FMODB ID: J2279
Calculation Name: 1M53-A-Xray372
Preferred Name:
Target Type:
Ligand Name:
ligand 3-letter code:
PDB ID: 1M53
Chain ID: A
UniProt ID: Q8KR84
Base Structure: X-ray
Registration Date: 2023-09-27
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 | 556 |
LigandCharge | |
Software | ABINIT-MP - Open Ver. 1 Rev. 23Q2 / 20200603(SMP) |
Total energy (hartree)
FMO2-HF: Electronic energy | -13525256.700555 |
---|---|
FMO2-HF: Nuclear repulsion | 13296181.545209 |
FMO2-HF: Total energy | -229075.155345 |
FMO2-MP2: Total energy | -229750.829835 |
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:43:GLU)
Summations of interaction energy for
fragment #1(A:43: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. |
-85.581 | -77.402 | 1.318 | -3.472 | -6.026 | 0.022 |
Interaction energy analysis for fragmet #1(A:43: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 | 45 | PRO | 0 | 0.129 | 0.070 | 2.842 | -7.566 | -4.803 | 0.160 | -0.952 | -1.971 | 0.003 |
4 | A | 46 | ALA | 0 | 0.010 | -0.002 | 4.323 | -4.343 | -4.226 | 0.000 | -0.021 | -0.096 | 0.000 |
5 | A | 47 | TRP | 0 | 0.095 | 0.049 | 7.873 | 0.506 | 0.506 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 48 | TRP | 0 | -0.004 | -0.008 | 10.166 | 0.418 | 0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 49 | LYS | 1 | 0.832 | 0.934 | 4.942 | -38.299 | -38.299 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 50 | GLU | -1 | -0.808 | -0.897 | 6.376 | 38.050 | 38.050 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 51 | ALA | 0 | -0.049 | -0.003 | 9.692 | -1.211 | -1.211 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 52 | VAL | 0 | 0.019 | 0.010 | 13.360 | 0.328 | 0.328 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 53 | PHE | 0 | -0.018 | -0.027 | 14.684 | -0.617 | -0.617 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 54 | TYR | 0 | -0.003 | -0.025 | 18.891 | -0.264 | -0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 55 | GLN | 0 | -0.020 | -0.024 | 22.635 | -0.398 | -0.398 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 56 | ILE | 0 | 0.013 | -0.001 | 25.045 | -0.246 | -0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 57 | TYR | 0 | 0.088 | 0.043 | 28.516 | -0.109 | -0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 58 | PRO | 0 | -0.030 | -0.027 | 31.137 | -0.227 | -0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 59 | ARG | 1 | 0.894 | 0.968 | 33.718 | -7.782 | -7.782 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 60 | SER | 0 | -0.044 | -0.025 | 35.206 | -0.281 | -0.281 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 61 | PHE | 0 | -0.012 | 0.010 | 30.106 | 0.056 | 0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 62 | LYS | 1 | 0.853 | 0.914 | 34.379 | -8.122 | -8.122 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 63 | ASP | -1 | -0.731 | -0.809 | 36.959 | 7.343 | 7.343 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 64 | THR | 0 | -0.075 | -0.061 | 38.997 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 65 | ASN | 0 | -0.078 | -0.051 | 41.760 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 66 | ASP | -1 | -0.827 | -0.883 | 44.428 | 6.723 | 6.723 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 67 | ASP | -1 | -0.842 | -0.917 | 44.109 | 6.983 | 6.983 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 68 | GLY | 0 | -0.038 | -0.016 | 44.644 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 69 | ILE | 0 | -0.068 | -0.049 | 40.064 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 70 | GLY | 0 | -0.024 | -0.008 | 37.473 | 0.011 | 0.011 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 71 | ASP | -1 | -0.738 | -0.866 | 37.523 | 8.004 | 8.004 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 72 | ILE | 0 | -0.014 | -0.033 | 33.344 | 0.267 | 0.267 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 73 | ARG | 1 | 0.871 | 0.920 | 34.416 | -7.503 | -7.503 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 74 | GLY | 0 | 0.041 | 0.021 | 36.258 | 0.065 | 0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 75 | ILE | 0 | -0.060 | -0.043 | 29.682 | 0.206 | 0.206 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 76 | ILE | 0 | -0.039 | -0.019 | 31.638 | 0.260 | 0.260 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 77 | GLU | -1 | -0.812 | -0.890 | 32.742 | 8.442 | 8.442 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 78 | LYS | 1 | 0.825 | 0.920 | 31.859 | -8.710 | -8.710 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 79 | LEU | 0 | 0.014 | 0.004 | 27.215 | 0.384 | 0.384 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 80 | ASP | -1 | -0.796 | -0.875 | 27.839 | 10.711 | 10.711 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 81 | TYR | 0 | -0.031 | -0.029 | 28.721 | 0.246 | 0.246 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 82 | LEU | 0 | 0.026 | 0.004 | 25.322 | 0.353 | 0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 83 | LYS | 1 | 0.887 | 0.929 | 19.908 | -14.390 | -14.390 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 84 | SER | 0 | -0.045 | -0.011 | 23.825 | 0.640 | 0.640 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 85 | LEU | 0 | -0.039 | -0.019 | 23.271 | 0.254 | 0.254 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 86 | GLY | 0 | 0.032 | 0.020 | 20.714 | 0.438 | 0.438 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 87 | ILE | 0 | -0.059 | -0.018 | 19.386 | 0.918 | 0.918 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 88 | ASP | -1 | -0.807 | -0.879 | 15.808 | 18.645 | 18.645 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 89 | ALA | 0 | -0.050 | -0.031 | 17.979 | -0.251 | -0.251 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 90 | ILE | 0 | 0.049 | 0.021 | 19.705 | -0.086 | -0.086 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 91 | TRP | 0 | -0.036 | -0.013 | 22.183 | 0.237 | 0.237 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 92 | ILE | 0 | -0.023 | -0.002 | 23.830 | -0.269 | -0.269 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 93 | ASN | 0 | 0.004 | -0.018 | 27.606 | 0.060 | 0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 94 | PRO | 0 | -0.081 | -0.029 | 29.666 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 95 | HIS | 1 | 0.943 | 0.977 | 29.960 | -9.952 | -9.952 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 96 | TYR | 0 | -0.064 | -0.055 | 29.639 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 97 | ASP | -1 | -0.841 | -0.898 | 36.138 | 7.227 | 7.227 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 98 | SER | 0 | 0.024 | -0.018 | 38.651 | 0.090 | 0.090 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 99 | PRO | 0 | -0.034 | -0.012 | 40.785 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 100 | ASN | 0 | -0.021 | -0.024 | 39.563 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 101 | THR | 0 | -0.033 | -0.026 | 41.661 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 102 | ASP | -1 | -0.833 | -0.938 | 36.775 | 8.388 | 8.388 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 103 | ASN | 0 | -0.073 | -0.030 | 37.098 | 0.144 | 0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 104 | GLY | 0 | 0.102 | 0.049 | 35.794 | 0.253 | 0.253 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 105 | TYR | 0 | -0.074 | -0.046 | 29.270 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 106 | ASP | -1 | -0.822 | -0.909 | 35.345 | 7.713 | 7.713 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 107 | ILE | 0 | 0.021 | 0.031 | 33.565 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 108 | SER | 0 | 0.014 | -0.029 | 38.199 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 109 | ASN | 0 | 0.014 | -0.014 | 39.524 | 0.031 | 0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 110 | TYR | 0 | 0.014 | -0.024 | 33.633 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 111 | ARG | 1 | 0.920 | 0.972 | 34.792 | -8.200 | -8.200 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 112 | GLN | 0 | -0.040 | -0.001 | 36.746 | -0.048 | -0.048 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 113 | ILE | 0 | -0.019 | -0.006 | 34.759 | 0.181 | 0.181 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 114 | MET | 0 | -0.032 | 0.022 | 36.735 | -0.256 | -0.256 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 115 | LYS | 1 | 1.007 | 0.991 | 39.312 | -6.549 | -6.549 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 116 | GLU | -1 | -0.804 | -0.906 | 40.819 | 7.372 | 7.372 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 117 | TYR | 0 | -0.001 | -0.003 | 34.473 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 118 | GLY | 0 | 0.057 | 0.045 | 38.142 | 0.149 | 0.149 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 119 | THR | 0 | -0.047 | -0.057 | 39.719 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 120 | MET | 0 | -0.020 | -0.021 | 35.289 | 0.316 | 0.316 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 121 | GLU | -1 | -0.896 | -0.930 | 36.256 | 7.844 | 7.844 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 122 | ASP | -1 | -0.736 | -0.824 | 36.575 | 8.106 | 8.106 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 123 | PHE | 0 | 0.009 | -0.008 | 29.019 | 0.303 | 0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 124 | ASP | -1 | -0.819 | -0.894 | 32.038 | 9.423 | 9.423 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 125 | SER | 0 | 0.022 | 0.007 | 31.992 | 0.209 | 0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 126 | LEU | 0 | -0.009 | 0.002 | 28.910 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 127 | VAL | 0 | -0.005 | -0.003 | 26.494 | 0.409 | 0.409 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 128 | ALA | 0 | -0.020 | -0.002 | 27.360 | 0.418 | 0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 129 | GLU | -1 | -0.760 | -0.870 | 28.948 | 9.962 | 9.962 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 130 | MET | 0 | -0.011 | -0.002 | 23.894 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 131 | LYS | 1 | 0.956 | 0.985 | 24.050 | -11.391 | -11.391 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 132 | LYS | 1 | 0.794 | 0.898 | 24.617 | -9.332 | -9.332 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 133 | ARG | 1 | 0.745 | 0.839 | 25.246 | -10.422 | -10.422 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 134 | ASN | 0 | -0.071 | -0.037 | 20.027 | 0.807 | 0.807 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 135 | MET | 0 | -0.026 | 0.003 | 20.074 | 0.590 | 0.590 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 136 | ARG | 1 | 0.924 | 0.957 | 14.758 | -18.602 | -18.602 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 137 | LEU | 0 | 0.033 | 0.016 | 20.788 | -0.050 | -0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 138 | MET | 0 | -0.056 | -0.012 | 18.219 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 139 | ILE | 0 | -0.001 | -0.005 | 22.699 | -0.446 | -0.446 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 140 | ASP | -1 | -0.703 | -0.837 | 25.004 | 11.239 | 11.239 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 141 | VAL | 0 | -0.009 | 0.007 | 26.142 | -0.462 | -0.462 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 142 | VAL | 0 | 0.030 | 0.014 | 28.279 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 143 | ILE | 0 | 0.029 | 0.021 | 28.175 | -0.316 | -0.316 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 144 | ASN | 0 | 0.010 | 0.027 | 31.185 | -0.168 | -0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 145 | HIS | 1 | 0.854 | 0.907 | 32.759 | -8.984 | -8.984 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 146 | THR | 0 | -0.004 | 0.034 | 35.747 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 147 | SER | 0 | 0.036 | 0.017 | 38.458 | -0.144 | -0.144 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 148 | ASP | -1 | -0.891 | -0.955 | 41.463 | 6.605 | 6.605 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 149 | GLN | 0 | 0.011 | -0.003 | 44.381 | -0.217 | -0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 150 | HIS | 0 | 0.038 | 0.035 | 38.809 | -0.184 | -0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 151 | PRO | 0 | 0.043 | 0.019 | 43.111 | -0.117 | -0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 152 | TRP | 0 | 0.010 | 0.010 | 36.745 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 153 | PHE | 0 | 0.008 | -0.002 | 43.631 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 154 | ILE | 0 | 0.008 | 0.004 | 45.274 | -0.159 | -0.159 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 155 | GLN | 0 | -0.046 | -0.027 | 46.640 | -0.223 | -0.223 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 156 | SER | 0 | -0.022 | 0.011 | 45.581 | -0.146 | -0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 157 | LYS | 1 | 0.894 | 0.955 | 47.747 | -6.400 | -6.400 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 158 | SER | 0 | -0.097 | -0.040 | 50.093 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 159 | ASP | -1 | -0.756 | -0.892 | 52.125 | 5.457 | 5.457 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 160 | LYS | 1 | 0.875 | 0.945 | 51.586 | -5.505 | -5.505 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 161 | ASN | 0 | -0.034 | -0.014 | 51.518 | 0.079 | 0.079 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 162 | ASN | 0 | 0.011 | 0.021 | 49.345 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 163 | PRO | 0 | 0.055 | 0.021 | 48.002 | 0.096 | 0.096 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 164 | TYR | 0 | 0.000 | 0.001 | 42.738 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 165 | ARG | 1 | 0.829 | 0.921 | 45.095 | -6.060 | -6.060 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 166 | ASP | -1 | -0.891 | -0.945 | 42.974 | 6.765 | 6.765 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 167 | TYR | 0 | -0.072 | -0.059 | 39.877 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 168 | TYR | 0 | -0.026 | -0.030 | 40.100 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 169 | PHE | 0 | -0.024 | -0.006 | 37.177 | -0.102 | -0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 170 | TRP | 0 | 0.023 | 0.010 | 42.771 | -0.110 | -0.110 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 171 | ARG | 1 | 0.936 | 0.960 | 42.604 | -6.801 | -6.801 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 172 | ASP | -1 | -0.810 | -0.895 | 48.042 | 5.806 | 5.806 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 173 | GLY | 0 | 0.008 | 0.003 | 50.678 | 0.085 | 0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 174 | LYS | 1 | 0.828 | 0.901 | 51.817 | -5.625 | -5.625 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 175 | ASP | -1 | -0.797 | -0.890 | 53.767 | 5.380 | 5.380 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 176 | ASN | 0 | -0.042 | -0.015 | 56.416 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 177 | GLN | 0 | 0.004 | -0.008 | 52.646 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 178 | PRO | 0 | -0.003 | 0.000 | 48.257 | -0.018 | -0.018 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 179 | PRO | 0 | -0.032 | -0.005 | 46.438 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 180 | ASN | 0 | 0.021 | 0.016 | 42.139 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 181 | ASN | 0 | 0.012 | 0.011 | 44.090 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 182 | TYR | 0 | 0.021 | 0.004 | 39.077 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 183 | PRO | 0 | 0.034 | 0.031 | 39.998 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 184 | SER | 0 | -0.015 | 0.012 | 40.089 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 185 | PHE | 0 | -0.024 | -0.030 | 33.248 | -0.020 | -0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 186 | PHE | 0 | -0.045 | -0.040 | 36.152 | 0.012 | 0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 187 | GLY | 0 | 0.055 | 0.052 | 40.932 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 188 | GLY | 0 | -0.018 | -0.003 | 43.892 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 189 | SER | 0 | -0.012 | -0.012 | 44.351 | 0.173 | 0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 190 | ALA | 0 | 0.011 | 0.009 | 41.079 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 191 | TRP | 0 | -0.015 | -0.028 | 42.987 | 0.039 | 0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 192 | GLN | 0 | -0.005 | 0.006 | 45.853 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 193 | LYS | 1 | 0.913 | 0.971 | 48.265 | -5.564 | -5.564 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 194 | ASP | -1 | -0.792 | -0.863 | 51.170 | 5.834 | 5.834 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 195 | ALA | 0 | -0.032 | -0.013 | 52.833 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 196 | LYS | 1 | 0.899 | 0.945 | 55.665 | -5.568 | -5.568 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 197 | SER | 0 | -0.048 | -0.055 | 52.915 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 198 | GLY | 0 | 0.041 | 0.009 | 54.978 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 199 | GLN | 0 | -0.083 | -0.049 | 50.237 | 0.026 | 0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 200 | TYR | 0 | -0.030 | -0.037 | 48.365 | -0.053 | -0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 201 | TYR | 0 | -0.010 | -0.016 | 44.116 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 202 | LEU | 0 | -0.021 | -0.011 | 39.428 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 203 | HIS | 1 | 0.792 | 0.895 | 40.137 | -7.065 | -7.065 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 204 | TYR | 0 | 0.056 | 0.025 | 34.185 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 205 | PHE | 0 | 0.041 | 0.035 | 32.314 | -0.040 | -0.040 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 206 | ALA | 0 | 0.096 | 0.066 | 38.428 | -0.227 | -0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 207 | ARG | 1 | 0.925 | 0.940 | 41.499 | -6.297 | -6.297 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 208 | GLN | 0 | -0.039 | -0.010 | 43.727 | -0.017 | -0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 209 | GLN | 0 | -0.028 | -0.034 | 37.126 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 210 | PRO | 0 | -0.040 | 0.004 | 39.744 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 211 | ASP | -1 | -0.750 | -0.886 | 35.960 | 8.437 | 8.437 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 212 | LEU | 0 | -0.018 | 0.002 | 34.958 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 213 | ASN | 0 | -0.012 | -0.025 | 36.376 | 0.266 | 0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 214 | TRP | 0 | 0.011 | -0.022 | 28.383 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 215 | ASP | -1 | -0.831 | -0.873 | 33.879 | 8.444 | 8.444 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 216 | ASN | 0 | -0.034 | -0.016 | 35.894 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 217 | PRO | 0 | 0.009 | -0.018 | 35.278 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 218 | LYS | 1 | 0.968 | 0.993 | 36.071 | -6.815 | -6.815 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 219 | VAL | 0 | 0.035 | 0.028 | 34.871 | 0.072 | 0.072 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 220 | ARG | 1 | 0.805 | 0.889 | 30.399 | -8.835 | -8.835 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 221 | GLU | -1 | -0.817 | -0.891 | 32.465 | 9.376 | 9.376 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 222 | ASP | -1 | -0.846 | -0.899 | 34.313 | 7.931 | 7.931 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 223 | LEU | 0 | -0.039 | -0.023 | 31.624 | 0.105 | 0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 224 | TYR | 0 | -0.030 | -0.047 | 28.331 | 0.396 | 0.396 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 225 | ALA | 0 | -0.039 | -0.018 | 30.787 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 226 | MET | 0 | -0.089 | -0.030 | 31.048 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 227 | LEU | 0 | 0.023 | 0.001 | 26.724 | 0.111 | 0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 228 | ARG | 1 | 0.979 | 0.990 | 28.435 | -9.764 | -9.764 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 229 | PHE | 0 | -0.002 | 0.015 | 29.463 | -0.042 | -0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 230 | TRP | 0 | 0.016 | -0.005 | 28.703 | -0.015 | -0.015 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 231 | LEU | 0 | -0.019 | -0.018 | 23.849 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 232 | ASP | -1 | -0.857 | -0.903 | 26.606 | 10.450 | 10.450 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 233 | LYS | 1 | 0.749 | 0.845 | 29.138 | -9.260 | -9.260 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 234 | GLY | 0 | 0.004 | 0.009 | 25.815 | -0.062 | -0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 235 | VAL | 0 | -0.065 | -0.027 | 24.484 | 0.389 | 0.389 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 236 | SER | 0 | 0.039 | 0.011 | 19.560 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 237 | GLY | 0 | 0.009 | 0.001 | 19.134 | 0.929 | 0.929 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 238 | MET | 0 | -0.069 | -0.006 | 20.457 | -0.738 | -0.738 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 239 | ARG | 1 | 0.803 | 0.881 | 21.174 | -10.675 | -10.675 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 240 | PHE | 0 | -0.036 | -0.035 | 21.862 | -0.595 | -0.595 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 241 | ASP | -1 | -0.768 | -0.886 | 24.908 | 10.257 | 10.257 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 242 | THR | 0 | -0.015 | -0.018 | 27.317 | -0.262 | -0.262 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 243 | VAL | 0 | 0.008 | 0.005 | 22.657 | -0.283 | -0.283 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 244 | ALA | 0 | -0.051 | -0.023 | 25.110 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 245 | THR | 0 | 0.059 | 0.031 | 26.554 | -0.197 | -0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 246 | TYR | 0 | -0.017 | 0.002 | 26.817 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 247 | SER | 0 | -0.042 | -0.001 | 30.172 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 248 | LYS | 1 | 0.841 | 0.918 | 31.788 | -8.516 | -8.516 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 249 | ILE | 0 | 0.038 | 0.014 | 34.490 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 250 | PRO | 0 | 0.023 | 0.003 | 35.462 | -0.214 | -0.214 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 251 | GLY | 0 | 0.003 | -0.005 | 38.677 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 252 | PHE | 0 | -0.065 | -0.018 | 38.823 | -0.165 | -0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 253 | PRO | 0 | 0.036 | 0.034 | 39.916 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 254 | ASN | 0 | 0.029 | -0.004 | 41.862 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 255 | LEU | 0 | -0.059 | -0.018 | 38.665 | 0.129 | 0.129 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 256 | THR | 0 | 0.004 | -0.020 | 40.354 | -0.143 | -0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 257 | PRO | 0 | 0.048 | -0.004 | 42.153 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 258 | GLU | -1 | -0.813 | -0.883 | 37.572 | 7.831 | 7.831 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 259 | GLN | 0 | 0.017 | 0.004 | 36.476 | -0.075 | -0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 260 | GLN | 0 | -0.039 | -0.004 | 38.115 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 261 | LYS | 1 | 0.897 | 0.936 | 38.254 | -7.438 | -7.438 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 262 | ASN | 0 | 0.016 | 0.022 | 33.462 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 263 | PHE | 0 | 0.031 | 0.006 | 34.473 | 0.203 | 0.203 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 264 | ALA | 0 | -0.012 | -0.017 | 31.960 | 0.112 | 0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 265 | GLU | -1 | -0.856 | -0.927 | 29.274 | 9.902 | 9.902 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 266 | GLN | 0 | 0.028 | 0.018 | 30.759 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 267 | TYR | 0 | -0.048 | -0.036 | 32.937 | -0.025 | -0.025 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 268 | THR | 0 | -0.005 | -0.014 | 27.317 | 0.212 | 0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 269 | MET | 0 | -0.107 | -0.048 | 28.185 | 0.382 | 0.382 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 270 | GLY | 0 | 0.039 | 0.027 | 30.115 | -0.209 | -0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 271 | PRO | 0 | -0.003 | -0.019 | 29.049 | 0.304 | 0.304 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 272 | ASN | 0 | -0.018 | -0.002 | 28.979 | 0.229 | 0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 273 | ILE | 0 | 0.014 | 0.017 | 24.930 | 0.182 | 0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 274 | HIS | 1 | 0.840 | 0.901 | 21.012 | -12.259 | -12.259 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 275 | ARG | 1 | 0.944 | 0.992 | 23.405 | -9.311 | -9.311 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 276 | TYR | 0 | -0.037 | -0.083 | 25.878 | 0.160 | 0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 277 | ILE | 0 | 0.046 | 0.033 | 21.192 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 278 | GLN | 0 | -0.020 | -0.020 | 20.284 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 279 | GLU | -1 | -0.912 | -0.927 | 22.424 | 9.749 | 9.749 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 280 | MET | 0 | 0.049 | 0.034 | 23.894 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 281 | ASN | 0 | -0.016 | -0.002 | 17.734 | 0.024 | 0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 282 | ARG | 1 | 0.930 | 0.993 | 21.905 | -11.501 | -11.501 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 283 | LYS | 1 | 0.794 | 0.877 | 23.401 | -9.417 | -9.417 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 284 | VAL | 0 | -0.039 | -0.022 | 25.009 | -0.275 | -0.275 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 285 | LEU | 0 | 0.034 | 0.023 | 20.408 | 0.162 | 0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 286 | SER | 0 | -0.057 | -0.035 | 19.224 | 0.357 | 0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 287 | ARG | 1 | 0.831 | 0.904 | 20.214 | -11.134 | -11.134 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 288 | TYR | 0 | -0.049 | -0.051 | 21.417 | -0.487 | -0.487 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 289 | ASP | -1 | -0.941 | -0.956 | 16.225 | 18.532 | 18.532 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 290 | VAL | 0 | -0.022 | -0.015 | 18.281 | -0.357 | -0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 291 | ALA | 0 | -0.028 | 0.010 | 15.281 | 0.482 | 0.482 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 292 | THR | 0 | -0.013 | -0.033 | 16.402 | -0.967 | -0.967 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 293 | ALA | 0 | 0.035 | 0.010 | 16.971 | 0.780 | 0.780 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 294 | GLY | 0 | 0.020 | 0.007 | 19.002 | -0.773 | -0.773 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 295 | GLU | -1 | -0.845 | -0.915 | 20.858 | 11.479 | 11.479 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 296 | ILE | 0 | -0.048 | -0.029 | 19.901 | -0.473 | -0.473 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 297 | PHE | 0 | 0.020 | 0.008 | 23.758 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 298 | GLY | 0 | 0.013 | 0.004 | 26.761 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 299 | VAL | 0 | -0.045 | -0.025 | 22.455 | -0.212 | -0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 300 | PRO | 0 | 0.030 | 0.036 | 24.218 | 0.326 | 0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 301 | LEU | 0 | 0.087 | 0.035 | 18.304 | 0.370 | 0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 302 | ASP | -1 | -0.917 | -0.951 | 19.864 | 12.160 | 12.160 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 303 | ARG | 1 | 0.870 | 0.927 | 21.101 | -10.597 | -10.597 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 304 | SER | 0 | -0.032 | -0.022 | 18.076 | 0.309 | 0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 305 | SER | 0 | 0.064 | 0.027 | 14.913 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 306 | GLN | 0 | -0.070 | -0.052 | 15.411 | 0.311 | 0.311 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 307 | PHE | 0 | 0.039 | 0.008 | 17.891 | -0.240 | -0.240 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 308 | PHE | 0 | 0.059 | 0.037 | 12.730 | 0.211 | 0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 309 | ASP | -1 | -0.832 | -0.869 | 11.511 | 20.047 | 20.047 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 310 | ARG | 1 | 0.982 | 0.984 | 6.590 | -28.522 | -28.522 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 311 | ARG | 1 | 0.828 | 0.880 | 10.170 | -19.489 | -19.489 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 312 | ARG | 1 | 0.794 | 0.900 | 12.390 | -14.821 | -14.821 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 313 | HIS | 0 | -0.057 | -0.013 | 14.147 | -0.447 | -0.447 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 314 | GLU | -1 | -0.725 | -0.841 | 16.010 | 12.178 | 12.178 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 315 | LEU | 0 | 0.024 | 0.012 | 16.949 | -0.269 | -0.269 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 316 | ASN | 0 | -0.022 | 0.014 | 12.993 | -0.212 | -0.212 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 317 | MET | 0 | 0.011 | 0.021 | 12.559 | 1.631 | 1.631 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 318 | ALA | 0 | -0.006 | 0.004 | 14.562 | -0.996 | -0.996 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 319 | PHE | 0 | 0.000 | 0.024 | 17.413 | 0.517 | 0.517 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 320 | MET | 0 | -0.001 | -0.001 | 16.073 | -0.581 | -0.581 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 321 | PHE | 0 | 0.022 | -0.020 | 21.107 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 322 | ASP | -1 | -0.878 | -0.939 | 22.393 | 12.131 | 12.131 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 323 | LEU | 0 | 0.012 | 0.003 | 20.947 | -0.303 | -0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 324 | ILE | 0 | -0.010 | 0.012 | 24.121 | -0.483 | -0.483 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 325 | ARG | 1 | 0.859 | 0.916 | 26.233 | -10.226 | -10.226 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 326 | LEU | 0 | 0.016 | 0.025 | 26.926 | -0.317 | -0.317 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 327 | ASP | -1 | -0.880 | -0.921 | 28.870 | 9.376 | 9.376 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 328 | ARG | 1 | 0.900 | 0.956 | 32.089 | -9.351 | -9.351 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 329 | ASP | -1 | -0.826 | -0.913 | 33.914 | 7.951 | 7.951 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 330 | SER | 0 | -0.020 | -0.008 | 34.469 | 0.092 | 0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 331 | ASN | 0 | -0.079 | -0.041 | 36.168 | -0.016 | -0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 332 | GLU | -1 | -0.875 | -0.922 | 39.442 | 7.033 | 7.033 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 333 | ARG | 1 | 0.850 | 0.912 | 33.954 | -8.391 | -8.391 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 334 | TRP | 0 | 0.013 | 0.006 | 36.380 | 0.258 | 0.258 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 335 | ARG | 1 | 0.782 | 0.864 | 38.965 | -7.043 | -7.043 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 336 | HIS | 0 | -0.053 | -0.036 | 34.975 | 0.094 | 0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 337 | LYS | 1 | 0.891 | 0.965 | 32.750 | -9.297 | -9.297 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 338 | SER | 0 | 0.039 | -0.002 | 35.500 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 339 | TRP | 0 | -0.045 | -0.007 | 28.290 | 0.216 | 0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 340 | SER | 0 | 0.014 | -0.011 | 31.171 | -0.052 | -0.052 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 341 | LEU | 0 | 0.047 | 0.024 | 25.069 | 0.264 | 0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 342 | SER | 0 | 0.008 | -0.007 | 26.457 | 0.405 | 0.405 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 343 | GLN | 0 | 0.014 | 0.016 | 26.339 | 0.187 | 0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 344 | PHE | 0 | 0.043 | 0.011 | 22.667 | 0.369 | 0.369 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 345 | ARG | 1 | 0.780 | 0.867 | 22.001 | -12.237 | -12.237 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 346 | GLN | 0 | -0.043 | -0.029 | 21.210 | 0.581 | 0.581 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 347 | ILE | 0 | -0.035 | -0.011 | 21.714 | 0.324 | 0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 348 | ILE | 0 | 0.032 | 0.015 | 17.288 | 0.424 | 0.424 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 349 | SER | 0 | -0.009 | -0.003 | 17.046 | 1.013 | 1.013 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 350 | LYS | 1 | 0.936 | 0.971 | 16.642 | -11.340 | -11.340 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 351 | MET | 0 | 0.005 | 0.025 | 16.448 | 0.336 | 0.336 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 352 | ASP | -1 | -0.804 | -0.880 | 11.505 | 24.293 | 24.293 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 353 | VAL | 0 | -0.006 | -0.016 | 12.177 | 1.153 | 1.153 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 354 | THR | 0 | -0.062 | -0.041 | 13.533 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 355 | VAL | 0 | -0.054 | -0.016 | 9.691 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 356 | GLY | 0 | 0.016 | 0.019 | 10.185 | 0.762 | 0.762 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 357 | LYS | 1 | 0.945 | 0.942 | 5.047 | -25.714 | -25.714 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 358 | TYR | 0 | -0.028 | -0.024 | 5.279 | 2.097 | 2.097 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 359 | GLY | 0 | 0.034 | 0.037 | 7.669 | -0.608 | -0.608 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 360 | TRP | 0 | -0.025 | -0.040 | 6.105 | 3.066 | 3.066 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 361 | ASN | 0 | 0.039 | 0.014 | 10.525 | -2.089 | -2.089 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 362 | THR | 0 | -0.010 | 0.002 | 13.191 | 0.980 | 0.980 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 363 | PHE | 0 | 0.019 | -0.005 | 15.892 | -0.163 | -0.163 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 364 | PHE | 0 | -0.020 | -0.011 | 17.576 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 365 | LEU | 0 | 0.020 | 0.009 | 21.236 | -0.192 | -0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 366 | ASP | -1 | -0.774 | -0.882 | 24.371 | 10.826 | 10.826 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 367 | ASN | 0 | 0.044 | 0.016 | 25.551 | 0.172 | 0.172 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 368 | HIS | 0 | 0.091 | 0.054 | 27.797 | -0.139 | -0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 369 | ASP | -1 | -0.809 | -0.896 | 29.937 | 9.170 | 9.170 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 370 | ASN | 0 | -0.046 | -0.032 | 28.559 | -0.309 | -0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 371 | PRO | 0 | -0.002 | 0.028 | 31.372 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 372 | ARG | 1 | 0.872 | 0.922 | 30.340 | -9.561 | -9.561 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 373 | ALA | 0 | -0.001 | -0.008 | 26.864 | -0.100 | -0.100 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 374 | VAL | 0 | -0.017 | -0.012 | 28.769 | 0.005 | 0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 375 | SER | 0 | -0.055 | -0.057 | 30.790 | -0.076 | -0.076 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 376 | HIS | 1 | 0.772 | 0.890 | 28.918 | -10.285 | -10.285 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 377 | PHE | 0 | -0.043 | -0.040 | 26.543 | 0.027 | 0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 378 | GLY | 0 | 0.020 | 0.018 | 29.488 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 379 | ASP | -1 | -0.785 | -0.864 | 31.053 | 8.177 | 8.177 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 380 | ASP | -1 | -0.806 | -0.882 | 34.743 | 8.499 | 8.499 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 381 | ARG | 1 | 0.908 | 0.963 | 36.263 | -8.227 | -8.227 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 382 | PRO | 0 | -0.002 | -0.024 | 38.303 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 383 | GLN | 0 | -0.036 | -0.012 | 39.291 | 0.118 | 0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 384 | TRP | 0 | 0.007 | -0.005 | 35.333 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 385 | ARG | 1 | 0.897 | 0.978 | 34.017 | -8.407 | -8.407 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 386 | GLU | -1 | -0.825 | -0.909 | 32.396 | 9.547 | 9.547 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 387 | ALA | 0 | 0.005 | 0.006 | 30.724 | 0.361 | 0.361 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 388 | SER | 0 | 0.050 | 0.015 | 29.501 | 0.447 | 0.447 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 389 | ALA | 0 | -0.008 | 0.000 | 28.365 | 0.422 | 0.422 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 390 | LYS | 1 | 0.826 | 0.896 | 26.337 | -9.538 | -9.538 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 391 | ALA | 0 | 0.007 | 0.016 | 24.807 | 0.610 | 0.610 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 392 | LEU | 0 | -0.004 | -0.016 | 23.768 | 0.681 | 0.681 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 393 | ALA | 0 | 0.000 | 0.026 | 22.535 | 0.680 | 0.680 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 394 | THR | 0 | 0.023 | 0.000 | 19.985 | 0.586 | 0.586 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 395 | ILE | 0 | -0.038 | 0.002 | 18.758 | 0.957 | 0.957 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 396 | THR | 0 | -0.047 | -0.044 | 17.776 | 1.014 | 1.014 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 397 | LEU | 0 | -0.011 | -0.001 | 16.206 | 0.840 | 0.840 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 398 | THR | 0 | 0.008 | -0.001 | 13.692 | 1.373 | 1.373 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 399 | GLN | 0 | 0.014 | 0.010 | 13.631 | 0.403 | 0.403 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 400 | ARG | 1 | 0.789 | 0.893 | 6.582 | -26.810 | -26.810 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 401 | ALA | 0 | -0.050 | -0.031 | 10.329 | -0.465 | -0.465 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 402 | THR | 0 | -0.002 | -0.010 | 11.982 | 1.027 | 1.027 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 403 | PRO | 0 | -0.010 | 0.017 | 13.424 | -1.336 | -1.336 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 404 | PHE | 0 | -0.024 | -0.032 | 16.633 | -0.152 | -0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 405 | ILE | 0 | 0.008 | 0.009 | 19.860 | -0.400 | -0.400 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 406 | TYR | 0 | -0.040 | -0.037 | 22.769 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 407 | GLN | 0 | 0.101 | 0.046 | 26.115 | -0.051 | -0.051 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 408 | GLY | 0 | 0.038 | 0.017 | 28.707 | -0.360 | -0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 409 | SER | 0 | -0.028 | -0.037 | 27.212 | -0.393 | -0.393 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 410 | GLU | -1 | -0.748 | -0.825 | 25.975 | 11.239 | 11.239 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 411 | LEU | 0 | -0.018 | -0.007 | 27.301 | 0.016 | 0.016 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 412 | GLY | 0 | 0.000 | 0.012 | 30.173 | -0.231 | -0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 413 | MET | 0 | -0.081 | -0.021 | 31.518 | -0.276 | -0.276 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 414 | THR | 0 | -0.009 | -0.016 | 32.875 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 415 | ASN | 0 | 0.029 | 0.008 | 35.225 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 416 | TYR | 0 | 0.000 | 0.001 | 37.139 | -0.105 | -0.105 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 417 | PRO | 0 | -0.013 | 0.004 | 40.483 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 418 | PHE | 0 | -0.006 | -0.009 | 39.965 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 419 | ARG | 1 | 0.876 | 0.909 | 45.221 | -6.341 | -6.341 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 420 | GLN | 0 | -0.032 | -0.035 | 48.815 | -0.092 | -0.092 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 421 | LEU | 0 | 0.063 | 0.021 | 46.583 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 422 | ASN | 0 | -0.032 | -0.004 | 47.613 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 423 | GLU | -1 | -0.774 | -0.854 | 46.534 | 6.563 | 6.563 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 424 | PHE | 0 | 0.007 | 0.020 | 41.261 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 425 | ASP | -1 | -0.856 | -0.936 | 42.172 | 6.912 | 6.912 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 426 | ASP | -1 | -0.813 | -0.927 | 38.861 | 8.031 | 8.031 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 427 | ILE | 0 | 0.003 | -0.007 | 39.798 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 428 | GLU | -1 | -0.847 | -0.894 | 36.155 | 8.475 | 8.475 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 429 | VAL | 0 | -0.011 | 0.003 | 40.156 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 430 | LYS | 1 | 0.832 | 0.900 | 42.438 | -6.991 | -6.991 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 431 | GLY | 0 | 0.046 | 0.024 | 43.520 | -0.167 | -0.167 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 432 | PHE | 0 | -0.004 | -0.019 | 37.635 | -0.094 | -0.094 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 433 | TRP | 0 | 0.021 | 0.009 | 43.899 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 434 | GLN | 0 | -0.043 | -0.020 | 47.354 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 435 | ASP | -1 | -0.804 | -0.907 | 44.413 | 6.704 | 6.704 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 436 | TYR | 0 | -0.100 | -0.029 | 41.778 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 437 | VAL | 0 | 0.041 | 0.029 | 47.723 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 438 | GLN | 0 | -0.038 | -0.012 | 50.469 | -0.061 | -0.061 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 439 | SER | 0 | -0.070 | -0.059 | 49.290 | -0.123 | -0.123 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 440 | GLY | 0 | 0.007 | 0.005 | 52.395 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 441 | LYS | 1 | 0.829 | 0.924 | 46.425 | -6.547 | -6.547 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 442 | VAL | 0 | 0.000 | 0.011 | 46.507 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 443 | THR | 0 | 0.016 | 0.017 | 49.486 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 444 | ALA | 0 | 0.062 | 0.008 | 49.705 | 0.121 | 0.121 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 445 | THR | 0 | -0.002 | -0.002 | 49.624 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 446 | GLU | -1 | -0.778 | -0.869 | 45.578 | 6.892 | 6.892 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 447 | PHE | 0 | -0.009 | 0.010 | 43.673 | 0.168 | 0.168 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 448 | LEU | 0 | -0.006 | -0.006 | 44.605 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 449 | ASP | -1 | -0.873 | -0.948 | 44.412 | 6.828 | 6.828 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 450 | ASN | 0 | -0.008 | -0.007 | 41.285 | 0.354 | 0.354 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 451 | VAL | 0 | 0.001 | 0.007 | 40.068 | 0.230 | 0.230 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 452 | ARG | 1 | 0.828 | 0.922 | 40.048 | -6.610 | -6.610 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 453 | LEU | 0 | -0.014 | 0.007 | 37.478 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 454 | THR | 0 | -0.046 | -0.040 | 35.460 | 0.286 | 0.286 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 455 | SER | 0 | -0.037 | -0.027 | 35.505 | 0.204 | 0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 456 | ARG | 1 | 0.840 | 0.918 | 34.081 | -8.543 | -8.543 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 457 | ASP | -1 | -0.726 | -0.868 | 35.288 | 7.913 | 7.913 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 458 | ASN | 0 | -0.089 | -0.046 | 35.624 | -0.127 | -0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 459 | SER | 0 | -0.030 | -0.013 | 31.830 | 0.014 | 0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 460 | ARG | 1 | 0.852 | 0.932 | 33.525 | -8.647 | -8.647 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 461 | THR | 0 | -0.001 | 0.027 | 36.056 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 462 | PRO | 0 | -0.069 | -0.033 | 36.639 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 463 | PHE | 0 | -0.003 | 0.003 | 30.578 | 0.002 | 0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 464 | GLN | 0 | -0.038 | -0.023 | 35.642 | -0.286 | -0.286 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 465 | TRP | 0 | 0.026 | 0.007 | 31.848 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 466 | ASN | 0 | -0.001 | 0.008 | 37.413 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 467 | ASP | -1 | -0.913 | -0.963 | 40.224 | 7.279 | 7.279 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 468 | THR | 0 | -0.015 | -0.011 | 43.429 | -0.239 | -0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 469 | LEU | 0 | 0.020 | -0.012 | 45.207 | 0.066 | 0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 470 | ASN | 0 | -0.058 | -0.041 | 44.463 | 0.030 | 0.030 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 471 | ALA | 0 | 0.047 | 0.026 | 40.587 | 0.184 | 0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 472 | GLY | 0 | 0.039 | 0.036 | 40.477 | 0.226 | 0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 473 | PHE | 0 | -0.120 | -0.053 | 37.721 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 474 | THR | 0 | -0.006 | -0.050 | 40.716 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 475 | ARG | 1 | 0.819 | 0.893 | 43.819 | -6.924 | -6.924 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 476 | GLY | 0 | 0.028 | 0.033 | 46.807 | -0.186 | -0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 477 | LYS | 1 | 0.907 | 0.944 | 48.066 | -6.195 | -6.195 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 478 | PRO | 0 | -0.001 | -0.003 | 43.500 | 0.057 | 0.057 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 479 | TRP | 0 | -0.019 | -0.013 | 38.488 | -0.166 | -0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 480 | PHE | 0 | -0.012 | 0.003 | 40.052 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 481 | HIS | 1 | 0.775 | 0.879 | 42.120 | -7.269 | -7.269 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 482 | ILE | 0 | 0.081 | 0.038 | 40.850 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 483 | ASN | 0 | 0.018 | 0.009 | 38.867 | -0.383 | -0.383 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 484 | PRO | 0 | 0.046 | 0.013 | 41.992 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 485 | ASN | 0 | -0.021 | -0.002 | 38.818 | -0.027 | -0.027 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 486 | TYR | 0 | 0.051 | 0.037 | 39.921 | 0.104 | 0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 487 | VAL | 0 | -0.044 | -0.011 | 40.878 | 0.082 | 0.082 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 488 | GLU | -1 | -0.898 | -0.923 | 39.071 | 7.986 | 7.986 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 489 | ILE | 0 | -0.046 | -0.025 | 34.946 | 0.143 | 0.143 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 490 | ASN | 0 | 0.042 | 0.006 | 36.597 | 0.010 | 0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 491 | ALA | 0 | 0.043 | 0.012 | 33.335 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 492 | GLU | -1 | -0.868 | -0.931 | 34.430 | 8.002 | 8.002 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 493 | ARG | 1 | 0.852 | 0.915 | 36.607 | -7.996 | -7.996 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 494 | GLU | -1 | -0.854 | -0.962 | 32.216 | 9.745 | 9.745 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 495 | GLU | -1 | -0.856 | -0.906 | 30.987 | 10.410 | 10.410 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 496 | THR | 0 | -0.036 | -0.013 | 33.002 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 497 | ARG | 1 | 0.922 | 0.977 | 34.810 | -8.207 | -8.207 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 498 | GLU | -1 | -0.772 | -0.878 | 29.823 | 10.982 | 10.982 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 499 | ASP | -1 | -0.955 | -0.966 | 30.550 | 9.418 | 9.418 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 500 | SER | 0 | -0.007 | -0.012 | 31.392 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 501 | VAL | 0 | -0.013 | -0.023 | 28.199 | 0.375 | 0.375 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 502 | LEU | 0 | 0.013 | 0.021 | 27.345 | 0.558 | 0.558 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 503 | ASN | 0 | 0.051 | 0.005 | 26.520 | 0.796 | 0.796 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 504 | TYR | 0 | -0.037 | -0.016 | 23.414 | 0.470 | 0.470 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 505 | TYR | 0 | 0.008 | -0.005 | 22.221 | 0.925 | 0.925 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 506 | LYS | 1 | 0.817 | 0.919 | 21.680 | -10.337 | -10.337 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 507 | LYS | 1 | 0.863 | 0.919 | 21.161 | -10.781 | -10.781 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 508 | MET | 0 | -0.024 | 0.007 | 17.817 | 0.748 | 0.748 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 509 | ILE | 0 | -0.005 | -0.004 | 17.133 | 1.309 | 1.309 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 510 | GLN | 0 | -0.003 | 0.017 | 16.308 | 0.731 | 0.731 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 511 | LEU | 0 | -0.007 | -0.014 | 15.864 | 1.150 | 1.150 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 512 | ARG | 1 | 0.811 | 0.917 | 11.023 | -22.683 | -22.683 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 513 | HIS | 0 | -0.077 | -0.053 | 11.427 | 2.082 | 2.082 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 514 | HIS | 0 | -0.046 | -0.022 | 12.237 | -0.036 | -0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 515 | ILE | 0 | 0.019 | 0.027 | 10.311 | 1.049 | 1.049 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 516 | PRO | 0 | 0.076 | 0.036 | 5.207 | 0.845 | 0.845 | 0.000 | 0.000 | 0.000 | 0.000 |
475 | A | 517 | ALA | 0 | 0.012 | 0.005 | 6.288 | 3.243 | 3.243 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 518 | LEU | 0 | -0.005 | -0.007 | 7.444 | -0.695 | -0.695 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 519 | VAL | 0 | -0.045 | 0.007 | 6.745 | -2.154 | -2.154 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 520 | TYR | 0 | -0.048 | -0.094 | 2.993 | -3.945 | -1.250 | 0.686 | -1.073 | -2.308 | 0.002 |
479 | A | 521 | GLY | 0 | -0.022 | 0.009 | 5.062 | -0.069 | 0.064 | -0.001 | -0.002 | -0.131 | 0.000 |
480 | A | 522 | ALA | 0 | -0.018 | -0.017 | 7.068 | -2.836 | -2.836 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 523 | TYR | 0 | 0.022 | 0.024 | 9.161 | -1.058 | -1.058 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 524 | GLN | 0 | -0.014 | -0.017 | 12.385 | -0.903 | -0.903 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 525 | ASP | -1 | -0.723 | -0.828 | 15.701 | 13.674 | 13.674 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 526 | LEU | 0 | 0.013 | 0.003 | 19.164 | -0.410 | -0.410 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 527 | ASN | 0 | -0.018 | -0.017 | 21.505 | -0.580 | -0.580 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 528 | PRO | 0 | 0.021 | 0.012 | 22.032 | -0.385 | -0.385 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 529 | GLN | 0 | 0.005 | -0.001 | 24.503 | -0.462 | -0.462 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 530 | ASP | -1 | -0.849 | -0.897 | 27.205 | 10.288 | 10.288 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 531 | ASN | 0 | 0.025 | 0.007 | 28.089 | 0.367 | 0.367 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 532 | THR | 0 | -0.070 | -0.035 | 30.247 | -0.320 | -0.320 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 533 | VAL | 0 | 0.056 | 0.024 | 25.871 | -0.001 | -0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 534 | TYR | 0 | -0.036 | -0.001 | 19.067 | 0.137 | 0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 535 | ALA | 0 | 0.030 | 0.002 | 21.709 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 536 | TYR | 0 | -0.011 | -0.009 | 15.590 | -0.344 | -0.344 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 537 | THR | 0 | -0.012 | -0.008 | 14.940 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 538 | ARG | 1 | 0.749 | 0.866 | 8.598 | -27.859 | -27.859 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 539 | THR | 0 | -0.005 | -0.007 | 10.084 | -0.653 | -0.653 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 540 | LEU | 0 | 0.019 | 0.023 | 2.743 | -4.591 | -2.120 | 0.473 | -1.424 | -1.520 | 0.017 |
499 | A | 541 | GLY | 0 | -0.007 | 0.007 | 6.857 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 542 | ASN | 0 | -0.003 | -0.015 | 8.708 | -2.496 | -2.496 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 543 | GLU | -1 | -0.817 | -0.867 | 9.160 | 21.671 | 21.671 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 544 | ARG | 1 | 0.827 | 0.882 | 10.453 | -16.397 | -16.397 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 545 | TYR | 0 | 0.012 | -0.011 | 11.062 | -1.525 | -1.525 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 546 | LEU | 0 | -0.018 | -0.013 | 14.540 | 0.314 | 0.314 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 547 | VAL | 0 | -0.003 | 0.009 | 16.191 | -0.280 | -0.280 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 548 | VAL | 0 | -0.023 | -0.017 | 18.975 | -0.278 | -0.278 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 549 | VAL | 0 | 0.048 | 0.013 | 22.486 | -0.112 | -0.112 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 550 | ASN | 0 | -0.037 | -0.018 | 25.162 | -0.118 | -0.118 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 551 | PHE | 0 | 0.009 | -0.012 | 24.880 | -0.045 | -0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 552 | LYS | 1 | 0.839 | 0.939 | 30.018 | -9.552 | -9.552 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 553 | GLH | 0 | -0.030 | -0.069 | 33.658 | 0.008 | 0.008 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 554 | TYR | 0 | 0.022 | 0.012 | 35.997 | -0.213 | -0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 555 | PRO | 0 | 0.021 | -0.005 | 35.073 | 0.242 | 0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 556 | VAL | 0 | -0.021 | -0.006 | 32.046 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 557 | ARG | 1 | 0.925 | 0.977 | 32.463 | -9.383 | -9.383 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 558 | TYR | 0 | 0.023 | 0.002 | 23.987 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 559 | THR | 0 | -0.030 | -0.031 | 28.949 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 560 | LEU | 0 | 0.028 | 0.030 | 22.706 | 0.222 | 0.222 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 561 | PRO | 0 | 0.022 | 0.002 | 22.040 | -0.522 | -0.522 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 562 | ALA | 0 | 0.022 | 0.000 | 25.212 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 563 | ASN | 0 | -0.037 | -0.015 | 23.726 | -0.466 | -0.466 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 564 | ASP | -1 | -0.845 | -0.882 | 20.448 | 16.187 | 16.187 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 565 | ALA | 0 | -0.019 | -0.011 | 21.949 | -0.641 | -0.641 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 566 | ILE | 0 | -0.038 | -0.024 | 21.517 | 0.816 | 0.816 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 567 | GLU | -1 | -0.873 | -0.923 | 20.132 | 13.123 | 13.123 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 568 | GLU | -1 | -0.903 | -0.949 | 19.531 | 14.026 | 14.026 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 569 | VAL | 0 | -0.031 | -0.021 | 20.772 | 0.420 | 0.420 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 570 | VAL | 0 | -0.061 | -0.023 | 16.562 | 0.038 | 0.038 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 571 | ILE | 0 | 0.022 | -0.001 | 19.755 | -0.176 | -0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 572 | ASP | -1 | -0.791 | -0.890 | 22.233 | 11.784 | 11.784 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 573 | THR | 0 | 0.011 | 0.008 | 24.903 | -0.189 | -0.189 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 574 | GLN | 0 | -0.068 | -0.031 | 27.508 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 575 | GLN | 0 | -0.016 | -0.004 | 29.843 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 576 | GLN | 0 | -0.045 | -0.027 | 31.943 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 577 | ALA | 0 | -0.003 | -0.010 | 30.545 | 0.127 | 0.127 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 578 | ALA | 0 | 0.040 | 0.042 | 30.545 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 579 | ALA | 0 | 0.004 | -0.002 | 27.938 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 580 | PRO | 0 | -0.002 | 0.015 | 26.581 | -0.367 | -0.367 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 581 | HIS | 0 | 0.023 | 0.002 | 28.669 | 0.208 | 0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 582 | SER | 0 | 0.025 | -0.002 | 26.164 | 0.088 | 0.088 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 583 | THR | 0 | 0.051 | 0.014 | 26.049 | 0.313 | 0.313 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 584 | SER | 0 | -0.073 | -0.038 | 28.363 | -0.182 | -0.182 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 585 | LEU | 0 | 0.062 | 0.049 | 24.503 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 586 | SER | 0 | -0.032 | -0.018 | 29.205 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 587 | LEU | 0 | -0.008 | 0.006 | 27.189 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 588 | SER | 0 | 0.051 | 0.010 | 31.255 | -0.465 | -0.465 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 589 | PRO | 0 | -0.050 | -0.025 | 32.139 | 0.285 | 0.285 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 590 | TRP | 0 | 0.008 | -0.003 | 28.388 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 591 | GLN | 0 | -0.004 | 0.012 | 28.021 | -0.115 | -0.115 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 592 | ALA | 0 | -0.007 | -0.013 | 23.723 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 593 | GLY | 0 | 0.046 | 0.032 | 22.852 | -0.306 | -0.306 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 594 | VAL | 0 | -0.025 | -0.010 | 16.266 | 0.529 | 0.529 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 595 | TYR | 0 | -0.014 | -0.025 | 18.614 | -0.400 | -0.400 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 596 | LYS | 1 | 0.877 | 0.947 | 14.293 | -19.790 | -19.790 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 597 | LEU | 0 | -0.029 | -0.014 | 16.532 | -1.062 | -1.062 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 598 | ARG | 1 | 0.844 | 0.918 | 17.069 | -13.095 | -13.095 | 0.000 | 0.000 | 0.000 | 0.000 |