FMODB ID: N22JQ
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 | OptH |
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 | -13520835.133696 |
---|---|
FMO2-HF: Nuclear repulsion | 13291763.088455 |
FMO2-HF: Total energy | -229072.045241 |
FMO2-MP2: Total energy | -229747.934629 |
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. |
-77.89 | -71.387 | 0.523 | -2.469 | -4.557 | 0.01 |
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 | 0.147 | 0.068 | 2.910 | -7.192 | -4.532 | 0.125 | -0.941 | -1.844 | 0.003 |
4 | A | 46 | ALA | 0 | 0.012 | -0.006 | 4.384 | -4.370 | -4.266 | -0.001 | -0.017 | -0.086 | 0.000 |
5 | A | 47 | TRP | 0 | 0.104 | 0.054 | 7.924 | 0.585 | 0.585 | 0.000 | 0.000 | 0.000 | 0.000 |
6 | A | 48 | TRP | 0 | 0.000 | -0.005 | 10.603 | 0.406 | 0.406 | 0.000 | 0.000 | 0.000 | 0.000 |
7 | A | 49 | LYS | 1 | 0.835 | 0.946 | 5.416 | -35.848 | -35.848 | 0.000 | 0.000 | 0.000 | 0.000 |
8 | A | 50 | GLU | -1 | -0.828 | -0.872 | 6.468 | 38.690 | 38.690 | 0.000 | 0.000 | 0.000 | 0.000 |
9 | A | 51 | ALA | 0 | -0.051 | -0.004 | 9.688 | -1.223 | -1.223 | 0.000 | 0.000 | 0.000 | 0.000 |
10 | A | 52 | VAL | 0 | 0.006 | 0.007 | 13.363 | 0.290 | 0.290 | 0.000 | 0.000 | 0.000 | 0.000 |
11 | A | 53 | PHE | 0 | -0.023 | -0.028 | 14.781 | -0.596 | -0.596 | 0.000 | 0.000 | 0.000 | 0.000 |
12 | A | 54 | TYR | 0 | 0.000 | -0.020 | 18.894 | -0.274 | -0.274 | 0.000 | 0.000 | 0.000 | 0.000 |
13 | A | 55 | GLN | 0 | 0.003 | -0.014 | 22.636 | -0.447 | -0.447 | 0.000 | 0.000 | 0.000 | 0.000 |
14 | A | 56 | ILE | 0 | 0.027 | 0.004 | 25.051 | -0.218 | -0.218 | 0.000 | 0.000 | 0.000 | 0.000 |
15 | A | 57 | TYR | 0 | 0.055 | 0.032 | 28.525 | -0.151 | -0.151 | 0.000 | 0.000 | 0.000 | 0.000 |
16 | A | 58 | PRO | 0 | -0.036 | -0.035 | 31.079 | -0.241 | -0.241 | 0.000 | 0.000 | 0.000 | 0.000 |
17 | A | 59 | ARG | 1 | 0.972 | 1.013 | 33.733 | -7.779 | -7.779 | 0.000 | 0.000 | 0.000 | 0.000 |
18 | A | 60 | SER | 0 | -0.059 | -0.034 | 35.108 | -0.267 | -0.267 | 0.000 | 0.000 | 0.000 | 0.000 |
19 | A | 61 | PHE | 0 | -0.017 | 0.006 | 30.251 | 0.045 | 0.045 | 0.000 | 0.000 | 0.000 | 0.000 |
20 | A | 62 | LYS | 1 | 0.869 | 0.926 | 34.383 | -8.152 | -8.152 | 0.000 | 0.000 | 0.000 | 0.000 |
21 | A | 63 | ASP | -1 | -0.697 | -0.807 | 36.964 | 7.351 | 7.351 | 0.000 | 0.000 | 0.000 | 0.000 |
22 | A | 64 | THR | 0 | -0.057 | -0.068 | 39.072 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
23 | A | 65 | ASN | 0 | -0.062 | -0.031 | 41.771 | -0.175 | -0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
24 | A | 66 | ASP | -1 | -0.858 | -0.917 | 44.433 | 6.665 | 6.665 | 0.000 | 0.000 | 0.000 | 0.000 |
25 | A | 67 | ASP | -1 | -0.854 | -0.931 | 44.132 | 6.963 | 6.963 | 0.000 | 0.000 | 0.000 | 0.000 |
26 | A | 68 | GLY | 0 | -0.057 | -0.026 | 44.650 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
27 | A | 69 | ILE | 0 | -0.065 | -0.055 | 40.188 | 0.150 | 0.150 | 0.000 | 0.000 | 0.000 | 0.000 |
28 | A | 70 | GLY | 0 | -0.023 | -0.005 | 37.482 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
29 | A | 71 | ASP | -1 | -0.732 | -0.856 | 37.549 | 7.965 | 7.965 | 0.000 | 0.000 | 0.000 | 0.000 |
30 | A | 72 | ILE | 0 | -0.026 | -0.039 | 33.318 | 0.271 | 0.271 | 0.000 | 0.000 | 0.000 | 0.000 |
31 | A | 73 | ARG | 1 | 0.907 | 0.951 | 34.436 | -7.456 | -7.456 | 0.000 | 0.000 | 0.000 | 0.000 |
32 | A | 74 | GLY | 0 | 0.064 | 0.040 | 36.270 | 0.071 | 0.071 | 0.000 | 0.000 | 0.000 | 0.000 |
33 | A | 75 | ILE | 0 | -0.068 | -0.044 | 29.794 | 0.213 | 0.213 | 0.000 | 0.000 | 0.000 | 0.000 |
34 | A | 76 | ILE | 0 | -0.037 | -0.016 | 31.649 | 0.264 | 0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
35 | A | 77 | GLU | -1 | -0.898 | -0.950 | 32.753 | 8.400 | 8.400 | 0.000 | 0.000 | 0.000 | 0.000 |
36 | A | 78 | LYS | 1 | 0.865 | 0.956 | 31.765 | -8.775 | -8.775 | 0.000 | 0.000 | 0.000 | 0.000 |
37 | A | 79 | LEU | 0 | 0.014 | 0.003 | 27.453 | 0.392 | 0.392 | 0.000 | 0.000 | 0.000 | 0.000 |
38 | A | 80 | ASP | -1 | -0.832 | -0.913 | 27.841 | 10.585 | 10.585 | 0.000 | 0.000 | 0.000 | 0.000 |
39 | A | 81 | TYR | 0 | -0.056 | -0.047 | 28.577 | 0.254 | 0.254 | 0.000 | 0.000 | 0.000 | 0.000 |
40 | A | 82 | LEU | 0 | 0.028 | 0.000 | 25.288 | 0.352 | 0.352 | 0.000 | 0.000 | 0.000 | 0.000 |
41 | A | 83 | LYS | 1 | 0.945 | 0.970 | 20.927 | -13.780 | -13.780 | 0.000 | 0.000 | 0.000 | 0.000 |
42 | A | 84 | SER | 0 | -0.050 | -0.018 | 23.649 | 0.640 | 0.640 | 0.000 | 0.000 | 0.000 | 0.000 |
43 | A | 85 | LEU | 0 | -0.044 | -0.020 | 23.072 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
44 | A | 86 | GLY | 0 | 0.023 | 0.013 | 20.604 | 0.417 | 0.417 | 0.000 | 0.000 | 0.000 | 0.000 |
45 | A | 87 | ILE | 0 | -0.076 | -0.020 | 19.261 | 0.893 | 0.893 | 0.000 | 0.000 | 0.000 | 0.000 |
46 | A | 88 | ASP | -1 | -0.791 | -0.877 | 15.793 | 18.699 | 18.699 | 0.000 | 0.000 | 0.000 | 0.000 |
47 | A | 89 | ALA | 0 | -0.056 | -0.036 | 18.067 | -0.239 | -0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
48 | A | 90 | ILE | 0 | 0.047 | 0.023 | 19.721 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
49 | A | 91 | TRP | 0 | -0.051 | -0.030 | 22.209 | 0.261 | 0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
50 | A | 92 | ILE | 0 | -0.021 | 0.002 | 23.850 | -0.257 | -0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
51 | A | 93 | ASN | 0 | 0.007 | -0.015 | 27.628 | 0.023 | 0.023 | 0.000 | 0.000 | 0.000 | 0.000 |
52 | A | 94 | PRO | 0 | -0.087 | -0.030 | 29.688 | -0.055 | -0.055 | 0.000 | 0.000 | 0.000 | 0.000 |
53 | A | 95 | HIS | 1 | 0.942 | 0.972 | 30.237 | -9.878 | -9.878 | 0.000 | 0.000 | 0.000 | 0.000 |
54 | A | 96 | TYR | 0 | -0.077 | -0.072 | 29.737 | -0.080 | -0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
55 | A | 97 | ASP | -1 | -0.851 | -0.911 | 36.175 | 7.221 | 7.221 | 0.000 | 0.000 | 0.000 | 0.000 |
56 | A | 98 | SER | 0 | 0.024 | -0.016 | 38.777 | 0.087 | 0.087 | 0.000 | 0.000 | 0.000 | 0.000 |
57 | A | 99 | PRO | 0 | -0.031 | -0.004 | 40.818 | -0.068 | -0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
58 | A | 100 | ASN | 0 | -0.016 | -0.010 | 39.814 | 0.095 | 0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
59 | A | 101 | THR | 0 | -0.044 | -0.023 | 41.686 | -0.085 | -0.085 | 0.000 | 0.000 | 0.000 | 0.000 |
60 | A | 102 | ASP | -1 | -0.849 | -0.953 | 36.712 | 8.358 | 8.358 | 0.000 | 0.000 | 0.000 | 0.000 |
61 | A | 103 | ASN | 0 | -0.057 | -0.014 | 37.119 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
62 | A | 104 | GLY | 0 | 0.092 | 0.038 | 35.823 | 0.252 | 0.252 | 0.000 | 0.000 | 0.000 | 0.000 |
63 | A | 105 | TYR | 0 | -0.082 | -0.066 | 29.155 | 0.153 | 0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
64 | A | 106 | ASP | -1 | -0.834 | -0.917 | 35.373 | 7.703 | 7.703 | 0.000 | 0.000 | 0.000 | 0.000 |
65 | A | 107 | ILE | 0 | 0.021 | 0.025 | 33.633 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
66 | A | 108 | SER | 0 | -0.006 | -0.027 | 38.236 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
67 | A | 109 | ASN | 0 | 0.018 | -0.014 | 39.596 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
68 | A | 110 | TYR | 0 | 0.021 | -0.018 | 33.659 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
69 | A | 111 | ARG | 1 | 0.929 | 0.969 | 34.839 | -8.132 | -8.132 | 0.000 | 0.000 | 0.000 | 0.000 |
70 | A | 112 | GLN | 0 | -0.014 | 0.019 | 36.795 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
71 | A | 113 | ILE | 0 | -0.026 | -0.009 | 34.772 | 0.192 | 0.192 | 0.000 | 0.000 | 0.000 | 0.000 |
72 | A | 114 | MET | 0 | -0.026 | 0.009 | 36.762 | -0.232 | -0.232 | 0.000 | 0.000 | 0.000 | 0.000 |
73 | A | 115 | LYS | 1 | 1.001 | 0.996 | 39.344 | -6.550 | -6.550 | 0.000 | 0.000 | 0.000 | 0.000 |
74 | A | 116 | GLU | -1 | -0.883 | -0.955 | 40.804 | 7.238 | 7.238 | 0.000 | 0.000 | 0.000 | 0.000 |
75 | A | 117 | TYR | 0 | -0.026 | -0.012 | 34.921 | 0.108 | 0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
76 | A | 118 | GLY | 0 | 0.070 | 0.051 | 38.168 | 0.146 | 0.146 | 0.000 | 0.000 | 0.000 | 0.000 |
77 | A | 119 | THR | 0 | -0.047 | -0.035 | 39.724 | -0.060 | -0.060 | 0.000 | 0.000 | 0.000 | 0.000 |
78 | A | 120 | MET | 0 | -0.011 | -0.023 | 34.898 | 0.348 | 0.348 | 0.000 | 0.000 | 0.000 | 0.000 |
79 | A | 121 | GLU | -1 | -0.888 | -0.923 | 36.295 | 7.825 | 7.825 | 0.000 | 0.000 | 0.000 | 0.000 |
80 | A | 122 | ASP | -1 | -0.766 | -0.876 | 36.610 | 8.134 | 8.134 | 0.000 | 0.000 | 0.000 | 0.000 |
81 | A | 123 | PHE | 0 | 0.007 | -0.017 | 29.082 | 0.308 | 0.308 | 0.000 | 0.000 | 0.000 | 0.000 |
82 | A | 124 | ASP | -1 | -0.859 | -0.944 | 32.073 | 9.306 | 9.306 | 0.000 | 0.000 | 0.000 | 0.000 |
83 | A | 125 | SER | 0 | -0.009 | -0.008 | 32.029 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
84 | A | 126 | LEU | 0 | 0.024 | 0.015 | 28.810 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
85 | A | 127 | VAL | 0 | 0.000 | -0.002 | 26.587 | 0.415 | 0.415 | 0.000 | 0.000 | 0.000 | 0.000 |
86 | A | 128 | ALA | 0 | -0.029 | -0.007 | 27.394 | 0.422 | 0.422 | 0.000 | 0.000 | 0.000 | 0.000 |
87 | A | 129 | GLU | -1 | -0.865 | -0.943 | 28.978 | 9.926 | 9.926 | 0.000 | 0.000 | 0.000 | 0.000 |
88 | A | 130 | MET | 0 | -0.037 | -0.009 | 23.928 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
89 | A | 131 | LYS | 1 | 0.961 | 0.989 | 24.084 | -11.317 | -11.317 | 0.000 | 0.000 | 0.000 | 0.000 |
90 | A | 132 | LYS | 1 | 0.922 | 0.969 | 24.645 | -9.357 | -9.357 | 0.000 | 0.000 | 0.000 | 0.000 |
91 | A | 133 | ARG | 1 | 0.790 | 0.894 | 25.262 | -10.422 | -10.422 | 0.000 | 0.000 | 0.000 | 0.000 |
92 | A | 134 | ASN | 0 | -0.079 | -0.040 | 20.023 | 0.736 | 0.736 | 0.000 | 0.000 | 0.000 | 0.000 |
93 | A | 135 | MET | 0 | -0.014 | 0.007 | 20.092 | 0.554 | 0.554 | 0.000 | 0.000 | 0.000 | 0.000 |
94 | A | 136 | ARG | 1 | 0.938 | 0.954 | 15.057 | -18.256 | -18.256 | 0.000 | 0.000 | 0.000 | 0.000 |
95 | A | 137 | LEU | 0 | 0.029 | 0.011 | 20.818 | -0.037 | -0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
96 | A | 138 | MET | 0 | -0.056 | -0.010 | 18.366 | 0.116 | 0.116 | 0.000 | 0.000 | 0.000 | 0.000 |
97 | A | 139 | ILE | 0 | 0.005 | -0.005 | 22.733 | -0.434 | -0.434 | 0.000 | 0.000 | 0.000 | 0.000 |
98 | A | 140 | ASP | -1 | -0.703 | -0.841 | 25.040 | 11.190 | 11.190 | 0.000 | 0.000 | 0.000 | 0.000 |
99 | A | 141 | VAL | 0 | -0.002 | 0.015 | 26.086 | -0.446 | -0.446 | 0.000 | 0.000 | 0.000 | 0.000 |
100 | A | 142 | VAL | 0 | 0.045 | 0.022 | 28.319 | 0.136 | 0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
101 | A | 143 | ILE | 0 | 0.026 | 0.019 | 28.348 | -0.307 | -0.307 | 0.000 | 0.000 | 0.000 | 0.000 |
102 | A | 144 | ASN | 0 | 0.041 | 0.053 | 31.225 | -0.304 | -0.304 | 0.000 | 0.000 | 0.000 | 0.000 |
103 | A | 145 | HIS | 1 | 0.877 | 0.904 | 32.806 | -8.959 | -8.959 | 0.000 | 0.000 | 0.000 | 0.000 |
104 | A | 146 | THR | 0 | 0.004 | 0.029 | 35.759 | 0.152 | 0.152 | 0.000 | 0.000 | 0.000 | 0.000 |
105 | A | 147 | SER | 0 | 0.050 | 0.026 | 38.469 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
106 | A | 148 | ASP | -1 | -0.937 | -0.982 | 41.475 | 6.750 | 6.750 | 0.000 | 0.000 | 0.000 | 0.000 |
107 | A | 149 | GLN | 0 | 0.007 | -0.007 | 44.464 | -0.211 | -0.211 | 0.000 | 0.000 | 0.000 | 0.000 |
108 | A | 150 | HIS | 0 | 0.023 | 0.030 | 39.213 | -0.148 | -0.148 | 0.000 | 0.000 | 0.000 | 0.000 |
109 | A | 151 | PRO | 0 | 0.031 | 0.014 | 43.069 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
110 | A | 152 | TRP | 0 | 0.010 | 0.003 | 36.911 | -0.111 | -0.111 | 0.000 | 0.000 | 0.000 | 0.000 |
111 | A | 153 | PHE | 0 | 0.003 | -0.003 | 43.697 | -0.135 | -0.135 | 0.000 | 0.000 | 0.000 | 0.000 |
112 | A | 154 | ILE | 0 | 0.005 | 0.004 | 45.371 | -0.160 | -0.160 | 0.000 | 0.000 | 0.000 | 0.000 |
113 | A | 155 | GLN | 0 | -0.041 | -0.024 | 46.855 | -0.227 | -0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
114 | A | 156 | SER | 0 | -0.023 | 0.025 | 45.673 | -0.153 | -0.153 | 0.000 | 0.000 | 0.000 | 0.000 |
115 | A | 157 | LYS | 1 | 0.962 | 0.981 | 47.846 | -6.339 | -6.339 | 0.000 | 0.000 | 0.000 | 0.000 |
116 | A | 158 | SER | 0 | -0.124 | -0.058 | 50.186 | -0.158 | -0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
117 | A | 159 | ASP | -1 | -0.800 | -0.920 | 52.224 | 5.448 | 5.448 | 0.000 | 0.000 | 0.000 | 0.000 |
118 | A | 160 | LYS | 1 | 0.898 | 0.935 | 51.684 | -5.457 | -5.457 | 0.000 | 0.000 | 0.000 | 0.000 |
119 | A | 161 | ASN | 0 | 0.016 | 0.010 | 51.616 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
120 | A | 162 | ASN | 0 | 0.017 | 0.036 | 49.260 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
121 | A | 163 | PRO | 0 | 0.050 | 0.018 | 48.160 | 0.093 | 0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
122 | A | 164 | TYR | 0 | -0.003 | -0.003 | 43.081 | 0.077 | 0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
123 | A | 165 | ARG | 1 | 0.836 | 0.922 | 45.197 | -6.065 | -6.065 | 0.000 | 0.000 | 0.000 | 0.000 |
124 | A | 166 | ASP | -1 | -0.907 | -0.956 | 43.041 | 6.766 | 6.766 | 0.000 | 0.000 | 0.000 | 0.000 |
125 | A | 167 | TYR | 0 | -0.080 | -0.107 | 40.207 | 0.139 | 0.139 | 0.000 | 0.000 | 0.000 | 0.000 |
126 | A | 168 | TYR | 0 | -0.021 | -0.019 | 40.196 | 0.132 | 0.132 | 0.000 | 0.000 | 0.000 | 0.000 |
127 | A | 169 | PHE | 0 | -0.038 | -0.011 | 37.270 | -0.107 | -0.107 | 0.000 | 0.000 | 0.000 | 0.000 |
128 | A | 170 | TRP | 0 | 0.022 | 0.005 | 42.853 | -0.093 | -0.093 | 0.000 | 0.000 | 0.000 | 0.000 |
129 | A | 171 | ARG | 1 | 0.934 | 0.959 | 42.375 | -6.830 | -6.830 | 0.000 | 0.000 | 0.000 | 0.000 |
130 | A | 172 | ASP | -1 | -0.839 | -0.914 | 48.116 | 5.770 | 5.770 | 0.000 | 0.000 | 0.000 | 0.000 |
131 | A | 173 | GLY | 0 | 0.007 | 0.004 | 50.742 | 0.089 | 0.089 | 0.000 | 0.000 | 0.000 | 0.000 |
132 | A | 174 | LYS | 1 | 0.920 | 0.950 | 51.876 | -5.706 | -5.706 | 0.000 | 0.000 | 0.000 | 0.000 |
133 | A | 175 | ASP | -1 | -0.855 | -0.916 | 53.825 | 5.335 | 5.335 | 0.000 | 0.000 | 0.000 | 0.000 |
134 | A | 176 | ASN | 0 | -0.072 | -0.041 | 56.469 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
135 | A | 177 | GLN | 0 | -0.036 | -0.026 | 52.755 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
136 | A | 178 | PRO | 0 | -0.016 | 0.003 | 48.338 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
137 | A | 179 | PRO | 0 | -0.023 | -0.006 | 46.509 | -0.031 | -0.031 | 0.000 | 0.000 | 0.000 | 0.000 |
138 | A | 180 | ASN | 0 | 0.048 | 0.053 | 42.331 | -0.083 | -0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
139 | A | 181 | ASN | 0 | -0.001 | 0.000 | 44.120 | -0.004 | -0.004 | 0.000 | 0.000 | 0.000 | 0.000 |
140 | A | 182 | TYR | 0 | 0.033 | 0.001 | 38.908 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
141 | A | 183 | PRO | 0 | 0.025 | 0.019 | 39.984 | -0.140 | -0.140 | 0.000 | 0.000 | 0.000 | 0.000 |
142 | A | 184 | SER | 0 | 0.006 | 0.015 | 40.102 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
143 | A | 185 | PHE | 0 | -0.027 | -0.031 | 33.235 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
144 | A | 186 | PHE | 0 | -0.033 | -0.031 | 36.555 | 0.042 | 0.042 | 0.000 | 0.000 | 0.000 | 0.000 |
145 | A | 187 | GLY | 0 | 0.079 | 0.064 | 40.943 | -0.145 | -0.145 | 0.000 | 0.000 | 0.000 | 0.000 |
146 | A | 188 | GLY | 0 | -0.042 | -0.014 | 43.905 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
147 | A | 189 | SER | 0 | -0.013 | -0.008 | 44.367 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
148 | A | 190 | ALA | 0 | 0.009 | 0.011 | 41.038 | 0.013 | 0.013 | 0.000 | 0.000 | 0.000 | 0.000 |
149 | A | 191 | TRP | 0 | -0.020 | -0.035 | 42.883 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
150 | A | 192 | GLN | 0 | 0.006 | 0.004 | 45.904 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
151 | A | 193 | LYS | 1 | 0.913 | 0.969 | 48.283 | -5.508 | -5.508 | 0.000 | 0.000 | 0.000 | 0.000 |
152 | A | 194 | ASP | -1 | -0.840 | -0.890 | 51.184 | 5.884 | 5.884 | 0.000 | 0.000 | 0.000 | 0.000 |
153 | A | 195 | ALA | 0 | -0.040 | -0.021 | 52.909 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
154 | A | 196 | LYS | 1 | 0.923 | 0.969 | 55.652 | -5.586 | -5.586 | 0.000 | 0.000 | 0.000 | 0.000 |
155 | A | 197 | SER | 0 | -0.054 | -0.056 | 52.992 | -0.056 | -0.056 | 0.000 | 0.000 | 0.000 | 0.000 |
156 | A | 198 | GLY | 0 | 0.029 | 0.004 | 55.034 | -0.069 | -0.069 | 0.000 | 0.000 | 0.000 | 0.000 |
157 | A | 199 | GLN | 0 | -0.052 | -0.017 | 50.478 | 0.058 | 0.058 | 0.000 | 0.000 | 0.000 | 0.000 |
158 | A | 200 | TYR | 0 | -0.002 | -0.018 | 48.267 | -0.054 | -0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
159 | A | 201 | TYR | 0 | -0.023 | -0.033 | 44.166 | -0.014 | -0.014 | 0.000 | 0.000 | 0.000 | 0.000 |
160 | A | 202 | LEU | 0 | -0.020 | -0.014 | 39.115 | -0.019 | -0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
161 | A | 203 | HIS | 1 | 0.795 | 0.904 | 40.162 | -7.038 | -7.038 | 0.000 | 0.000 | 0.000 | 0.000 |
162 | A | 204 | TYR | 0 | 0.057 | 0.030 | 34.070 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
163 | A | 205 | PHE | 0 | 0.037 | 0.032 | 32.363 | -0.044 | -0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
164 | A | 206 | ALA | 0 | 0.087 | 0.059 | 38.442 | -0.226 | -0.226 | 0.000 | 0.000 | 0.000 | 0.000 |
165 | A | 207 | ARG | 1 | 0.945 | 0.950 | 41.510 | -6.281 | -6.281 | 0.000 | 0.000 | 0.000 | 0.000 |
166 | A | 208 | GLN | 0 | -0.003 | 0.017 | 43.432 | 0.001 | 0.001 | 0.000 | 0.000 | 0.000 | 0.000 |
167 | A | 209 | GLN | 0 | -0.045 | -0.033 | 37.031 | 0.017 | 0.017 | 0.000 | 0.000 | 0.000 | 0.000 |
168 | A | 210 | PRO | 0 | -0.049 | 0.002 | 39.758 | 0.084 | 0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
169 | A | 211 | ASP | -1 | -0.761 | -0.903 | 36.370 | 8.337 | 8.337 | 0.000 | 0.000 | 0.000 | 0.000 |
170 | A | 212 | LEU | 0 | -0.015 | 0.000 | 34.913 | -0.196 | -0.196 | 0.000 | 0.000 | 0.000 | 0.000 |
171 | A | 213 | ASN | 0 | 0.004 | -0.015 | 36.463 | 0.236 | 0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
172 | A | 214 | TRP | 0 | 0.015 | -0.018 | 28.561 | 0.034 | 0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
173 | A | 215 | ASP | -1 | -0.843 | -0.888 | 33.979 | 8.349 | 8.349 | 0.000 | 0.000 | 0.000 | 0.000 |
174 | A | 216 | ASN | 0 | -0.029 | -0.002 | 35.990 | 0.044 | 0.044 | 0.000 | 0.000 | 0.000 | 0.000 |
175 | A | 217 | PRO | 0 | -0.003 | -0.030 | 35.387 | 0.133 | 0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
176 | A | 218 | LYS | 1 | 0.976 | 0.996 | 36.189 | -6.825 | -6.825 | 0.000 | 0.000 | 0.000 | 0.000 |
177 | A | 219 | VAL | 0 | 0.034 | 0.035 | 34.935 | 0.070 | 0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
178 | A | 220 | ARG | 1 | 0.821 | 0.893 | 30.878 | -8.723 | -8.723 | 0.000 | 0.000 | 0.000 | 0.000 |
179 | A | 221 | GLU | -1 | -0.882 | -0.936 | 32.584 | 9.271 | 9.271 | 0.000 | 0.000 | 0.000 | 0.000 |
180 | A | 222 | ASP | -1 | -0.827 | -0.857 | 34.438 | 7.941 | 7.941 | 0.000 | 0.000 | 0.000 | 0.000 |
181 | A | 223 | LEU | 0 | -0.052 | -0.028 | 31.794 | 0.103 | 0.103 | 0.000 | 0.000 | 0.000 | 0.000 |
182 | A | 224 | TYR | 0 | -0.020 | -0.031 | 28.570 | 0.387 | 0.387 | 0.000 | 0.000 | 0.000 | 0.000 |
183 | A | 225 | ALA | 0 | -0.030 | -0.018 | 30.848 | 0.201 | 0.201 | 0.000 | 0.000 | 0.000 | 0.000 |
184 | A | 226 | MET | 0 | -0.074 | -0.024 | 31.356 | 0.124 | 0.124 | 0.000 | 0.000 | 0.000 | 0.000 |
185 | A | 227 | LEU | 0 | 0.014 | -0.006 | 26.816 | 0.120 | 0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
186 | A | 228 | ARG | 1 | 0.969 | 0.990 | 28.496 | -9.689 | -9.689 | 0.000 | 0.000 | 0.000 | 0.000 |
187 | A | 229 | PHE | 0 | 0.016 | 0.025 | 29.524 | -0.046 | -0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
188 | A | 230 | TRP | 0 | 0.006 | -0.010 | 28.763 | -0.010 | -0.010 | 0.000 | 0.000 | 0.000 | 0.000 |
189 | A | 231 | LEU | 0 | -0.016 | -0.017 | 23.742 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
190 | A | 232 | ASP | -1 | -0.860 | -0.907 | 26.663 | 10.441 | 10.441 | 0.000 | 0.000 | 0.000 | 0.000 |
191 | A | 233 | LYS | 1 | 0.746 | 0.892 | 29.197 | -9.420 | -9.420 | 0.000 | 0.000 | 0.000 | 0.000 |
192 | A | 234 | GLY | 0 | 0.008 | 0.011 | 25.866 | -0.065 | -0.065 | 0.000 | 0.000 | 0.000 | 0.000 |
193 | A | 235 | VAL | 0 | -0.065 | -0.014 | 24.311 | 0.381 | 0.381 | 0.000 | 0.000 | 0.000 | 0.000 |
194 | A | 236 | SER | 0 | 0.007 | -0.002 | 19.382 | 0.266 | 0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
195 | A | 237 | GLY | 0 | 0.010 | -0.001 | 19.181 | 0.916 | 0.916 | 0.000 | 0.000 | 0.000 | 0.000 |
196 | A | 238 | MET | 0 | -0.062 | -0.010 | 20.500 | -0.722 | -0.722 | 0.000 | 0.000 | 0.000 | 0.000 |
197 | A | 239 | ARG | 1 | 0.924 | 0.969 | 21.214 | -10.807 | -10.807 | 0.000 | 0.000 | 0.000 | 0.000 |
198 | A | 240 | PHE | 0 | -0.055 | -0.040 | 21.765 | -0.582 | -0.582 | 0.000 | 0.000 | 0.000 | 0.000 |
199 | A | 241 | ASP | -1 | -0.814 | -0.921 | 24.920 | 10.228 | 10.228 | 0.000 | 0.000 | 0.000 | 0.000 |
200 | A | 242 | THR | 0 | -0.031 | -0.020 | 27.375 | -0.258 | -0.258 | 0.000 | 0.000 | 0.000 | 0.000 |
201 | A | 243 | VAL | 0 | -0.012 | -0.005 | 22.727 | -0.245 | -0.245 | 0.000 | 0.000 | 0.000 | 0.000 |
202 | A | 244 | ALA | 0 | -0.050 | -0.020 | 25.204 | -0.033 | -0.033 | 0.000 | 0.000 | 0.000 | 0.000 |
203 | A | 245 | THR | 0 | 0.047 | 0.021 | 26.615 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
204 | A | 246 | TYR | 0 | -0.028 | -0.010 | 26.327 | -0.370 | -0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
205 | A | 247 | SER | 0 | -0.015 | 0.004 | 30.254 | -0.236 | -0.236 | 0.000 | 0.000 | 0.000 | 0.000 |
206 | A | 248 | LYS | 1 | 0.828 | 0.925 | 31.865 | -8.468 | -8.468 | 0.000 | 0.000 | 0.000 | 0.000 |
207 | A | 249 | ILE | 0 | 0.032 | 0.011 | 34.598 | 0.068 | 0.068 | 0.000 | 0.000 | 0.000 | 0.000 |
208 | A | 250 | PRO | 0 | 0.030 | 0.006 | 35.485 | -0.216 | -0.216 | 0.000 | 0.000 | 0.000 | 0.000 |
209 | A | 251 | GLY | 0 | 0.016 | -0.001 | 38.744 | -0.034 | -0.034 | 0.000 | 0.000 | 0.000 | 0.000 |
210 | A | 252 | PHE | 0 | -0.080 | -0.022 | 39.130 | -0.157 | -0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
211 | A | 253 | PRO | 0 | 0.017 | 0.005 | 39.946 | -0.142 | -0.142 | 0.000 | 0.000 | 0.000 | 0.000 |
212 | A | 254 | ASN | 0 | 0.068 | 0.024 | 41.906 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
213 | A | 255 | LEU | 0 | -0.052 | -0.012 | 38.661 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
214 | A | 256 | THR | 0 | 0.009 | 0.002 | 40.403 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
215 | A | 257 | PRO | 0 | 0.048 | -0.004 | 42.167 | 0.091 | 0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
216 | A | 258 | GLU | -1 | -0.908 | -0.950 | 37.054 | 7.884 | 7.884 | 0.000 | 0.000 | 0.000 | 0.000 |
217 | A | 259 | GLN | 0 | 0.015 | -0.005 | 36.840 | -0.026 | -0.026 | 0.000 | 0.000 | 0.000 | 0.000 |
218 | A | 260 | GLN | 0 | -0.053 | -0.014 | 38.134 | 0.022 | 0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
219 | A | 261 | LYS | 1 | 0.960 | 0.986 | 38.273 | -7.331 | -7.331 | 0.000 | 0.000 | 0.000 | 0.000 |
220 | A | 262 | ASN | 0 | 0.033 | 0.032 | 33.454 | 0.158 | 0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
221 | A | 263 | PHE | 0 | 0.032 | 0.007 | 34.496 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
222 | A | 264 | ALA | 0 | -0.023 | -0.019 | 31.933 | 0.109 | 0.109 | 0.000 | 0.000 | 0.000 | 0.000 |
223 | A | 265 | GLU | -1 | -0.870 | -0.935 | 29.069 | 9.891 | 9.891 | 0.000 | 0.000 | 0.000 | 0.000 |
224 | A | 266 | GLN | 0 | 0.042 | 0.020 | 30.790 | 0.258 | 0.258 | 0.000 | 0.000 | 0.000 | 0.000 |
225 | A | 267 | TYR | 0 | -0.044 | -0.024 | 32.921 | -0.024 | -0.024 | 0.000 | 0.000 | 0.000 | 0.000 |
226 | A | 268 | THR | 0 | -0.013 | -0.031 | 27.355 | 0.209 | 0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
227 | A | 269 | MET | 0 | -0.118 | -0.039 | 28.234 | 0.394 | 0.394 | 0.000 | 0.000 | 0.000 | 0.000 |
228 | A | 270 | GLY | 0 | 0.027 | 0.022 | 30.172 | -0.209 | -0.209 | 0.000 | 0.000 | 0.000 | 0.000 |
229 | A | 271 | PRO | 0 | -0.005 | -0.021 | 29.111 | 0.309 | 0.309 | 0.000 | 0.000 | 0.000 | 0.000 |
230 | A | 272 | ASN | 0 | -0.006 | 0.007 | 29.075 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
231 | A | 273 | ILE | 0 | 0.032 | 0.018 | 25.001 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
232 | A | 274 | HIS | 1 | 0.852 | 0.927 | 21.078 | -12.159 | -12.159 | 0.000 | 0.000 | 0.000 | 0.000 |
233 | A | 275 | ARG | 1 | 0.934 | 0.989 | 23.499 | -9.288 | -9.288 | 0.000 | 0.000 | 0.000 | 0.000 |
234 | A | 276 | TYR | 0 | -0.021 | -0.055 | 25.981 | 0.141 | 0.141 | 0.000 | 0.000 | 0.000 | 0.000 |
235 | A | 277 | ILE | 0 | 0.049 | 0.034 | 21.276 | 0.053 | 0.053 | 0.000 | 0.000 | 0.000 | 0.000 |
236 | A | 278 | GLN | 0 | -0.022 | -0.010 | 20.449 | 0.075 | 0.075 | 0.000 | 0.000 | 0.000 | 0.000 |
237 | A | 279 | GLU | -1 | -0.926 | -0.958 | 22.533 | 9.753 | 9.753 | 0.000 | 0.000 | 0.000 | 0.000 |
238 | A | 280 | MET | 0 | 0.049 | 0.032 | 24.013 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
239 | A | 281 | ASN | 0 | 0.002 | 0.005 | 17.958 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
240 | A | 282 | ARG | 1 | 0.940 | 0.990 | 22.029 | -11.281 | -11.281 | 0.000 | 0.000 | 0.000 | 0.000 |
241 | A | 283 | LYS | 1 | 0.838 | 0.913 | 23.532 | -9.515 | -9.515 | 0.000 | 0.000 | 0.000 | 0.000 |
242 | A | 284 | VAL | 0 | -0.030 | -0.015 | 25.112 | -0.273 | -0.273 | 0.000 | 0.000 | 0.000 | 0.000 |
243 | A | 285 | LEU | 0 | 0.028 | 0.020 | 20.426 | 0.176 | 0.176 | 0.000 | 0.000 | 0.000 | 0.000 |
244 | A | 286 | SER | 0 | -0.069 | -0.042 | 19.360 | 0.370 | 0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
245 | A | 287 | ARG | 1 | 0.865 | 0.927 | 20.351 | -11.121 | -11.121 | 0.000 | 0.000 | 0.000 | 0.000 |
246 | A | 288 | TYR | 0 | -0.030 | -0.038 | 21.475 | -0.515 | -0.515 | 0.000 | 0.000 | 0.000 | 0.000 |
247 | A | 289 | ASP | -1 | -0.913 | -0.943 | 16.546 | 17.763 | 17.763 | 0.000 | 0.000 | 0.000 | 0.000 |
248 | A | 290 | VAL | 0 | -0.063 | -0.026 | 18.379 | -0.324 | -0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
249 | A | 291 | ALA | 0 | -0.029 | 0.011 | 15.253 | 0.448 | 0.448 | 0.000 | 0.000 | 0.000 | 0.000 |
250 | A | 292 | THR | 0 | -0.010 | -0.008 | 16.470 | -0.738 | -0.738 | 0.000 | 0.000 | 0.000 | 0.000 |
251 | A | 293 | ALA | 0 | 0.050 | 0.016 | 16.979 | 0.763 | 0.763 | 0.000 | 0.000 | 0.000 | 0.000 |
252 | A | 294 | GLY | 0 | 0.014 | 0.004 | 19.009 | -0.762 | -0.762 | 0.000 | 0.000 | 0.000 | 0.000 |
253 | A | 295 | GLU | -1 | -0.865 | -0.928 | 20.871 | 11.278 | 11.278 | 0.000 | 0.000 | 0.000 | 0.000 |
254 | A | 296 | ILE | 0 | -0.062 | -0.035 | 20.166 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
255 | A | 297 | PHE | 0 | 0.020 | 0.006 | 23.775 | -0.081 | -0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
256 | A | 298 | GLY | 0 | 0.011 | 0.003 | 26.776 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
257 | A | 299 | VAL | 0 | -0.039 | -0.023 | 22.546 | -0.208 | -0.208 | 0.000 | 0.000 | 0.000 | 0.000 |
258 | A | 300 | PRO | 0 | 0.026 | 0.035 | 24.240 | 0.334 | 0.334 | 0.000 | 0.000 | 0.000 | 0.000 |
259 | A | 301 | LEU | 0 | 0.091 | 0.038 | 18.389 | 0.372 | 0.372 | 0.000 | 0.000 | 0.000 | 0.000 |
260 | A | 302 | ASP | -1 | -0.909 | -0.951 | 19.861 | 12.141 | 12.141 | 0.000 | 0.000 | 0.000 | 0.000 |
261 | A | 303 | ARG | 1 | 0.870 | 0.924 | 21.106 | -10.678 | -10.678 | 0.000 | 0.000 | 0.000 | 0.000 |
262 | A | 304 | SER | 0 | -0.031 | -0.018 | 18.006 | 0.318 | 0.318 | 0.000 | 0.000 | 0.000 | 0.000 |
263 | A | 305 | SER | 0 | 0.075 | 0.029 | 14.990 | 0.006 | 0.006 | 0.000 | 0.000 | 0.000 | 0.000 |
264 | A | 306 | GLN | 0 | -0.085 | -0.069 | 15.460 | 0.175 | 0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
265 | A | 307 | PHE | 0 | 0.028 | 0.004 | 17.930 | -0.261 | -0.261 | 0.000 | 0.000 | 0.000 | 0.000 |
266 | A | 308 | PHE | 0 | 0.061 | 0.035 | 12.707 | 0.227 | 0.227 | 0.000 | 0.000 | 0.000 | 0.000 |
267 | A | 309 | ASP | -1 | -0.823 | -0.868 | 11.684 | 20.137 | 20.137 | 0.000 | 0.000 | 0.000 | 0.000 |
268 | A | 310 | ARG | 1 | 0.971 | 0.979 | 6.358 | -28.331 | -28.331 | 0.000 | 0.000 | 0.000 | 0.000 |
269 | A | 311 | ARG | 1 | 0.812 | 0.876 | 10.209 | -19.782 | -19.782 | 0.000 | 0.000 | 0.000 | 0.000 |
270 | A | 312 | ARG | 1 | 0.831 | 0.940 | 12.489 | -14.681 | -14.681 | 0.000 | 0.000 | 0.000 | 0.000 |
271 | A | 313 | HIS | 0 | -0.068 | -0.015 | 14.537 | -0.465 | -0.465 | 0.000 | 0.000 | 0.000 | 0.000 |
272 | A | 314 | GLU | -1 | -0.765 | -0.890 | 16.124 | 12.391 | 12.391 | 0.000 | 0.000 | 0.000 | 0.000 |
273 | A | 315 | LEU | 0 | -0.007 | -0.014 | 17.048 | -0.241 | -0.241 | 0.000 | 0.000 | 0.000 | 0.000 |
274 | A | 316 | ASN | 0 | -0.039 | -0.010 | 13.289 | 0.166 | 0.166 | 0.000 | 0.000 | 0.000 | 0.000 |
275 | A | 317 | MET | 0 | 0.024 | 0.024 | 12.574 | 1.532 | 1.532 | 0.000 | 0.000 | 0.000 | 0.000 |
276 | A | 318 | ALA | 0 | -0.009 | -0.001 | 14.573 | -0.990 | -0.990 | 0.000 | 0.000 | 0.000 | 0.000 |
277 | A | 319 | PHE | 0 | 0.004 | 0.028 | 17.421 | 0.525 | 0.525 | 0.000 | 0.000 | 0.000 | 0.000 |
278 | A | 320 | MET | 0 | 0.016 | -0.003 | 15.896 | -0.591 | -0.591 | 0.000 | 0.000 | 0.000 | 0.000 |
279 | A | 321 | PHE | 0 | 0.039 | -0.013 | 21.118 | -0.039 | -0.039 | 0.000 | 0.000 | 0.000 | 0.000 |
280 | A | 322 | ASP | -1 | -0.892 | -0.942 | 22.367 | 11.933 | 11.933 | 0.000 | 0.000 | 0.000 | 0.000 |
281 | A | 323 | LEU | 0 | 0.008 | 0.005 | 21.079 | -0.294 | -0.294 | 0.000 | 0.000 | 0.000 | 0.000 |
282 | A | 324 | ILE | 0 | 0.002 | 0.016 | 24.125 | -0.461 | -0.461 | 0.000 | 0.000 | 0.000 | 0.000 |
283 | A | 325 | ARG | 1 | 0.865 | 0.926 | 26.244 | -10.215 | -10.215 | 0.000 | 0.000 | 0.000 | 0.000 |
284 | A | 326 | LEU | 0 | 0.017 | 0.024 | 27.007 | -0.305 | -0.305 | 0.000 | 0.000 | 0.000 | 0.000 |
285 | A | 327 | ASP | -1 | -0.895 | -0.927 | 28.876 | 9.364 | 9.364 | 0.000 | 0.000 | 0.000 | 0.000 |
286 | A | 328 | ARG | 1 | 0.915 | 0.966 | 32.019 | -9.353 | -9.353 | 0.000 | 0.000 | 0.000 | 0.000 |
287 | A | 329 | ASP | -1 | -0.864 | -0.928 | 33.923 | 7.871 | 7.871 | 0.000 | 0.000 | 0.000 | 0.000 |
288 | A | 330 | SER | 0 | -0.018 | -0.010 | 34.581 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
289 | A | 331 | ASN | 0 | -0.051 | -0.030 | 36.183 | 0.037 | 0.037 | 0.000 | 0.000 | 0.000 | 0.000 |
290 | A | 332 | GLU | -1 | -0.926 | -0.971 | 39.457 | 6.991 | 6.991 | 0.000 | 0.000 | 0.000 | 0.000 |
291 | A | 333 | ARG | 1 | 0.855 | 0.912 | 34.559 | -8.285 | -8.285 | 0.000 | 0.000 | 0.000 | 0.000 |
292 | A | 334 | TRP | 0 | 0.004 | 0.005 | 36.387 | 0.247 | 0.247 | 0.000 | 0.000 | 0.000 | 0.000 |
293 | A | 335 | ARG | 1 | 0.889 | 0.965 | 38.971 | -7.082 | -7.082 | 0.000 | 0.000 | 0.000 | 0.000 |
294 | A | 336 | HIS | 0 | -0.055 | -0.029 | 34.933 | 0.097 | 0.097 | 0.000 | 0.000 | 0.000 | 0.000 |
295 | A | 337 | LYS | 1 | 0.921 | 0.968 | 33.187 | -9.159 | -9.159 | 0.000 | 0.000 | 0.000 | 0.000 |
296 | A | 338 | SER | 0 | 0.045 | -0.001 | 35.515 | 0.199 | 0.199 | 0.000 | 0.000 | 0.000 | 0.000 |
297 | A | 339 | TRP | 0 | -0.072 | -0.024 | 28.414 | 0.207 | 0.207 | 0.000 | 0.000 | 0.000 | 0.000 |
298 | A | 340 | SER | 0 | 0.024 | -0.006 | 31.225 | -0.032 | -0.032 | 0.000 | 0.000 | 0.000 | 0.000 |
299 | A | 341 | LEU | 0 | 0.030 | 0.022 | 25.437 | 0.258 | 0.258 | 0.000 | 0.000 | 0.000 | 0.000 |
300 | A | 342 | SER | 0 | 0.013 | -0.016 | 26.505 | 0.413 | 0.413 | 0.000 | 0.000 | 0.000 | 0.000 |
301 | A | 343 | GLN | 0 | 0.014 | 0.024 | 26.342 | 0.134 | 0.134 | 0.000 | 0.000 | 0.000 | 0.000 |
302 | A | 344 | PHE | 0 | 0.045 | 0.014 | 22.778 | 0.368 | 0.368 | 0.000 | 0.000 | 0.000 | 0.000 |
303 | A | 345 | ARG | 1 | 0.785 | 0.886 | 22.048 | -12.138 | -12.138 | 0.000 | 0.000 | 0.000 | 0.000 |
304 | A | 346 | GLN | 0 | -0.039 | -0.029 | 21.212 | 0.517 | 0.517 | 0.000 | 0.000 | 0.000 | 0.000 |
305 | A | 347 | ILE | 0 | -0.029 | -0.006 | 21.636 | 0.326 | 0.326 | 0.000 | 0.000 | 0.000 | 0.000 |
306 | A | 348 | ILE | 0 | 0.021 | 0.012 | 17.296 | 0.402 | 0.402 | 0.000 | 0.000 | 0.000 | 0.000 |
307 | A | 349 | SER | 0 | 0.017 | 0.009 | 17.051 | 1.020 | 1.020 | 0.000 | 0.000 | 0.000 | 0.000 |
308 | A | 350 | LYS | 1 | 0.923 | 0.967 | 16.654 | -11.279 | -11.279 | 0.000 | 0.000 | 0.000 | 0.000 |
309 | A | 351 | MET | 0 | 0.000 | 0.011 | 16.492 | 0.367 | 0.367 | 0.000 | 0.000 | 0.000 | 0.000 |
310 | A | 352 | ASP | -1 | -0.816 | -0.897 | 11.428 | 23.706 | 23.706 | 0.000 | 0.000 | 0.000 | 0.000 |
311 | A | 353 | VAL | 0 | -0.006 | -0.012 | 12.194 | 1.133 | 1.133 | 0.000 | 0.000 | 0.000 | 0.000 |
312 | A | 354 | THR | 0 | -0.064 | -0.036 | 13.504 | 0.204 | 0.204 | 0.000 | 0.000 | 0.000 | 0.000 |
313 | A | 355 | VAL | 0 | -0.058 | -0.015 | 9.744 | 0.117 | 0.117 | 0.000 | 0.000 | 0.000 | 0.000 |
314 | A | 356 | GLY | 0 | 0.013 | 0.018 | 10.141 | 0.781 | 0.781 | 0.000 | 0.000 | 0.000 | 0.000 |
315 | A | 357 | LYS | 1 | 0.947 | 0.943 | 4.986 | -25.466 | -25.466 | 0.000 | 0.000 | 0.000 | 0.000 |
316 | A | 358 | TYR | 0 | -0.040 | -0.031 | 5.294 | 2.628 | 2.628 | 0.000 | 0.000 | 0.000 | 0.000 |
317 | A | 359 | GLY | 0 | 0.034 | 0.036 | 7.708 | -0.578 | -0.578 | 0.000 | 0.000 | 0.000 | 0.000 |
318 | A | 360 | TRP | 0 | -0.041 | -0.053 | 6.354 | 3.162 | 3.162 | 0.000 | 0.000 | 0.000 | 0.000 |
319 | A | 361 | ASN | 0 | 0.084 | 0.037 | 10.538 | -1.988 | -1.988 | 0.000 | 0.000 | 0.000 | 0.000 |
320 | A | 362 | THR | 0 | -0.036 | -0.004 | 13.203 | 1.015 | 1.015 | 0.000 | 0.000 | 0.000 | 0.000 |
321 | A | 363 | PHE | 0 | 0.012 | -0.011 | 15.994 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
322 | A | 364 | PHE | 0 | -0.031 | -0.016 | 17.684 | -0.043 | -0.043 | 0.000 | 0.000 | 0.000 | 0.000 |
323 | A | 365 | LEU | 0 | 0.025 | 0.010 | 21.346 | -0.184 | -0.184 | 0.000 | 0.000 | 0.000 | 0.000 |
324 | A | 366 | ASP | -1 | -0.797 | -0.899 | 24.474 | 10.770 | 10.770 | 0.000 | 0.000 | 0.000 | 0.000 |
325 | A | 367 | ASN | 0 | 0.041 | 0.024 | 25.666 | 0.128 | 0.128 | 0.000 | 0.000 | 0.000 | 0.000 |
326 | A | 368 | HIS | 0 | 0.104 | 0.060 | 27.832 | -0.158 | -0.158 | 0.000 | 0.000 | 0.000 | 0.000 |
327 | A | 369 | ASP | -1 | -0.905 | -0.955 | 29.946 | 9.383 | 9.383 | 0.000 | 0.000 | 0.000 | 0.000 |
328 | A | 370 | ASN | 0 | -0.069 | -0.067 | 28.781 | -0.242 | -0.242 | 0.000 | 0.000 | 0.000 | 0.000 |
329 | A | 371 | PRO | 0 | -0.018 | 0.036 | 31.485 | -0.007 | -0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
330 | A | 372 | ARG | 1 | 0.904 | 0.948 | 30.560 | -9.444 | -9.444 | 0.000 | 0.000 | 0.000 | 0.000 |
331 | A | 373 | ALA | 0 | 0.001 | -0.006 | 26.961 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
332 | A | 374 | VAL | 0 | -0.008 | -0.007 | 28.869 | 0.009 | 0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
333 | A | 375 | SER | 0 | -0.048 | -0.049 | 30.883 | -0.084 | -0.084 | 0.000 | 0.000 | 0.000 | 0.000 |
334 | A | 376 | HIS | 1 | 0.765 | 0.892 | 29.503 | -10.178 | -10.178 | 0.000 | 0.000 | 0.000 | 0.000 |
335 | A | 377 | PHE | 0 | -0.035 | -0.039 | 26.864 | 0.019 | 0.019 | 0.000 | 0.000 | 0.000 | 0.000 |
336 | A | 378 | GLY | 0 | 0.014 | 0.012 | 29.572 | 0.197 | 0.197 | 0.000 | 0.000 | 0.000 | 0.000 |
337 | A | 379 | ASP | -1 | -0.804 | -0.883 | 31.133 | 8.156 | 8.156 | 0.000 | 0.000 | 0.000 | 0.000 |
338 | A | 380 | ASP | -1 | -0.831 | -0.898 | 34.823 | 8.435 | 8.435 | 0.000 | 0.000 | 0.000 | 0.000 |
339 | A | 381 | ARG | 1 | 0.946 | 0.985 | 36.351 | -8.172 | -8.172 | 0.000 | 0.000 | 0.000 | 0.000 |
340 | A | 382 | PRO | 0 | -0.011 | -0.027 | 38.499 | 0.186 | 0.186 | 0.000 | 0.000 | 0.000 | 0.000 |
341 | A | 383 | GLN | 0 | -0.024 | -0.010 | 39.503 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
342 | A | 384 | TRP | 0 | 0.020 | 0.003 | 35.562 | 0.175 | 0.175 | 0.000 | 0.000 | 0.000 | 0.000 |
343 | A | 385 | ARG | 1 | 0.961 | 1.019 | 34.162 | -8.387 | -8.387 | 0.000 | 0.000 | 0.000 | 0.000 |
344 | A | 386 | GLU | -1 | -0.889 | -0.949 | 32.586 | 9.366 | 9.366 | 0.000 | 0.000 | 0.000 | 0.000 |
345 | A | 387 | ALA | 0 | 0.013 | 0.009 | 30.929 | 0.373 | 0.373 | 0.000 | 0.000 | 0.000 | 0.000 |
346 | A | 388 | SER | 0 | 0.045 | 0.014 | 29.752 | 0.452 | 0.452 | 0.000 | 0.000 | 0.000 | 0.000 |
347 | A | 389 | ALA | 0 | -0.004 | 0.005 | 28.556 | 0.423 | 0.423 | 0.000 | 0.000 | 0.000 | 0.000 |
348 | A | 390 | LYS | 1 | 0.899 | 0.935 | 26.535 | -9.708 | -9.708 | 0.000 | 0.000 | 0.000 | 0.000 |
349 | A | 391 | ALA | 0 | -0.005 | 0.017 | 25.034 | 0.645 | 0.645 | 0.000 | 0.000 | 0.000 | 0.000 |
350 | A | 392 | LEU | 0 | -0.007 | -0.017 | 24.046 | 0.676 | 0.676 | 0.000 | 0.000 | 0.000 | 0.000 |
351 | A | 393 | ALA | 0 | 0.004 | 0.029 | 22.618 | 0.662 | 0.662 | 0.000 | 0.000 | 0.000 | 0.000 |
352 | A | 394 | THR | 0 | 0.009 | -0.015 | 20.422 | 0.786 | 0.786 | 0.000 | 0.000 | 0.000 | 0.000 |
353 | A | 395 | ILE | 0 | -0.037 | -0.006 | 19.020 | 0.915 | 0.915 | 0.000 | 0.000 | 0.000 | 0.000 |
354 | A | 396 | THR | 0 | -0.047 | -0.047 | 17.854 | 0.949 | 0.949 | 0.000 | 0.000 | 0.000 | 0.000 |
355 | A | 397 | LEU | 0 | -0.005 | 0.008 | 16.352 | 0.843 | 0.843 | 0.000 | 0.000 | 0.000 | 0.000 |
356 | A | 398 | THR | 0 | 0.006 | 0.024 | 13.953 | 1.421 | 1.421 | 0.000 | 0.000 | 0.000 | 0.000 |
357 | A | 399 | GLN | 0 | 0.028 | 0.022 | 13.708 | 0.125 | 0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
358 | A | 400 | ARG | 1 | 0.816 | 0.914 | 6.648 | -27.076 | -27.076 | 0.000 | 0.000 | 0.000 | 0.000 |
359 | A | 401 | ALA | 0 | -0.059 | -0.034 | 10.410 | -0.418 | -0.418 | 0.000 | 0.000 | 0.000 | 0.000 |
360 | A | 402 | THR | 0 | -0.013 | -0.025 | 12.090 | 1.024 | 1.024 | 0.000 | 0.000 | 0.000 | 0.000 |
361 | A | 403 | PRO | 0 | -0.016 | 0.013 | 13.418 | -1.315 | -1.315 | 0.000 | 0.000 | 0.000 | 0.000 |
362 | A | 404 | PHE | 0 | -0.019 | -0.025 | 16.676 | -0.161 | -0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
363 | A | 405 | ILE | 0 | 0.008 | 0.009 | 19.854 | -0.389 | -0.389 | 0.000 | 0.000 | 0.000 | 0.000 |
364 | A | 406 | TYR | 0 | -0.042 | -0.026 | 22.757 | -0.091 | -0.091 | 0.000 | 0.000 | 0.000 | 0.000 |
365 | A | 407 | GLN | 0 | 0.126 | 0.059 | 26.108 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
366 | A | 408 | GLY | 0 | 0.026 | 0.010 | 28.700 | -0.357 | -0.357 | 0.000 | 0.000 | 0.000 | 0.000 |
367 | A | 409 | SER | 0 | -0.033 | -0.044 | 27.290 | -0.386 | -0.386 | 0.000 | 0.000 | 0.000 | 0.000 |
368 | A | 410 | GLU | -1 | -0.754 | -0.825 | 26.099 | 11.183 | 11.183 | 0.000 | 0.000 | 0.000 | 0.000 |
369 | A | 411 | LEU | 0 | -0.018 | -0.002 | 27.379 | 0.020 | 0.020 | 0.000 | 0.000 | 0.000 | 0.000 |
370 | A | 412 | GLY | 0 | 0.000 | 0.015 | 30.272 | -0.229 | -0.229 | 0.000 | 0.000 | 0.000 | 0.000 |
371 | A | 413 | MET | 0 | -0.074 | -0.024 | 31.660 | -0.264 | -0.264 | 0.000 | 0.000 | 0.000 | 0.000 |
372 | A | 414 | THR | 0 | -0.016 | -0.018 | 32.979 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
373 | A | 415 | ASN | 0 | 0.051 | 0.019 | 35.379 | 0.165 | 0.165 | 0.000 | 0.000 | 0.000 | 0.000 |
374 | A | 416 | TYR | 0 | -0.015 | -0.009 | 37.245 | -0.104 | -0.104 | 0.000 | 0.000 | 0.000 | 0.000 |
375 | A | 417 | PRO | 0 | -0.015 | 0.004 | 40.592 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
376 | A | 418 | PHE | 0 | -0.003 | -0.003 | 40.043 | -0.195 | -0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
377 | A | 419 | ARG | 1 | 0.948 | 0.979 | 45.331 | -6.275 | -6.275 | 0.000 | 0.000 | 0.000 | 0.000 |
378 | A | 420 | GLN | 0 | -0.004 | -0.021 | 48.925 | -0.137 | -0.137 | 0.000 | 0.000 | 0.000 | 0.000 |
379 | A | 421 | LEU | 0 | 0.047 | 0.017 | 46.833 | 0.102 | 0.102 | 0.000 | 0.000 | 0.000 | 0.000 |
380 | A | 422 | ASN | 0 | -0.042 | -0.019 | 47.728 | 0.179 | 0.179 | 0.000 | 0.000 | 0.000 | 0.000 |
381 | A | 423 | GLU | -1 | -0.829 | -0.901 | 46.658 | 6.559 | 6.559 | 0.000 | 0.000 | 0.000 | 0.000 |
382 | A | 424 | PHE | 0 | 0.004 | 0.011 | 41.264 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
383 | A | 425 | ASP | -1 | -0.878 | -0.959 | 42.230 | 6.898 | 6.898 | 0.000 | 0.000 | 0.000 | 0.000 |
384 | A | 426 | ASP | -1 | -0.833 | -0.964 | 38.778 | 8.042 | 8.042 | 0.000 | 0.000 | 0.000 | 0.000 |
385 | A | 427 | ILE | 0 | -0.001 | -0.006 | 39.595 | -0.173 | -0.173 | 0.000 | 0.000 | 0.000 | 0.000 |
386 | A | 428 | GLU | -1 | -0.882 | -0.916 | 35.992 | 8.447 | 8.447 | 0.000 | 0.000 | 0.000 | 0.000 |
387 | A | 429 | VAL | 0 | -0.026 | 0.001 | 40.161 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
388 | A | 430 | LYS | 1 | 0.877 | 0.931 | 42.442 | -6.902 | -6.902 | 0.000 | 0.000 | 0.000 | 0.000 |
389 | A | 431 | GLY | 0 | 0.049 | 0.028 | 43.530 | -0.162 | -0.162 | 0.000 | 0.000 | 0.000 | 0.000 |
390 | A | 432 | PHE | 0 | 0.005 | -0.013 | 37.808 | -0.078 | -0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
391 | A | 433 | TRP | 0 | 0.005 | 0.000 | 43.907 | -0.136 | -0.136 | 0.000 | 0.000 | 0.000 | 0.000 |
392 | A | 434 | GLN | 0 | -0.009 | -0.014 | 47.360 | -0.035 | -0.035 | 0.000 | 0.000 | 0.000 | 0.000 |
393 | A | 435 | ASP | -1 | -0.790 | -0.898 | 44.472 | 6.693 | 6.693 | 0.000 | 0.000 | 0.000 | 0.000 |
394 | A | 436 | TYR | 0 | -0.081 | 0.000 | 42.216 | -0.012 | -0.012 | 0.000 | 0.000 | 0.000 | 0.000 |
395 | A | 437 | VAL | 0 | 0.026 | 0.022 | 47.733 | -0.070 | -0.070 | 0.000 | 0.000 | 0.000 | 0.000 |
396 | A | 438 | GLN | 0 | -0.066 | -0.025 | 50.477 | -0.067 | -0.067 | 0.000 | 0.000 | 0.000 | 0.000 |
397 | A | 439 | SER | 0 | -0.088 | -0.082 | 49.205 | -0.120 | -0.120 | 0.000 | 0.000 | 0.000 | 0.000 |
398 | A | 440 | GLY | 0 | -0.004 | 0.000 | 52.408 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
399 | A | 441 | LYS | 1 | 0.884 | 0.950 | 46.925 | -6.498 | -6.498 | 0.000 | 0.000 | 0.000 | 0.000 |
400 | A | 442 | VAL | 0 | 0.005 | 0.019 | 46.622 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
401 | A | 443 | THR | 0 | 0.016 | 0.015 | 49.494 | -0.066 | -0.066 | 0.000 | 0.000 | 0.000 | 0.000 |
402 | A | 444 | ALA | 0 | 0.059 | 0.007 | 49.709 | 0.119 | 0.119 | 0.000 | 0.000 | 0.000 | 0.000 |
403 | A | 445 | THR | 0 | 0.003 | -0.002 | 49.671 | 0.074 | 0.074 | 0.000 | 0.000 | 0.000 | 0.000 |
404 | A | 446 | GLU | -1 | -0.823 | -0.915 | 46.163 | 6.730 | 6.730 | 0.000 | 0.000 | 0.000 | 0.000 |
405 | A | 447 | PHE | 0 | -0.002 | 0.003 | 43.752 | 0.171 | 0.171 | 0.000 | 0.000 | 0.000 | 0.000 |
406 | A | 448 | LEU | 0 | -0.022 | -0.014 | 44.638 | 0.174 | 0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
407 | A | 449 | ASP | -1 | -0.909 | -0.962 | 44.514 | 6.815 | 6.815 | 0.000 | 0.000 | 0.000 | 0.000 |
408 | A | 450 | ASN | 0 | -0.016 | -0.013 | 41.183 | 0.360 | 0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
409 | A | 451 | VAL | 0 | 0.009 | 0.017 | 40.168 | 0.231 | 0.231 | 0.000 | 0.000 | 0.000 | 0.000 |
410 | A | 452 | ARG | 1 | 0.845 | 0.912 | 40.154 | -6.612 | -6.612 | 0.000 | 0.000 | 0.000 | 0.000 |
411 | A | 453 | LEU | 0 | -0.022 | 0.001 | 37.547 | 0.161 | 0.161 | 0.000 | 0.000 | 0.000 | 0.000 |
412 | A | 454 | THR | 0 | -0.060 | -0.044 | 35.566 | 0.287 | 0.287 | 0.000 | 0.000 | 0.000 | 0.000 |
413 | A | 455 | SER | 0 | -0.026 | -0.003 | 35.612 | 0.195 | 0.195 | 0.000 | 0.000 | 0.000 | 0.000 |
414 | A | 456 | ARG | 1 | 0.957 | 0.994 | 34.390 | -8.436 | -8.436 | 0.000 | 0.000 | 0.000 | 0.000 |
415 | A | 457 | ASP | -1 | -0.750 | -0.869 | 35.368 | 7.888 | 7.888 | 0.000 | 0.000 | 0.000 | 0.000 |
416 | A | 458 | ASN | 0 | -0.080 | -0.041 | 35.697 | -0.154 | -0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
417 | A | 459 | SER | 0 | -0.041 | -0.037 | 31.845 | 0.021 | 0.021 | 0.000 | 0.000 | 0.000 | 0.000 |
418 | A | 460 | ARG | 1 | 0.859 | 0.931 | 33.521 | -8.568 | -8.568 | 0.000 | 0.000 | 0.000 | 0.000 |
419 | A | 461 | THR | 0 | -0.006 | 0.023 | 36.055 | -0.133 | -0.133 | 0.000 | 0.000 | 0.000 | 0.000 |
420 | A | 462 | PRO | 0 | -0.057 | -0.030 | 36.633 | 0.244 | 0.244 | 0.000 | 0.000 | 0.000 | 0.000 |
421 | A | 463 | PHE | 0 | 0.006 | 0.007 | 30.633 | -0.009 | -0.009 | 0.000 | 0.000 | 0.000 | 0.000 |
422 | A | 464 | GLN | 0 | -0.034 | -0.024 | 35.628 | -0.304 | -0.304 | 0.000 | 0.000 | 0.000 | 0.000 |
423 | A | 465 | TRP | 0 | 0.027 | 0.004 | 31.908 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
424 | A | 466 | ASN | 0 | 0.068 | 0.066 | 37.401 | -0.022 | -0.022 | 0.000 | 0.000 | 0.000 | 0.000 |
425 | A | 467 | ASP | -1 | -0.900 | -0.958 | 40.208 | 7.224 | 7.224 | 0.000 | 0.000 | 0.000 | 0.000 |
426 | A | 468 | THR | 0 | -0.024 | -0.028 | 43.438 | -0.233 | -0.233 | 0.000 | 0.000 | 0.000 | 0.000 |
427 | A | 469 | LEU | 0 | 0.023 | -0.013 | 45.194 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
428 | A | 470 | ASN | 0 | -0.053 | -0.038 | 44.507 | 0.036 | 0.036 | 0.000 | 0.000 | 0.000 | 0.000 |
429 | A | 471 | ALA | 0 | 0.050 | 0.032 | 40.507 | 0.183 | 0.183 | 0.000 | 0.000 | 0.000 | 0.000 |
430 | A | 472 | GLY | 0 | 0.031 | 0.028 | 40.467 | 0.228 | 0.228 | 0.000 | 0.000 | 0.000 | 0.000 |
431 | A | 473 | PHE | 0 | -0.123 | -0.056 | 37.856 | 0.130 | 0.130 | 0.000 | 0.000 | 0.000 | 0.000 |
432 | A | 474 | THR | 0 | 0.007 | -0.030 | 40.713 | -0.005 | -0.005 | 0.000 | 0.000 | 0.000 | 0.000 |
433 | A | 475 | ARG | 1 | 0.836 | 0.918 | 43.820 | -6.865 | -6.865 | 0.000 | 0.000 | 0.000 | 0.000 |
434 | A | 476 | GLY | 0 | 0.030 | 0.035 | 46.814 | -0.187 | -0.187 | 0.000 | 0.000 | 0.000 | 0.000 |
435 | A | 477 | LYS | 1 | 0.897 | 0.939 | 48.067 | -6.139 | -6.139 | 0.000 | 0.000 | 0.000 | 0.000 |
436 | A | 478 | PRO | 0 | -0.002 | -0.003 | 43.553 | 0.059 | 0.059 | 0.000 | 0.000 | 0.000 | 0.000 |
437 | A | 479 | TRP | 0 | -0.005 | 0.001 | 38.611 | -0.170 | -0.170 | 0.000 | 0.000 | 0.000 | 0.000 |
438 | A | 480 | PHE | 0 | -0.003 | 0.003 | 39.887 | -0.077 | -0.077 | 0.000 | 0.000 | 0.000 | 0.000 |
439 | A | 481 | HIS | 1 | 0.770 | 0.881 | 42.380 | -7.224 | -7.224 | 0.000 | 0.000 | 0.000 | 0.000 |
440 | A | 482 | ILE | 0 | 0.077 | 0.036 | 41.027 | 0.155 | 0.155 | 0.000 | 0.000 | 0.000 | 0.000 |
441 | A | 483 | ASN | 0 | 0.012 | 0.019 | 39.357 | -0.359 | -0.359 | 0.000 | 0.000 | 0.000 | 0.000 |
442 | A | 484 | PRO | 0 | 0.041 | 0.009 | 42.007 | 0.046 | 0.046 | 0.000 | 0.000 | 0.000 | 0.000 |
443 | A | 485 | ASN | 0 | -0.010 | 0.000 | 38.867 | -0.041 | -0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
444 | A | 486 | TYR | 0 | 0.043 | 0.022 | 39.998 | 0.101 | 0.101 | 0.000 | 0.000 | 0.000 | 0.000 |
445 | A | 487 | VAL | 0 | -0.040 | -0.014 | 40.938 | 0.080 | 0.080 | 0.000 | 0.000 | 0.000 | 0.000 |
446 | A | 488 | GLU | -1 | -0.980 | -0.972 | 39.180 | 7.814 | 7.814 | 0.000 | 0.000 | 0.000 | 0.000 |
447 | A | 489 | ILE | 0 | -0.032 | -0.028 | 35.040 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
448 | A | 490 | ASN | 0 | 0.045 | 0.024 | 36.659 | 0.041 | 0.041 | 0.000 | 0.000 | 0.000 | 0.000 |
449 | A | 491 | ALA | 0 | 0.038 | 0.004 | 33.408 | 0.073 | 0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
450 | A | 492 | GLU | -1 | -0.901 | -0.947 | 34.416 | 7.956 | 7.956 | 0.000 | 0.000 | 0.000 | 0.000 |
451 | A | 493 | ARG | 1 | 0.833 | 0.902 | 36.584 | -7.911 | -7.911 | 0.000 | 0.000 | 0.000 | 0.000 |
452 | A | 494 | GLU | -1 | -0.845 | -0.958 | 31.947 | 9.773 | 9.773 | 0.000 | 0.000 | 0.000 | 0.000 |
453 | A | 495 | GLU | -1 | -0.949 | -0.959 | 31.738 | 9.881 | 9.881 | 0.000 | 0.000 | 0.000 | 0.000 |
454 | A | 496 | THR | 0 | -0.034 | -0.011 | 32.964 | 0.081 | 0.081 | 0.000 | 0.000 | 0.000 | 0.000 |
455 | A | 497 | ARG | 1 | 0.932 | 0.985 | 34.772 | -8.192 | -8.192 | 0.000 | 0.000 | 0.000 | 0.000 |
456 | A | 498 | GLU | -1 | -0.845 | -0.926 | 30.411 | 10.486 | 10.486 | 0.000 | 0.000 | 0.000 | 0.000 |
457 | A | 499 | ASP | -1 | -0.990 | -0.971 | 30.611 | 9.403 | 9.403 | 0.000 | 0.000 | 0.000 | 0.000 |
458 | A | 500 | SER | 0 | 0.016 | 0.000 | 31.512 | 0.157 | 0.157 | 0.000 | 0.000 | 0.000 | 0.000 |
459 | A | 501 | VAL | 0 | -0.013 | -0.020 | 28.329 | 0.374 | 0.374 | 0.000 | 0.000 | 0.000 | 0.000 |
460 | A | 502 | LEU | 0 | 0.016 | 0.020 | 27.439 | 0.579 | 0.579 | 0.000 | 0.000 | 0.000 | 0.000 |
461 | A | 503 | ASN | 0 | 0.039 | -0.006 | 26.553 | 0.821 | 0.821 | 0.000 | 0.000 | 0.000 | 0.000 |
462 | A | 504 | TYR | 0 | -0.062 | -0.034 | 23.053 | 0.416 | 0.416 | 0.000 | 0.000 | 0.000 | 0.000 |
463 | A | 505 | TYR | 0 | 0.009 | -0.009 | 22.430 | 0.897 | 0.897 | 0.000 | 0.000 | 0.000 | 0.000 |
464 | A | 506 | LYS | 1 | 0.927 | 0.982 | 21.722 | -10.397 | -10.397 | 0.000 | 0.000 | 0.000 | 0.000 |
465 | A | 507 | LYS | 1 | 0.970 | 0.991 | 21.145 | -10.985 | -10.985 | 0.000 | 0.000 | 0.000 | 0.000 |
466 | A | 508 | MET | 0 | -0.029 | 0.007 | 17.942 | 0.756 | 0.756 | 0.000 | 0.000 | 0.000 | 0.000 |
467 | A | 509 | ILE | 0 | -0.012 | -0.008 | 17.207 | 1.273 | 1.273 | 0.000 | 0.000 | 0.000 | 0.000 |
468 | A | 510 | GLN | 0 | 0.011 | 0.020 | 16.276 | 0.787 | 0.787 | 0.000 | 0.000 | 0.000 | 0.000 |
469 | A | 511 | LEU | 0 | -0.015 | -0.017 | 15.870 | 1.127 | 1.127 | 0.000 | 0.000 | 0.000 | 0.000 |
470 | A | 512 | ARG | 1 | 0.809 | 0.902 | 11.160 | -22.274 | -22.274 | 0.000 | 0.000 | 0.000 | 0.000 |
471 | A | 513 | HIS | 0 | -0.060 | -0.045 | 11.407 | 1.965 | 1.965 | 0.000 | 0.000 | 0.000 | 0.000 |
472 | A | 514 | HIS | 0 | -0.050 | -0.021 | 12.063 | 0.063 | 0.063 | 0.000 | 0.000 | 0.000 | 0.000 |
473 | A | 515 | ILE | 0 | 0.010 | 0.022 | 10.392 | 1.081 | 1.081 | 0.000 | 0.000 | 0.000 | 0.000 |
474 | A | 516 | PRO | 0 | 0.082 | 0.040 | 5.152 | 0.517 | 0.571 | -0.001 | 0.000 | -0.053 | 0.000 |
475 | A | 517 | ALA | 0 | 0.019 | 0.006 | 6.462 | 2.743 | 2.743 | 0.000 | 0.000 | 0.000 | 0.000 |
476 | A | 518 | LEU | 0 | 0.001 | -0.001 | 7.721 | -0.814 | -0.814 | 0.000 | 0.000 | 0.000 | 0.000 |
477 | A | 519 | VAL | 0 | -0.039 | 0.018 | 6.612 | -2.408 | -2.408 | 0.000 | 0.000 | 0.000 | 0.000 |
478 | A | 520 | TYR | 0 | -0.051 | -0.119 | 3.008 | -3.257 | -1.175 | 0.330 | -0.699 | -1.713 | 0.000 |
479 | A | 521 | GLY | 0 | -0.020 | 0.010 | 5.125 | -0.132 | -0.012 | -0.001 | -0.001 | -0.118 | 0.000 |
480 | A | 522 | ALA | 0 | -0.016 | -0.022 | 7.308 | -2.588 | -2.588 | 0.000 | 0.000 | 0.000 | 0.000 |
481 | A | 523 | TYR | 0 | 0.004 | -0.007 | 9.150 | -0.818 | -0.818 | 0.000 | 0.000 | 0.000 | 0.000 |
482 | A | 524 | GLN | 0 | -0.012 | -0.014 | 12.399 | -1.098 | -1.098 | 0.000 | 0.000 | 0.000 | 0.000 |
483 | A | 525 | ASP | -1 | -0.732 | -0.843 | 15.697 | 13.608 | 13.608 | 0.000 | 0.000 | 0.000 | 0.000 |
484 | A | 526 | LEU | 0 | 0.005 | -0.005 | 19.171 | -0.365 | -0.365 | 0.000 | 0.000 | 0.000 | 0.000 |
485 | A | 527 | ASN | 0 | -0.018 | -0.015 | 21.497 | -0.531 | -0.531 | 0.000 | 0.000 | 0.000 | 0.000 |
486 | A | 528 | PRO | 0 | 0.030 | 0.020 | 22.126 | -0.366 | -0.366 | 0.000 | 0.000 | 0.000 | 0.000 |
487 | A | 529 | GLN | 0 | 0.009 | -0.003 | 24.517 | -0.487 | -0.487 | 0.000 | 0.000 | 0.000 | 0.000 |
488 | A | 530 | ASP | -1 | -0.858 | -0.896 | 27.318 | 10.161 | 10.161 | 0.000 | 0.000 | 0.000 | 0.000 |
489 | A | 531 | ASN | 0 | 0.037 | 0.018 | 28.118 | 0.452 | 0.452 | 0.000 | 0.000 | 0.000 | 0.000 |
490 | A | 532 | THR | 0 | -0.092 | -0.050 | 30.300 | -0.324 | -0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
491 | A | 533 | VAL | 0 | 0.061 | 0.019 | 25.961 | 0.007 | 0.007 | 0.000 | 0.000 | 0.000 | 0.000 |
492 | A | 534 | TYR | 0 | -0.024 | 0.020 | 18.894 | 0.239 | 0.239 | 0.000 | 0.000 | 0.000 | 0.000 |
493 | A | 535 | ALA | 0 | 0.037 | 0.000 | 21.897 | 0.062 | 0.062 | 0.000 | 0.000 | 0.000 | 0.000 |
494 | A | 536 | TYR | 0 | -0.034 | -0.036 | 15.455 | -0.370 | -0.370 | 0.000 | 0.000 | 0.000 | 0.000 |
495 | A | 537 | THR | 0 | -0.011 | -0.007 | 15.349 | 0.317 | 0.317 | 0.000 | 0.000 | 0.000 | 0.000 |
496 | A | 538 | ARG | 1 | 0.754 | 0.867 | 8.695 | -27.084 | -27.084 | 0.000 | 0.000 | 0.000 | 0.000 |
497 | A | 539 | THR | 0 | -0.011 | -0.010 | 10.547 | -0.742 | -0.742 | 0.000 | 0.000 | 0.000 | 0.000 |
498 | A | 540 | LEU | 0 | 0.032 | 0.026 | 3.277 | -2.431 | -0.948 | 0.071 | -0.811 | -0.743 | 0.007 |
499 | A | 541 | GLY | 0 | -0.008 | 0.006 | 7.272 | 0.083 | 0.083 | 0.000 | 0.000 | 0.000 | 0.000 |
500 | A | 542 | ASN | 0 | -0.006 | -0.016 | 8.970 | -2.970 | -2.970 | 0.000 | 0.000 | 0.000 | 0.000 |
501 | A | 543 | GLU | -1 | -0.926 | -0.951 | 9.496 | 22.714 | 22.714 | 0.000 | 0.000 | 0.000 | 0.000 |
502 | A | 544 | ARG | 1 | 0.845 | 0.902 | 10.805 | -16.323 | -16.323 | 0.000 | 0.000 | 0.000 | 0.000 |
503 | A | 545 | TYR | 0 | 0.037 | 0.011 | 11.479 | -1.563 | -1.563 | 0.000 | 0.000 | 0.000 | 0.000 |
504 | A | 546 | LEU | 0 | -0.013 | -0.010 | 14.893 | 0.303 | 0.303 | 0.000 | 0.000 | 0.000 | 0.000 |
505 | A | 547 | VAL | 0 | -0.004 | 0.010 | 16.605 | -0.289 | -0.289 | 0.000 | 0.000 | 0.000 | 0.000 |
506 | A | 548 | VAL | 0 | -0.017 | -0.015 | 19.346 | -0.277 | -0.277 | 0.000 | 0.000 | 0.000 | 0.000 |
507 | A | 549 | VAL | 0 | 0.037 | 0.008 | 22.761 | -0.108 | -0.108 | 0.000 | 0.000 | 0.000 | 0.000 |
508 | A | 550 | ASN | 0 | -0.020 | -0.006 | 25.465 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
509 | A | 551 | PHE | 0 | 0.013 | -0.010 | 25.065 | -0.049 | -0.049 | 0.000 | 0.000 | 0.000 | 0.000 |
510 | A | 552 | LYS | 1 | 0.862 | 0.960 | 30.068 | -9.432 | -9.432 | 0.000 | 0.000 | 0.000 | 0.000 |
511 | A | 553 | GLH | 0 | -0.057 | -0.081 | 33.722 | 0.003 | 0.003 | 0.000 | 0.000 | 0.000 | 0.000 |
512 | A | 554 | TYR | 0 | 0.010 | 0.005 | 36.194 | -0.259 | -0.259 | 0.000 | 0.000 | 0.000 | 0.000 |
513 | A | 555 | PRO | 0 | 0.007 | -0.011 | 35.439 | 0.257 | 0.257 | 0.000 | 0.000 | 0.000 | 0.000 |
514 | A | 556 | VAL | 0 | 0.005 | 0.003 | 32.192 | -0.174 | -0.174 | 0.000 | 0.000 | 0.000 | 0.000 |
515 | A | 557 | ARG | 1 | 0.972 | 1.005 | 32.847 | -9.120 | -9.120 | 0.000 | 0.000 | 0.000 | 0.000 |
516 | A | 558 | TYR | 0 | 0.021 | -0.001 | 24.378 | 0.050 | 0.050 | 0.000 | 0.000 | 0.000 | 0.000 |
517 | A | 559 | THR | 0 | -0.038 | -0.029 | 29.359 | -0.106 | -0.106 | 0.000 | 0.000 | 0.000 | 0.000 |
518 | A | 560 | LEU | 0 | 0.010 | 0.014 | 23.300 | 0.217 | 0.217 | 0.000 | 0.000 | 0.000 | 0.000 |
519 | A | 561 | PRO | 0 | 0.013 | 0.003 | 22.506 | -0.525 | -0.525 | 0.000 | 0.000 | 0.000 | 0.000 |
520 | A | 562 | ALA | 0 | 0.029 | 0.002 | 25.623 | 0.122 | 0.122 | 0.000 | 0.000 | 0.000 | 0.000 |
521 | A | 563 | ASN | 0 | -0.041 | -0.017 | 24.167 | -0.381 | -0.381 | 0.000 | 0.000 | 0.000 | 0.000 |
522 | A | 564 | ASP | -1 | -0.859 | -0.900 | 21.057 | 15.897 | 15.897 | 0.000 | 0.000 | 0.000 | 0.000 |
523 | A | 565 | ALA | 0 | -0.012 | -0.008 | 22.322 | -0.634 | -0.634 | 0.000 | 0.000 | 0.000 | 0.000 |
524 | A | 566 | ILE | 0 | -0.050 | -0.031 | 21.854 | 0.810 | 0.810 | 0.000 | 0.000 | 0.000 | 0.000 |
525 | A | 567 | GLU | -1 | -0.908 | -0.934 | 20.387 | 12.952 | 12.952 | 0.000 | 0.000 | 0.000 | 0.000 |
526 | A | 568 | GLU | -1 | -0.884 | -0.935 | 19.773 | 14.067 | 14.067 | 0.000 | 0.000 | 0.000 | 0.000 |
527 | A | 569 | VAL | 0 | -0.020 | -0.018 | 21.012 | 0.440 | 0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
528 | A | 570 | VAL | 0 | -0.057 | -0.022 | 16.860 | 0.078 | 0.078 | 0.000 | 0.000 | 0.000 | 0.000 |
529 | A | 571 | ILE | 0 | 0.006 | -0.011 | 19.959 | -0.164 | -0.164 | 0.000 | 0.000 | 0.000 | 0.000 |
530 | A | 572 | ASP | -1 | -0.891 | -0.952 | 22.410 | 11.827 | 11.827 | 0.000 | 0.000 | 0.000 | 0.000 |
531 | A | 573 | THR | 0 | -0.001 | 0.001 | 25.124 | -0.202 | -0.202 | 0.000 | 0.000 | 0.000 | 0.000 |
532 | A | 574 | GLN | 0 | -0.079 | -0.029 | 27.723 | -0.353 | -0.353 | 0.000 | 0.000 | 0.000 | 0.000 |
533 | A | 575 | GLN | 0 | -0.016 | -0.012 | 30.026 | -0.064 | -0.064 | 0.000 | 0.000 | 0.000 | 0.000 |
534 | A | 576 | GLN | 0 | -0.049 | -0.028 | 32.099 | -0.073 | -0.073 | 0.000 | 0.000 | 0.000 | 0.000 |
535 | A | 577 | ALA | 0 | 0.004 | -0.011 | 30.605 | 0.099 | 0.099 | 0.000 | 0.000 | 0.000 | 0.000 |
536 | A | 578 | ALA | 0 | 0.048 | 0.051 | 30.742 | 0.193 | 0.193 | 0.000 | 0.000 | 0.000 | 0.000 |
537 | A | 579 | ALA | 0 | 0.006 | -0.002 | 28.156 | 0.191 | 0.191 | 0.000 | 0.000 | 0.000 | 0.000 |
538 | A | 580 | PRO | 0 | -0.018 | 0.008 | 26.785 | -0.360 | -0.360 | 0.000 | 0.000 | 0.000 | 0.000 |
539 | A | 581 | HIS | 0 | 0.036 | 0.006 | 28.936 | 0.266 | 0.266 | 0.000 | 0.000 | 0.000 | 0.000 |
540 | A | 582 | SER | 0 | 0.012 | -0.011 | 26.489 | 0.098 | 0.098 | 0.000 | 0.000 | 0.000 | 0.000 |
541 | A | 583 | THR | 0 | 0.060 | 0.019 | 26.409 | 0.316 | 0.316 | 0.000 | 0.000 | 0.000 | 0.000 |
542 | A | 584 | SER | 0 | -0.094 | -0.036 | 28.766 | -0.125 | -0.125 | 0.000 | 0.000 | 0.000 | 0.000 |
543 | A | 585 | LEU | 0 | 0.059 | 0.038 | 24.880 | -0.002 | -0.002 | 0.000 | 0.000 | 0.000 | 0.000 |
544 | A | 586 | SER | 0 | -0.023 | -0.006 | 29.566 | -0.265 | -0.265 | 0.000 | 0.000 | 0.000 | 0.000 |
545 | A | 587 | LEU | 0 | -0.025 | -0.011 | 27.639 | 0.054 | 0.054 | 0.000 | 0.000 | 0.000 | 0.000 |
546 | A | 588 | SER | 0 | 0.053 | 0.009 | 31.602 | -0.440 | -0.440 | 0.000 | 0.000 | 0.000 | 0.000 |
547 | A | 589 | PRO | 0 | -0.048 | -0.025 | 32.470 | 0.297 | 0.297 | 0.000 | 0.000 | 0.000 | 0.000 |
548 | A | 590 | TRP | 0 | 0.029 | 0.013 | 28.270 | 0.131 | 0.131 | 0.000 | 0.000 | 0.000 | 0.000 |
549 | A | 591 | GLN | 0 | 0.023 | 0.040 | 28.276 | -0.095 | -0.095 | 0.000 | 0.000 | 0.000 | 0.000 |
550 | A | 592 | ALA | 0 | -0.003 | -0.012 | 24.006 | 0.154 | 0.154 | 0.000 | 0.000 | 0.000 | 0.000 |
551 | A | 593 | GLY | 0 | 0.044 | 0.025 | 23.134 | -0.324 | -0.324 | 0.000 | 0.000 | 0.000 | 0.000 |
552 | A | 594 | VAL | 0 | -0.016 | -0.001 | 16.554 | 0.503 | 0.503 | 0.000 | 0.000 | 0.000 | 0.000 |
553 | A | 595 | TYR | 0 | 0.028 | -0.002 | 18.928 | -0.473 | -0.473 | 0.000 | 0.000 | 0.000 | 0.000 |
554 | A | 596 | LYS | 1 | 0.953 | 1.006 | 14.032 | -19.471 | -19.471 | 0.000 | 0.000 | 0.000 | 0.000 |
555 | A | 597 | LEU | 0 | -0.023 | -0.015 | 16.851 | -1.026 | -1.026 | 0.000 | 0.000 | 0.000 | 0.000 |
556 | A | 598 | ARG | 1 | 0.867 | 0.922 | 17.380 | -13.164 | -13.164 | 0.000 | 0.000 | 0.000 | 0.000 |