FMODB ID: ZV41N
Calculation Name: 1H2T-C-Xray372
Preferred Name:
Target Type:
Ligand Name: guanosine-5'-diphosphate
ligand 3-letter code: GDP
PDB ID: 1H2T
Chain ID: C
UniProt ID: Q09161
Base Structure: X-ray
Registration Date: 2023-09-24
Reference: C. Watanabe, N. Tani, K. Kamisaka, T. Honma et al., Interaction energy analysis of Apo structure dataset on FMODB, To be published.
Modeling method
Optimization | MOE:Amber10:EHT |
---|---|
Restraint | 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 | 703 |
LigandResidueName | |
LigandFragmentNumber | 0 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -17854054.624651 |
---|---|
FMO2-HF: Nuclear repulsion | 17565521.131502 |
FMO2-HF: Total energy | -288533.493149 |
FMO2-MP2: Total energy | -289365.922702 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(C:29:ASP)
Summations of interaction energy for
fragment #1(C:29:ASP)
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. |
-86.371 | -91.868 | 26.954 | -12.165 | -9.29 | 0.044 |
Interaction energy analysis for fragmet #1(C:29:ASP)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | C | 31 | LEU | 0 | 0.044 | 0.007 | 3.763 | -11.821 | -9.463 | 0.050 | -1.251 | -1.157 | 0.009 |
4 | C | 32 | GLU | -1 | -0.755 | -0.863 | 1.775 | 35.943 | 33.775 | 9.842 | -3.785 | -3.888 | -0.025 |
5 | C | 33 | SER | 0 | -0.002 | 0.003 | 3.767 | -8.154 | -7.542 | 0.003 | -0.234 | -0.380 | 0.000 |
6 | C | 34 | LEU | 0 | -0.024 | -0.001 | 5.976 | -4.543 | -4.543 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | C | 35 | ILE | 0 | 0.040 | 0.028 | 7.537 | -3.067 | -3.067 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | C | 36 | CYS | 0 | -0.044 | -0.017 | 6.942 | -2.693 | -2.693 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | C | 37 | LYS | 1 | 0.943 | 0.960 | 7.415 | -37.637 | -37.637 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | C | 38 | VAL | 0 | 0.001 | 0.019 | 11.788 | -1.605 | -1.605 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | C | 39 | GLY | 0 | 0.023 | -0.008 | 14.041 | -0.573 | -0.573 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | C | 40 | GLU | -1 | -0.970 | -0.969 | 13.251 | 20.931 | 20.931 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | C | 41 | LYS | 1 | 0.922 | 0.948 | 15.456 | -19.633 | -19.633 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | C | 42 | SER | 0 | 0.005 | -0.006 | 17.738 | 0.785 | 0.785 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | C | 43 | ALA | 0 | -0.006 | 0.002 | 19.531 | -0.728 | -0.728 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | C | 44 | CYS | 0 | -0.021 | -0.005 | 20.979 | -0.735 | -0.735 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | C | 45 | SER | 0 | 0.026 | -0.016 | 22.065 | 0.409 | 0.409 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | C | 46 | LEU | 0 | 0.027 | 0.029 | 19.268 | 0.748 | 0.748 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | C | 47 | GLU | -1 | -0.787 | -0.886 | 20.188 | 13.299 | 13.299 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | C | 48 | SER | 0 | 0.011 | 0.005 | 21.471 | 0.240 | 0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | C | 49 | ASN | 0 | -0.086 | -0.042 | 16.876 | 1.415 | 1.415 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | C | 50 | LEU | 0 | -0.019 | -0.006 | 16.762 | 1.111 | 1.111 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | C | 51 | GLU | -1 | -0.751 | -0.870 | 17.544 | 14.542 | 14.542 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | C | 52 | GLY | 0 | -0.013 | 0.000 | 18.025 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | C | 53 | LEU | 0 | -0.028 | -0.021 | 10.687 | 0.971 | 0.971 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | C | 54 | ALA | 0 | 0.020 | -0.001 | 14.185 | 0.943 | 0.943 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | C | 55 | GLY | 0 | 0.022 | 0.015 | 16.540 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | C | 56 | VAL | 0 | -0.053 | -0.025 | 11.212 | 0.457 | 0.457 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | C | 57 | LEU | 0 | -0.017 | -0.025 | 9.595 | 1.249 | 1.249 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | C | 58 | GLU | -1 | -0.849 | -0.917 | 12.816 | 15.272 | 15.272 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | C | 59 | ALA | 0 | -0.015 | -0.009 | 14.896 | -0.414 | -0.414 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | C | 60 | ASP | -1 | -0.828 | -0.916 | 10.100 | 29.390 | 29.390 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | C | 61 | LEU | 0 | -0.076 | -0.022 | 12.686 | 0.524 | 0.524 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | C | 62 | PRO | 0 | -0.040 | -0.027 | 14.738 | -0.209 | -0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | C | 63 | ASN | 0 | -0.038 | -0.014 | 11.832 | -1.675 | -1.675 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | C | 64 | TYR | 0 | -0.019 | -0.018 | 8.613 | 1.794 | 1.794 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | C | 65 | LYS | 1 | 0.867 | 0.924 | 10.285 | -14.684 | -14.684 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | C | 66 | SER | 0 | -0.005 | -0.003 | 12.022 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | C | 67 | LYS | 1 | 0.868 | 0.922 | 1.850 | -80.712 | -87.095 | 17.061 | -6.888 | -3.790 | 0.060 |
40 | C | 68 | ILE | 0 | 0.028 | 0.014 | 8.202 | 0.554 | 0.554 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | C | 69 | LEU | 0 | 0.017 | 0.017 | 9.773 | -0.749 | -0.749 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | C | 70 | ARG | 1 | 0.878 | 0.924 | 4.628 | -31.194 | -31.144 | -0.001 | -0.002 | -0.047 | 0.000 |
43 | C | 71 | LEU | 0 | -0.036 | 0.002 | 4.629 | -0.557 | -0.523 | -0.001 | -0.005 | -0.028 | 0.000 |
44 | C | 72 | LEU | 0 | 0.038 | 0.018 | 8.654 | -0.850 | -0.850 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | C | 73 | CYS | 0 | -0.017 | -0.010 | 12.121 | -1.342 | -1.342 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | C | 74 | THR | 0 | -0.077 | -0.048 | 9.452 | -0.666 | -0.666 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | C | 75 | VAL | 0 | -0.022 | -0.014 | 10.333 | -0.662 | -0.662 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | C | 76 | ALA | 0 | -0.002 | 0.004 | 12.916 | -0.893 | -0.893 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | C | 77 | ARG | 1 | 0.824 | 0.898 | 14.653 | -16.364 | -16.364 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | C | 78 | LEU | 0 | -0.015 | -0.006 | 12.343 | -0.454 | -0.454 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | C | 79 | LEU | 0 | -0.026 | -0.005 | 12.362 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | C | 80 | PRO | 0 | 0.016 | 0.014 | 16.148 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | C | 81 | GLU | -1 | -0.750 | -0.865 | 17.962 | 14.666 | 14.666 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | C | 82 | LYS | 1 | 0.834 | 0.917 | 13.680 | -19.320 | -19.320 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | C | 83 | LEU | 0 | 0.014 | 0.017 | 18.498 | 0.316 | 0.316 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | C | 84 | THR | 0 | -0.027 | -0.023 | 19.643 | 0.431 | 0.431 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | C | 85 | ILE | 0 | 0.007 | 0.022 | 16.711 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | C | 86 | TYR | 0 | -0.022 | -0.039 | 12.085 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | C | 87 | THR | 0 | -0.036 | -0.028 | 16.801 | 0.385 | 0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | C | 88 | THR | 0 | 0.059 | 0.003 | 19.932 | -0.363 | -0.363 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | C | 89 | LEU | 0 | -0.035 | -0.006 | 12.863 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | C | 90 | VAL | 0 | -0.010 | -0.012 | 16.145 | 0.169 | 0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | C | 91 | GLY | 0 | 0.020 | 0.004 | 18.019 | -0.309 | -0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | C | 92 | LEU | 0 | 0.007 | 0.006 | 19.264 | -0.248 | -0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | C | 93 | LEU | 0 | -0.016 | -0.013 | 14.180 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | C | 94 | ASN | 0 | -0.039 | -0.021 | 18.811 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | C | 95 | ALA | 0 | -0.006 | -0.005 | 21.819 | -0.411 | -0.411 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | C | 96 | ARG | 1 | 0.774 | 0.886 | 20.151 | -15.340 | -15.340 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | C | 97 | ASN | 0 | -0.022 | -0.019 | 19.884 | -0.515 | -0.515 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | C | 98 | TYR | 0 | 0.056 | 0.024 | 21.450 | 0.340 | 0.340 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | C | 99 | ASN | 0 | -0.012 | -0.018 | 22.725 | -0.305 | -0.305 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | C | 100 | PHE | 0 | 0.037 | 0.018 | 13.929 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | C | 101 | GLY | 0 | 0.034 | 0.013 | 19.015 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | C | 102 | GLY | 0 | -0.010 | -0.002 | 20.779 | -0.228 | -0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | C | 103 | GLU | -1 | -0.805 | -0.888 | 18.761 | 14.779 | 14.779 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | C | 104 | PHE | 0 | -0.007 | -0.019 | 14.695 | 0.178 | 0.178 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | C | 105 | VAL | 0 | 0.028 | 0.015 | 18.296 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | C | 106 | GLU | -1 | -0.838 | -0.897 | 21.649 | 11.846 | 11.846 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | C | 107 | ALA | 0 | -0.078 | -0.039 | 16.911 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | C | 108 | MET | 0 | 0.011 | 0.010 | 18.188 | 0.204 | 0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | C | 109 | ILE | 0 | -0.003 | 0.007 | 19.894 | -0.286 | -0.286 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | C | 110 | ARG | 1 | 0.847 | 0.896 | 20.031 | -13.084 | -13.084 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | C | 111 | GLN | 0 | 0.014 | 0.023 | 16.662 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | C | 112 | LEU | 0 | 0.011 | 0.024 | 19.939 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | C | 113 | LYS | 1 | 0.934 | 0.969 | 23.035 | -10.026 | -10.026 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | C | 114 | GLU | -1 | -0.883 | -0.966 | 21.630 | 10.985 | 10.985 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | C | 115 | SER | 0 | -0.021 | -0.026 | 20.918 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | C | 116 | LEU | 0 | -0.058 | -0.029 | 22.914 | -0.223 | -0.223 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | C | 117 | LYS | 1 | 0.909 | 0.972 | 25.715 | -10.443 | -10.443 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | C | 118 | ALA | 0 | -0.019 | 0.003 | 23.572 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | C | 119 | ASN | 0 | 0.020 | 0.012 | 25.614 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | C | 120 | ASN | 0 | -0.008 | 0.003 | 22.151 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | C | 121 | TYR | 0 | 0.036 | -0.005 | 24.029 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | C | 122 | ASN | 0 | 0.001 | -0.011 | 24.415 | -0.275 | -0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | C | 123 | GLU | -1 | -0.831 | -0.901 | 18.619 | 14.298 | 14.298 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | C | 124 | ALA | 0 | 0.017 | 0.007 | 21.794 | 0.244 | 0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | C | 125 | VAL | 0 | -0.010 | 0.004 | 23.874 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | C | 126 | TYR | 0 | -0.007 | -0.004 | 20.250 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | C | 127 | LEU | 0 | 0.031 | 0.020 | 18.125 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | C | 128 | VAL | 0 | 0.015 | 0.010 | 21.529 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | C | 129 | ARG | 1 | 0.799 | 0.884 | 23.828 | -10.850 | -10.850 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | C | 130 | PHE | 0 | 0.022 | 0.007 | 16.805 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | C | 131 | LEU | 0 | -0.025 | -0.023 | 21.997 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | C | 132 | SER | 0 | 0.019 | -0.011 | 24.177 | -0.394 | -0.394 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | C | 133 | ASP | -1 | -0.749 | -0.850 | 23.982 | 11.346 | 11.346 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | C | 134 | LEU | 0 | 0.011 | -0.002 | 20.333 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | C | 135 | VAL | 0 | -0.072 | -0.017 | 24.323 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | C | 136 | ASN | 0 | -0.034 | -0.039 | 27.367 | -0.435 | -0.435 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | C | 137 | CYS | 0 | -0.082 | -0.022 | 23.599 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | C | 138 | HIS | 0 | 0.069 | 0.040 | 25.488 | 0.237 | 0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | C | 139 | VAL | 0 | 0.000 | 0.010 | 21.888 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | C | 140 | ILE | 0 | -0.050 | -0.030 | 23.796 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | C | 141 | ALA | 0 | 0.051 | 0.032 | 27.425 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | C | 142 | ALA | 0 | 0.063 | 0.021 | 31.253 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | C | 143 | PRO | 0 | 0.009 | -0.018 | 33.120 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | C | 144 | SER | 0 | 0.009 | 0.019 | 30.998 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | C | 145 | MET | 0 | 0.010 | 0.017 | 28.320 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | C | 146 | VAL | 0 | -0.011 | -0.004 | 31.518 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | C | 147 | ALA | 0 | 0.026 | 0.019 | 34.758 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | C | 148 | MET | 0 | -0.011 | 0.004 | 27.306 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | C | 149 | PHE | 0 | 0.013 | -0.010 | 29.892 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | C | 150 | GLU | -1 | -0.932 | -0.967 | 34.595 | 7.161 | 7.161 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | C | 151 | ASN | 0 | -0.051 | -0.024 | 34.335 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | C | 152 | PHE | 0 | -0.020 | 0.001 | 28.665 | -0.029 | -0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | C | 153 | VAL | 0 | 0.027 | 0.011 | 34.936 | -0.089 | -0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | C | 154 | SER | 0 | -0.071 | -0.027 | 38.125 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | C | 155 | VAL | 0 | 0.049 | 0.026 | 35.492 | -0.147 | -0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | C | 156 | THR | 0 | -0.108 | -0.072 | 38.903 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | C | 157 | GLN | 0 | 0.006 | 0.007 | 41.429 | -0.190 | -0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | C | 158 | GLU | -1 | -0.775 | -0.840 | 38.430 | 7.563 | 7.563 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | C | 159 | GLU | -1 | -0.886 | -0.942 | 43.093 | 6.086 | 6.086 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | C | 160 | ASP | -1 | -0.903 | -0.948 | 44.506 | 6.346 | 6.346 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | C | 161 | VAL | 0 | -0.086 | -0.029 | 40.028 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | C | 162 | PRO | 0 | 0.030 | 0.006 | 38.651 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | C | 163 | GLN | 0 | 0.013 | -0.001 | 40.231 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | C | 164 | VAL | 0 | 0.000 | -0.005 | 35.997 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | C | 165 | ARG | 1 | 0.741 | 0.844 | 34.518 | -7.829 | -7.829 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | C | 166 | ARG | 1 | 0.781 | 0.884 | 35.633 | -6.783 | -6.783 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | C | 167 | ASP | -1 | -0.732 | -0.814 | 36.486 | 7.630 | 7.630 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | C | 168 | TRP | 0 | -0.001 | 0.010 | 27.182 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | C | 169 | TYR | 0 | 0.061 | 0.018 | 31.436 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | C | 170 | VAL | 0 | 0.037 | 0.023 | 33.643 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | C | 171 | TYR | 0 | 0.007 | -0.003 | 29.167 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | C | 172 | ALA | 0 | 0.000 | 0.016 | 29.151 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | C | 173 | PHE | 0 | 0.037 | 0.022 | 30.217 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | C | 174 | LEU | 0 | 0.017 | 0.008 | 32.594 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | C | 175 | SER | 0 | -0.034 | -0.030 | 29.959 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | C | 176 | SER | 0 | 0.007 | -0.019 | 28.572 | 0.496 | 0.496 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | C | 177 | LEU | 0 | -0.041 | 0.000 | 29.811 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | C | 178 | PRO | 0 | -0.019 | -0.003 | 30.601 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | C | 179 | TRP | 0 | 0.010 | 0.014 | 25.414 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | C | 180 | VAL | 0 | 0.050 | 0.034 | 29.346 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | C | 181 | GLY | 0 | 0.010 | 0.003 | 31.171 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | C | 182 | LYS | 1 | 0.860 | 0.940 | 34.782 | -8.187 | -8.187 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | C | 183 | GLU | -1 | -0.794 | -0.883 | 31.981 | 8.436 | 8.436 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | C | 184 | LEU | 0 | -0.010 | -0.019 | 32.074 | -0.150 | -0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | C | 185 | TYR | 0 | -0.001 | -0.027 | 35.734 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | C | 186 | GLU | -1 | -0.895 | -0.971 | 37.856 | 7.693 | 7.693 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | C | 187 | LYS | 1 | 0.787 | 0.904 | 35.955 | -8.248 | -8.248 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | C | 188 | LYS | 1 | 0.841 | 0.914 | 37.989 | -7.370 | -7.370 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | C | 189 | ASP | -1 | -0.806 | -0.880 | 40.513 | 6.783 | 6.783 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | C | 190 | ALA | 0 | -0.019 | -0.018 | 42.724 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | C | 191 | GLU | -1 | -0.819 | -0.897 | 40.649 | 6.871 | 6.871 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | C | 192 | MET | 0 | -0.008 | -0.010 | 36.367 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | C | 193 | ASP | -1 | -0.785 | -0.878 | 40.914 | 6.713 | 6.713 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | C | 194 | ARG | 1 | 0.861 | 0.933 | 44.002 | -6.773 | -6.773 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | C | 195 | ILE | 0 | 0.025 | 0.034 | 38.250 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | C | 196 | PHE | 0 | 0.025 | 0.018 | 38.907 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | C | 197 | ALA | 0 | 0.007 | 0.013 | 42.840 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | C | 198 | ASN | 0 | -0.026 | -0.024 | 43.183 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | C | 199 | THR | 0 | 0.025 | 0.010 | 39.685 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | C | 200 | GLU | -1 | -0.805 | -0.898 | 42.339 | 6.347 | 6.347 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | C | 201 | SER | 0 | -0.060 | -0.050 | 45.317 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | C | 202 | TYR | 0 | 0.005 | -0.028 | 40.063 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | C | 203 | LEU | 0 | 0.011 | -0.014 | 40.539 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | C | 204 | LYS | 1 | 0.820 | 0.893 | 44.424 | -6.181 | -6.181 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | C | 205 | ARG | 1 | 0.837 | 0.918 | 45.368 | -6.616 | -6.616 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | C | 206 | ARG | 1 | 0.679 | 0.814 | 39.710 | -7.339 | -7.339 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | C | 207 | GLN | 0 | 0.025 | 0.010 | 45.381 | -0.169 | -0.169 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | C | 208 | LYS | 1 | 0.837 | 0.874 | 43.916 | -6.504 | -6.504 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | C | 209 | THR | 0 | 0.015 | 0.008 | 46.133 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | C | 210 | HIS | 0 | 0.034 | 0.001 | 41.184 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | C | 211 | VAL | 0 | -0.015 | -0.002 | 43.141 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | C | 212 | PRO | 0 | 0.000 | -0.006 | 44.374 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | C | 213 | MET | 0 | -0.048 | 0.008 | 42.580 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | C | 214 | LEU | 0 | -0.018 | -0.029 | 38.761 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | C | 215 | GLN | 0 | -0.062 | -0.024 | 40.801 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | C | 216 | VAL | 0 | 0.022 | 0.003 | 39.475 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | C | 217 | TRP | 0 | -0.010 | -0.010 | 42.201 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | C | 218 | THR | 0 | 0.025 | 0.005 | 46.201 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | C | 219 | ALA | 0 | 0.000 | 0.015 | 49.077 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | C | 220 | ASP | -1 | -0.818 | -0.909 | 48.596 | 6.090 | 6.090 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | C | 221 | LYS | 1 | 0.812 | 0.904 | 49.346 | -5.844 | -5.844 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | C | 222 | PRO | 0 | -0.002 | -0.006 | 47.336 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | C | 223 | HIS | 0 | -0.007 | -0.019 | 44.131 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | C | 224 | PRO | 0 | 0.034 | 0.029 | 45.623 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | C | 225 | GLN | 0 | -0.032 | -0.009 | 41.881 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | C | 226 | GLU | -1 | -0.777 | -0.862 | 41.404 | 7.026 | 7.026 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | C | 227 | GLU | -1 | -0.683 | -0.807 | 40.532 | 7.630 | 7.630 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | C | 228 | TYR | 0 | -0.053 | -0.051 | 34.278 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | C | 229 | LEU | 0 | -0.038 | -0.013 | 36.424 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | C | 230 | ASP | -1 | -0.843 | -0.889 | 38.574 | 6.824 | 6.824 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | C | 231 | CYS | 0 | -0.060 | -0.033 | 39.047 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | C | 232 | LEU | 0 | -0.001 | 0.005 | 33.976 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | C | 233 | TRP | 0 | -0.014 | -0.025 | 37.693 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | C | 234 | ALA | 0 | 0.017 | 0.017 | 40.447 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | C | 235 | GLN | 0 | -0.031 | -0.019 | 36.103 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | C | 236 | ILE | 0 | -0.019 | -0.009 | 34.901 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | C | 237 | GLN | 0 | 0.009 | 0.008 | 38.903 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | C | 238 | LYS | 1 | 0.851 | 0.931 | 40.541 | -7.442 | -7.442 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | C | 239 | LEU | 0 | -0.028 | -0.001 | 35.522 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | C | 240 | LYS | 1 | 0.866 | 0.936 | 39.755 | -6.884 | -6.884 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | C | 241 | LYS | 1 | 0.881 | 0.936 | 41.695 | -6.670 | -6.670 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | C | 242 | ASP | -1 | -0.869 | -0.916 | 41.796 | 6.837 | 6.837 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | C | 243 | ARG | 1 | 0.889 | 0.927 | 42.145 | -6.619 | -6.619 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | C | 244 | TRP | 0 | 0.022 | 0.007 | 37.162 | 0.163 | 0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | C | 245 | GLN | 0 | -0.007 | 0.014 | 36.879 | 0.262 | 0.262 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | C | 246 | GLU | -1 | -0.714 | -0.831 | 32.371 | 9.265 | 9.265 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | C | 247 | ARG | 1 | 0.856 | 0.906 | 35.396 | -7.936 | -7.936 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | C | 248 | HIS | 0 | 0.004 | -0.005 | 28.230 | -0.250 | -0.250 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | C | 249 | ILE | 0 | 0.025 | 0.014 | 27.089 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | C | 250 | LEU | 0 | 0.011 | 0.011 | 25.628 | -0.203 | -0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | C | 251 | ARG | 1 | 0.783 | 0.872 | 25.762 | -9.499 | -9.499 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | C | 252 | PRO | 0 | 0.043 | 0.013 | 21.978 | -0.256 | -0.256 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | C | 253 | TYR | 0 | 0.024 | -0.017 | 24.020 | -0.325 | -0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | C | 254 | LEU | 0 | -0.008 | -0.004 | 25.538 | -0.236 | -0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | C | 255 | ALA | 0 | -0.047 | -0.014 | 26.466 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | C | 256 | PHE | 0 | -0.032 | -0.021 | 22.364 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | C | 257 | ASP | -1 | -0.858 | -0.915 | 27.230 | 9.308 | 9.308 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | C | 258 | SER | 0 | 0.002 | -0.011 | 30.350 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | C | 259 | ILE | 0 | -0.006 | 0.009 | 25.028 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | C | 260 | LEU | 0 | -0.054 | -0.033 | 23.863 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | C | 261 | CYS | 0 | -0.077 | -0.048 | 27.837 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | C | 262 | GLU | -1 | -0.943 | -0.952 | 30.693 | 8.924 | 8.924 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | C | 263 | ALA | 0 | -0.043 | -0.001 | 26.455 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | C | 264 | LEU | 0 | -0.005 | -0.001 | 28.067 | -0.312 | -0.312 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | C | 265 | GLN | 0 | 0.012 | 0.010 | 27.372 | 0.242 | 0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | C | 266 | HIS | 1 | 0.801 | 0.909 | 24.133 | -11.595 | -11.595 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | C | 267 | ASN | 0 | 0.025 | 0.002 | 28.217 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | C | 268 | LEU | 0 | 0.012 | 0.000 | 26.264 | 0.366 | 0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | C | 269 | PRO | 0 | -0.021 | -0.002 | 27.966 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | C | 270 | PRO | 0 | 0.020 | -0.005 | 30.925 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | C | 271 | PHE | 0 | 0.022 | 0.016 | 27.094 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | C | 272 | THR | 0 | 0.005 | -0.001 | 32.039 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | C | 273 | PRO | 0 | -0.003 | 0.005 | 31.852 | 0.320 | 0.320 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | C | 274 | PRO | 0 | -0.009 | -0.017 | 29.406 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | C | 275 | PRO | 0 | 0.036 | 0.019 | 32.581 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | C | 276 | HIS | 0 | 0.061 | 0.052 | 35.047 | 0.331 | 0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | C | 277 | THR | 0 | 0.004 | 0.004 | 34.581 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | C | 278 | GLU | -1 | -0.921 | -0.967 | 37.064 | 7.126 | 7.126 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | C | 279 | ASP | -1 | -0.930 | -0.951 | 33.219 | 8.340 | 8.340 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | C | 280 | SER | 0 | -0.098 | -0.040 | 32.775 | 0.331 | 0.331 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | C | 281 | VAL | 0 | -0.016 | -0.011 | 31.380 | -0.207 | -0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | C | 282 | TYR | 0 | 0.031 | -0.011 | 31.163 | 0.338 | 0.338 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | C | 283 | PRO | 0 | -0.038 | -0.020 | 29.484 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | C | 284 | MET | 0 | 0.020 | 0.027 | 32.133 | -0.263 | -0.263 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | C | 285 | PRO | 0 | -0.022 | 0.013 | 34.647 | 0.221 | 0.221 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | C | 286 | ARG | 1 | 0.917 | 0.948 | 31.687 | -8.916 | -8.916 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | C | 287 | VAL | 0 | 0.002 | -0.006 | 36.876 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | C | 288 | ILE | 0 | -0.049 | -0.024 | 35.724 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | C | 289 | PHE | 0 | 0.015 | 0.007 | 36.608 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | C | 290 | ARG | 1 | 0.741 | 0.827 | 36.344 | -7.898 | -7.898 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | C | 291 | MET | 0 | -0.032 | -0.006 | 39.281 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | C | 292 | PHE | 0 | 0.025 | 0.017 | 37.692 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | C | 293 | ASP | -1 | -0.814 | -0.882 | 41.505 | 6.852 | 6.852 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | C | 294 | TYR | 0 | -0.004 | -0.019 | 43.031 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | C | 295 | THR | 0 | -0.067 | -0.052 | 43.943 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | C | 296 | ASP | -1 | -0.786 | -0.905 | 43.030 | 6.966 | 6.966 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | C | 297 | ASP | -1 | -0.874 | -0.952 | 40.002 | 7.839 | 7.839 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | C | 298 | PRO | 0 | -0.023 | 0.006 | 43.370 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | C | 299 | GLU | -1 | -0.937 | -0.973 | 45.605 | 6.537 | 6.537 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | C | 300 | GLY | 0 | -0.008 | 0.009 | 41.375 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | C | 301 | PRO | 0 | -0.145 | -0.077 | 37.166 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | C | 302 | VAL | 0 | 0.049 | 0.014 | 40.069 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | C | 303 | MET | 0 | -0.012 | 0.019 | 38.296 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | C | 304 | PRO | 0 | -0.033 | -0.004 | 35.685 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | C | 305 | GLY | 0 | 0.063 | 0.039 | 38.787 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | C | 306 | SER | 0 | 0.066 | 0.026 | 39.531 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | C | 307 | HIS | 0 | -0.043 | -0.034 | 39.442 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | C | 308 | SER | 0 | -0.061 | -0.043 | 38.097 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | C | 309 | VAL | 0 | 0.062 | 0.019 | 33.906 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | C | 310 | GLU | -1 | -0.826 | -0.918 | 33.046 | 8.537 | 8.537 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | C | 311 | ARG | 1 | 0.716 | 0.825 | 32.722 | -7.795 | -7.795 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | C | 312 | PHE | 0 | 0.033 | 0.022 | 30.089 | 0.225 | 0.225 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | C | 313 | VAL | 0 | -0.025 | -0.016 | 27.572 | 0.277 | 0.277 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | C | 314 | ILE | 0 | -0.006 | 0.002 | 28.091 | 0.400 | 0.400 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | C | 315 | GLU | -1 | -0.754 | -0.841 | 28.558 | 8.926 | 8.926 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | C | 316 | GLU | -1 | -0.778 | -0.869 | 26.053 | 10.800 | 10.800 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | C | 317 | ASN | 0 | -0.022 | 0.001 | 24.271 | 0.624 | 0.624 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | C | 318 | LEU | 0 | 0.019 | 0.015 | 23.857 | 0.555 | 0.555 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | C | 319 | HIS | 0 | -0.001 | -0.016 | 25.116 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | C | 320 | CYS | 0 | -0.091 | -0.043 | 21.252 | 0.369 | 0.369 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | C | 321 | ILE | 0 | 0.005 | 0.009 | 20.405 | 0.683 | 0.683 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | C | 322 | ILE | 0 | -0.003 | -0.010 | 20.749 | 0.618 | 0.618 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | C | 323 | LYS | 1 | 0.762 | 0.867 | 17.624 | -14.572 | -14.572 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | C | 324 | SER | 0 | -0.063 | -0.033 | 16.465 | 0.299 | 0.299 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | C | 325 | HIS | 0 | -0.007 | -0.022 | 15.367 | 0.822 | 0.822 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | C | 326 | TRP | 0 | -0.008 | -0.002 | 19.046 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | C | 327 | LYS | 1 | 0.865 | 0.940 | 15.857 | -16.832 | -16.832 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | C | 328 | GLU | -1 | -0.913 | -0.950 | 16.456 | 16.746 | 16.746 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | C | 329 | ARG | 1 | 0.906 | 0.937 | 19.882 | -11.589 | -11.589 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | C | 330 | LYS | 1 | 0.932 | 0.957 | 22.069 | -12.414 | -12.414 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | C | 331 | THR | 0 | 0.044 | 0.024 | 16.502 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | C | 332 | CYS | 0 | -0.034 | -0.003 | 19.951 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | C | 333 | ALA | 0 | 0.041 | 0.013 | 21.849 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | C | 334 | ALA | 0 | -0.013 | -0.014 | 21.146 | -0.283 | -0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | C | 335 | GLN | 0 | -0.006 | -0.006 | 17.681 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | C | 336 | LEU | 0 | 0.000 | 0.006 | 21.544 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | C | 337 | VAL | 0 | 0.019 | -0.003 | 25.037 | -0.322 | -0.322 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | C | 338 | SER | 0 | -0.103 | -0.046 | 22.289 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | C | 339 | TYR | 0 | 0.004 | -0.002 | 23.867 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | C | 340 | PRO | 0 | 0.001 | 0.011 | 23.491 | -0.468 | -0.468 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | C | 341 | GLY | 0 | 0.046 | 0.000 | 26.585 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | C | 342 | LYS | 1 | 0.719 | 0.859 | 29.173 | -9.328 | -9.328 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | C | 343 | ASN | 0 | -0.025 | -0.018 | 31.343 | -0.554 | -0.554 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | C | 344 | LYS | 1 | 0.966 | 0.990 | 33.214 | -8.514 | -8.514 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | C | 345 | ILE | 0 | 0.052 | 0.028 | 30.693 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | C | 346 | PRO | 0 | 0.051 | 0.046 | 34.888 | 0.218 | 0.218 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | C | 347 | LEU | 0 | -0.032 | -0.021 | 28.482 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | C | 348 | ASN | 0 | -0.012 | -0.016 | 32.614 | 0.358 | 0.358 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | C | 349 | TYR | 0 | 0.047 | 0.013 | 34.170 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | C | 350 | HIS | 0 | 0.047 | 0.009 | 32.423 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | C | 351 | ILE | 0 | -0.009 | -0.003 | 28.868 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | C | 352 | VAL | 0 | 0.000 | -0.004 | 31.407 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | C | 353 | GLU | -1 | -0.712 | -0.828 | 34.321 | 7.999 | 7.999 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | C | 354 | VAL | 0 | 0.027 | 0.011 | 28.706 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | C | 355 | ILE | 0 | -0.026 | -0.020 | 29.073 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | C | 356 | PHE | 0 | -0.013 | -0.012 | 31.846 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | C | 357 | ALA | 0 | 0.008 | 0.019 | 33.114 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | C | 358 | GLU | -1 | -0.798 | -0.886 | 27.411 | 10.874 | 10.874 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | C | 359 | LEU | 0 | -0.057 | -0.017 | 32.098 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | C | 360 | PHE | 0 | 0.004 | -0.024 | 34.446 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | C | 361 | GLN | 0 | 0.011 | 0.009 | 30.935 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | C | 362 | LEU | 0 | -0.023 | 0.021 | 35.656 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | C | 363 | PRO | 0 | 0.038 | -0.001 | 35.429 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | C | 364 | ALA | 0 | -0.020 | -0.008 | 33.658 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | C | 365 | PRO | 0 | 0.041 | 0.043 | 31.443 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | C | 366 | PRO | 0 | -0.019 | -0.001 | 26.868 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | C | 367 | HIS | 1 | 0.836 | 0.923 | 24.105 | -11.090 | -11.090 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | C | 368 | ILE | 0 | 0.042 | 0.025 | 27.493 | -0.327 | -0.327 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | C | 369 | ASP | -1 | -0.795 | -0.918 | 29.761 | 9.091 | 9.091 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | C | 370 | VAL | 0 | -0.005 | -0.010 | 30.128 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | C | 371 | MET | 0 | -0.062 | 0.001 | 25.532 | 0.138 | 0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | C | 372 | TYR | 0 | 0.047 | -0.019 | 28.609 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | C | 373 | THR | 0 | 0.019 | 0.014 | 30.573 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | C | 374 | THR | 0 | -0.029 | -0.029 | 28.610 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | C | 375 | LEU | 0 | -0.016 | -0.011 | 25.296 | 0.237 | 0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | C | 376 | LEU | 0 | 0.052 | 0.028 | 28.325 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | C | 377 | ILE | 0 | 0.020 | 0.025 | 31.445 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | C | 378 | GLU | -1 | -0.837 | -0.901 | 26.127 | 11.201 | 11.201 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | C | 379 | LEU | 0 | 0.032 | 0.016 | 27.651 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | C | 380 | CYS | 0 | -0.051 | -0.018 | 29.943 | -0.199 | -0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | C | 381 | LYS | 1 | 0.812 | 0.898 | 29.916 | -10.381 | -10.381 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | C | 382 | LEU | 0 | -0.033 | 0.006 | 25.737 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | C | 383 | GLN | 0 | -0.010 | -0.007 | 29.653 | -0.170 | -0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | C | 384 | PRO | 0 | 0.026 | 0.009 | 32.795 | -0.293 | -0.293 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | C | 385 | GLY | 0 | 0.020 | 0.009 | 35.833 | -0.237 | -0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | C | 386 | SER | 0 | -0.003 | 0.017 | 35.033 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | C | 387 | LEU | 0 | 0.021 | 0.019 | 32.588 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | C | 388 | PRO | 0 | 0.011 | -0.011 | 35.792 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | C | 389 | GLN | 0 | 0.005 | -0.007 | 38.292 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | C | 390 | VAL | 0 | 0.039 | 0.036 | 37.358 | -0.119 | -0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | C | 391 | LEU | 0 | -0.005 | 0.000 | 35.578 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | C | 392 | ALA | 0 | -0.003 | 0.012 | 38.824 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | C | 393 | GLN | 0 | 0.014 | 0.014 | 42.398 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | C | 394 | ALA | 0 | -0.005 | -0.015 | 39.647 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | C | 395 | THR | 0 | -0.040 | -0.036 | 41.168 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | C | 396 | GLU | -1 | -0.813 | -0.910 | 43.033 | 6.241 | 6.241 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | C | 397 | MET | 0 | -0.062 | -0.026 | 44.101 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | C | 398 | LEU | 0 | -0.043 | -0.017 | 40.173 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | C | 399 | TYR | 0 | 0.003 | -0.043 | 44.816 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | C | 400 | MET | 0 | -0.037 | -0.008 | 47.936 | -0.177 | -0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | C | 401 | ARG | 1 | 0.858 | 0.938 | 44.793 | -6.915 | -6.915 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | C | 402 | LEU | 0 | -0.010 | -0.005 | 46.910 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | C | 403 | ASP | -1 | -0.901 | -0.953 | 49.295 | 5.853 | 5.853 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | C | 404 | THR | 0 | -0.042 | -0.021 | 50.299 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | C | 405 | MET | 0 | -0.025 | 0.006 | 42.486 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | C | 406 | ASN | 0 | 0.006 | 0.000 | 44.247 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | C | 407 | THR | 0 | 0.013 | -0.036 | 45.022 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | C | 408 | THR | 0 | -0.024 | -0.003 | 40.375 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | C | 409 | CYS | 0 | -0.057 | 0.006 | 40.077 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | C | 410 | VAL | 0 | 0.050 | 0.023 | 41.695 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | C | 411 | ASP | -1 | -0.747 | -0.851 | 42.331 | 6.972 | 6.972 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | C | 412 | ARG | 1 | 0.801 | 0.891 | 36.619 | -8.140 | -8.140 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | C | 413 | PHE | 0 | 0.029 | 0.026 | 39.307 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | C | 414 | ILE | 0 | 0.042 | 0.024 | 41.283 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | C | 415 | ASN | 0 | -0.059 | -0.022 | 38.844 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | C | 416 | TRP | 0 | 0.018 | 0.016 | 35.091 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | C | 417 | PHE | 0 | 0.029 | 0.017 | 38.279 | 0.115 | 0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | C | 418 | SER | 0 | 0.018 | -0.018 | 41.222 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | C | 419 | HIS | 0 | -0.001 | 0.001 | 33.526 | 0.051 | 0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | C | 420 | HIS | 0 | 0.025 | 0.018 | 37.230 | 0.257 | 0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | C | 421 | LEU | 0 | 0.025 | 0.012 | 38.404 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | C | 422 | SER | 0 | -0.055 | -0.029 | 39.378 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | C | 423 | ASN | 0 | -0.083 | -0.054 | 35.286 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | C | 424 | PHE | 0 | -0.070 | -0.029 | 35.675 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | C | 425 | GLN | 0 | 0.000 | 0.006 | 40.154 | -0.263 | -0.263 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | C | 426 | PHE | 0 | 0.028 | -0.002 | 43.634 | -0.179 | -0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | C | 427 | ARG | 1 | 0.869 | 0.941 | 41.571 | -7.495 | -7.495 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | C | 428 | TRP | 0 | 0.025 | 0.001 | 43.969 | 0.291 | 0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | C | 429 | SER | 0 | -0.009 | -0.006 | 47.890 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | C | 430 | TRP | 0 | 0.011 | -0.005 | 47.891 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | C | 431 | GLU | -1 | -0.868 | -0.940 | 52.556 | 5.778 | 5.778 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | C | 432 | ASP | -1 | -0.844 | -0.880 | 51.745 | 5.965 | 5.965 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | C | 433 | TRP | 0 | -0.074 | -0.047 | 46.343 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | C | 434 | SER | 0 | -0.002 | -0.036 | 54.001 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | C | 435 | ASP | -1 | -0.781 | -0.850 | 55.439 | 5.650 | 5.650 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | C | 436 | CYS | 0 | -0.048 | -0.019 | 55.164 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | C | 437 | LEU | 0 | -0.011 | -0.007 | 57.321 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | C | 438 | SER | 0 | -0.102 | -0.045 | 60.277 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | C | 439 | GLN | 0 | -0.002 | 0.020 | 56.718 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | C | 440 | ASP | -1 | -0.843 | -0.921 | 60.786 | 5.102 | 5.102 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | C | 441 | PRO | 0 | 0.049 | 0.009 | 59.314 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | C | 442 | GLU | -1 | -0.877 | -0.938 | 57.160 | 5.581 | 5.581 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | C | 443 | SER | 0 | -0.042 | -0.025 | 55.942 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | C | 444 | PRO | 0 | 0.003 | -0.010 | 51.221 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | C | 445 | LYS | 1 | 0.860 | 0.943 | 51.708 | -5.770 | -5.770 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | C | 446 | PRO | 0 | 0.008 | 0.014 | 52.673 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | C | 447 | LYS | 1 | 0.805 | 0.878 | 51.390 | -5.948 | -5.948 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | C | 448 | PHE | 0 | 0.009 | -0.001 | 44.824 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | C | 449 | VAL | 0 | 0.042 | 0.016 | 49.308 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | C | 450 | ARG | 1 | 0.876 | 0.938 | 51.004 | -5.579 | -5.579 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | C | 451 | GLU | -1 | -0.819 | -0.903 | 48.307 | 6.234 | 6.234 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | C | 452 | VAL | 0 | 0.004 | -0.001 | 45.426 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | C | 453 | LEU | 0 | 0.049 | 0.038 | 47.145 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | C | 454 | GLU | -1 | -0.805 | -0.893 | 49.443 | 6.305 | 6.305 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | C | 455 | LYS | 1 | 0.782 | 0.862 | 41.848 | -7.250 | -7.250 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | C | 456 | CYS | 0 | -0.038 | -0.026 | 44.968 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | C | 457 | MET | 0 | -0.019 | 0.010 | 46.192 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | C | 458 | ARG | 1 | 0.708 | 0.829 | 44.842 | -6.745 | -6.745 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | C | 459 | LEU | 0 | -0.058 | -0.012 | 40.337 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | C | 460 | SER | 0 | -0.042 | -0.028 | 43.857 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | C | 461 | TYR | 0 | 0.013 | 0.006 | 46.827 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | C | 462 | HIS | 0 | 0.017 | -0.007 | 50.612 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | C | 463 | GLN | 0 | -0.029 | -0.019 | 53.752 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | C | 464 | ARG | 1 | 0.897 | 0.956 | 46.480 | -6.674 | -6.674 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | C | 465 | ILE | 0 | -0.046 | -0.031 | 48.062 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | C | 466 | LEU | 0 | 0.000 | 0.000 | 51.880 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | C | 467 | ASP | -1 | -0.858 | -0.922 | 54.109 | 5.629 | 5.629 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | C | 468 | ILE | 0 | -0.100 | -0.040 | 48.960 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | C | 469 | VAL | 0 | -0.021 | 0.002 | 52.225 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | C | 470 | PRO | 0 | 0.061 | 0.035 | 54.578 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | C | 471 | PRO | 0 | 0.048 | 0.010 | 57.837 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | C | 472 | THR | 0 | -0.021 | 0.000 | 60.193 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | C | 473 | PHE | 0 | 0.067 | 0.023 | 54.938 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | C | 474 | SER | 0 | 0.002 | -0.010 | 57.346 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | C | 475 | ALA | 0 | -0.024 | -0.014 | 59.097 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | C | 476 | LEU | 0 | -0.053 | -0.028 | 55.388 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | C | 477 | CYS | 0 | -0.012 | 0.014 | 54.414 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | C | 478 | PRO | 0 | -0.031 | -0.007 | 51.677 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | C | 479 | SER | 0 | 0.046 | 0.009 | 54.751 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | C | 480 | ASN | 0 | 0.028 | 0.002 | 55.940 | 0.190 | 0.190 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | C | 481 | PRO | 0 | -0.002 | 0.014 | 52.909 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | C | 482 | THR | 0 | -0.047 | -0.032 | 55.826 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | C | 483 | CYS | 0 | -0.069 | -0.023 | 58.199 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | C | 484 | ILE | 0 | 0.005 | 0.016 | 59.434 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | C | 485 | TYR | 0 | 0.002 | -0.028 | 62.537 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | C | 486 | LYS | 1 | 0.806 | 0.871 | 65.132 | -4.809 | -4.809 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | C | 487 | TYR | 0 | -0.062 | -0.046 | 67.799 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | C | 488 | GLY | 0 | 0.037 | 0.023 | 68.551 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | C | 489 | ASP | -1 | -0.941 | -0.963 | 69.360 | 4.550 | 4.550 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | C | 490 | GLU | -1 | -0.974 | -0.973 | 69.852 | 4.538 | 4.538 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | C | 491 | SER | 0 | -0.072 | -0.032 | 71.673 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | C | 492 | SER | 0 | 0.025 | -0.011 | 73.590 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | C | 493 | ASN | 0 | 0.027 | -0.002 | 76.375 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | C | 494 | SER | 0 | -0.043 | 0.000 | 78.511 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | C | 495 | LEU | 0 | 0.022 | 0.014 | 73.021 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | C | 496 | PRO | 0 | 0.026 | 0.001 | 73.169 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | C | 497 | GLY | 0 | 0.049 | 0.025 | 72.665 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | C | 498 | HIS | 0 | 0.012 | 0.019 | 72.742 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | C | 499 | SER | 0 | 0.050 | 0.013 | 72.989 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | C | 500 | VAL | 0 | 0.037 | 0.023 | 71.103 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | C | 501 | ALA | 0 | 0.030 | 0.021 | 68.743 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | C | 502 | LEU | 0 | 0.026 | 0.011 | 68.836 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | C | 503 | CYS | 0 | -0.045 | -0.026 | 70.777 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | C | 504 | LEU | 0 | 0.009 | -0.002 | 66.239 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | C | 505 | ALA | 0 | -0.005 | -0.003 | 66.210 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | C | 506 | VAL | 0 | -0.029 | -0.016 | 66.781 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | C | 507 | ALA | 0 | 0.034 | 0.019 | 67.278 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | C | 508 | PHE | 0 | 0.012 | -0.013 | 61.980 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | C | 509 | LYS | 1 | 0.864 | 0.944 | 62.666 | -4.876 | -4.876 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | C | 510 | SER | 0 | -0.020 | -0.004 | 64.343 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | C | 511 | LYN | 0 | -0.021 | 0.019 | 58.007 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | C | 512 | ALA | 0 | 0.038 | 0.032 | 62.766 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | C | 513 | THR | 0 | -0.048 | -0.037 | 62.110 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | C | 514 | ASN | 0 | 0.014 | -0.031 | 58.411 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | C | 515 | ASP | -1 | -0.847 | -0.909 | 62.719 | 4.951 | 4.951 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | C | 516 | GLU | -1 | -0.851 | -0.923 | 66.113 | 4.729 | 4.729 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | C | 517 | ILE | 0 | -0.023 | -0.004 | 63.429 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | C | 518 | PHE | 0 | 0.001 | -0.010 | 62.221 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | C | 519 | SER | 0 | -0.046 | -0.030 | 67.341 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | C | 520 | ILE | 0 | -0.004 | 0.002 | 68.833 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | C | 521 | LEU | 0 | -0.015 | 0.001 | 65.413 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | C | 522 | LYS | 1 | 0.894 | 0.961 | 70.055 | -4.529 | -4.529 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | C | 523 | ASP | -1 | -0.883 | -0.930 | 73.239 | 4.219 | 4.219 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | C | 524 | VAL | 0 | -0.058 | -0.034 | 71.146 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | C | 525 | PRO | 0 | 0.026 | 0.022 | 74.353 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | C | 526 | ASN | 0 | 0.030 | 0.015 | 71.903 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | C | 538 | SER | 0 | 0.025 | 0.021 | 66.026 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | C | 539 | PHE | 0 | 0.039 | -0.009 | 64.824 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | C | 540 | ASN | 0 | -0.020 | -0.021 | 67.176 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | C | 541 | PRO | 0 | 0.036 | 0.033 | 66.777 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | C | 542 | LEU | 0 | 0.029 | 0.014 | 67.143 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | C | 543 | LYS | 1 | 0.844 | 0.906 | 67.872 | -4.432 | -4.432 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | C | 544 | ILE | 0 | 0.012 | 0.018 | 62.187 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | C | 545 | GLU | -1 | -0.842 | -0.907 | 63.996 | 4.819 | 4.819 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | C | 546 | VAL | 0 | -0.008 | -0.013 | 65.315 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | C | 547 | PHE | 0 | 0.017 | 0.009 | 59.647 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | C | 548 | VAL | 0 | -0.012 | -0.015 | 59.118 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | C | 549 | GLN | 0 | 0.043 | 0.014 | 61.027 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | C | 550 | THR | 0 | 0.008 | 0.013 | 62.839 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | C | 551 | LEU | 0 | -0.028 | 0.005 | 58.075 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | C | 552 | LEU | 0 | -0.037 | -0.019 | 55.678 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | C | 553 | HIS | 0 | 0.034 | 0.021 | 58.217 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | C | 554 | LEU | 0 | -0.050 | -0.024 | 60.258 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | C | 555 | ALA | 0 | -0.026 | -0.002 | 55.285 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | C | 556 | ALA | 0 | -0.007 | -0.007 | 54.971 | 0.147 | 0.147 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | C | 557 | LYS | 1 | 0.880 | 0.943 | 53.692 | -5.825 | -5.825 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | C | 558 | SER | 0 | 0.006 | -0.009 | 49.711 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | C | 559 | PHE | 0 | 0.079 | 0.029 | 45.658 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | C | 560 | SER | 0 | 0.041 | 0.018 | 46.043 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | C | 561 | HIS | 0 | 0.009 | 0.027 | 48.489 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | C | 562 | SER | 0 | 0.083 | 0.044 | 51.789 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | C | 563 | PHE | 0 | -0.024 | -0.025 | 44.841 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | C | 564 | SER | 0 | -0.026 | -0.025 | 49.896 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | C | 565 | ALA | 0 | 0.016 | 0.016 | 51.481 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | C | 566 | LEU | 0 | -0.022 | -0.021 | 50.848 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | C | 567 | ALA | 0 | -0.027 | -0.020 | 50.098 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | C | 568 | LYS | 1 | 0.826 | 0.901 | 52.152 | -5.749 | -5.749 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | C | 569 | PHE | 0 | 0.056 | 0.025 | 55.305 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | C | 570 | HIS | 0 | -0.040 | -0.017 | 51.571 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | C | 571 | GLU | -1 | -0.827 | -0.913 | 55.406 | 5.303 | 5.303 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | C | 572 | VAL | 0 | 0.011 | 0.015 | 58.111 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | C | 573 | PHE | 0 | 0.010 | -0.007 | 56.483 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | C | 574 | LYS | 1 | 0.846 | 0.913 | 52.740 | -5.927 | -5.927 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | C | 575 | THR | 0 | -0.011 | 0.005 | 57.597 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | C | 576 | LEU | 0 | -0.058 | -0.033 | 61.380 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | C | 577 | ALA | 0 | -0.042 | -0.019 | 57.746 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | C | 578 | GLU | -1 | -0.928 | -0.949 | 58.591 | 5.174 | 5.174 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | C | 579 | SER | 0 | -0.012 | -0.026 | 59.811 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | C | 580 | ASP | -1 | -0.850 | -0.928 | 58.621 | 5.449 | 5.449 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | C | 581 | GLU | -1 | -0.868 | -0.922 | 60.135 | 4.835 | 4.835 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | C | 582 | GLY | 0 | 0.036 | 0.012 | 61.951 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | C | 583 | LYS | 1 | 0.802 | 0.913 | 55.245 | -5.461 | -5.461 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | C | 584 | LEU | 0 | -0.017 | -0.010 | 57.824 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | C | 585 | HIS | 0 | -0.014 | 0.003 | 59.579 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | C | 586 | VAL | 0 | 0.012 | 0.006 | 56.750 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | C | 587 | LEU | 0 | -0.025 | -0.009 | 53.444 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | C | 588 | ARG | 1 | 0.878 | 0.918 | 57.294 | -4.984 | -4.984 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | C | 589 | VAL | 0 | 0.024 | 0.013 | 60.410 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | C | 590 | MET | 0 | -0.067 | -0.023 | 53.910 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | C | 591 | PHE | 0 | -0.023 | -0.027 | 55.686 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | C | 592 | GLU | -1 | -0.885 | -0.930 | 58.028 | 4.866 | 4.866 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | C | 593 | VAL | 0 | -0.023 | 0.001 | 58.735 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | C | 594 | TRP | 0 | 0.020 | -0.008 | 55.142 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | C | 595 | ARG | 1 | 0.884 | 0.944 | 55.899 | -5.147 | -5.147 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | C | 596 | ASN | 0 | -0.015 | -0.002 | 56.786 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | C | 597 | HIS | 0 | -0.011 | -0.014 | 49.801 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | C | 598 | PRO | 0 | 0.037 | 0.014 | 50.065 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | C | 599 | GLN | 0 | 0.000 | 0.000 | 44.355 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | C | 600 | MET | 0 | -0.015 | 0.010 | 47.877 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | C | 601 | ILE | 0 | 0.041 | 0.021 | 50.282 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | C | 602 | ALA | 0 | 0.005 | 0.002 | 46.072 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | C | 603 | VAL | 0 | -0.055 | -0.027 | 44.452 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | C | 604 | LEU | 0 | 0.039 | 0.015 | 46.779 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | C | 605 | VAL | 0 | 0.034 | 0.019 | 48.628 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | C | 606 | ASP | -1 | -0.807 | -0.861 | 42.991 | 7.410 | 7.410 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | C | 607 | LYS | 1 | 0.872 | 0.926 | 43.373 | -7.043 | -7.043 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | C | 608 | MET | 0 | 0.022 | 0.029 | 47.367 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | C | 609 | ILE | 0 | 0.035 | 0.027 | 45.790 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | C | 610 | ARG | 1 | 0.795 | 0.861 | 39.060 | -7.599 | -7.599 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | C | 611 | THR | 0 | -0.029 | -0.018 | 45.661 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | C | 612 | GLN | 0 | 0.007 | 0.004 | 46.517 | -0.180 | -0.180 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | C | 613 | ILE | 0 | -0.021 | 0.015 | 50.731 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | C | 614 | VAL | 0 | 0.017 | 0.000 | 51.336 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | C | 615 | ASP | -1 | -0.765 | -0.884 | 50.570 | 6.003 | 6.003 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | C | 616 | CYS | 0 | -0.008 | -0.028 | 45.988 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | C | 617 | ALA | 0 | 0.054 | 0.039 | 49.556 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | C | 618 | ALA | 0 | 0.016 | 0.014 | 52.538 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | C | 619 | VAL | 0 | -0.004 | -0.014 | 49.604 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | C | 620 | ALA | 0 | 0.004 | -0.001 | 50.773 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | C | 621 | ASN | 0 | -0.027 | -0.036 | 52.395 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | C | 622 | TRP | 0 | 0.028 | 0.012 | 51.738 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | C | 623 | ILE | 0 | -0.023 | 0.004 | 49.991 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | C | 624 | PHE | 0 | -0.010 | -0.003 | 51.884 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | C | 625 | SER | 0 | -0.033 | -0.013 | 56.748 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | C | 626 | SER | 0 | 0.024 | -0.018 | 59.833 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | C | 627 | GLU | -1 | -0.851 | -0.906 | 60.736 | 5.066 | 5.066 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | C | 628 | LEU | 0 | 0.034 | 0.011 | 54.522 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | C | 629 | SER | 0 | 0.006 | 0.021 | 57.855 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | C | 630 | ARG | 1 | 0.944 | 0.958 | 59.520 | -4.981 | -4.981 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | C | 631 | ASP | -1 | -0.818 | -0.896 | 55.602 | 5.502 | 5.502 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | C | 632 | PHE | 0 | -0.018 | 0.006 | 54.623 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | C | 633 | THR | 0 | 0.037 | 0.007 | 53.347 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | C | 634 | ARG | 1 | 0.809 | 0.917 | 51.921 | -5.720 | -5.720 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | C | 635 | LEU | 0 | 0.017 | 0.000 | 44.909 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | C | 636 | PHE | 0 | -0.003 | -0.006 | 47.500 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | C | 637 | VAL | 0 | 0.017 | 0.024 | 48.333 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | C | 638 | TRP | 0 | 0.040 | 0.004 | 46.687 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | C | 639 | GLU | -1 | -0.829 | -0.882 | 43.415 | 7.232 | 7.232 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | C | 640 | ILE | 0 | -0.009 | -0.001 | 44.108 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | C | 641 | LEU | 0 | 0.049 | 0.041 | 46.206 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | C | 642 | HIS | 0 | 0.053 | 0.006 | 41.625 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | C | 643 | SER | 0 | -0.069 | -0.035 | 41.476 | 0.210 | 0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | C | 644 | THR | 0 | -0.026 | -0.016 | 42.517 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | C | 645 | ILE | 0 | 0.028 | 0.020 | 41.943 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | C | 646 | ARG | 1 | 0.887 | 0.934 | 37.139 | -7.760 | -7.760 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | C | 647 | LYS | 1 | 0.772 | 0.897 | 39.031 | -7.015 | -7.015 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | C | 648 | MET | 0 | 0.046 | 0.048 | 41.035 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | C | 649 | ASN | 0 | -0.002 | -0.003 | 38.178 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | C | 650 | LYS | 1 | 0.895 | 0.948 | 33.332 | -8.712 | -8.712 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | C | 651 | HIS | 0 | -0.056 | -0.031 | 38.342 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | C | 652 | VAL | 0 | 0.019 | 0.007 | 38.150 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | C | 653 | GLY | 0 | 0.010 | 0.006 | 40.013 | -0.141 | -0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | C | 702 | ALA | 0 | 0.016 | 0.019 | 42.275 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | C | 703 | GLN | 0 | 0.018 | -0.001 | 40.320 | -0.191 | -0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | C | 704 | SER | 0 | 0.007 | 0.004 | 44.445 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | C | 705 | GLU | -1 | -0.822 | -0.905 | 46.933 | 6.454 | 6.454 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | C | 706 | GLN | 0 | 0.024 | -0.025 | 39.962 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | C | 707 | LYS | 1 | 0.879 | 0.953 | 45.605 | -6.391 | -6.391 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | C | 708 | ASN | 0 | -0.005 | -0.020 | 47.310 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | C | 709 | LEU | 0 | -0.006 | 0.014 | 46.014 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | C | 710 | PHE | 0 | -0.018 | -0.012 | 42.211 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | C | 711 | LEU | 0 | -0.005 | 0.005 | 48.187 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | C | 712 | VAL | 0 | 0.033 | 0.022 | 51.456 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | C | 713 | ILE | 0 | -0.010 | -0.012 | 48.167 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | C | 714 | PHE | 0 | 0.011 | -0.007 | 46.432 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | C | 715 | GLN | 0 | 0.025 | 0.016 | 52.258 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | C | 716 | ARG | 1 | 0.856 | 0.929 | 55.022 | -5.474 | -5.474 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | C | 717 | PHE | 0 | 0.033 | 0.005 | 49.692 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | C | 718 | ILE | 0 | 0.016 | 0.016 | 54.464 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | C | 719 | MET | 0 | -0.020 | 0.010 | 57.042 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | C | 720 | ILE | 0 | -0.013 | -0.010 | 55.974 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | C | 721 | LEU | 0 | -0.008 | -0.004 | 54.119 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | C | 722 | THR | 0 | 0.006 | -0.018 | 58.820 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | C | 723 | GLU | -1 | -0.854 | -0.882 | 61.669 | 4.767 | 4.767 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | C | 724 | HIS | 0 | 0.003 | -0.011 | 60.788 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | C | 725 | LEU | 0 | -0.048 | -0.019 | 58.836 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | C | 726 | VAL | 0 | 0.068 | 0.031 | 63.361 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | C | 727 | ARG | 1 | 0.806 | 0.899 | 64.279 | -4.857 | -4.857 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | C | 728 | CYS | 0 | -0.092 | -0.045 | 64.628 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | C | 729 | GLU | -1 | -0.978 | -0.980 | 66.912 | 4.571 | 4.571 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | C | 730 | THR | 0 | -0.069 | -0.042 | 68.757 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | C | 731 | ASP | -1 | -0.914 | -0.969 | 70.683 | 4.321 | 4.321 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | C | 732 | GLY | 0 | -0.024 | 0.006 | 70.723 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | C | 733 | THR | 0 | -0.068 | -0.036 | 66.596 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | C | 734 | SER | 0 | -0.033 | -0.028 | 63.453 | 0.061 | 0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | C | 735 | VAL | 0 | 0.068 | 0.019 | 59.629 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | C | 736 | LEU | 0 | -0.031 | -0.003 | 56.858 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | C | 737 | THR | 0 | 0.045 | 0.024 | 59.551 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | C | 738 | PRO | 0 | 0.039 | 0.015 | 56.477 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | C | 739 | TRP | 0 | 0.057 | 0.025 | 55.646 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | C | 740 | TYR | 0 | 0.039 | 0.016 | 55.846 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | C | 741 | LYS | 1 | 0.833 | 0.901 | 49.595 | -6.113 | -6.113 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | C | 742 | ASN | 0 | 0.015 | 0.006 | 51.230 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | C | 743 | CYS | 0 | -0.059 | -0.018 | 51.425 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | C | 744 | ILE | 0 | 0.031 | 0.011 | 51.916 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | C | 745 | GLU | -1 | -0.737 | -0.837 | 47.861 | 6.457 | 6.457 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | C | 746 | ARG | 1 | 0.746 | 0.848 | 45.486 | -6.420 | -6.420 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | C | 747 | LEU | 0 | 0.008 | 0.018 | 47.596 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | C | 748 | GLN | 0 | 0.036 | 0.013 | 44.091 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | C | 749 | GLN | 0 | -0.020 | -0.008 | 42.704 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | C | 750 | ILE | 0 | -0.055 | -0.018 | 42.792 | 0.211 | 0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | C | 751 | PHE | 0 | 0.039 | 0.006 | 42.905 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | C | 752 | LEU | 0 | -0.007 | 0.003 | 39.900 | 0.200 | 0.200 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | C | 753 | GLN | 0 | -0.045 | -0.017 | 38.342 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | C | 754 | HIS | 0 | -0.005 | -0.011 | 37.801 | 0.310 | 0.310 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | C | 755 | HIS | 0 | 0.019 | 0.005 | 34.808 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | C | 756 | GLN | 0 | 0.012 | -0.003 | 32.292 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | C | 757 | ILE | 0 | -0.032 | -0.008 | 37.224 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | C | 758 | ILE | 0 | -0.005 | 0.004 | 39.710 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | C | 759 | GLN | 0 | 0.037 | 0.019 | 38.934 | -0.309 | -0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | C | 760 | GLN | 0 | -0.038 | -0.011 | 39.884 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | C | 761 | TYR | 0 | -0.048 | -0.049 | 42.650 | -0.166 | -0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | C | 762 | MET | 0 | 0.055 | 0.047 | 44.491 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | C | 763 | VAL | 0 | 0.090 | 0.058 | 47.011 | -0.116 | -0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | C | 764 | THR | 0 | -0.030 | -0.016 | 49.591 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | C | 765 | LEU | 0 | -0.005 | 0.003 | 47.244 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | C | 766 | GLU | -1 | -0.881 | -0.957 | 49.616 | 6.045 | 6.045 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | C | 767 | ASN | 0 | -0.064 | -0.037 | 52.686 | -0.184 | -0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | C | 768 | LEU | 0 | -0.040 | -0.015 | 54.884 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | C | 769 | LEU | 0 | -0.072 | -0.031 | 52.452 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | C | 770 | PHE | 0 | -0.020 | -0.028 | 51.135 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | C | 771 | THR | 0 | 0.036 | -0.002 | 54.464 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | C | 772 | ALA | 0 | -0.034 | -0.038 | 57.177 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | C | 773 | GLU | -1 | -0.885 | -0.906 | 59.170 | 4.937 | 4.937 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | C | 774 | LEU | 0 | -0.053 | -0.007 | 55.672 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | C | 775 | ASP | -1 | -0.746 | -0.878 | 59.364 | 5.169 | 5.169 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | C | 776 | PRO | 0 | 0.026 | -0.001 | 57.624 | 0.114 | 0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | C | 777 | HIS | 1 | 0.851 | 0.915 | 55.889 | -5.145 | -5.145 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | C | 778 | ILE | 0 | 0.017 | 0.013 | 54.310 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | C | 779 | LEU | 0 | -0.011 | 0.007 | 53.107 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | C | 780 | ALA | 0 | 0.027 | 0.015 | 52.156 | 0.123 | 0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | C | 781 | VAL | 0 | -0.011 | 0.004 | 48.144 | 0.148 | 0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | C | 782 | PHE | 0 | 0.006 | 0.003 | 47.541 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | C | 783 | GLN | 0 | -0.001 | -0.010 | 47.722 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | C | 784 | GLN | 0 | -0.010 | -0.014 | 45.806 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | C | 785 | PHE | 0 | -0.001 | -0.012 | 41.231 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | C | 786 | CYS | 0 | 0.029 | 0.019 | 42.819 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | C | 787 | ALA | 0 | -0.006 | -0.013 | 43.151 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | C | 788 | LEU | 0 | -0.039 | -0.010 | 38.835 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | C | 789 | GLN | 0 | -0.060 | -0.059 | 35.225 | 0.336 | 0.336 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | C | 790 | ALA | 0 | 0.020 | 0.046 | 39.464 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |