structure](./Kdata/F036580/ligand_interaction/ligand_F036580.png)
Ligand Interaction
![ligand interaction](./Kdata/F036580/ligand_interaction/ligand_interaction_F036580.png)
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(1:2:SER)
Summations of interaction energy for
fragment #1(1:2:SER)
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. |
-28.051 | -23.354 | 19.303 | -11.232 | -12.767 | -0.068 |
Interaction energy analysis for fragmet #1(1:2:SER)
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 | 1 | 4 | LYS | 1 | 0.760 | 0.903 | 3.003 | 1.771 | 5.413 | 0.067 | -1.814 | -1.895 | 0.006 |
4 | 1 | 5 | TYR | 0 | -0.058 | -0.035 | 5.094 | 1.115 | 1.230 | -0.001 | -0.005 | -0.109 | 0.000 |
5 | 1 | 6 | THR | 0 | 0.009 | -0.027 | 7.936 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | 1 | 7 | GLN | 0 | 0.014 | -0.010 | 10.924 | -0.340 | -0.340 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | 1 | 8 | GLN | 0 | 0.037 | 0.024 | 12.315 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | 1 | 9 | GLN | 0 | 0.035 | 0.041 | 11.432 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | 1 | 10 | TYR | 0 | 0.007 | -0.021 | 4.698 | -0.018 | 0.002 | -0.001 | -0.006 | -0.013 | 0.000 |
10 | 1 | 11 | GLU | -1 | -0.848 | -0.910 | 11.419 | -0.732 | -0.732 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | 1 | 12 | LYS | 1 | 0.869 | 0.920 | 15.054 | 0.668 | 0.668 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | 1 | 13 | TYR | 0 | -0.006 | 0.009 | 11.071 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | 1 | 14 | LEU | 0 | -0.023 | -0.011 | 12.293 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | 1 | 15 | ALA | 0 | 0.023 | 0.014 | 15.781 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | 1 | 16 | GLN | 0 | -0.057 | -0.013 | 18.215 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | 1 | 17 | PRO | 0 | 0.015 | 0.008 | 19.900 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | 1 | 18 | ALA | 0 | -0.006 | -0.022 | 21.161 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | 1 | 19 | ASN | 0 | 0.024 | 0.007 | 23.301 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | 1 | 20 | ASN | 0 | 0.035 | 0.010 | 21.241 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | 1 | 21 | THR | 0 | 0.019 | 0.038 | 22.604 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | 1 | 22 | PHE | 0 | 0.021 | 0.006 | 18.004 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | 1 | 23 | GLY | 0 | -0.016 | 0.008 | 23.296 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | 1 | 24 | LEU | 0 | -0.028 | -0.011 | 21.737 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | 1 | 25 | SER | 0 | -0.032 | -0.019 | 25.491 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | 1 | 26 | PRO | 0 | -0.001 | 0.000 | 27.617 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | 1 | 27 | GLN | 0 | 0.052 | 0.013 | 28.314 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | 1 | 28 | GLN | 0 | 0.060 | 0.023 | 25.460 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | 1 | 29 | VAL | 0 | 0.041 | 0.035 | 21.845 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | 1 | 30 | ALA | 0 | 0.004 | 0.004 | 23.542 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | 1 | 31 | ASP | -1 | -0.909 | -0.981 | 25.908 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | 1 | 32 | TRP | 0 | -0.045 | -0.011 | 20.277 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | 1 | 33 | PHE | 0 | 0.002 | 0.000 | 21.252 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | 1 | 34 | MET | 0 | -0.030 | -0.002 | 22.477 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | 1 | 35 | GLY | 0 | -0.022 | -0.015 | 22.997 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | 1 | 36 | GLN | 0 | -0.007 | -0.017 | 16.464 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | 1 | 37 | ALA | 0 | -0.113 | -0.042 | 18.153 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | 1 | 38 | GLY | 0 | 0.069 | 0.050 | 17.615 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | 1 | 39 | ALA | 0 | 0.090 | 0.035 | 18.546 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | 1 | 40 | ARG | 1 | 0.889 | 0.959 | 21.676 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | 1 | 41 | PRO | 0 | 0.008 | 0.001 | 21.697 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | 1 | 42 | VAL | 0 | 0.034 | 0.012 | 22.924 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | 1 | 43 | ILE | 0 | -0.052 | -0.008 | 24.945 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | 1 | 44 | ASN | 0 | -0.074 | -0.049 | 27.559 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | 1 | 45 | SER | 0 | -0.005 | 0.011 | 28.406 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | 1 | 46 | TYR | 0 | 0.022 | -0.005 | 27.382 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | 1 | 47 | GLY | 0 | 0.005 | 0.013 | 31.697 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | 1 | 48 | VAL | 0 | 0.038 | 0.031 | 29.202 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | 1 | 49 | ASN | 0 | -0.032 | -0.029 | 32.334 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | 1 | 50 | ALA | 0 | 0.014 | -0.006 | 30.376 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | 1 | 51 | SER | 0 | 0.087 | 0.046 | 30.321 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | 1 | 52 | ASN | 0 | -0.016 | 0.001 | 31.255 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | 1 | 53 | LEU | 0 | 0.011 | 0.011 | 33.385 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | 1 | 54 | VAL | 0 | 0.054 | 0.024 | 27.552 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | 1 | 55 | SER | 0 | -0.052 | -0.032 | 30.673 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | 1 | 56 | THR | 0 | -0.076 | -0.032 | 32.893 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | 1 | 57 | TYR | 0 | 0.015 | -0.003 | 29.244 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | 1 | 58 | ILE | 0 | 0.036 | 0.016 | 27.282 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | 1 | 59 | PRO | 0 | -0.035 | -0.027 | 29.913 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | 1 | 60 | LYS | 1 | 0.837 | 0.915 | 31.542 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | 1 | 61 | MET | 0 | 0.019 | 0.014 | 25.562 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | 1 | 62 | GLN | 0 | -0.082 | -0.042 | 29.058 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | 1 | 63 | GLU | -1 | -0.909 | -0.932 | 30.830 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | 1 | 64 | TYR | 0 | -0.022 | -0.021 | 29.687 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | 1 | 65 | GLY | 0 | -0.024 | 0.004 | 29.559 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | 1 | 66 | VAL | 0 | 0.026 | 0.018 | 23.685 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | 1 | 67 | SER | 0 | -0.049 | -0.048 | 22.045 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | 1 | 68 | TYR | 0 | 0.080 | 0.009 | 23.133 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | 1 | 69 | THR | 0 | -0.037 | -0.025 | 19.222 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | 1 | 70 | LEU | 0 | -0.001 | -0.007 | 16.722 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | 1 | 71 | PHE | 0 | 0.067 | 0.044 | 18.391 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | 1 | 72 | LEU | 0 | -0.013 | 0.000 | 20.341 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | 1 | 73 | MET | 0 | -0.029 | -0.010 | 13.787 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | 1 | 74 | TYR | 0 | -0.021 | -0.027 | 13.729 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | 1 | 75 | THR | 0 | -0.013 | -0.010 | 16.604 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | 1 | 76 | VAL | 0 | -0.080 | -0.034 | 15.232 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | 1 | 77 | PHE | 0 | -0.060 | -0.021 | 10.033 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | 1 | 78 | GLU | -1 | -0.852 | -0.910 | 13.749 | 0.269 | 0.269 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | 1 | 79 | GLY | 0 | 0.089 | 0.036 | 16.381 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | 1 | 80 | GLY | 0 | -0.027 | -0.050 | 19.928 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | 1 | 81 | GLY | 0 | -0.040 | -0.007 | 22.243 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | 1 | 82 | ALA | 0 | -0.110 | -0.089 | 23.514 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | 1 | 83 | GLY | 0 | 0.102 | 0.063 | 24.970 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | 1 | 84 | ASN | 0 | -0.012 | 0.032 | 24.560 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | 1 | 85 | TRP | 0 | -0.063 | -0.032 | 23.803 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | 1 | 86 | ILE | 0 | -0.002 | 0.008 | 18.838 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | 1 | 87 | ASN | 0 | -0.036 | -0.012 | 18.242 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | 1 | 88 | HIS | 0 | 0.003 | 0.001 | 21.199 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | 1 | 89 | TYR | 0 | -0.041 | -0.042 | 24.350 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | 1 | 90 | MET | 0 | -0.045 | 0.011 | 26.983 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | 1 | 91 | TYR | 0 | -0.046 | -0.029 | 29.525 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | 1 | 92 | ASP | -1 | -0.777 | -0.877 | 31.323 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | 1 | 93 | THR | 0 | 0.035 | -0.013 | 33.386 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | 1 | 94 | GLY | 0 | -0.002 | -0.018 | 34.906 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | 1 | 95 | SER | 0 | -0.027 | 0.017 | 34.734 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | 1 | 96 | ASN | 0 | -0.054 | -0.061 | 35.253 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | 1 | 97 | GLY | 0 | 0.095 | 0.037 | 31.244 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | 1 | 98 | LEU | 0 | -0.037 | -0.025 | 30.942 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | 1 | 99 | GLU | -1 | -0.855 | -0.893 | 32.972 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | 1 | 100 | CYS | 0 | -0.003 | -0.011 | 29.433 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | 1 | 101 | LEU | 0 | -0.073 | -0.013 | 26.843 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | 1 | 102 | GLU | -1 | -0.790 | -0.876 | 28.620 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | 1 | 103 | HIS | 0 | 0.038 | 0.018 | 30.241 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | 1 | 104 | ASP | -1 | -0.818 | -0.927 | 24.156 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | 1 | 105 | LEU | 0 | -0.087 | -0.047 | 26.009 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | 1 | 106 | GLN | 0 | -0.009 | -0.021 | 27.730 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | 1 | 107 | TYR | 0 | 0.012 | 0.022 | 21.140 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | 1 | 108 | ILE | 0 | -0.006 | -0.008 | 22.728 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | 1 | 109 | HIS | 0 | -0.057 | -0.044 | 25.312 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | 1 | 110 | GLY | 0 | -0.022 | 0.004 | 28.407 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | 1 | 111 | VAL | 0 | -0.026 | -0.022 | 22.020 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | 1 | 112 | TRP | 0 | -0.011 | -0.022 | 23.895 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | 1 | 113 | GLU | -1 | -0.791 | -0.871 | 24.879 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | 1 | 114 | THR | 0 | -0.063 | -0.018 | 26.591 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | 1 | 115 | TYR | 0 | -0.025 | -0.003 | 23.153 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | 1 | 116 | PHE | 0 | 0.006 | -0.021 | 21.726 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | 1 | 117 | PRO | 0 | -0.018 | 0.000 | 21.724 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | 1 | 118 | PRO | 0 | -0.003 | -0.014 | 16.857 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | 1 | 119 | ALA | 0 | 0.011 | 0.008 | 13.646 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | 1 | 120 | LEU | 0 | -0.033 | 0.003 | 12.190 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | 1 | 121 | SER | 0 | -0.036 | -0.046 | 12.188 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | 1 | 122 | ALA | 0 | 0.053 | 0.021 | 14.074 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | 1 | 123 | PRO | 0 | -0.035 | -0.017 | 15.930 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | 1 | 124 | GLU | -1 | -0.942 | -0.972 | 16.297 | 0.210 | 0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | 1 | 125 | CYS | 0 | -0.059 | -0.029 | 16.805 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | 1 | 126 | TYR | 0 | -0.014 | -0.028 | 14.702 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | 1 | 127 | PRO | 0 | 0.054 | 0.047 | 14.470 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | 1 | 128 | ALA | 0 | 0.012 | 0.013 | 11.105 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | 1 | 129 | THR | 0 | -0.039 | -0.021 | 13.008 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | 1 | 130 | GLU | -1 | -0.833 | -0.930 | 12.845 | -0.703 | -0.703 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | 1 | 131 | ASP | -1 | -1.031 | -1.044 | 11.161 | -1.153 | -1.153 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | 1 | 132 | ASN | 0 | -0.022 | 0.045 | 14.646 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | 1 | 133 | ALA | 0 | 0.046 | -0.018 | 17.388 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | 1 | 134 | GLY | 0 | 0.013 | 0.048 | 17.207 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | 1 | 135 | ALA | 0 | -0.011 | -0.053 | 16.825 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | 1 | 136 | LEU | 0 | 0.028 | 0.031 | 13.630 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | 1 | 137 | ASP | -1 | -0.741 | -0.860 | 16.728 | -0.307 | -0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | 1 | 138 | ARG | 1 | 0.754 | 0.867 | 20.105 | 0.401 | 0.401 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | 1 | 139 | PHE | 0 | 0.000 | -0.009 | 15.933 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | 1 | 140 | TYR | 0 | 0.016 | -0.002 | 18.720 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | 1 | 141 | GLN | 0 | 0.001 | -0.001 | 20.279 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | 1 | 142 | SER | 0 | -0.073 | -0.025 | 22.131 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | 1 | 143 | LEU | 0 | -0.086 | -0.020 | 18.362 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | 1 | 144 | PRO | 0 | -0.026 | -0.010 | 22.948 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | 1 | 145 | GLY | 0 | 0.055 | 0.011 | 26.366 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | 1 | 146 | ARG | 1 | 0.820 | 0.917 | 24.870 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | 1 | 147 | THR | 0 | -0.099 | -0.085 | 21.045 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | 1 | 148 | TRP | 0 | 0.001 | -0.026 | 14.379 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | 1 | 149 | GLY | 0 | 0.056 | 0.012 | 16.620 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | 1 | 150 | ASP | -1 | -0.821 | -0.881 | 17.671 | -0.351 | -0.351 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | 1 | 151 | VAL | 0 | -0.039 | 0.001 | 19.247 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | 1 | 152 | MET | 0 | -0.044 | -0.020 | 12.720 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | 1 | 153 | ILE | 0 | -0.011 | -0.002 | 14.620 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | 1 | 154 | PRO | 0 | 0.010 | 0.016 | 15.425 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | 1 | 155 | SER | 0 | 0.020 | 0.025 | 16.482 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | 1 | 156 | THR | 0 | -0.028 | -0.019 | 10.798 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | 1 | 157 | MET | 0 | 0.013 | 0.018 | 12.116 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | 1 | 158 | ALA | 0 | -0.016 | -0.013 | 7.235 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | 1 | 159 | GLY | 0 | 0.030 | 0.012 | 6.570 | -0.450 | -0.450 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | 1 | 160 | ASN | 0 | 0.024 | -0.010 | 7.697 | -0.666 | -0.666 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | 1 | 161 | ALA | 0 | 0.023 | 0.020 | 8.117 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | 1 | 162 | TRP | 0 | -0.003 | -0.006 | 2.367 | -6.499 | -5.367 | 6.255 | -2.561 | -4.825 | -0.022 |
162 | 1 | 163 | VAL | 0 | -0.069 | -0.027 | 5.330 | -0.804 | -0.806 | -0.001 | -0.004 | 0.007 | 0.000 |
163 | 1 | 164 | TRP | 0 | 0.050 | 0.012 | 8.138 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | 1 | 165 | ALA | 0 | 0.052 | 0.039 | 9.033 | 0.238 | 0.238 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | 1 | 166 | TYR | 0 | 0.002 | 0.015 | 3.478 | 0.107 | 0.395 | 0.011 | -0.052 | -0.247 | 0.000 |
166 | 1 | 167 | ASN | 0 | 0.015 | -0.005 | 6.891 | 0.227 | 0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | 1 | 168 | TYR | 0 | 0.029 | 0.023 | 9.571 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | 1 | 169 | CYS | 0 | -0.016 | -0.001 | 5.115 | 0.312 | 0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | 1 | 170 | VAL | 0 | -0.028 | -0.014 | 5.052 | 0.461 | 0.461 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | 1 | 171 | ASN | 0 | -0.098 | -0.047 | 6.951 | 0.358 | 0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | 1 | 172 | ASN | 0 | -0.081 | -0.036 | 9.580 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | 1 | 173 | GLN | 0 | -0.047 | 0.014 | 5.593 | 0.971 | 0.971 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | 1 | 174 | GLY | 0 | -0.014 | -0.021 | 9.439 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | 1 | 175 | ALA | 0 | 0.003 | -0.031 | 11.309 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | 1 | 176 | ALA | 0 | 0.018 | 0.006 | 13.343 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | 1 | 177 | PRO | 0 | 0.019 | 0.016 | 15.819 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | 1 | 178 | LEU | 0 | -0.016 | 0.007 | 12.085 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | 1 | 179 | VAL | 0 | 0.008 | 0.011 | 6.425 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | 1 | 180 | TYR | 0 | 0.057 | 0.029 | 9.206 | 0.252 | 0.252 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | 1 | 181 | PHE | 0 | -0.012 | 0.003 | 6.179 | 0.472 | 0.472 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | 1 | 182 | GLY | 0 | 0.068 | 0.031 | 3.678 | 0.351 | 0.577 | 0.002 | -0.040 | -0.188 | 0.000 |
182 | 1 | 183 | ASN | 0 | -0.006 | -0.028 | 2.406 | -3.040 | -0.215 | 1.141 | -1.713 | -2.253 | 0.007 |
183 | 1 | 184 | PRO | 0 | 0.050 | 0.025 | 3.989 | 0.432 | 0.624 | 0.001 | -0.042 | -0.151 | 0.000 |
184 | 1 | 185 | TYR | 0 | 0.038 | -0.001 | 6.703 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | 1 | 186 | ASP | -1 | -0.769 | -0.870 | 1.751 | -22.628 | -26.485 | 11.830 | -4.990 | -2.983 | -0.059 |
186 | 1 | 187 | SER | 0 | 0.039 | 0.024 | 4.885 | 0.458 | 0.574 | -0.001 | -0.005 | -0.110 | 0.000 |
187 | 1 | 188 | GLN | 0 | 0.005 | 0.010 | 7.191 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | 1 | 189 | ILE | 0 | -0.035 | -0.016 | 7.926 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | 1 | 190 | ASP | -1 | -0.813 | -0.892 | 6.662 | -0.472 | -0.472 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | 1 | 191 | SER | 0 | 0.003 | -0.012 | 9.593 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | 1 | 192 | LEU | 0 | -0.027 | -0.009 | 12.346 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | 1 | 193 | LEU | 0 | -0.023 | -0.011 | 11.187 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | 1 | 194 | ALA | 0 | -0.055 | -0.016 | 14.032 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | 1 | 195 | MET | 0 | -0.043 | -0.024 | 15.715 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | 1 | 196 | GLY | 0 | -0.034 | -0.005 | 17.720 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | 1 | 197 | ALA | 0 | -0.023 | -0.012 | 17.819 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | 1 | 198 | ASP | -1 | -0.786 | -0.868 | 16.697 | -0.522 | -0.522 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | 1 | 199 | PRO | 0 | -0.004 | -0.010 | 13.475 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | 1 | 200 | PHE | 0 | 0.012 | -0.007 | 10.945 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | 1 | 201 | THR | 0 | -0.077 | -0.085 | 16.355 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | 1 | 202 | GLY | 0 | 0.001 | 0.008 | 19.523 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | 1 | 203 | GLY | 0 | 0.019 | 0.009 | 19.936 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | 1 | 204 | SER | 0 | -0.025 | -0.025 | 20.700 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | 1 | 205 | ILE | 0 | -0.090 | -0.098 | 22.507 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | 1 | 206 | THR | 0 | 0.235 | 0.350 | 24.438 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | 1 | 207 | GLY | 0 | -0.268 | -0.258 | 24.841 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | 1 | 208 | ASP | -1 | -0.805 | -0.923 | 24.511 | -0.270 | -0.270 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | 1 | 209 | GLY | 0 | -0.012 | -0.017 | 26.266 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | 1 | 210 | LYS | 1 | 0.831 | 0.909 | 27.247 | 0.230 | 0.230 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | 1 | 211 | ASN | 0 | 0.033 | 0.016 | 30.520 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | 1 | 212 | PRO | 0 | 0.104 | 0.134 | 28.624 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | 1 | 213 | SER | 0 | -0.150 | -0.121 | 29.765 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | 1 | 214 | VAL | 0 | -0.011 | -0.015 | 28.964 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | 1 | 215 | GLY | 0 | 0.036 | 0.030 | 28.544 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | 1 | 216 | THR | 0 | -0.059 | -0.031 | 29.613 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | 1 | 217 | GLY | 0 | 0.050 | 0.029 | 31.547 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | 1 | 218 | ASN | 0 | -0.054 | -0.057 | 31.463 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | 1 | 219 | ALA | 0 | 0.031 | 0.039 | 31.386 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | 1 | 220 | THR | 0 | -0.025 | -0.006 | 33.385 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | 1 | 221 | VAL | 0 | -0.040 | -0.027 | 35.364 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | 1 | 222 | SER | 0 | 0.028 | -0.004 | 35.060 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | 1 | 223 | ALA | 0 | -0.022 | 0.000 | 36.152 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | 1 | 224 | SER | 0 | -0.058 | 0.004 | 34.092 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | 1 | 225 | SER | 0 | 0.028 | -0.036 | 32.737 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | 1 | 226 | GLU | -1 | -0.980 | -0.958 | 34.340 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | 1 | 227 | ALA | 0 | 0.000 | -0.017 | 36.178 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | 1 | 228 | ASN | 0 | 0.039 | 0.010 | 31.910 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | 1 | 229 | ARG | 1 | 0.935 | 0.961 | 33.525 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | 1 | 230 | GLU | -1 | -0.839 | -0.902 | 37.996 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | 1 | 231 | LYS | 1 | 0.905 | 0.953 | 35.352 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | 1 | 232 | LEU | 0 | 0.030 | 0.018 | 35.691 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | 1 | 233 | LYS | 1 | 0.868 | 0.928 | 39.323 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | 1 | 234 | LYS | 1 | 0.902 | 0.963 | 42.802 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | 1 | 235 | ALA | 0 | 0.087 | 0.059 | 40.921 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | 1 | 236 | LEU | 0 | 0.005 | 0.002 | 40.248 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | 1 | 237 | THR | 0 | -0.067 | -0.056 | 43.929 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | 1 | 238 | ASP | -1 | -0.882 | -0.954 | 46.519 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | 1 | 239 | LEU | 0 | 0.005 | 0.031 | 43.178 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | 1 | 240 | PHE | 0 | -0.025 | -0.026 | 45.002 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | 1 | 241 | ASN | 0 | -0.067 | -0.034 | 49.552 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | 1 | 242 | ASN | 0 | -0.010 | -0.019 | 49.723 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | 1 | 243 | ASN | 0 | -0.051 | -0.014 | 49.145 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | 1 | 244 | LEU | 0 | -0.005 | 0.003 | 52.027 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | 1 | 245 | GLU | -1 | -0.874 | -0.942 | 53.761 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | 1 | 246 | HIS | 0 | -0.030 | -0.006 | 53.703 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | 1 | 247 | LEU | 0 | -0.070 | -0.016 | 52.096 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | 1 | 248 | SER | 0 | 0.003 | 0.001 | 56.486 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | 1 | 249 | GLY | 0 | -0.025 | -0.019 | 59.483 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | 1 | 250 | GLU | -1 | -0.797 | -0.904 | 56.555 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | 1 | 251 | PHE | 0 | -0.020 | -0.004 | 58.447 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | 1 | 252 | TYR | 0 | -0.030 | -0.026 | 53.856 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | 1 | 253 | GLY | 0 | 0.052 | 0.015 | 53.547 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | 1 | 254 | ASN | 0 | 0.007 | -0.004 | 53.866 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | 1 | 255 | GLN | 0 | -0.078 | -0.047 | 53.241 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | 1 | 256 | VAL | 0 | -0.007 | 0.000 | 48.492 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | 1 | 257 | LEU | 0 | 0.001 | 0.021 | 49.747 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | 1 | 258 | ASN | 0 | -0.117 | -0.055 | 51.542 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | 1 | 259 | ALA | 0 | 0.027 | 0.013 | 48.081 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | 1 | 260 | MET | 0 | -0.031 | -0.004 | 43.851 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | 1 | 261 | LYS | 1 | 0.898 | 0.943 | 48.695 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | 1 | 262 | TYR | 0 | -0.010 | 0.015 | 48.660 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | 1 | 263 | GLY | 0 | 0.005 | 0.004 | 45.303 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | 1 | 264 | THR | 0 | 0.020 | -0.020 | 41.575 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | 1 | 265 | ILE | 0 | 0.007 | 0.011 | 37.686 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | 1 | 266 | LEU | 0 | -0.013 | -0.003 | 35.814 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | 1 | 267 | LYS | 1 | 0.884 | 0.906 | 30.250 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | 1 | 268 | CYS | 0 | -0.056 | -0.039 | 29.713 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | 1 | 269 | ASP | -1 | -0.761 | -0.856 | 26.594 | 0.162 | 0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | 1 | 270 | LEU | 0 | -0.038 | -0.010 | 27.514 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | 1 | 271 | THR | 0 | 0.006 | -0.013 | 24.704 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | 1 | 272 | ASP | -1 | -0.808 | -0.894 | 28.116 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | 1 | 273 | ASP | -1 | -0.818 | -0.885 | 24.384 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | 1 | 274 | GLY | 0 | 0.012 | 0.009 | 27.617 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | 1 | 275 | LEU | 0 | -0.065 | -0.046 | 28.647 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | 1 | 276 | ASN | 0 | 0.019 | 0.002 | 30.853 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | 1 | 277 | ALA | 0 | 0.050 | 0.043 | 29.370 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | 1 | 278 | ILE | 0 | -0.017 | -0.012 | 31.532 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | 1 | 279 | LEU | 0 | -0.037 | -0.042 | 34.228 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | 1 | 280 | GLN | 0 | -0.054 | -0.024 | 31.438 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | 1 | 281 | LEU | 0 | -0.002 | 0.014 | 33.636 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | 1 | 282 | ILE | 0 | -0.040 | -0.021 | 36.730 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | 1 | 283 | ALA | 0 | -0.007 | -0.006 | 39.414 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | 1 | 284 | ASP | -1 | -0.946 | -0.983 | 37.531 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | 1 | 285 | VAL | 0 | 0.003 | 0.015 | 40.769 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | 1 | 286 | ASN | 0 | -0.051 | -0.042 | 43.187 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | 1 | 287 | LEU | 0 | -0.071 | 0.000 | 44.016 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | 1 | 288 | GLN | 0 | -0.031 | -0.006 | 42.641 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | 1 | 310 | SER | 0 | 0.034 | 0.008 | 58.335 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | 1 | 311 | ASP | -1 | -0.911 | -0.968 | 59.346 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | 1 | 312 | ARG | 1 | 0.865 | 0.935 | 56.740 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | 1 | 313 | VAL | 0 | 0.012 | 0.007 | 54.749 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | 1 | 314 | ALA | 0 | 0.017 | -0.003 | 57.457 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | 1 | 315 | ALA | 0 | -0.021 | 0.001 | 60.289 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | 1 | 316 | ASN | 0 | 0.006 | -0.003 | 56.555 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | 1 | 317 | LEU | 0 | 0.011 | 0.012 | 55.881 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | 1 | 318 | ALA | 0 | 0.024 | 0.009 | 56.949 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | 1 | 319 | ASN | 0 | -0.061 | -0.037 | 57.387 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | 1 | 320 | ALA | 0 | 0.042 | 0.018 | 53.028 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | 1 | 321 | GLN | 0 | -0.012 | -0.027 | 53.453 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | 1 | 322 | ALA | 0 | -0.031 | -0.002 | 55.083 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | 1 | 323 | GLN | 0 | -0.021 | -0.025 | 51.732 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | 1 | 324 | VAL | 0 | -0.006 | 0.007 | 49.855 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | 1 | 325 | GLY | 0 | -0.042 | -0.016 | 49.273 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | 1 | 326 | LYS | 1 | 0.834 | 0.927 | 49.399 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | 1 | 327 | TYR | 0 | 0.033 | 0.010 | 42.090 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | 1 | 328 | ILE | 0 | -0.038 | -0.024 | 46.447 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | 1 | 329 | GLY | 0 | -0.018 | -0.016 | 43.855 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | 1 | 330 | ASP | -1 | -0.829 | -0.879 | 40.793 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | 1 | 331 | GLY | 0 | -0.013 | -0.001 | 40.370 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | 1 | 332 | GLN | 0 | 0.115 | 0.087 | 37.014 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | 1 | 333 | CYS | 0 | -0.013 | -0.003 | 37.030 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | 1 | 334 | TYR | 0 | 0.083 | 0.011 | 34.234 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | 1 | 335 | ALA | 0 | -0.030 | -0.010 | 41.076 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | 1 | 336 | TRP | 0 | -0.033 | -0.027 | 43.801 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | 1 | 337 | VAL | 0 | 0.014 | 0.010 | 43.073 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | 1 | 338 | GLY | 0 | -0.006 | -0.007 | 45.037 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | 1 | 339 | TRP | 0 | 0.021 | -0.002 | 46.550 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | 1 | 340 | TRP | 0 | -0.001 | -0.009 | 49.027 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | 1 | 341 | SER | 0 | 0.015 | -0.009 | 48.689 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | 1 | 342 | ALA | 0 | -0.011 | 0.012 | 50.526 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | 1 | 343 | ARG | 1 | 0.737 | 0.851 | 51.733 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | 1 | 344 | VAL | 0 | -0.038 | 0.000 | 53.946 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | 1 | 345 | CYS | 0 | -0.144 | -0.079 | 51.988 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | 1 | 346 | GLY | 0 | 0.036 | 0.022 | 53.954 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | 1 | 347 | TYR | 0 | -0.030 | -0.029 | 49.831 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | 1 | 348 | SER | 0 | 0.002 | -0.018 | 47.185 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | 1 | 349 | ILE | 0 | -0.003 | 0.012 | 41.410 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | 1 | 350 | SER | 0 | -0.010 | -0.029 | 41.593 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | 1 | 351 | TYR | 0 | 0.070 | 0.008 | 40.709 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | 1 | 352 | SER | 0 | -0.059 | -0.047 | 41.964 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | 1 | 353 | THR | 0 | -0.075 | -0.010 | 44.936 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | 1 | 354 | GLY | 0 | 0.016 | 0.014 | 47.446 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | 1 | 355 | ASP | -1 | -0.806 | -0.858 | 49.219 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | 1 | 356 | PRO | 0 | -0.021 | -0.003 | 49.680 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | 1 | 357 | MET | 0 | -0.011 | -0.006 | 45.301 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | 1 | 358 | LEU | 0 | 0.014 | 0.021 | 46.123 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | 1 | 359 | PRO | 0 | -0.027 | -0.013 | 45.681 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | 1 | 360 | LEU | 0 | 0.006 | 0.006 | 38.385 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | 1 | 361 | ILE | 0 | -0.028 | -0.007 | 41.557 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | 1 | 362 | GLY | 0 | -0.012 | -0.028 | 38.066 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | 1 | 363 | ASP | -1 | -0.839 | -0.874 | 33.467 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | 1 | 364 | GLY | 0 | 0.042 | 0.009 | 36.126 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | 1 | 365 | MET | 0 | -0.066 | -0.039 | 30.263 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | 1 | 366 | ASN | 0 | -0.013 | -0.038 | 30.156 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | 1 | 367 | ALA | 0 | -0.010 | 0.007 | 33.367 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | 1 | 368 | HIS | 0 | -0.005 | 0.023 | 30.347 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | 1 | 369 | SER | 0 | 0.037 | -0.010 | 34.271 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | 1 | 370 | ILE | 0 | 0.000 | -0.003 | 37.767 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | 1 | 371 | HIS | 0 | 0.033 | 0.002 | 40.327 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | 1 | 372 | LEU | 0 | -0.040 | 0.014 | 36.716 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | 1 | 373 | GLY | 0 | 0.080 | 0.026 | 40.043 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | 1 | 374 | TRP | 0 | -0.032 | -0.027 | 39.619 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | 1 | 375 | ASP | -1 | -0.780 | -0.879 | 43.862 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | 1 | 376 | TRP | 0 | -0.005 | -0.029 | 44.764 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | 1 | 377 | SER | 0 | -0.009 | -0.024 | 49.447 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | 1 | 378 | ILE | 0 | -0.080 | -0.031 | 50.583 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | 1 | 379 | ALA | 0 | -0.057 | -0.026 | 52.938 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | 1 | 380 | ASN | 0 | -0.008 | 0.001 | 53.188 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | 1 | 381 | THR | 0 | 0.028 | 0.015 | 48.420 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | 1 | 382 | GLY | 0 | -0.032 | 0.003 | 49.428 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | 1 | 383 | ILE | 0 | -0.027 | -0.022 | 46.908 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | 1 | 384 | VAL | 0 | -0.029 | -0.014 | 45.497 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | 1 | 385 | ASN | 0 | 0.040 | 0.025 | 39.877 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | 1 | 386 | TYR | 0 | -0.050 | -0.046 | 40.023 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | 1 | 387 | PRO | 0 | 0.036 | 0.017 | 37.169 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | 1 | 388 | VAL | 0 | -0.042 | -0.041 | 31.630 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | 1 | 389 | GLY | 0 | 0.100 | 0.088 | 34.620 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | 1 | 390 | THR | 0 | -0.061 | -0.004 | 36.728 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | 1 | 391 | VAL | 0 | -0.020 | -0.029 | 39.145 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | 1 | 392 | GLY | 0 | 0.098 | 0.022 | 41.810 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | 1 | 393 | ARG | 1 | 0.788 | 0.868 | 43.571 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | 1 | 394 | LYS | 1 | 0.963 | 0.958 | 47.275 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | 1 | 395 | GLU | -1 | -0.877 | -0.921 | 49.549 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | 1 | 396 | ASP | -1 | -0.870 | -0.896 | 48.792 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | 1 | 397 | LEU | 0 | 0.035 | 0.027 | 47.850 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | 1 | 398 | ARG | 1 | 0.879 | 0.923 | 50.712 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | 1 | 399 | VAL | 0 | -0.003 | 0.035 | 52.480 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | 1 | 400 | GLY | 0 | 0.004 | -0.012 | 52.182 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | 1 | 401 | ALA | 0 | -0.013 | -0.011 | 48.904 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | 1 | 402 | ILE | 0 | 0.000 | -0.001 | 43.968 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | 1 | 403 | TRP | 0 | 0.017 | 0.009 | 39.665 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | 1 | 404 | CYS | 0 | -0.037 | -0.001 | 38.683 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | 1 | 405 | ALA | 0 | 0.034 | 0.014 | 36.312 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | 1 | 406 | THR | 0 | 0.056 | 0.005 | 32.578 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | 1 | 407 | ALA | 0 | 0.008 | 0.024 | 28.605 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | 1 | 408 | PHE | 0 | 0.009 | -0.002 | 24.189 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | 1 | 409 | SER | 0 | -0.109 | -0.052 | 29.453 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | 1 | 410 | GLY | 0 | 0.047 | 0.022 | 31.453 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | 1 | 411 | ALA | 0 | 0.020 | -0.022 | 32.208 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | 1 | 412 | PRO | 0 | -0.027 | 0.011 | 35.397 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | 1 | 413 | PHE | 0 | 0.004 | -0.016 | 35.749 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | 1 | 414 | TYR | 0 | -0.027 | -0.020 | 30.623 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | 1 | 415 | THR | 0 | -0.016 | 0.005 | 31.282 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | 1 | 416 | GLY | 0 | 0.085 | 0.020 | 27.536 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | 1 | 417 | GLN | 0 | -0.053 | 0.010 | 24.845 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | 1 | 418 | TYR | 0 | 0.002 | -0.011 | 27.225 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | 1 | 419 | GLY | 0 | 0.019 | 0.023 | 30.833 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | 1 | 420 | HIS | 0 | -0.021 | -0.022 | 33.439 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | 1 | 421 | THR | 0 | -0.032 | -0.032 | 36.727 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | 1 | 422 | GLY | 0 | 0.032 | 0.004 | 40.337 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | 1 | 423 | ILE | 0 | -0.029 | -0.001 | 43.867 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | 1 | 424 | ILE | 0 | -0.013 | 0.012 | 47.180 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | 1 | 425 | GLU | -1 | -0.757 | -0.844 | 49.304 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | 1 | 426 | SER | 0 | -0.029 | -0.034 | 52.043 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | 1 | 427 | TRP | 0 | 0.032 | 0.008 | 51.335 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | 1 | 428 | SER | 0 | 0.002 | 0.014 | 52.471 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | 1 | 429 | ASP | -1 | -0.952 | -0.980 | 52.205 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | 1 | 430 | THR | 0 | -0.015 | -0.012 | 50.841 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | 1 | 431 | THR | 0 | -0.005 | 0.000 | 48.719 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | 1 | 432 | VAL | 0 | 0.010 | 0.000 | 46.311 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | 1 | 433 | THR | 0 | -0.019 | -0.005 | 47.857 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | 1 | 434 | VAL | 0 | -0.023 | -0.001 | 44.344 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | 1 | 435 | LEU | 0 | 0.011 | 0.012 | 47.456 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | 1 | 436 | GLU | -1 | -0.712 | -0.852 | 41.700 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | 1 | 437 | GLN | 0 | -0.007 | -0.023 | 42.018 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | 1 | 438 | ASN | 0 | -0.026 | -0.016 | 35.159 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | 1 | 439 | ILE | 0 | 0.012 | 0.023 | 37.288 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | 1 | 440 | LEU | 0 | -0.003 | -0.014 | 33.118 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | 1 | 441 | GLY | 0 | 0.016 | 0.030 | 36.082 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | 1 | 442 | SER | 0 | -0.097 | -0.036 | 37.872 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | 1 | 443 | PRO | 0 | -0.018 | -0.014 | 41.124 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | 1 | 444 | VAL | 0 | -0.015 | -0.003 | 43.986 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | 1 | 445 | ILE | 0 | 0.024 | 0.013 | 43.053 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | 1 | 446 | ARG | 1 | 0.804 | 0.863 | 46.490 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | 1 | 447 | SER | 0 | -0.014 | -0.019 | 44.125 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | 1 | 448 | THR | 0 | -0.051 | -0.021 | 46.417 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | 1 | 449 | TYR | 0 | 0.000 | -0.004 | 41.214 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | 1 | 450 | ASP | -1 | -0.752 | -0.857 | 43.647 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | 1 | 451 | LEU | 0 | -0.019 | 0.004 | 44.309 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | 1 | 452 | ASN | 0 | -0.073 | -0.058 | 44.192 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | 1 | 453 | THR | 0 | 0.001 | -0.034 | 39.085 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | 1 | 454 | PHE | 0 | -0.039 | -0.021 | 39.885 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | 1 | 455 | LEU | 0 | -0.038 | -0.022 | 41.069 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | 1 | 456 | SER | 0 | 0.022 | 0.018 | 37.406 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | 1 | 457 | THR | 0 | -0.015 | 0.000 | 35.939 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | 1 | 458 | LEU | 0 | -0.050 | -0.016 | 37.074 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | 1 | 459 | THR | 0 | 0.025 | 0.019 | 35.375 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | 1 | 460 | GLY | 0 | 0.048 | 0.028 | 38.717 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | 1 | 461 | LEU | 0 | -0.065 | -0.019 | 41.995 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | 1 | 462 | ILE | 0 | 0.008 | 0.008 | 43.553 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | 1 | 463 | THR | 0 | 0.003 | -0.014 | 47.658 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | 1 | 464 | PHE | 0 | -0.014 | -0.004 | 50.050 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |