Table 4. Energy decomposition terms.
| Protein | Energy term | 0-2 ns kJ/mol | 28-30 ns kJ/mol | ΔE kJ/mol |
|---|---|---|---|---|
| p53_human | Coulomb | -8162 (144) | -8353 (163) | -191 |
| LJ-SR | -4837 (69) | -4939 (65) | -102 | |
| LJ-LR | -223 (2) | -227 (2) | -4 | |
| LJ-14 | -163 (40) | -190 (40) | -27 | |
| p63_human | Coulomb | -8420 (229) | -8636 (140) | -216 |
| LJ-SR | -4909 (68) | -5031 (65) | -122 | |
| LJ-LR | -229 (2) | -236 (2) | -7 | |
| LJ-14 | -182 (41) | -209 (39) | -27 | |
| p73_human | Coulomb | -8264 (166) | -8341 (133) | -77 |
| LJ-SR | -4766 (68) | -4754 (67) | 12 | |
| LJ-LR | -220 (2) | -222 (2) | -2 | |
| LJ-14 | -160 (40) | -203 (38) | -43 | |
| p53_mouse | Coulomb | -7807 (184) | -8257 (141) | -450 |
| LJ-SR | -4651 (67) | -4754 (66) | -103 | |
| LJ-LR | -213 (2) | -217 (2) | -4 | |
| LJ-14 | -151 (38) | -204 (37) | -53 | |
| p53_chicken | Coulomb | -8022 (182) | -8308 (134) | -286 |
| LJ-SR | -4750 (63) | -4779 (65) | -29 | |
| LJ-LR | -218 (2) | -216 (2) | 2 | |
| LJ-14 | -164 (39) | -204 (39) | -40 | |
| p53_fly | Coulomb | -8114 (157) | -8642 (146) | -528 |
| LJ-SR | -4909 (73) | -5099 (67) | -190 | |
| LJ-LR | -227 (2) | -239 (2) | -12 | |
| LJ-14 | -229 (40) | -261 (39) | -32 | |
| p53_worm | Coulomb | -9359 (171) | -9476 (168) | -117 |
| LJ-SR | -5374 (72) | -5305 (70) | 69 | |
| LJ-LR | -245 (2) | -249 (2) | -4 | |
| LJ-14 | -196 (39) | -275 (39) | -79 |