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. 2020 May 18;43(4):363–367. doi: 10.1016/j.bj.2020.05.002

Table 2.

The Total Interaction energy of Standard X77 and Narcissoside with corona virus protein 6W63 COVID -19.

S.No. Target Atoms: Molecule Residue ID Total Energy of Interaction
Standard X77 Narcissoside
1 6W63 [A] Arg 188 −7.66744 −10.9985
2 6W63 [A] Asn 142 −15.5609 −19.9549
3 6W63 [A] Asp 187 −5.02839 −2.15432
4 6W63 [A] Cys 44 −0.895733 −1.73084
5 6W63 [A] Cys 145 −10.3877 −5.53185
6 6W63 [A] Gln 189 −9.77781 −12.3962
7 6W63 [A] Gln 192 −0.400777 −7.60682
8 6W63 [A] Glu 166 −23.2155 −21.4249
9 6W63 [A] Gly 143 −7.30909 −2.03337
10 6W63 [A] His 41 −23.5486 −25.5306
11 6W63 [A] His 163 −2.50682 −0.714996
12 6W63 [A] His 164 −4.38194 −6.59603
13 6W63 [A] His 172 −1.35267 NA
14 6W63 [A] Leu 27 −3.6484 NA
15 6W63 [A] Leu 141 −7.1357 −3.79481
16 6W63 [A] Leu 167 NA −5.21798
17 6W63 [A] Met 49 −4.62123 −14.7328
18 6W63 [A] Met 165 −20.9047 −23.4037
19 6W63 [A] Phe 140 −5.14266 −0.782012
20 6W63 [A] Pro 52 NA −0.357936
21 6W63 [A] Pro 168 NA −2.51004
22 6W63 [A] Ser 144 −6.14224 −1.10625
23 6W63 [A] Thr 25 −0.777035 −0.430475
24 6W63 [A] Thr 26 −1.97101 NA
25 6W63 [A] Thr 190 −0.547215 −6.94543
26 6W63 [A] Tyr 54 −1.20212 −0.778733
27 6W63 [A] Val 186 −0.313283 −0.87103