FMODB ID: 3JY8L
Calculation Name: 4HZK-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 4HZK
Chain ID: A
UniProt ID: G0RZB7
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 | 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 | 1038 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -30240481.271877 |
---|---|
FMO2-HF: Nuclear repulsion | 29814902.563222 |
FMO2-HF: Total energy | -425578.708655 |
FMO2-MP2: Total energy | -426794.394671 |
3D Structure
Ligand structure
Ligand Interaction
Ligand binding energy
"IFIE [kcal/mol] | PIEDA [kcal/mol] | Charge transfer value [e] | |||
---|---|---|---|---|---|
IFIE SUMIFIE SUM at MP2 level. | ESElectro static interaction energy. | EXExchange-repulsion energy. | CT+mixCharge transfer and mixing terms energy. | DI(MP2)Dispersion energy. | q(I=>J)Charge transfer value from I to J fragments. |
N/A | N/A | N/A | N/A | N/A | N/A |
Interactive mode: IFIE and PIEDA for fragment #1(A:35:GLU)
Summations of interaction energy for
fragment #1(A:35:GLU)
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. |
45.053 | 45.508 | 15.431 | -8.064 | -7.822 | 0.083 |
Interaction energy analysis for fragmet #1(A:35:GLU)
frag_NumFragment number. | ChainChain species. | Res #Residue number. | RES3-letter code of amino acid residue, ligand and solvent molecule. | FCHARGEFormal charge [e]. | q_MullikenFragment charge evaluated by Mulliken charge [e]. | q_NPAFragment charge evaluated by natural population analysis(NPA) charge [e]. | DISTDistance from Ligand [Å]. | TotalIFIE at MP2 level [kcal/mol]. | ESElectro static interaction energy by PIEDA [kcal/mol]. | EXExchange-repulsion energy by PIEDA [kcal/mol]. | CT+mixCharge transfer and mixing terms energy by PIEDA [kcal/mol]. | DI(MP2)Dispersion energy by PIEDA [kcal/mol]. | q(I=>J)Charge transfer value from I to J fragmens [e]. |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3 | A | 37 | PRO | 0 | 0.007 | 0.020 | 2.234 | -5.599 | -2.985 | 1.391 | -1.349 | -2.656 | -0.001 |
4 | A | 38 | ASP | -1 | -0.886 | -0.966 | 5.138 | 25.804 | 25.804 | 0.000 | 0.000 | 0.000 | 0.000 |
5 | A | 39 | ALA | 0 | -0.028 | -0.011 | 6.825 | -2.451 | -2.451 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 40 | TRP | 0 | -0.018 | -0.014 | 6.746 | -2.037 | -2.037 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 41 | LEU | 0 | 0.027 | 0.025 | 10.068 | -1.172 | -1.172 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 42 | MET | 0 | -0.039 | -0.010 | 10.864 | -1.943 | -1.943 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 43 | VAL | 0 | -0.076 | -0.045 | 12.578 | -1.245 | -1.245 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 44 | ASP | -1 | -0.870 | -0.925 | 14.846 | 14.892 | 14.892 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 45 | GLU | -1 | -0.952 | -0.976 | 15.124 | 15.183 | 15.183 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 46 | ILE | 0 | -0.034 | -0.005 | 15.123 | -0.749 | -0.749 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 47 | LEU | 0 | -0.050 | 0.010 | 17.322 | -0.704 | -0.704 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 48 | SER | 0 | 0.002 | -0.008 | 20.094 | -0.660 | -0.660 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 49 | ARG | 1 | 0.861 | 0.914 | 22.076 | -11.930 | -11.930 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 50 | ALA | 0 | 0.039 | 0.009 | 24.756 | -0.410 | -0.410 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 51 | THR | 0 | 0.004 | -0.007 | 24.576 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 52 | TYR | 0 | -0.004 | -0.010 | 21.655 | 0.259 | 0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 53 | GLU | -1 | -0.817 | -0.909 | 18.674 | 13.439 | 13.439 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 54 | GLN | 0 | 0.036 | 0.018 | 17.840 | 0.323 | 0.323 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 55 | THR | 0 | 0.030 | 0.000 | 14.222 | 0.473 | 0.473 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 56 | LYS | 1 | 0.960 | 0.986 | 12.743 | -13.187 | -13.187 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 57 | PHE | 0 | -0.005 | 0.001 | 12.680 | 1.040 | 1.040 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 58 | LEU | 0 | -0.034 | -0.017 | 13.144 | 0.574 | 0.574 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 59 | ALA | 0 | 0.024 | 0.014 | 8.736 | 1.196 | 1.196 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 60 | LEU | 0 | 0.007 | 0.006 | 8.711 | 1.968 | 1.968 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 61 | GLN | 0 | -0.022 | -0.009 | 10.758 | -0.405 | -0.405 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 62 | VAL | 0 | -0.016 | -0.008 | 6.051 | 0.452 | 0.452 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 63 | LEU | 0 | 0.043 | 0.023 | 6.615 | 2.227 | 2.227 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 64 | ASP | -1 | -0.839 | -0.909 | 7.636 | 23.115 | 23.115 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 65 | ASN | 0 | 0.034 | 0.008 | 10.251 | -0.480 | -0.480 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 66 | VAL | 0 | -0.012 | 0.021 | 4.636 | 0.938 | 1.082 | -0.001 | -0.010 | -0.133 | 0.000 |
33 | A | 67 | ILE | 0 | -0.021 | -0.001 | 7.748 | 1.752 | 1.752 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 68 | MET | 0 | -0.036 | -0.013 | 9.261 | -1.272 | -1.272 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 69 | THR | 0 | -0.083 | -0.050 | 8.185 | -0.965 | -0.965 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 70 | ARG | 1 | 0.794 | 0.872 | 1.696 | -101.143 | -104.268 | 14.040 | -6.480 | -4.434 | 0.083 |
37 | A | 71 | TRP | 0 | 0.067 | 0.026 | 8.023 | 0.775 | 0.775 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 72 | LYS | 1 | 0.918 | 0.944 | 9.687 | -21.777 | -21.777 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 73 | VAL | 0 | 0.005 | 0.009 | 4.399 | -2.370 | -2.199 | -0.001 | -0.021 | -0.149 | 0.000 |
40 | A | 74 | LEU | 0 | 0.021 | 0.024 | 4.440 | 1.434 | 1.629 | -0.001 | -0.015 | -0.179 | 0.000 |
41 | A | 75 | PRO | 0 | 0.043 | 0.038 | 6.111 | -5.741 | -5.741 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 76 | ARG | 1 | 0.884 | 0.884 | 9.037 | -21.112 | -21.112 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 77 | GLU | -1 | -0.887 | -0.941 | 11.676 | 21.256 | 21.256 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 78 | GLN | 0 | 0.061 | 0.025 | 3.703 | -3.618 | -3.162 | 0.003 | -0.189 | -0.271 | 0.001 |
45 | A | 79 | CYS | 0 | -0.014 | 0.040 | 9.174 | -0.758 | -0.758 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 80 | GLN | 0 | -0.002 | -0.015 | 10.576 | -0.897 | -0.897 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 81 | GLY | 0 | 0.024 | 0.014 | 11.567 | -1.315 | -1.315 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 82 | ILE | 0 | -0.001 | 0.003 | 6.573 | -1.310 | -1.310 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 83 | ARG | 1 | 0.914 | 0.961 | 10.352 | -18.660 | -18.660 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 84 | ASN | 0 | -0.025 | -0.004 | 13.740 | -1.192 | -1.192 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 85 | PHE | 0 | 0.046 | 0.019 | 9.870 | -0.840 | -0.840 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 86 | VAL | 0 | 0.021 | 0.016 | 12.712 | -0.986 | -0.986 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 87 | VAL | 0 | 0.004 | -0.002 | 14.449 | -1.059 | -1.059 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 88 | GLN | 0 | -0.044 | -0.028 | 17.247 | -1.178 | -1.178 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 89 | TYR | 0 | -0.045 | -0.032 | 14.951 | -0.493 | -0.493 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 90 | ILE | 0 | -0.045 | -0.016 | 17.857 | -0.679 | -0.679 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 91 | LEU | 0 | -0.025 | -0.014 | 20.051 | -0.712 | -0.712 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 92 | GLN | 0 | -0.022 | 0.018 | 19.941 | -0.749 | -0.749 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 93 | CYS | 0 | -0.001 | -0.004 | 22.342 | -0.325 | -0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 94 | SER | 0 | -0.048 | -0.039 | 24.435 | -0.547 | -0.547 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 95 | SER | 0 | 0.012 | -0.014 | 26.629 | -0.282 | -0.282 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 96 | SER | 0 | -0.022 | 0.023 | 29.316 | -0.338 | -0.338 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 97 | GLU | -1 | -0.732 | -0.856 | 29.986 | 9.000 | 9.000 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 98 | GLU | -1 | -0.872 | -0.947 | 31.497 | 8.904 | 8.904 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 99 | SER | 0 | 0.001 | 0.004 | 26.855 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 100 | LEU | 0 | -0.015 | 0.009 | 26.692 | 0.390 | 0.390 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 101 | ARG | 1 | 0.805 | 0.888 | 27.385 | -8.773 | -8.773 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 102 | THR | 0 | -0.053 | -0.034 | 26.821 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 103 | HIS | 0 | -0.019 | -0.010 | 22.839 | 0.142 | 0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 104 | ARG | 1 | 1.021 | 1.014 | 23.305 | -9.709 | -9.709 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 105 | THR | 0 | 0.007 | -0.007 | 21.190 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 106 | LEU | 0 | 0.027 | 0.018 | 17.057 | 0.514 | 0.514 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 107 | LEU | 0 | 0.023 | 0.009 | 18.910 | 0.697 | 0.697 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 108 | ASN | 0 | -0.018 | -0.002 | 20.700 | 0.325 | 0.325 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 109 | LYS | 1 | 0.913 | 0.946 | 16.281 | -15.912 | -15.912 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 110 | LEU | 0 | 0.010 | 0.012 | 14.989 | 0.903 | 0.903 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 111 | ASN | 0 | 0.004 | -0.015 | 17.013 | 0.923 | 0.923 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 112 | LEU | 0 | -0.014 | -0.004 | 17.880 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 113 | VAL | 0 | 0.048 | 0.029 | 11.904 | 0.485 | 0.485 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 114 | LEU | 0 | -0.029 | -0.005 | 14.726 | 0.839 | 0.839 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 115 | VAL | 0 | 0.014 | -0.007 | 16.627 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 116 | SER | 0 | -0.035 | -0.022 | 14.655 | -0.612 | -0.612 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 117 | VAL | 0 | -0.045 | -0.021 | 11.770 | 0.641 | 0.641 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 118 | LEU | 0 | -0.048 | -0.020 | 14.499 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 119 | LYS | 1 | 0.892 | 0.933 | 18.099 | -14.961 | -14.961 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 120 | GLN | 0 | -0.026 | -0.011 | 13.835 | -0.493 | -0.493 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 121 | GLU | -1 | -0.860 | -0.936 | 15.413 | 19.852 | 19.852 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 122 | TRP | 0 | -0.039 | -0.032 | 17.386 | -0.581 | -0.581 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 123 | PRO | 0 | -0.016 | -0.001 | 20.331 | -0.628 | -0.628 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 124 | HIS | 0 | -0.077 | -0.012 | 18.051 | -0.877 | -0.877 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 125 | ASN | 0 | -0.018 | -0.036 | 21.114 | -1.017 | -1.017 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 126 | TRP | 0 | -0.056 | -0.032 | 17.444 | 0.929 | 0.929 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 127 | PRO | 0 | 0.087 | 0.065 | 23.072 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 128 | THR | 0 | -0.047 | -0.061 | 24.043 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 129 | PHE | 0 | 0.040 | 0.035 | 22.122 | -0.291 | -0.291 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 130 | ILE | 0 | 0.071 | 0.034 | 24.392 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 131 | ASN | 0 | 0.022 | 0.000 | 27.690 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 132 | GLU | -1 | -0.838 | -0.907 | 23.015 | 12.996 | 12.996 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 133 | ILE | 0 | 0.020 | 0.009 | 24.321 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 134 | VAL | 0 | -0.026 | -0.011 | 27.772 | -0.294 | -0.294 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 135 | SER | 0 | -0.045 | -0.035 | 29.801 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 136 | ALA | 0 | -0.017 | 0.007 | 27.281 | -0.138 | -0.138 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 137 | CYS | 0 | -0.032 | 0.011 | 29.317 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 138 | HIS | 0 | -0.027 | -0.002 | 31.887 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 139 | SER | 0 | -0.058 | -0.052 | 30.476 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 140 | SER | 0 | -0.008 | -0.011 | 31.409 | -0.266 | -0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 141 | LEU | 0 | 0.054 | 0.027 | 32.783 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 142 | SER | 0 | 0.042 | 0.013 | 29.898 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 143 | VAL | 0 | -0.011 | 0.003 | 26.843 | 0.292 | 0.292 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 144 | CYS | 0 | 0.021 | 0.023 | 28.452 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 145 | GLU | -1 | -0.860 | -0.910 | 30.492 | 9.599 | 9.599 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 146 | ASN | 0 | 0.008 | -0.002 | 22.895 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 147 | ASN | 0 | 0.018 | -0.003 | 25.763 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 148 | MET | 0 | 0.023 | 0.022 | 27.324 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 149 | ILE | 0 | -0.031 | -0.020 | 25.520 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 150 | ILE | 0 | -0.004 | -0.002 | 22.354 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 151 | LEU | 0 | -0.008 | 0.002 | 24.856 | 0.238 | 0.238 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 152 | ARG | 1 | 0.838 | 0.875 | 27.318 | -10.931 | -10.931 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 153 | LEU | 0 | -0.026 | -0.009 | 22.798 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 154 | LEU | 0 | 0.016 | 0.016 | 22.525 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 155 | SER | 0 | -0.016 | -0.015 | 24.555 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 156 | GLU | -1 | -0.759 | -0.843 | 27.277 | 10.517 | 10.517 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 157 | GLU | -1 | -0.861 | -0.909 | 21.821 | 14.238 | 14.238 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 158 | VAL | 0 | -0.039 | -0.023 | 24.898 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 159 | PHE | 0 | -0.009 | -0.021 | 26.882 | -0.243 | -0.243 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 160 | ASP | -1 | -0.912 | -0.942 | 28.021 | 10.655 | 10.655 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 161 | TYR | 0 | -0.004 | 0.012 | 26.571 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 162 | SER | 0 | -0.089 | -0.077 | 28.717 | -0.235 | -0.235 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 163 | ALA | 0 | -0.001 | 0.001 | 31.663 | -0.335 | -0.335 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 164 | ASP | -1 | -0.827 | -0.898 | 32.163 | 9.537 | 9.537 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 165 | GLN | 0 | -0.094 | -0.041 | 31.106 | -0.444 | -0.444 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 166 | MET | 0 | -0.013 | -0.003 | 35.419 | -0.215 | -0.215 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 167 | THR | 0 | -0.069 | -0.034 | 36.955 | -0.248 | -0.248 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 168 | SER | 0 | 0.038 | 0.021 | 38.529 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 169 | THR | 0 | 0.012 | -0.001 | 38.435 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 170 | LYS | 1 | 0.934 | 0.962 | 33.379 | -9.487 | -9.487 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 171 | THR | 0 | 0.096 | 0.044 | 34.495 | 0.076 | 0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 172 | ARG | 1 | 0.935 | 0.976 | 35.650 | -7.753 | -7.753 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 173 | ASN | 0 | 0.007 | 0.013 | 35.757 | -0.206 | -0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 174 | LEU | 0 | 0.022 | 0.021 | 30.262 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 175 | LYS | 1 | 0.825 | 0.910 | 33.646 | -7.999 | -7.999 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 176 | SER | 0 | -0.048 | -0.040 | 36.081 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 177 | THR | 0 | -0.074 | -0.051 | 33.103 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 178 | MET | 0 | 0.008 | 0.029 | 30.027 | 0.175 | 0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 179 | CYS | 0 | 0.024 | 0.019 | 33.314 | -0.130 | -0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 180 | ALA | 0 | -0.015 | -0.006 | 35.334 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 181 | GLU | -1 | -0.879 | -0.952 | 29.536 | 10.724 | 10.724 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 182 | PHE | 0 | 0.022 | -0.009 | 30.924 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 183 | SER | 0 | -0.024 | -0.006 | 34.968 | -0.238 | -0.238 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 184 | MET | 0 | -0.011 | 0.002 | 33.864 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 185 | ILE | 0 | 0.026 | 0.005 | 30.693 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 186 | PHE | 0 | 0.009 | 0.008 | 34.655 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 187 | GLN | 0 | -0.004 | -0.011 | 38.273 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 188 | LEU | 0 | -0.020 | 0.001 | 32.158 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 189 | CYS | 0 | 0.001 | -0.006 | 35.331 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 190 | GLN | 0 | -0.052 | -0.022 | 37.585 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 191 | GLU | -1 | -0.805 | -0.899 | 40.093 | 7.046 | 7.046 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 192 | ILE | 0 | -0.035 | -0.014 | 34.622 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 193 | LEU | 0 | -0.057 | -0.027 | 39.033 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 194 | ASN | 0 | -0.069 | -0.042 | 41.442 | -0.201 | -0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 195 | SER | 0 | -0.060 | -0.031 | 40.811 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 196 | ALA | 0 | -0.033 | 0.002 | 39.579 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 197 | THR | 0 | -0.011 | -0.022 | 41.161 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 198 | GLN | 0 | -0.001 | -0.011 | 36.682 | -0.322 | -0.322 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 199 | PRO | 0 | 0.051 | 0.019 | 39.319 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 200 | SER | 0 | -0.039 | -0.049 | 34.071 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 201 | LEU | 0 | 0.037 | 0.026 | 34.139 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 202 | ILE | 0 | 0.007 | 0.026 | 36.159 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 203 | LYS | 1 | 0.887 | 0.954 | 36.375 | -8.335 | -8.335 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 204 | ALA | 0 | 0.020 | 0.008 | 32.172 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 205 | THR | 0 | 0.019 | -0.012 | 33.979 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 206 | LEU | 0 | 0.011 | 0.017 | 35.784 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 207 | GLU | -1 | -0.862 | -0.920 | 33.677 | 8.834 | 8.834 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 208 | THR | 0 | -0.031 | -0.032 | 30.920 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 209 | LEU | 0 | 0.008 | -0.008 | 33.517 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 210 | LEU | 0 | 0.033 | 0.012 | 36.590 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 211 | ARG | 1 | 0.792 | 0.879 | 31.082 | -9.570 | -9.570 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 212 | PHE | 0 | -0.021 | -0.019 | 29.195 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 213 | CYS | 0 | -0.041 | -0.012 | 34.988 | -0.183 | -0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 214 | ASN | 0 | -0.026 | -0.029 | 37.593 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 215 | TRP | 0 | 0.006 | 0.014 | 31.769 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 216 | ILE | 0 | 0.036 | 0.030 | 36.678 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 217 | PRO | 0 | 0.005 | -0.005 | 38.512 | -0.177 | -0.177 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 218 | LEU | 0 | 0.041 | 0.015 | 41.554 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 219 | GLY | 0 | 0.052 | 0.030 | 44.689 | -0.103 | -0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 220 | TYR | 0 | -0.027 | -0.007 | 40.577 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 221 | ILE | 0 | 0.011 | 0.013 | 41.510 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 222 | PHE | 0 | -0.053 | -0.034 | 44.930 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 223 | GLU | -1 | -0.949 | -0.964 | 48.533 | 6.409 | 6.409 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 224 | THR | 0 | -0.032 | -0.012 | 45.157 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 225 | PRO | 0 | 0.038 | 0.025 | 48.151 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 226 | LEU | 0 | 0.028 | 0.003 | 42.797 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 227 | ILE | 0 | 0.052 | 0.026 | 46.614 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 228 | ASP | -1 | -0.830 | -0.906 | 48.800 | 5.966 | 5.966 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 229 | THR | 0 | -0.032 | -0.001 | 46.302 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 230 | LEU | 0 | 0.005 | -0.004 | 43.020 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 231 | ARG | 1 | 0.892 | 0.938 | 47.016 | -5.798 | -5.798 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 232 | THR | 0 | -0.064 | -0.057 | 50.481 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 233 | ARG | 1 | 0.919 | 0.972 | 44.555 | -6.935 | -6.935 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 234 | PHE | 0 | -0.052 | -0.027 | 43.768 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 235 | LEU | 0 | 0.038 | 0.027 | 46.900 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 236 | GLU | -1 | -0.878 | -0.947 | 48.813 | 5.788 | 5.788 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 237 | VAL | 0 | -0.048 | -0.015 | 46.058 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 238 | PRO | 0 | 0.007 | -0.019 | 47.195 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 239 | GLU | -1 | -0.951 | -0.968 | 42.618 | 7.264 | 7.264 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 240 | PHE | 0 | -0.005 | -0.017 | 41.321 | 0.175 | 0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 241 | ARG | 1 | 0.905 | 1.016 | 43.576 | -6.268 | -6.268 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 242 | ASN | 0 | 0.007 | -0.004 | 42.812 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 243 | VAL | 0 | 0.066 | 0.030 | 38.476 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 244 | THR | 0 | -0.014 | -0.019 | 41.508 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 245 | LEU | 0 | 0.005 | 0.000 | 44.070 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 246 | GLN | 0 | -0.022 | -0.003 | 39.870 | 0.110 | 0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 247 | CYS | 0 | -0.026 | -0.005 | 40.669 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 248 | LEU | 0 | -0.032 | -0.022 | 42.456 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 249 | THR | 0 | -0.018 | -0.017 | 44.644 | -0.155 | -0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 250 | GLU | -1 | -0.849 | -0.912 | 39.979 | 7.865 | 7.865 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 251 | ILE | 0 | -0.050 | -0.034 | 43.424 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 252 | GLY | 0 | -0.015 | -0.004 | 45.379 | -0.098 | -0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 253 | GLY | 0 | 0.013 | 0.000 | 46.050 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 254 | LEU | 0 | -0.037 | -0.004 | 41.747 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 255 | GLN | 0 | -0.004 | -0.005 | 45.515 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 256 | THR | 0 | -0.014 | -0.006 | 46.888 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 257 | GLY | 0 | -0.028 | -0.020 | 48.237 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 258 | GLY | 0 | 0.019 | -0.003 | 49.638 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 259 | PRO | 0 | -0.026 | -0.014 | 51.621 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 260 | GLY | 0 | 0.058 | 0.016 | 54.791 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 261 | GLN | 0 | -0.075 | -0.022 | 49.872 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 262 | PRO | 0 | -0.042 | 0.010 | 48.804 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 263 | HIS | 0 | 0.079 | 0.032 | 50.259 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 264 | THR | 0 | -0.023 | -0.006 | 52.985 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 265 | TYR | 0 | -0.013 | -0.039 | 49.330 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 266 | ASP | -1 | -0.844 | -0.921 | 53.721 | 5.635 | 5.635 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 267 | GLU | -1 | -0.892 | -0.952 | 56.321 | 5.472 | 5.472 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 268 | GLN | 0 | -0.023 | -0.015 | 52.973 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 269 | LEU | 0 | 0.000 | 0.002 | 50.193 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 270 | ILE | 0 | 0.002 | 0.003 | 53.898 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 271 | LYS | 1 | 0.870 | 0.939 | 54.536 | -5.881 | -5.881 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 272 | MET | 0 | -0.045 | -0.018 | 49.130 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 273 | PHE | 0 | 0.020 | 0.005 | 53.948 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 274 | THR | 0 | 0.023 | 0.010 | 55.354 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 275 | GLU | -1 | -0.879 | -0.930 | 55.607 | 5.456 | 5.456 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 276 | VAL | 0 | -0.002 | -0.001 | 51.552 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 277 | LEU | 0 | -0.001 | 0.011 | 54.535 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 278 | THR | 0 | -0.026 | -0.027 | 57.192 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 279 | THR | 0 | -0.048 | -0.038 | 53.859 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 280 | ILE | 0 | 0.008 | -0.001 | 52.829 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 281 | SER | 0 | -0.039 | -0.016 | 56.094 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 282 | ASN | 0 | -0.052 | -0.024 | 58.310 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 283 | ILE | 0 | -0.070 | -0.020 | 52.603 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 284 | ILE | 0 | -0.038 | -0.017 | 54.355 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 285 | PRO | 0 | 0.026 | 0.017 | 58.245 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 286 | LEU | 0 | 0.027 | 0.015 | 61.793 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 287 | GLN | 0 | 0.014 | -0.014 | 64.227 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 288 | MET | 0 | -0.025 | 0.012 | 58.005 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 289 | ASP | -1 | -0.781 | -0.895 | 62.024 | 5.224 | 5.224 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 290 | LEU | 0 | 0.012 | 0.002 | 56.152 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 291 | LYS | 1 | 0.966 | 0.997 | 57.347 | -5.133 | -5.133 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 292 | ALA | 0 | -0.028 | -0.023 | 58.140 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 293 | THR | 0 | -0.041 | -0.037 | 55.886 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 294 | TYR | 0 | -0.019 | -0.026 | 49.251 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 295 | PRO | 0 | 0.024 | 0.008 | 52.550 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 296 | ASN | 0 | -0.065 | -0.009 | 52.568 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 297 | SER | 0 | -0.016 | -0.013 | 50.773 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 298 | ASN | 0 | -0.088 | -0.039 | 46.175 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 299 | SER | 0 | 0.095 | 0.025 | 41.938 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 300 | ARG | 1 | 0.935 | 0.958 | 43.288 | -6.671 | -6.671 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 301 | ASP | -1 | -0.812 | -0.900 | 44.482 | 6.465 | 6.465 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 302 | GLN | 0 | -0.010 | 0.007 | 46.679 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 303 | GLU | -1 | -0.835 | -0.907 | 41.028 | 7.686 | 7.686 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 304 | PHE | 0 | -0.006 | -0.007 | 44.976 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 305 | ILE | 0 | 0.003 | -0.005 | 47.172 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 306 | GLN | 0 | 0.017 | 0.016 | 44.170 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 307 | ASN | 0 | -0.043 | -0.041 | 43.009 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 308 | LEU | 0 | 0.005 | 0.015 | 46.546 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 309 | ALA | 0 | 0.030 | 0.012 | 50.008 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 310 | LEU | 0 | 0.037 | 0.031 | 44.149 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 311 | PHE | 0 | -0.015 | 0.017 | 48.278 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 312 | LEU | 0 | -0.030 | -0.020 | 49.362 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 313 | THR | 0 | -0.019 | -0.028 | 50.572 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 314 | SER | 0 | 0.005 | 0.012 | 47.570 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 315 | PHE | 0 | 0.009 | -0.004 | 49.739 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 316 | PHE | 0 | -0.027 | -0.015 | 51.964 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 317 | THR | 0 | -0.030 | -0.036 | 51.072 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 318 | MET | 0 | -0.063 | -0.016 | 48.773 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 319 | HIS | 1 | 0.801 | 0.888 | 49.831 | -6.444 | -6.444 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 320 | LEU | 0 | 0.091 | 0.064 | 54.973 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 321 | PRO | 0 | 0.005 | -0.017 | 58.174 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 322 | LEU | 0 | -0.009 | 0.007 | 56.083 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 323 | ILE | 0 | 0.040 | 0.013 | 57.348 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 324 | GLU | -1 | -0.794 | -0.831 | 61.457 | 5.004 | 5.004 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 325 | ASN | 0 | -0.038 | -0.028 | 63.808 | -0.149 | -0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 326 | LEU | 0 | -0.019 | 0.010 | 61.287 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 327 | PRO | 0 | -0.024 | -0.014 | 65.573 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 328 | ASN | 0 | -0.024 | -0.017 | 66.491 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 329 | ARG | 1 | 0.909 | 0.965 | 66.572 | -4.816 | -4.816 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 330 | ASP | -1 | -0.815 | -0.911 | 66.301 | 4.783 | 4.783 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 331 | PHE | 0 | 0.012 | -0.007 | 61.023 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 332 | LEU | 0 | 0.014 | 0.021 | 61.230 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 333 | THR | 0 | 0.042 | 0.021 | 62.224 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 334 | HIS | 0 | 0.016 | 0.007 | 62.343 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 335 | GLY | 0 | 0.020 | 0.013 | 59.125 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 336 | HIS | 0 | 0.000 | -0.006 | 59.035 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 337 | PHE | 0 | 0.030 | 0.014 | 61.013 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 338 | TYR | 0 | -0.009 | -0.007 | 57.342 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 339 | LEU | 0 | 0.007 | 0.010 | 54.637 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 340 | ILE | 0 | -0.016 | 0.017 | 57.904 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 341 | ARG | 1 | 0.853 | 0.927 | 59.725 | -5.254 | -5.254 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 342 | ILE | 0 | 0.005 | -0.012 | 53.342 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 343 | SER | 0 | -0.024 | -0.034 | 55.803 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 344 | GLN | 0 | -0.029 | -0.015 | 57.351 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 345 | ILE | 0 | -0.062 | -0.015 | 53.365 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 346 | ASP | -1 | -0.928 | -0.955 | 55.530 | 5.735 | 5.735 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 347 | ASP | -1 | -0.805 | -0.890 | 49.031 | 6.678 | 6.678 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 348 | ARG | 1 | 0.887 | 0.916 | 44.326 | -7.080 | -7.080 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 349 | GLU | -1 | -0.824 | -0.895 | 44.036 | 7.346 | 7.346 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 350 | ILE | 0 | 0.023 | 0.006 | 48.201 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 351 | PHE | 0 | 0.017 | 0.002 | 50.334 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 352 | LYS | 1 | 0.872 | 0.923 | 48.898 | -6.538 | -6.538 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 353 | ILE | 0 | 0.018 | 0.006 | 46.606 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 354 | CYS | 0 | -0.043 | -0.017 | 50.663 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 355 | LEU | 0 | -0.014 | 0.006 | 54.229 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 356 | ASP | -1 | -0.829 | -0.897 | 50.290 | 6.343 | 6.343 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 357 | TYR | 0 | -0.054 | -0.051 | 53.472 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 358 | TRP | 0 | 0.016 | -0.016 | 54.831 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 359 | LEU | 0 | 0.042 | 0.013 | 55.456 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 360 | LYS | 1 | 0.913 | 0.956 | 51.034 | -6.371 | -6.371 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 361 | LEU | 0 | 0.006 | 0.020 | 57.046 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 362 | VAL | 0 | -0.028 | -0.029 | 59.797 | -0.101 | -0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 363 | GLN | 0 | -0.033 | -0.019 | 58.458 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 364 | GLU | -1 | -0.843 | -0.894 | 58.754 | 5.433 | 5.433 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 365 | LEU | 0 | -0.053 | -0.032 | 61.691 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 366 | TYR | 0 | 0.004 | -0.001 | 64.903 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 367 | GLU | -1 | -0.878 | -0.942 | 61.744 | 5.253 | 5.253 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 368 | GLU | -1 | -0.815 | -0.895 | 65.628 | 4.739 | 4.739 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 369 | MET | 0 | -0.030 | -0.025 | 67.732 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 370 | GLN | 0 | 0.047 | 0.021 | 65.545 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 371 | SER | 0 | -0.097 | -0.043 | 67.664 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 372 | LEU | 0 | -0.020 | 0.005 | 69.747 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 373 | PRO | 0 | 0.053 | 0.025 | 73.297 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 374 | LEU | 0 | -0.027 | -0.016 | 76.191 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 375 | ASN | 0 | 0.007 | -0.008 | 72.690 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 376 | ASP | -1 | -0.890 | -0.936 | 76.377 | 4.258 | 4.258 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 377 | MET | 0 | -0.135 | -0.066 | 78.664 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 378 | SER | 0 | 0.059 | 0.018 | 78.411 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 379 | SER | 0 | -0.062 | -0.026 | 80.529 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 380 | MET | 0 | -0.065 | -0.040 | 83.546 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 381 | GLY | 0 | 0.010 | 0.019 | 83.605 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 382 | LEU | 0 | -0.083 | -0.035 | 81.972 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 383 | GLY | 0 | 0.031 | 0.013 | 78.766 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 384 | MET | 0 | -0.034 | -0.004 | 72.982 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 385 | MET | 0 | -0.001 | -0.008 | 75.844 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 386 | SER | 0 | 0.011 | -0.007 | 71.825 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 387 | GLY | 0 | 0.007 | 0.020 | 71.195 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 388 | GLY | 0 | 0.058 | 0.020 | 71.678 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 389 | GLY | 0 | -0.049 | -0.023 | 73.162 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 390 | ALA | 0 | -0.008 | 0.013 | 73.638 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 391 | PRO | 0 | 0.025 | 0.014 | 74.400 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 392 | ASN | 0 | -0.004 | -0.018 | 77.293 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 393 | PRO | 0 | 0.038 | 0.016 | 76.459 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 394 | ALA | 0 | 0.034 | 0.014 | 78.126 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 395 | LEU | 0 | -0.042 | -0.024 | 80.838 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 396 | LEU | 0 | 0.016 | -0.006 | 74.860 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 397 | GLU | -1 | -0.979 | -0.973 | 77.694 | 4.139 | 4.139 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 398 | HIS | 0 | -0.057 | -0.017 | 79.036 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 399 | TYR | 0 | 0.007 | 0.002 | 75.877 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 400 | PRO | 0 | -0.053 | -0.025 | 74.489 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 401 | LEU | 0 | 0.005 | 0.004 | 71.089 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 402 | ARG | 1 | 0.740 | 0.815 | 61.502 | -5.224 | -5.224 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 403 | LYS | 1 | 0.915 | 0.961 | 68.343 | -4.496 | -4.496 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 404 | HIS | 0 | 0.024 | 0.007 | 69.347 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 405 | LYS | 1 | 0.835 | 0.925 | 66.875 | -4.901 | -4.901 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 406 | TYR | 0 | -0.012 | -0.035 | 62.737 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 407 | LYS | 1 | 0.868 | 0.941 | 67.994 | -4.400 | -4.400 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 408 | GLU | -1 | -0.891 | -0.956 | 70.255 | 4.589 | 4.589 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 409 | VAL | 0 | 0.018 | 0.010 | 64.159 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 410 | LEU | 0 | -0.003 | -0.010 | 65.604 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 411 | SER | 0 | -0.067 | -0.045 | 67.787 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 412 | ASN | 0 | -0.021 | -0.017 | 66.636 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 413 | LEU | 0 | 0.004 | 0.012 | 61.385 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 414 | ARG | 1 | 0.834 | 0.908 | 64.710 | -4.592 | -4.592 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 415 | VAL | 0 | 0.023 | 0.018 | 66.641 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 416 | VAL | 0 | 0.034 | 0.020 | 61.305 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 417 | MET | 0 | -0.048 | -0.032 | 59.927 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 418 | ILE | 0 | -0.051 | -0.028 | 63.371 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 419 | GLU | -1 | -0.961 | -0.984 | 63.719 | 4.997 | 4.997 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 420 | LYS | 1 | 0.788 | 0.901 | 57.208 | -5.571 | -5.571 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 421 | MET | 0 | -0.030 | 0.016 | 59.992 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 422 | VAL | 0 | -0.004 | -0.019 | 57.369 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 423 | ARG | 1 | 0.873 | 0.920 | 58.074 | -5.520 | -5.520 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 424 | PRO | 0 | -0.046 | -0.018 | 60.724 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 425 | GLU | -1 | -0.971 | -0.982 | 59.745 | 5.467 | 5.467 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 426 | GLU | -1 | -0.874 | -0.961 | 61.836 | 5.012 | 5.012 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 427 | VAL | 0 | -0.021 | -0.002 | 64.734 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 428 | LEU | 0 | 0.023 | 0.013 | 63.765 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 429 | ILE | 0 | -0.057 | -0.036 | 64.245 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 430 | VAL | 0 | -0.026 | -0.017 | 60.143 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 431 | GLU | -1 | -0.913 | -0.960 | 63.300 | 4.926 | 4.926 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 432 | ASN | 0 | -0.052 | -0.025 | 59.801 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 433 | ASP | -1 | -0.896 | -0.960 | 56.742 | 5.633 | 5.633 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 434 | GLU | -1 | -1.000 | -0.988 | 59.506 | 5.225 | 5.225 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 435 | GLY | 0 | -0.006 | -0.009 | 61.617 | -0.079 | -0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 436 | GLU | -1 | -0.964 | -0.967 | 64.889 | 4.731 | 4.731 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 437 | ILE | 0 | -0.016 | -0.003 | 64.880 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 438 | VAL | 0 | 0.015 | 0.016 | 61.577 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 439 | ARG | 1 | 0.847 | 0.903 | 63.014 | -5.047 | -5.047 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 440 | GLU | -1 | -0.823 | -0.882 | 56.760 | 5.754 | 5.754 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 441 | PHE | 0 | -0.028 | -0.020 | 58.280 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 442 | VAL | 0 | 0.008 | 0.000 | 54.296 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 443 | LYS | 1 | 0.872 | 0.942 | 53.808 | -5.950 | -5.950 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 444 | ASP | -1 | -0.862 | -0.938 | 49.658 | 6.445 | 6.445 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 445 | THR | 0 | 0.033 | -0.004 | 48.244 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 446 | ASP | -1 | -0.920 | -0.958 | 46.718 | 6.842 | 6.842 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 447 | SER | 0 | 0.010 | 0.005 | 50.097 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 448 | VAL | 0 | 0.019 | 0.015 | 53.635 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 449 | GLN | 0 | 0.002 | -0.001 | 51.226 | -0.122 | -0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 450 | LEU | 0 | 0.019 | 0.026 | 52.816 | -0.063 | -0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 451 | TYR | 0 | 0.045 | 0.014 | 54.768 | -0.121 | -0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 452 | LYS | 1 | 0.922 | 0.962 | 55.292 | -5.927 | -5.927 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 453 | THR | 0 | -0.017 | -0.019 | 54.807 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 454 | ILE | 0 | 0.042 | 0.025 | 57.335 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 455 | ARG | 1 | 0.886 | 0.954 | 59.812 | -5.075 | -5.075 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 456 | GLU | -1 | -0.777 | -0.870 | 59.122 | 5.426 | 5.426 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 457 | CYS | 0 | -0.042 | -0.018 | 59.317 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 458 | LEU | 0 | 0.020 | 0.006 | 62.154 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 459 | VAL | 0 | -0.001 | 0.020 | 65.107 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 460 | TYR | 0 | 0.005 | -0.020 | 60.944 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 461 | LEU | 0 | -0.023 | -0.016 | 64.232 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 462 | THR | 0 | -0.026 | -0.040 | 67.593 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 463 | HIS | 0 | -0.066 | -0.047 | 69.067 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 464 | LEU | 0 | -0.043 | -0.012 | 66.434 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 465 | ASP | -1 | -0.877 | -0.941 | 70.970 | 4.279 | 4.279 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 466 | VAL | 0 | 0.127 | 0.070 | 73.834 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 467 | VAL | 0 | -0.013 | 0.000 | 75.444 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 468 | ASP | -1 | -0.799 | -0.880 | 73.226 | 4.464 | 4.464 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 469 | MET | 0 | 0.045 | 0.024 | 68.788 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 470 | GLU | -1 | -0.798 | -0.876 | 73.881 | 4.068 | 4.068 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 471 | GLN | 0 | -0.030 | -0.010 | 76.951 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 472 | ILE | 0 | 0.017 | 0.023 | 71.308 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 473 | MET | 0 | -0.014 | -0.003 | 72.305 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 474 | THR | 0 | -0.017 | -0.029 | 74.650 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 475 | GLU | -1 | -0.842 | -0.892 | 75.558 | 4.252 | 4.252 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 476 | LYS | 1 | 0.865 | 0.903 | 70.844 | -4.486 | -4.486 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 477 | LEU | 0 | 0.004 | 0.005 | 75.073 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 478 | ALA | 0 | 0.026 | 0.010 | 77.079 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 479 | ARG | 1 | 0.820 | 0.895 | 76.219 | -4.174 | -4.174 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 480 | GLN | 0 | -0.032 | -0.035 | 72.837 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 481 | VAL | 0 | -0.066 | -0.023 | 76.631 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 482 | ASP | -1 | -0.901 | -0.950 | 80.101 | 3.831 | 3.831 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 483 | GLY | 0 | -0.112 | -0.055 | 79.495 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 484 | SER | 0 | -0.039 | -0.016 | 78.022 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 485 | GLU | -1 | -0.860 | -0.910 | 72.587 | 4.464 | 4.464 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 486 | TRP | 0 | 0.006 | -0.010 | 72.826 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 487 | SER | 0 | 0.033 | 0.014 | 68.183 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 488 | TRP | 0 | -0.004 | -0.002 | 67.600 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 489 | HIS | 0 | 0.049 | 0.038 | 62.021 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 490 | ASN | 0 | 0.008 | -0.011 | 66.561 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 491 | CYS | 0 | 0.012 | 0.006 | 68.867 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 492 | ASN | 0 | 0.052 | 0.037 | 66.468 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 493 | VAL | 0 | 0.020 | 0.023 | 63.912 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 494 | LEU | 0 | -0.013 | 0.010 | 66.698 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 495 | CYS | 0 | -0.060 | -0.041 | 70.053 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 496 | TRP | 0 | 0.041 | 0.009 | 62.816 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 497 | ALA | 0 | 0.022 | 0.011 | 67.310 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 498 | ILE | 0 | 0.002 | -0.002 | 68.200 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 499 | GLY | 0 | -0.015 | -0.005 | 70.586 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 500 | SER | 0 | -0.018 | -0.022 | 65.881 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 501 | ILE | 0 | -0.017 | 0.005 | 67.439 | 0.052 | 0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 502 | SER | 0 | -0.009 | -0.019 | 69.932 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 503 | MET | 0 | -0.073 | -0.046 | 70.746 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 504 | ALA | 0 | 0.032 | 0.030 | 70.297 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 505 | MET | 0 | -0.005 | 0.009 | 72.166 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 506 | ASN | 0 | 0.025 | 0.031 | 75.727 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 507 | GLU | -1 | -0.802 | -0.920 | 78.712 | 3.925 | 3.925 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 508 | GLU | -1 | -0.907 | -0.962 | 81.004 | 3.925 | 3.925 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 509 | THR | 0 | -0.040 | -0.041 | 79.723 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 510 | GLU | -1 | -0.806 | -0.887 | 76.356 | 4.268 | 4.268 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 511 | LYS | 1 | 0.845 | 0.920 | 79.620 | -3.843 | -3.843 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 512 | ARG | 1 | 0.800 | 0.871 | 81.886 | -3.970 | -3.970 | 0.000 | 0.000 | 0.000 | 0.000 |
479 | A | 513 | PHE | 0 | 0.045 | 0.026 | 75.480 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
480 | A | 514 | LEU | 0 | 0.071 | 0.036 | 76.859 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 515 | VAL | 0 | -0.065 | -0.031 | 80.572 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 516 | THR | 0 | -0.070 | -0.046 | 81.942 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 517 | VAL | 0 | 0.049 | 0.032 | 77.127 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 518 | ILE | 0 | -0.004 | -0.002 | 80.293 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 519 | LYS | 1 | 0.888 | 0.941 | 81.739 | -3.729 | -3.729 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 520 | ASP | -1 | -0.834 | -0.918 | 80.917 | 3.944 | 3.944 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 521 | LEU | 0 | 0.020 | 0.001 | 76.093 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 522 | LEU | 0 | -0.025 | 0.003 | 79.996 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 523 | GLY | 0 | 0.016 | 0.014 | 82.867 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 524 | LEU | 0 | -0.010 | -0.015 | 77.460 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 525 | THR | 0 | -0.060 | -0.040 | 79.835 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 526 | GLU | -1 | -0.893 | -0.931 | 80.818 | 3.765 | 3.765 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 527 | MET | 0 | -0.042 | -0.008 | 83.227 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 528 | LYS | 1 | 0.886 | 0.964 | 76.656 | -4.209 | -4.209 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 529 | ARG | 1 | 0.900 | 0.949 | 80.377 | -3.835 | -3.835 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 530 | GLY | 0 | 0.021 | 0.011 | 77.378 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 531 | LYS | 1 | 0.872 | 0.911 | 74.443 | -4.150 | -4.150 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 532 | ASP | -1 | -0.785 | -0.887 | 70.721 | 4.538 | 4.538 | 0.000 | 0.000 | 0.000 | 0.000 |
499 | A | 533 | ASN | 0 | -0.016 | -0.022 | 72.641 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 534 | LYS | 1 | 0.828 | 0.908 | 74.673 | -4.028 | -4.028 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 535 | ALA | 0 | 0.044 | 0.030 | 71.633 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 536 | VAL | 0 | 0.041 | 0.023 | 69.349 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 537 | VAL | 0 | -0.026 | 0.000 | 71.768 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 538 | ALA | 0 | 0.016 | 0.011 | 74.936 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 539 | SER | 0 | -0.022 | -0.029 | 69.870 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 540 | ASN | 0 | 0.002 | -0.028 | 69.977 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 541 | ILE | 0 | -0.028 | -0.010 | 72.169 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 542 | MET | 0 | -0.040 | -0.004 | 72.944 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 543 | TYR | 0 | 0.011 | 0.018 | 66.164 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 544 | ILE | 0 | 0.004 | -0.007 | 71.377 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 545 | VAL | 0 | -0.040 | -0.032 | 73.475 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 546 | GLY | 0 | -0.009 | 0.005 | 72.643 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 547 | GLN | 0 | -0.048 | -0.003 | 67.571 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 548 | TYR | 0 | -0.046 | -0.004 | 72.241 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 549 | PRO | 0 | 0.013 | 0.007 | 74.439 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 550 | ARG | 1 | 0.862 | 0.892 | 76.722 | -4.313 | -4.313 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 551 | PHE | 0 | 0.084 | 0.047 | 79.178 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 552 | LEU | 0 | 0.042 | 0.018 | 79.434 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 553 | LYS | 1 | 0.860 | 0.938 | 78.441 | -4.211 | -4.211 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 554 | ALA | 0 | 0.003 | 0.017 | 83.573 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 555 | HIS | 0 | -0.100 | -0.065 | 84.563 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 556 | TRP | 0 | 0.069 | 0.017 | 86.179 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 557 | LYS | 1 | 0.949 | 0.977 | 87.610 | -3.536 | -3.536 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 558 | PHE | 0 | 0.049 | 0.022 | 84.278 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 559 | LEU | 0 | 0.049 | 0.045 | 81.932 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 560 | LYS | 1 | 0.857 | 0.926 | 84.211 | -3.533 | -3.533 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 561 | THR | 0 | -0.099 | -0.054 | 85.760 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 562 | VAL | 0 | 0.035 | 0.004 | 80.695 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 563 | VAL | 0 | 0.002 | 0.013 | 81.561 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 564 | ASN | 0 | 0.019 | -0.001 | 82.688 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 565 | LYS | 1 | 0.773 | 0.861 | 81.849 | -3.883 | -3.883 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 566 | LEU | 0 | 0.012 | 0.015 | 76.743 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 567 | PHE | 0 | 0.024 | -0.003 | 79.499 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 568 | GLU | -1 | -0.845 | -0.895 | 81.665 | 3.917 | 3.917 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 569 | PHE | 0 | -0.012 | -0.027 | 76.849 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 570 | MET | 0 | -0.015 | -0.004 | 77.339 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 571 | HIS | 0 | -0.101 | -0.054 | 78.165 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 572 | GLU | -1 | -0.851 | -0.896 | 77.102 | 4.082 | 4.082 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 573 | SER | 0 | -0.057 | -0.034 | 75.326 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 574 | HIS | 0 | -0.014 | -0.014 | 67.826 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 575 | GLU | -1 | -0.830 | -0.923 | 68.477 | 4.710 | 4.710 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 576 | GLY | 0 | 0.005 | 0.006 | 68.810 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 577 | VAL | 0 | -0.020 | -0.014 | 69.435 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 578 | GLN | 0 | 0.058 | 0.036 | 72.633 | 0.018 | 0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 579 | ASP | -1 | -0.782 | -0.863 | 67.948 | 4.756 | 4.756 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 580 | MET | 0 | -0.016 | 0.012 | 68.271 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 581 | ALA | 0 | 0.038 | 0.022 | 71.114 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 582 | CYS | 0 | -0.056 | -0.027 | 72.998 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 583 | ASP | -1 | -0.793 | -0.887 | 68.627 | 4.760 | 4.760 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 584 | THR | 0 | -0.006 | -0.018 | 71.625 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 585 | PHE | 0 | -0.035 | -0.016 | 73.516 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 586 | ILE | 0 | 0.011 | 0.006 | 71.724 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 587 | LYS | 1 | 0.813 | 0.898 | 67.750 | -4.796 | -4.796 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 588 | ILE | 0 | 0.006 | -0.002 | 73.327 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 589 | ALA | 0 | -0.021 | 0.001 | 76.827 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 590 | LYS | 1 | 0.895 | 0.958 | 70.172 | -4.628 | -4.628 | 0.000 | 0.000 | 0.000 | 0.000 |
557 | A | 591 | GLN | 0 | -0.003 | -0.003 | 73.429 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
558 | A | 592 | CYS | 0 | -0.091 | -0.045 | 76.494 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
559 | A | 593 | ARG | 1 | 0.978 | 1.004 | 76.523 | -4.273 | -4.273 | 0.000 | 0.000 | 0.000 | 0.000 |
560 | A | 594 | ARG | 1 | 0.943 | 0.950 | 81.360 | -4.024 | -4.024 | 0.000 | 0.000 | 0.000 | 0.000 |
561 | A | 595 | HIS | 0 | -0.019 | -0.008 | 84.233 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
562 | A | 596 | PHE | 0 | 0.019 | 0.011 | 81.690 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
563 | A | 597 | VAL | 0 | -0.008 | 0.006 | 85.891 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
564 | A | 598 | ALA | 0 | -0.023 | -0.002 | 88.492 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
565 | A | 599 | LEU | 0 | 0.009 | 0.010 | 90.773 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
566 | A | 600 | GLN | 0 | -0.021 | -0.015 | 89.398 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
567 | A | 601 | PRO | 0 | 0.007 | -0.012 | 93.559 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
568 | A | 602 | SER | 0 | -0.090 | -0.035 | 94.452 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
569 | A | 603 | GLU | -1 | -0.735 | -0.856 | 92.915 | 3.468 | 3.468 | 0.000 | 0.000 | 0.000 | 0.000 |
570 | A | 604 | ASN | 0 | -0.024 | -0.011 | 96.152 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
571 | A | 605 | GLU | -1 | -0.794 | -0.852 | 94.458 | 3.416 | 3.416 | 0.000 | 0.000 | 0.000 | 0.000 |
572 | A | 606 | PRO | 0 | 0.002 | -0.002 | 91.384 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
573 | A | 607 | PHE | 0 | 0.023 | 0.011 | 85.648 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
574 | A | 608 | ILE | 0 | 0.039 | 0.012 | 85.685 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
575 | A | 609 | GLU | -1 | -0.759 | -0.853 | 88.179 | 3.550 | 3.550 | 0.000 | 0.000 | 0.000 | 0.000 |
576 | A | 610 | GLU | -1 | -0.947 | -0.972 | 90.503 | 3.595 | 3.595 | 0.000 | 0.000 | 0.000 | 0.000 |
577 | A | 611 | ILE | 0 | -0.022 | -0.019 | 84.405 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
578 | A | 612 | ILE | 0 | -0.007 | -0.003 | 86.211 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
579 | A | 613 | ARG | 1 | 0.799 | 0.863 | 88.566 | -3.467 | -3.467 | 0.000 | 0.000 | 0.000 | 0.000 |
580 | A | 614 | ASN | 0 | -0.076 | -0.037 | 89.070 | -0.030 | -0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
581 | A | 615 | ILE | 0 | 0.052 | 0.033 | 82.829 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
582 | A | 616 | GLY | 0 | 0.016 | 0.017 | 84.590 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
583 | A | 617 | LYS | 1 | 0.934 | 0.963 | 85.231 | -3.673 | -3.673 | 0.000 | 0.000 | 0.000 | 0.000 |
584 | A | 618 | ILE | 0 | 0.014 | 0.007 | 81.895 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
585 | A | 619 | THR | 0 | -0.046 | -0.046 | 80.364 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
586 | A | 620 | CYS | 0 | -0.084 | -0.016 | 80.806 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
587 | A | 621 | ASP | -1 | -0.824 | -0.916 | 79.026 | 4.028 | 4.028 | 0.000 | 0.000 | 0.000 | 0.000 |
588 | A | 622 | LEU | 0 | -0.048 | -0.009 | 76.014 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
589 | A | 623 | THR | 0 | 0.043 | 0.018 | 71.720 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
590 | A | 624 | PRO | 0 | 0.020 | -0.014 | 72.249 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
591 | A | 625 | GLN | 0 | 0.013 | 0.003 | 65.919 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
592 | A | 626 | GLN | 0 | 0.077 | 0.039 | 71.374 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
593 | A | 627 | VAL | 0 | 0.036 | 0.027 | 73.536 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
594 | A | 628 | HIS | 0 | -0.055 | -0.033 | 71.364 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
595 | A | 629 | THR | 0 | 0.026 | 0.005 | 70.697 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
596 | A | 630 | PHE | 0 | 0.032 | 0.015 | 73.683 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
597 | A | 631 | TYR | 0 | 0.026 | -0.016 | 77.296 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
598 | A | 632 | GLU | -1 | -0.867 | -0.901 | 71.782 | 4.548 | 4.548 | 0.000 | 0.000 | 0.000 | 0.000 |
599 | A | 633 | ALA | 0 | 0.008 | 0.008 | 76.094 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
600 | A | 634 | CYS | 0 | -0.041 | -0.036 | 77.497 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
601 | A | 635 | GLY | 0 | 0.055 | 0.032 | 78.936 | -0.057 | -0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
602 | A | 636 | TYR | 0 | -0.037 | -0.050 | 72.198 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
603 | A | 637 | MET | 0 | -0.037 | 0.009 | 78.919 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
604 | A | 638 | VAL | 0 | 0.031 | 0.018 | 82.375 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
605 | A | 639 | SER | 0 | -0.062 | -0.037 | 79.871 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
606 | A | 640 | ALA | 0 | -0.067 | -0.041 | 81.886 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
607 | A | 641 | GLN | 0 | -0.016 | 0.014 | 83.538 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
608 | A | 642 | GLY | 0 | 0.022 | 0.013 | 86.559 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
609 | A | 643 | ASN | 0 | -0.048 | -0.030 | 88.416 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
610 | A | 644 | ARG | 1 | 1.004 | 0.993 | 86.175 | -3.778 | -3.778 | 0.000 | 0.000 | 0.000 | 0.000 |
611 | A | 645 | ASN | 0 | 0.012 | 0.004 | 90.415 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
612 | A | 646 | GLN | 0 | -0.017 | -0.013 | 92.341 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
613 | A | 647 | GLN | 0 | 0.001 | 0.002 | 84.794 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
614 | A | 648 | GLU | -1 | -0.881 | -0.936 | 88.007 | 3.625 | 3.625 | 0.000 | 0.000 | 0.000 | 0.000 |
615 | A | 649 | ARG | 1 | 0.729 | 0.823 | 89.676 | -3.490 | -3.490 | 0.000 | 0.000 | 0.000 | 0.000 |
616 | A | 650 | LEU | 0 | -0.014 | -0.011 | 87.757 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
617 | A | 651 | LEU | 0 | -0.017 | -0.002 | 83.314 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
618 | A | 652 | ALA | 0 | -0.022 | -0.016 | 86.335 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
619 | A | 653 | GLU | -1 | -0.885 | -0.947 | 88.563 | 3.535 | 3.535 | 0.000 | 0.000 | 0.000 | 0.000 |
620 | A | 654 | LEU | 0 | -0.026 | 0.000 | 81.976 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
621 | A | 655 | MET | 0 | -0.039 | -0.018 | 80.262 | 0.048 | 0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
622 | A | 656 | ALA | 0 | 0.036 | 0.031 | 84.950 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
623 | A | 657 | ILE | 0 | 0.013 | 0.000 | 84.947 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
624 | A | 658 | PRO | 0 | 0.014 | 0.002 | 81.344 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
625 | A | 659 | ASN | 0 | -0.013 | -0.023 | 83.450 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
626 | A | 660 | ALA | 0 | 0.043 | 0.037 | 85.856 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
627 | A | 661 | ALA | 0 | -0.008 | -0.008 | 83.926 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
628 | A | 662 | TRP | 0 | -0.006 | -0.009 | 79.313 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
629 | A | 663 | ASP | -1 | -0.738 | -0.838 | 84.401 | 3.701 | 3.701 | 0.000 | 0.000 | 0.000 | 0.000 |
630 | A | 664 | GLU | -1 | -0.899 | -0.932 | 87.333 | 3.582 | 3.582 | 0.000 | 0.000 | 0.000 | 0.000 |
631 | A | 665 | ILE | 0 | 0.016 | -0.004 | 81.317 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
632 | A | 666 | ILE | 0 | 0.028 | 0.026 | 83.338 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
633 | A | 667 | LYS | 1 | 0.810 | 0.909 | 86.058 | -3.600 | -3.600 | 0.000 | 0.000 | 0.000 | 0.000 |
634 | A | 668 | ALA | 0 | -0.005 | -0.004 | 86.126 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
635 | A | 669 | ALA | 0 | 0.004 | -0.015 | 83.307 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
636 | A | 670 | THR | 0 | -0.065 | -0.047 | 85.092 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
637 | A | 671 | MET | 0 | -0.100 | -0.035 | 87.820 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
638 | A | 672 | ASN | 0 | -0.022 | -0.019 | 85.333 | -0.023 | -0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
639 | A | 673 | PRO | 0 | 0.107 | 0.050 | 81.836 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
640 | A | 674 | GLY | 0 | -0.001 | 0.003 | 80.753 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
641 | A | 675 | ILE | 0 | -0.021 | -0.015 | 80.249 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
642 | A | 676 | LEU | 0 | 0.050 | 0.022 | 78.225 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
643 | A | 677 | HIS | 0 | -0.076 | -0.033 | 75.495 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
644 | A | 678 | GLU | -1 | -0.812 | -0.892 | 76.705 | 4.232 | 4.232 | 0.000 | 0.000 | 0.000 | 0.000 |
645 | A | 679 | PRO | 0 | -0.026 | -0.022 | 73.123 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
646 | A | 680 | ASP | -1 | -0.854 | -0.925 | 74.681 | 4.195 | 4.195 | 0.000 | 0.000 | 0.000 | 0.000 |
647 | A | 681 | THR | 0 | 0.047 | 0.021 | 77.411 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
648 | A | 682 | ILE | 0 | -0.042 | -0.008 | 71.894 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
649 | A | 683 | LYS | 1 | 0.914 | 0.958 | 70.740 | -4.527 | -4.527 | 0.000 | 0.000 | 0.000 | 0.000 |
650 | A | 684 | ILE | 0 | -0.002 | 0.012 | 74.199 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
651 | A | 685 | ILE | 0 | 0.039 | 0.015 | 76.047 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
652 | A | 686 | GLY | 0 | 0.032 | 0.012 | 73.034 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
653 | A | 687 | ASN | 0 | 0.000 | -0.008 | 73.665 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
654 | A | 688 | ILE | 0 | 0.005 | 0.017 | 75.191 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
655 | A | 689 | MET | 0 | -0.019 | 0.009 | 74.151 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
656 | A | 690 | LYS | 1 | 0.928 | 0.955 | 68.443 | -4.730 | -4.730 | 0.000 | 0.000 | 0.000 | 0.000 |
657 | A | 691 | THR | 0 | -0.031 | -0.013 | 73.310 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
658 | A | 692 | ASN | 0 | -0.040 | -0.042 | 76.297 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
659 | A | 693 | VAL | 0 | 0.026 | 0.023 | 70.470 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
660 | A | 694 | SER | 0 | 0.038 | 0.024 | 72.512 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
661 | A | 695 | ALA | 0 | 0.013 | 0.020 | 74.000 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
662 | A | 696 | CYS | 0 | -0.025 | 0.003 | 75.497 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
663 | A | 697 | SER | 0 | -0.020 | -0.026 | 71.534 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
664 | A | 698 | SER | 0 | 0.000 | -0.013 | 73.621 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
665 | A | 699 | ILE | 0 | -0.089 | -0.035 | 75.682 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
666 | A | 700 | GLY | 0 | -0.015 | -0.011 | 76.521 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
667 | A | 701 | PRO | 0 | 0.063 | 0.020 | 77.153 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
668 | A | 702 | TYR | 0 | -0.068 | -0.035 | 79.610 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
669 | A | 703 | PHE | 0 | 0.056 | 0.021 | 79.489 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
670 | A | 704 | PHE | 0 | 0.017 | -0.012 | 81.748 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
671 | A | 705 | PRO | 0 | 0.008 | 0.011 | 83.393 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
672 | A | 706 | GLN | 0 | -0.017 | 0.008 | 82.454 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
673 | A | 707 | ILE | 0 | 0.024 | 0.012 | 78.706 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
674 | A | 708 | GLY | 0 | 0.036 | 0.023 | 82.421 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
675 | A | 709 | ARG | 1 | 0.754 | 0.846 | 85.234 | -3.734 | -3.734 | 0.000 | 0.000 | 0.000 | 0.000 |
676 | A | 710 | LEU | 0 | 0.013 | -0.001 | 81.170 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
677 | A | 711 | TYR | 0 | -0.041 | -0.032 | 78.292 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
678 | A | 712 | ASN | 0 | 0.034 | 0.003 | 81.886 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
679 | A | 713 | ASP | -1 | -0.854 | -0.935 | 83.645 | 3.810 | 3.810 | 0.000 | 0.000 | 0.000 | 0.000 |
680 | A | 714 | MET | 0 | -0.044 | -0.016 | 77.222 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
681 | A | 715 | LEU | 0 | 0.006 | 0.021 | 78.426 | 0.055 | 0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
682 | A | 716 | GLN | 0 | -0.017 | -0.001 | 79.828 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
683 | A | 717 | MET | 0 | -0.018 | 0.005 | 78.287 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
684 | A | 718 | TYR | 0 | -0.044 | -0.036 | 71.959 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
685 | A | 719 | ALA | 0 | 0.031 | 0.010 | 76.292 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
686 | A | 720 | ALA | 0 | -0.007 | 0.008 | 78.386 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
687 | A | 721 | THR | 0 | -0.014 | -0.030 | 74.697 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
688 | A | 722 | SER | 0 | 0.033 | -0.018 | 73.627 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
689 | A | 723 | GLN | 0 | -0.071 | -0.023 | 74.562 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
690 | A | 724 | LEU | 0 | -0.003 | 0.001 | 76.370 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
691 | A | 725 | ILE | 0 | -0.046 | -0.026 | 69.999 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
692 | A | 726 | SER | 0 | -0.042 | -0.024 | 72.541 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
693 | A | 727 | GLU | -1 | -0.866 | -0.921 | 73.949 | 4.118 | 4.118 | 0.000 | 0.000 | 0.000 | 0.000 |
694 | A | 728 | ALA | 0 | -0.041 | -0.022 | 72.456 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
695 | A | 729 | VAL | 0 | -0.017 | -0.015 | 68.613 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
696 | A | 730 | ALA | 0 | -0.015 | 0.007 | 70.968 | 0.028 | 0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
697 | A | 731 | ARG | 1 | 0.756 | 0.853 | 73.419 | -4.366 | -4.366 | 0.000 | 0.000 | 0.000 | 0.000 |
698 | A | 732 | ASP | -1 | -0.836 | -0.886 | 70.231 | 4.500 | 4.500 | 0.000 | 0.000 | 0.000 | 0.000 |
699 | A | 733 | GLY | 0 | 0.022 | 0.013 | 68.078 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
700 | A | 734 | GLU | -1 | -0.844 | -0.949 | 64.057 | 4.970 | 4.970 | 0.000 | 0.000 | 0.000 | 0.000 |
701 | A | 735 | ILE | 0 | -0.048 | -0.026 | 62.452 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
702 | A | 736 | ALA | 0 | 0.051 | 0.031 | 64.529 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
703 | A | 737 | THR | 0 | -0.027 | -0.016 | 63.795 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
704 | A | 738 | LYS | 1 | 0.907 | 0.953 | 58.409 | -5.493 | -5.493 | 0.000 | 0.000 | 0.000 | 0.000 |
705 | A | 739 | MET | 0 | 0.011 | 0.012 | 63.678 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
706 | A | 740 | PRO | 0 | 0.023 | -0.008 | 66.910 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
707 | A | 741 | LYS | 1 | 0.862 | 0.926 | 68.278 | -4.310 | -4.310 | 0.000 | 0.000 | 0.000 | 0.000 |
708 | A | 742 | VAL | 0 | 0.081 | 0.047 | 67.825 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
709 | A | 743 | ARG | 1 | 0.947 | 0.983 | 61.014 | -5.219 | -5.219 | 0.000 | 0.000 | 0.000 | 0.000 |
710 | A | 744 | GLY | 0 | 0.015 | 0.025 | 67.392 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
711 | A | 745 | LEU | 0 | 0.015 | 0.004 | 70.424 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
712 | A | 746 | ARG | 1 | 0.848 | 0.899 | 62.821 | -5.097 | -5.097 | 0.000 | 0.000 | 0.000 | 0.000 |
713 | A | 747 | THR | 0 | -0.054 | -0.038 | 67.745 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
714 | A | 748 | ILE | 0 | 0.021 | 0.007 | 68.925 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
715 | A | 749 | LYS | 1 | 0.856 | 0.937 | 70.520 | -4.598 | -4.598 | 0.000 | 0.000 | 0.000 | 0.000 |
716 | A | 750 | LYS | 1 | 0.863 | 0.930 | 63.116 | -5.112 | -5.112 | 0.000 | 0.000 | 0.000 | 0.000 |
717 | A | 751 | GLU | -1 | -0.850 | -0.919 | 68.804 | 4.775 | 4.775 | 0.000 | 0.000 | 0.000 | 0.000 |
718 | A | 752 | ILE | 0 | 0.002 | -0.007 | 71.037 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
719 | A | 753 | LEU | 0 | -0.018 | -0.009 | 68.827 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
720 | A | 754 | LYS | 1 | 0.912 | 0.957 | 64.752 | -4.981 | -4.981 | 0.000 | 0.000 | 0.000 | 0.000 |
721 | A | 755 | LEU | 0 | -0.013 | 0.002 | 69.937 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
722 | A | 756 | VAL | 0 | -0.035 | -0.024 | 73.342 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
723 | A | 757 | GLU | -1 | -0.800 | -0.895 | 66.857 | 4.908 | 4.908 | 0.000 | 0.000 | 0.000 | 0.000 |
724 | A | 758 | THR | 0 | -0.005 | -0.009 | 70.972 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
725 | A | 759 | PHE | 0 | 0.004 | -0.025 | 71.876 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
726 | A | 760 | VAL | 0 | -0.029 | -0.013 | 72.438 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
727 | A | 761 | GLU | -1 | -0.925 | -0.958 | 67.213 | 4.831 | 4.831 | 0.000 | 0.000 | 0.000 | 0.000 |
728 | A | 762 | LYS | 1 | 0.808 | 0.919 | 71.872 | -4.516 | -4.516 | 0.000 | 0.000 | 0.000 | 0.000 |
729 | A | 763 | ALA | 0 | -0.038 | 0.001 | 74.781 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
730 | A | 764 | GLU | -1 | -0.913 | -0.958 | 76.595 | 4.050 | 4.050 | 0.000 | 0.000 | 0.000 | 0.000 |
731 | A | 765 | ASP | -1 | -0.893 | -0.946 | 79.195 | 3.910 | 3.910 | 0.000 | 0.000 | 0.000 | 0.000 |
732 | A | 766 | LEU | 0 | 0.029 | -0.005 | 75.542 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
733 | A | 767 | GLN | 0 | 0.052 | 0.031 | 79.154 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
734 | A | 768 | ALA | 0 | 0.025 | 0.029 | 81.879 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
735 | A | 769 | VAL | 0 | 0.031 | 0.017 | 77.295 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
736 | A | 770 | ARG | 1 | 0.797 | 0.888 | 77.427 | -4.151 | -4.151 | 0.000 | 0.000 | 0.000 | 0.000 |
737 | A | 771 | SER | 0 | -0.054 | -0.063 | 79.691 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
738 | A | 772 | GLN | 0 | -0.058 | -0.036 | 83.145 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
739 | A | 773 | MET | 0 | -0.036 | 0.000 | 78.010 | -0.003 | -0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
740 | A | 774 | ILE | 0 | 0.012 | 0.019 | 75.040 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
741 | A | 775 | PRO | 0 | 0.021 | 0.018 | 77.584 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
742 | A | 776 | GLY | 0 | 0.063 | 0.032 | 79.434 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
743 | A | 777 | LEU | 0 | 0.019 | 0.019 | 73.513 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
744 | A | 778 | LEU | 0 | -0.008 | -0.032 | 73.303 | 0.047 | 0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
745 | A | 779 | ASP | -1 | -0.964 | -0.968 | 75.568 | 4.100 | 4.100 | 0.000 | 0.000 | 0.000 | 0.000 |
746 | A | 780 | SER | 0 | -0.035 | -0.016 | 77.073 | -0.011 | -0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
747 | A | 781 | VAL | 0 | -0.044 | -0.034 | 71.849 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
748 | A | 782 | LEU | 0 | -0.002 | 0.009 | 70.519 | 0.064 | 0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
749 | A | 783 | VAL | 0 | 0.057 | 0.026 | 71.639 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
750 | A | 784 | ASP | -1 | -0.757 | -0.851 | 72.473 | 4.551 | 4.551 | 0.000 | 0.000 | 0.000 | 0.000 |
751 | A | 785 | TYR | 0 | -0.029 | -0.011 | 63.258 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
752 | A | 786 | ASN | 0 | -0.036 | -0.026 | 68.034 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
753 | A | 787 | ARG | 1 | 0.852 | 0.917 | 68.942 | -4.440 | -4.440 | 0.000 | 0.000 | 0.000 | 0.000 |
754 | A | 788 | ASN | 0 | -0.068 | -0.026 | 68.337 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
755 | A | 789 | VAL | 0 | 0.016 | 0.019 | 65.933 | 0.049 | 0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
756 | A | 790 | PRO | 0 | 0.065 | 0.003 | 61.081 | -0.006 | -0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
757 | A | 791 | GLY | 0 | -0.009 | 0.003 | 62.341 | 0.043 | 0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
758 | A | 792 | ALA | 0 | -0.031 | -0.030 | 63.332 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
759 | A | 793 | ARG | 1 | 0.866 | 0.953 | 63.414 | -5.036 | -5.036 | 0.000 | 0.000 | 0.000 | 0.000 |
760 | A | 794 | ASP | -1 | -0.760 | -0.870 | 63.696 | 5.129 | 5.129 | 0.000 | 0.000 | 0.000 | 0.000 |
761 | A | 795 | ALA | 0 | 0.043 | 0.024 | 60.546 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
762 | A | 796 | GLU | -1 | -0.803 | -0.885 | 62.589 | 5.046 | 5.046 | 0.000 | 0.000 | 0.000 | 0.000 |
763 | A | 797 | VAL | 0 | 0.036 | 0.025 | 65.088 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
764 | A | 798 | LEU | 0 | 0.029 | 0.015 | 61.066 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
765 | A | 799 | LYS | 1 | 0.820 | 0.914 | 61.707 | -5.095 | -5.095 | 0.000 | 0.000 | 0.000 | 0.000 |
766 | A | 800 | ALA | 0 | 0.043 | 0.018 | 64.240 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
767 | A | 801 | MET | 0 | -0.055 | -0.024 | 66.497 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
768 | A | 802 | THR | 0 | 0.050 | 0.002 | 62.061 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
769 | A | 803 | VAL | 0 | 0.012 | 0.028 | 65.279 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
770 | A | 804 | ILE | 0 | -0.029 | -0.025 | 67.415 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
771 | A | 805 | ILE | 0 | -0.020 | -0.016 | 67.276 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
772 | A | 806 | THR | 0 | -0.026 | -0.020 | 65.448 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
773 | A | 807 | ARG | 1 | 0.813 | 0.912 | 67.667 | -4.571 | -4.571 | 0.000 | 0.000 | 0.000 | 0.000 |
774 | A | 808 | LEU | 0 | -0.049 | -0.043 | 70.919 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
775 | A | 809 | GLN | 0 | 0.005 | 0.009 | 69.354 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
776 | A | 810 | GLY | 0 | 0.062 | 0.031 | 71.379 | 0.004 | 0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
777 | A | 811 | LEU | 0 | -0.030 | -0.024 | 73.500 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
778 | A | 812 | MET | 0 | -0.016 | 0.000 | 71.898 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
779 | A | 813 | GLU | -1 | -0.867 | -0.944 | 71.604 | 4.556 | 4.556 | 0.000 | 0.000 | 0.000 | 0.000 |
780 | A | 814 | ASP | -1 | -0.841 | -0.912 | 73.425 | 4.226 | 4.226 | 0.000 | 0.000 | 0.000 | 0.000 |
781 | A | 815 | GLN | 0 | -0.021 | -0.012 | 74.417 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
782 | A | 816 | VAL | 0 | 0.013 | 0.012 | 68.972 | 0.029 | 0.029 | 0.000 | 0.000 | 0.000 | 0.000 |
783 | A | 817 | PRO | 0 | -0.016 | -0.011 | 70.519 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
784 | A | 818 | ALA | 0 | 0.048 | 0.035 | 71.559 | 0.033 | 0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
785 | A | 819 | ILE | 0 | 0.019 | 0.012 | 67.697 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
786 | A | 820 | MET | 0 | -0.012 | -0.010 | 63.467 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
787 | A | 821 | GLU | -1 | -0.958 | -0.974 | 67.277 | 4.484 | 4.484 | 0.000 | 0.000 | 0.000 | 0.000 |
788 | A | 822 | ASN | 0 | -0.058 | -0.036 | 69.331 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
789 | A | 823 | VAL | 0 | 0.020 | 0.008 | 63.959 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
790 | A | 824 | PHE | 0 | 0.004 | 0.005 | 59.779 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
791 | A | 825 | GLU | -1 | -0.780 | -0.887 | 62.037 | 5.028 | 5.028 | 0.000 | 0.000 | 0.000 | 0.000 |
792 | A | 826 | CYS | 0 | -0.093 | -0.024 | 62.257 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
793 | A | 827 | THR | 0 | 0.016 | -0.024 | 59.272 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
794 | A | 828 | LEU | 0 | 0.005 | 0.011 | 56.802 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
795 | A | 829 | ASP | -1 | -0.865 | -0.924 | 56.721 | 5.636 | 5.636 | 0.000 | 0.000 | 0.000 | 0.000 |
796 | A | 830 | MET | 0 | -0.120 | -0.049 | 57.360 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
797 | A | 831 | ILE | 0 | -0.028 | -0.012 | 52.287 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
798 | A | 832 | ASN | 0 | -0.089 | -0.039 | 52.287 | 0.210 | 0.210 | 0.000 | 0.000 | 0.000 | 0.000 |
799 | A | 833 | LYS | 1 | 0.878 | 0.945 | 51.912 | -5.755 | -5.755 | 0.000 | 0.000 | 0.000 | 0.000 |
800 | A | 834 | ASP | -1 | -0.833 | -0.917 | 51.467 | 6.097 | 6.097 | 0.000 | 0.000 | 0.000 | 0.000 |
801 | A | 835 | PHE | 0 | 0.004 | 0.000 | 46.969 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
802 | A | 836 | ALA | 0 | 0.021 | 0.002 | 46.843 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
803 | A | 837 | GLU | -1 | -0.932 | -0.952 | 48.892 | 6.207 | 6.207 | 0.000 | 0.000 | 0.000 | 0.000 |
804 | A | 838 | TYR | 0 | -0.063 | -0.030 | 52.417 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
805 | A | 839 | PRO | 0 | 0.044 | 0.018 | 51.204 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
806 | A | 840 | GLU | -1 | -0.904 | -0.947 | 53.195 | 5.629 | 5.629 | 0.000 | 0.000 | 0.000 | 0.000 |
807 | A | 841 | HIS | 0 | -0.018 | -0.033 | 56.342 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
808 | A | 842 | ARG | 1 | 0.865 | 0.943 | 50.740 | -6.377 | -6.377 | 0.000 | 0.000 | 0.000 | 0.000 |
809 | A | 843 | VAL | 0 | -0.002 | -0.003 | 52.356 | -0.013 | -0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
810 | A | 844 | GLU | -1 | -0.796 | -0.911 | 54.876 | 5.489 | 5.489 | 0.000 | 0.000 | 0.000 | 0.000 |
811 | A | 845 | PHE | 0 | -0.017 | 0.003 | 56.841 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
812 | A | 846 | PHE | 0 | -0.016 | -0.013 | 54.027 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
813 | A | 847 | ASN | 0 | -0.012 | -0.027 | 56.011 | 0.015 | 0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
814 | A | 848 | LEU | 0 | -0.005 | 0.017 | 58.301 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
815 | A | 849 | LEU | 0 | -0.019 | -0.018 | 57.828 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
816 | A | 850 | ARG | 1 | 0.832 | 0.894 | 56.034 | -5.817 | -5.817 | 0.000 | 0.000 | 0.000 | 0.000 |
817 | A | 851 | ALA | 0 | 0.009 | 0.005 | 59.468 | -0.047 | -0.047 | 0.000 | 0.000 | 0.000 | 0.000 |
818 | A | 852 | ILE | 0 | 0.012 | 0.002 | 62.845 | -0.088 | -0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
819 | A | 853 | ASN | 0 | 0.004 | 0.000 | 59.796 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
820 | A | 854 | LEU | 0 | -0.084 | -0.029 | 60.138 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
821 | A | 855 | TYR | 0 | -0.027 | -0.012 | 63.242 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
822 | A | 856 | CYS | 0 | -0.063 | -0.021 | 66.619 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
823 | A | 857 | PHE | 0 | 0.030 | 0.012 | 63.295 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
824 | A | 858 | PRO | 0 | -0.011 | -0.006 | 67.000 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
825 | A | 859 | ALA | 0 | 0.016 | 0.007 | 69.944 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
826 | A | 860 | LEU | 0 | 0.018 | 0.008 | 62.467 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
827 | A | 861 | LEU | 0 | -0.039 | -0.018 | 66.417 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
828 | A | 862 | LYS | 1 | 0.894 | 0.948 | 68.033 | -4.490 | -4.490 | 0.000 | 0.000 | 0.000 | 0.000 |
829 | A | 863 | LEU | 0 | -0.010 | 0.014 | 63.955 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
830 | A | 864 | ASP | -1 | -0.839 | -0.907 | 66.667 | 4.888 | 4.888 | 0.000 | 0.000 | 0.000 | 0.000 |
831 | A | 865 | ASN | 0 | 0.015 | -0.018 | 63.509 | 0.025 | 0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
832 | A | 866 | ARG | 1 | 0.917 | 0.949 | 61.776 | -5.076 | -5.076 | 0.000 | 0.000 | 0.000 | 0.000 |
833 | A | 867 | GLN | 0 | 0.041 | 0.008 | 60.672 | 0.145 | 0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
834 | A | 868 | PHE | 0 | 0.063 | 0.033 | 59.902 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
835 | A | 869 | LYS | 1 | 0.865 | 0.942 | 54.807 | -5.805 | -5.805 | 0.000 | 0.000 | 0.000 | 0.000 |
836 | A | 870 | PHE | 0 | 0.015 | 0.003 | 55.642 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
837 | A | 871 | VAL | 0 | 0.021 | 0.023 | 55.952 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
838 | A | 872 | ILE | 0 | -0.016 | -0.012 | 52.759 | 0.100 | 0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
839 | A | 873 | ASP | -1 | -0.810 | -0.891 | 51.642 | 6.309 | 6.309 | 0.000 | 0.000 | 0.000 | 0.000 |
840 | A | 874 | SER | 0 | 0.019 | 0.011 | 51.064 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
841 | A | 875 | CYS | 0 | -0.057 | -0.021 | 51.764 | 0.067 | 0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
842 | A | 876 | MET | 0 | -0.028 | -0.022 | 48.017 | 0.164 | 0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
843 | A | 877 | TRP | 0 | -0.009 | -0.011 | 46.343 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
844 | A | 878 | ALA | 0 | -0.005 | -0.003 | 47.069 | 0.113 | 0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
845 | A | 879 | SER | 0 | -0.022 | -0.014 | 45.599 | 0.040 | 0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
846 | A | 880 | LYS | 1 | 0.808 | 0.913 | 42.907 | -7.103 | -7.103 | 0.000 | 0.000 | 0.000 | 0.000 |
847 | A | 881 | HIS | 0 | -0.001 | -0.007 | 43.366 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
848 | A | 882 | ASP | -1 | -0.822 | -0.906 | 39.652 | 8.050 | 8.050 | 0.000 | 0.000 | 0.000 | 0.000 |
849 | A | 883 | ASN | 0 | -0.108 | -0.055 | 41.767 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
850 | A | 884 | ARG | 1 | 1.029 | 1.003 | 39.285 | -7.967 | -7.967 | 0.000 | 0.000 | 0.000 | 0.000 |
851 | A | 885 | ASP | -1 | -0.861 | -0.917 | 44.998 | 6.720 | 6.720 | 0.000 | 0.000 | 0.000 | 0.000 |
852 | A | 886 | VAL | 0 | 0.002 | -0.020 | 47.849 | -0.124 | -0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
853 | A | 887 | GLU | -1 | -0.838 | -0.909 | 42.797 | 7.525 | 7.525 | 0.000 | 0.000 | 0.000 | 0.000 |
854 | A | 888 | THR | 0 | -0.085 | -0.052 | 47.252 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
855 | A | 889 | ALA | 0 | 0.006 | 0.001 | 48.874 | -0.097 | -0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
856 | A | 890 | GLY | 0 | 0.063 | 0.023 | 50.363 | -0.129 | -0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
857 | A | 891 | LEU | 0 | -0.018 | -0.012 | 45.447 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
858 | A | 892 | ASN | 0 | -0.083 | -0.045 | 50.041 | -0.090 | -0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
859 | A | 893 | MET | 0 | 0.033 | 0.048 | 53.140 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
860 | A | 894 | CYS | 0 | 0.003 | -0.006 | 51.816 | -0.087 | -0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
861 | A | 895 | LEU | 0 | -0.035 | -0.007 | 52.258 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
862 | A | 896 | GLU | -1 | -0.797 | -0.900 | 54.337 | 5.612 | 5.612 | 0.000 | 0.000 | 0.000 | 0.000 |
863 | A | 897 | LEU | 0 | -0.015 | 0.005 | 56.654 | -0.114 | -0.114 | 0.000 | 0.000 | 0.000 | 0.000 |
864 | A | 898 | ILE | 0 | 0.007 | -0.006 | 53.296 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
865 | A | 899 | ASN | 0 | 0.037 | 0.018 | 56.151 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
866 | A | 900 | ASN | 0 | 0.014 | 0.014 | 59.216 | -0.123 | -0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
867 | A | 901 | ILE | 0 | -0.038 | -0.012 | 60.212 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
868 | A | 902 | ALA | 0 | -0.060 | -0.027 | 59.946 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
869 | A | 903 | GLU | -1 | -0.864 | -0.928 | 61.319 | 5.222 | 5.222 | 0.000 | 0.000 | 0.000 | 0.000 |
870 | A | 904 | LYS | 1 | 0.843 | 0.933 | 64.503 | -5.102 | -5.102 | 0.000 | 0.000 | 0.000 | 0.000 |
871 | A | 905 | THR | 0 | -0.002 | 0.001 | 65.089 | -0.074 | -0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
872 | A | 906 | ASP | -1 | -0.906 | -0.936 | 67.385 | 4.605 | 4.605 | 0.000 | 0.000 | 0.000 | 0.000 |
873 | A | 907 | VAL | 0 | 0.052 | -0.012 | 65.933 | 0.069 | 0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
874 | A | 908 | GLN | 0 | -0.021 | -0.007 | 65.247 | 0.035 | 0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
875 | A | 909 | THR | 0 | 0.025 | 0.014 | 65.482 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
876 | A | 910 | CYS | 0 | -0.003 | 0.014 | 62.541 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
877 | A | 911 | ASN | 0 | 0.040 | -0.006 | 61.083 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
878 | A | 912 | ALA | 0 | 0.028 | 0.025 | 60.742 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
879 | A | 913 | PHE | 0 | -0.001 | 0.004 | 57.232 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
880 | A | 914 | PHE | 0 | 0.002 | -0.028 | 56.348 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
881 | A | 915 | ASN | 0 | -0.053 | -0.021 | 56.116 | 0.126 | 0.126 | 0.000 | 0.000 | 0.000 | 0.000 |
882 | A | 916 | GLN | 0 | 0.018 | 0.008 | 56.000 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
883 | A | 917 | PHE | 0 | -0.021 | -0.031 | 54.139 | 0.156 | 0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
884 | A | 918 | PHE | 0 | 0.020 | 0.028 | 50.773 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
885 | A | 919 | ILE | 0 | 0.005 | 0.009 | 49.109 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
886 | A | 920 | ARG | 1 | 0.783 | 0.874 | 47.899 | -6.449 | -6.449 | 0.000 | 0.000 | 0.000 | 0.000 |
887 | A | 921 | ILE | 0 | 0.037 | 0.005 | 48.526 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
888 | A | 922 | LEU | 0 | -0.002 | 0.011 | 46.325 | 0.140 | 0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
889 | A | 923 | GLN | 0 | -0.014 | 0.002 | 43.504 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
890 | A | 924 | ASP | -1 | -0.788 | -0.872 | 43.643 | 7.204 | 7.204 | 0.000 | 0.000 | 0.000 | 0.000 |
891 | A | 925 | VAL | 0 | 0.003 | -0.009 | 43.475 | 0.167 | 0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
892 | A | 926 | PHE | 0 | 0.002 | 0.001 | 40.222 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
893 | A | 927 | PHE | 0 | -0.030 | -0.015 | 39.378 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
894 | A | 928 | VAL | 0 | -0.020 | -0.006 | 38.647 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
895 | A | 929 | LEU | 0 | -0.026 | 0.003 | 38.814 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
896 | A | 930 | THR | 0 | -0.094 | -0.076 | 35.369 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
897 | A | 931 | ASP | -1 | -0.873 | -0.926 | 34.236 | 9.489 | 9.489 | 0.000 | 0.000 | 0.000 | 0.000 |
898 | A | 932 | THR | 0 | -0.062 | -0.039 | 30.618 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
899 | A | 933 | ASP | -1 | -0.858 | -0.934 | 33.014 | 8.572 | 8.572 | 0.000 | 0.000 | 0.000 | 0.000 |
900 | A | 934 | HIS | 1 | 0.826 | 0.904 | 35.755 | -8.425 | -8.425 | 0.000 | 0.000 | 0.000 | 0.000 |
901 | A | 935 | LYS | 1 | 0.800 | 0.899 | 32.419 | -9.955 | -9.955 | 0.000 | 0.000 | 0.000 | 0.000 |
902 | A | 936 | ALA | 0 | -0.024 | -0.012 | 38.240 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
903 | A | 937 | GLY | 0 | 0.072 | 0.047 | 41.251 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
904 | A | 938 | PHE | 0 | 0.004 | -0.006 | 40.395 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
905 | A | 939 | LYS | 1 | 0.864 | 0.920 | 42.516 | -6.748 | -6.748 | 0.000 | 0.000 | 0.000 | 0.000 |
906 | A | 940 | THR | 0 | -0.012 | -0.016 | 45.555 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
907 | A | 941 | GLN | 0 | 0.027 | 0.021 | 41.461 | -0.028 | -0.028 | 0.000 | 0.000 | 0.000 | 0.000 |
908 | A | 942 | SER | 0 | -0.026 | -0.019 | 44.116 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
909 | A | 943 | MET | 0 | -0.003 | -0.001 | 45.649 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
910 | A | 944 | LEU | 0 | -0.009 | -0.006 | 48.323 | -0.113 | -0.113 | 0.000 | 0.000 | 0.000 | 0.000 |
911 | A | 945 | LEU | 0 | 0.025 | 0.008 | 43.449 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
912 | A | 946 | MET | 0 | 0.005 | 0.032 | 48.034 | -0.059 | -0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
913 | A | 947 | ARG | 1 | 0.808 | 0.871 | 49.933 | -5.834 | -5.834 | 0.000 | 0.000 | 0.000 | 0.000 |
914 | A | 948 | LEU | 0 | -0.005 | 0.006 | 49.031 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
915 | A | 949 | PHE | 0 | 0.020 | -0.016 | 45.511 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
916 | A | 950 | TYR | 0 | -0.030 | -0.003 | 51.635 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
917 | A | 951 | PHE | 0 | -0.052 | -0.029 | 54.731 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
918 | A | 952 | VAL | 0 | -0.029 | -0.007 | 52.559 | -0.096 | -0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
919 | A | 953 | HIS | 0 | -0.061 | -0.045 | 54.024 | -0.071 | -0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
920 | A | 954 | PRO | 0 | 0.027 | 0.053 | 55.000 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
921 | A | 955 | ALA | 0 | 0.028 | 0.001 | 55.748 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
922 | A | 956 | ASP | -1 | -0.924 | -0.952 | 57.777 | 5.370 | 5.370 | 0.000 | 0.000 | 0.000 | 0.000 |
923 | A | 957 | GLY | 0 | -0.031 | -0.022 | 61.559 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
924 | A | 958 | SER | 0 | -0.065 | -0.028 | 64.457 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
925 | A | 959 | ALA | 0 | 0.013 | -0.006 | 66.485 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
926 | A | 960 | PRO | 0 | 0.010 | 0.010 | 61.687 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
927 | A | 961 | LYS | 1 | 0.916 | 0.950 | 62.989 | -5.084 | -5.084 | 0.000 | 0.000 | 0.000 | 0.000 |
928 | A | 962 | ILE | 0 | 0.008 | 0.000 | 59.691 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
929 | A | 963 | GLN | 0 | 0.011 | 0.027 | 59.755 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
930 | A | 964 | GLY | 0 | 0.061 | 0.016 | 60.328 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
931 | A | 965 | PRO | 0 | -0.091 | -0.030 | 59.899 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
932 | A | 966 | ILE | 0 | -0.012 | 0.004 | 60.543 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
933 | A | 967 | TYR | 0 | 0.026 | 0.003 | 51.722 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
934 | A | 968 | GLN | 0 | -0.015 | 0.012 | 50.715 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
935 | A | 969 | PRO | 0 | -0.006 | -0.010 | 55.818 | -0.038 | -0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
936 | A | 970 | ASP | -1 | -0.857 | -0.931 | 56.007 | 5.511 | 5.511 | 0.000 | 0.000 | 0.000 | 0.000 |
937 | A | 971 | GLN | 0 | -0.110 | -0.058 | 54.815 | 0.086 | 0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
938 | A | 972 | ALA | 0 | -0.021 | 0.013 | 51.303 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
939 | A | 973 | GLN | 0 | 0.007 | -0.005 | 50.313 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
940 | A | 974 | PRO | 0 | 0.026 | 0.013 | 53.621 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
941 | A | 975 | GLY | 0 | -0.047 | -0.014 | 54.845 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
942 | A | 976 | THR | 0 | -0.004 | 0.001 | 55.513 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
943 | A | 977 | GLY | 0 | 0.034 | 0.015 | 56.010 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
944 | A | 978 | ASN | 0 | -0.007 | -0.010 | 54.571 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
945 | A | 979 | ARG | 1 | 0.900 | 0.961 | 50.069 | -6.205 | -6.205 | 0.000 | 0.000 | 0.000 | 0.000 |
946 | A | 980 | GLU | -1 | -0.879 | -0.950 | 50.314 | 6.167 | 6.167 | 0.000 | 0.000 | 0.000 | 0.000 |
947 | A | 981 | PHE | 0 | 0.021 | 0.007 | 48.753 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
948 | A | 982 | LEU | 0 | 0.023 | 0.021 | 47.604 | 0.151 | 0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
949 | A | 983 | ALA | 0 | 0.021 | -0.001 | 45.959 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
950 | A | 984 | ASN | 0 | -0.066 | -0.032 | 44.401 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
951 | A | 985 | PHE | 0 | 0.043 | 0.027 | 43.717 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
952 | A | 986 | VAL | 0 | 0.034 | 0.027 | 42.013 | 0.185 | 0.185 | 0.000 | 0.000 | 0.000 | 0.000 |
953 | A | 987 | GLY | 0 | 0.024 | 0.010 | 40.174 | 0.233 | 0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
954 | A | 988 | THR | 0 | -0.104 | -0.069 | 38.956 | 0.211 | 0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
955 | A | 989 | LEU | 0 | 0.005 | 0.002 | 38.785 | 0.188 | 0.188 | 0.000 | 0.000 | 0.000 | 0.000 |
956 | A | 990 | LEU | 0 | 0.004 | -0.007 | 36.833 | 0.244 | 0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
957 | A | 991 | GLN | 0 | -0.067 | -0.033 | 34.613 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
958 | A | 992 | ASN | 0 | -0.081 | -0.041 | 33.103 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
959 | A | 993 | ALA | 0 | 0.002 | 0.027 | 32.168 | 0.269 | 0.269 | 0.000 | 0.000 | 0.000 | 0.000 |
960 | A | 994 | PHE | 0 | 0.033 | 0.012 | 26.721 | 0.397 | 0.397 | 0.000 | 0.000 | 0.000 | 0.000 |
961 | A | 995 | ALA | 0 | 0.034 | 0.018 | 28.404 | -0.254 | -0.254 | 0.000 | 0.000 | 0.000 | 0.000 |
962 | A | 996 | ASN | 0 | -0.069 | -0.036 | 26.295 | -0.021 | -0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
963 | A | 997 | LEU | 0 | 0.022 | 0.024 | 28.308 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
964 | A | 998 | THR | 0 | 0.020 | 0.011 | 31.882 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
965 | A | 999 | PRO | 0 | 0.074 | 0.013 | 34.095 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
966 | A | 1000 | LEU | 0 | -0.010 | 0.004 | 37.467 | -0.244 | -0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
967 | A | 1001 | GLN | 0 | 0.057 | 0.034 | 32.581 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
968 | A | 1002 | ILE | 0 | 0.028 | 0.017 | 35.872 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
969 | A | 1003 | THR | 0 | -0.052 | -0.038 | 39.096 | -0.269 | -0.269 | 0.000 | 0.000 | 0.000 | 0.000 |
970 | A | 1004 | THR | 0 | -0.008 | -0.020 | 39.859 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
971 | A | 1005 | PHE | 0 | 0.044 | 0.042 | 39.368 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
972 | A | 1006 | VAL | 0 | 0.050 | 0.022 | 41.483 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
973 | A | 1007 | LYS | 1 | 0.782 | 0.870 | 44.428 | -6.835 | -6.835 | 0.000 | 0.000 | 0.000 | 0.000 |
974 | A | 1008 | ASP | -1 | -0.873 | -0.931 | 42.518 | 7.380 | 7.380 | 0.000 | 0.000 | 0.000 | 0.000 |
975 | A | 1009 | CYS | 0 | -0.089 | -0.055 | 43.806 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
976 | A | 1010 | PHE | 0 | -0.051 | -0.049 | 46.663 | -0.181 | -0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
977 | A | 1011 | GLU | -1 | -0.801 | -0.879 | 49.465 | 6.378 | 6.378 | 0.000 | 0.000 | 0.000 | 0.000 |
978 | A | 1012 | LEU | 0 | -0.050 | -0.010 | 46.109 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
979 | A | 1013 | ASN | 0 | -0.010 | -0.016 | 50.099 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
980 | A | 1014 | THR | 0 | 0.027 | 0.003 | 51.888 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
981 | A | 1015 | GLN | 0 | -0.052 | -0.018 | 51.252 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
982 | A | 1016 | TYR | 0 | 0.052 | 0.008 | 47.968 | 0.107 | 0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
983 | A | 1017 | ASP | -1 | -0.842 | -0.918 | 48.061 | 6.677 | 6.677 | 0.000 | 0.000 | 0.000 | 0.000 |
984 | A | 1018 | LYS | 1 | 0.953 | 0.963 | 46.333 | -6.581 | -6.581 | 0.000 | 0.000 | 0.000 | 0.000 |
985 | A | 1019 | PHE | 0 | 0.038 | 0.039 | 45.124 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
986 | A | 1020 | ARG | 1 | 0.784 | 0.855 | 44.087 | -6.856 | -6.856 | 0.000 | 0.000 | 0.000 | 0.000 |
987 | A | 1021 | VAL | 0 | -0.025 | -0.008 | 41.564 | 0.201 | 0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
988 | A | 1022 | VAL | 0 | -0.003 | 0.003 | 40.439 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
989 | A | 1023 | LEU | 0 | -0.020 | -0.007 | 39.393 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
990 | A | 1024 | ARG | 1 | 0.860 | 0.927 | 37.712 | -7.875 | -7.875 | 0.000 | 0.000 | 0.000 | 0.000 |
991 | A | 1025 | ASP | -1 | -0.837 | -0.924 | 35.869 | 8.798 | 8.798 | 0.000 | 0.000 | 0.000 | 0.000 |
992 | A | 1026 | PHE | 0 | -0.042 | -0.018 | 34.489 | 0.366 | 0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
993 | A | 1027 | LEU | 0 | -0.003 | -0.012 | 33.961 | 0.255 | 0.255 | 0.000 | 0.000 | 0.000 | 0.000 |
994 | A | 1028 | ILE | 0 | -0.007 | -0.002 | 31.415 | 0.313 | 0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
995 | A | 1029 | SER | 0 | -0.089 | -0.042 | 30.170 | 0.363 | 0.363 | 0.000 | 0.000 | 0.000 | 0.000 |
996 | A | 1030 | LEU | 0 | -0.072 | -0.013 | 28.473 | 0.496 | 0.496 | 0.000 | 0.000 | 0.000 | 0.000 |
997 | A | 1031 | ARG | 1 | 0.900 | 0.932 | 21.032 | -14.339 | -14.339 | 0.000 | 0.000 | 0.000 | 0.000 |
998 | A | 1032 | GLU | -1 | -0.795 | -0.905 | 23.809 | 13.381 | 13.381 | 0.000 | 0.000 | 0.000 | 0.000 |
999 | A | 1033 | PHE | 0 | 0.022 | 0.012 | 26.666 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
1000 | A | 1034 | ALA | 0 | -0.063 | -0.017 | 26.059 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
1001 | A | 1035 | GLY | 0 | -0.055 | -0.028 | 25.435 | 0.032 | 0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
1002 | A | 1036 | ASP | -1 | -0.771 | -0.862 | 26.279 | 10.362 | 10.362 | 0.000 | 0.000 | 0.000 | 0.000 |
1003 | A | 1037 | ASN | 0 | -0.087 | -0.029 | 28.876 | -0.231 | -0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
1004 | A | 1038 | ALA | 0 | 0.009 | -0.004 | 31.249 | -0.156 | -0.156 | 0.000 | 0.000 | 0.000 | 0.000 |
1005 | A | 1039 | GLU | -1 | -0.784 | -0.884 | 34.856 | 9.135 | 9.135 | 0.000 | 0.000 | 0.000 | 0.000 |
1006 | A | 1040 | LEU | 0 | -0.019 | -0.014 | 35.673 | -0.304 | -0.304 | 0.000 | 0.000 | 0.000 | 0.000 |
1007 | A | 1041 | TYR | 0 | -0.017 | -0.018 | 36.289 | -0.167 | -0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
1008 | A | 1042 | GLN | 0 | 0.009 | 0.006 | 41.086 | -0.058 | -0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
1009 | A | 1043 | VAL | 0 | 0.006 | 0.001 | 43.568 | -0.128 | -0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
1010 | A | 1044 | GLU | -1 | -0.770 | -0.861 | 43.058 | 7.105 | 7.105 | 0.000 | 0.000 | 0.000 | 0.000 |
1011 | A | 1045 | LYS | 1 | 0.805 | 0.892 | 42.215 | -7.430 | -7.430 | 0.000 | 0.000 | 0.000 | 0.000 |
1012 | A | 1046 | GLU | -1 | -0.758 | -0.861 | 45.449 | 6.570 | 6.570 | 0.000 | 0.000 | 0.000 | 0.000 |
1013 | A | 1047 | GLN | 0 | 0.000 | -0.008 | 48.793 | -0.223 | -0.223 | 0.000 | 0.000 | 0.000 | 0.000 |
1014 | A | 1048 | GLN | 0 | 0.060 | 0.038 | 44.713 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
1015 | A | 1049 | GLU | -1 | -0.813 | -0.909 | 46.599 | 6.841 | 6.841 | 0.000 | 0.000 | 0.000 | 0.000 |
1016 | A | 1050 | ARG | 1 | 0.852 | 0.939 | 50.775 | -5.903 | -5.903 | 0.000 | 0.000 | 0.000 | 0.000 |
1017 | A | 1051 | GLU | -1 | -0.919 | -0.966 | 53.021 | 6.013 | 6.013 | 0.000 | 0.000 | 0.000 | 0.000 |
1018 | A | 1052 | ALA | 0 | -0.005 | 0.008 | 51.627 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
1019 | A | 1053 | ARG | 1 | 0.946 | 0.965 | 53.008 | -6.114 | -6.114 | 0.000 | 0.000 | 0.000 | 0.000 |
1020 | A | 1054 | ALA | 0 | -0.015 | -0.001 | 55.894 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
1021 | A | 1055 | ALA | 0 | 0.030 | 0.020 | 56.594 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
1022 | A | 1056 | ASP | -1 | -0.802 | -0.880 | 56.230 | 5.594 | 5.594 | 0.000 | 0.000 | 0.000 | 0.000 |
1023 | A | 1057 | LEU | 0 | -0.013 | -0.023 | 58.312 | -0.082 | -0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
1024 | A | 1058 | GLU | -1 | -0.909 | -0.940 | 61.198 | 4.901 | 4.901 | 0.000 | 0.000 | 0.000 | 0.000 |
1025 | A | 1059 | ARG | 1 | 0.775 | 0.864 | 58.064 | -5.655 | -5.655 | 0.000 | 0.000 | 0.000 | 0.000 |
1026 | A | 1060 | ARG | 1 | 0.850 | 0.898 | 58.401 | -5.561 | -5.561 | 0.000 | 0.000 | 0.000 | 0.000 |
1027 | A | 1061 | SER | 0 | -0.069 | -0.032 | 63.544 | -0.099 | -0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
1028 | A | 1062 | LYS | 1 | 0.845 | 0.937 | 65.777 | -5.010 | -5.010 | 0.000 | 0.000 | 0.000 | 0.000 |
1029 | A | 1063 | VAL | 0 | 0.007 | 0.023 | 65.934 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
1030 | A | 1064 | GLY | 0 | 0.025 | 0.007 | 67.727 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
1031 | A | 1065 | GLY | 0 | 0.033 | 0.010 | 68.802 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
1032 | A | 1066 | LEU | 0 | -0.032 | -0.008 | 62.782 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
1033 | A | 1067 | LEU | 0 | -0.043 | -0.003 | 64.002 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
1034 | A | 1068 | LYS | 1 | 0.895 | 0.941 | 61.483 | -5.341 | -5.341 | 0.000 | 0.000 | 0.000 | 0.000 |
1035 | A | 1069 | PRO | 0 | 0.021 | -0.007 | 67.144 | -0.008 | -0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
1036 | A | 1070 | SER | 0 | -0.017 | -0.009 | 66.510 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
1037 | A | 1071 | GLU | -1 | -0.893 | -0.931 | 62.135 | 5.261 | 5.261 | 0.000 | 0.000 | 0.000 | 0.000 |
1038 | A | 1072 | LEU | 0 | -0.039 | -0.006 | 66.143 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |