Table 3. Candidates for structures of the four domains of Nav1.5.
| Structure | Energy | CA_str | CA_DCA | N_Coin | N/DCA (%) | N_T10 |
| DI structure | ||||||
| domain1_5x0mS_0177 | −259.869 | 1405 | 63 | 44 | 69.841 | 4 |
| domain1_5x0mS_0467 | −257.737 | 1450 | 63 | 43 | 68.253 | 3 |
| domain1_5x0mS_0792 | −257.319 | 1431 | 63 | 43 | 68.253 | 4 |
| domain1_5x0mS_0264 | −257.180 | 1486 | 63 | 40 | 63.492 | 3 |
| domain1_5x0mS_0772 | −254.850 | 1439 | 63 | 42 | 66.666 | 4 |
| domain1_5x0mS_0062 | −251.525 | 1326 | 63 | 41 | 65.079 | 3 |
| domain1_5x0mS_0972 | −250.669 | 1450 | 63 | 42 | 66.666 | 3 |
| domain1_5x0mS_0982 | −250.593 | 1417 | 63 | 44 | 69.841 | 4 |
| domain1_5x0mS_0784 | −249.046 | 1365 | 63 | 41 | 65.079 | 2 |
| domain1_5x0mS_0490 | −248.589 | 1372 | 63 | 39 | 61.904 | 3 |
| DII structure | ||||||
| domain2_5x0mS_0322 | −201.976 | 917 | 48 | 33 | 68.750 | 8 |
| domain2_5x0mS_0980 | −195.486 | 917 | 48 | 34 | 70.833 | 8 |
| domain2_5x0mS_0393 | −194.378 | 910 | 48 | 33 | 68.750 | 8 |
| domain2_5x0mS_0886 | −191.752 | 898 | 48 | 33 | 68.750 | 9 |
| domain2_5x0mS_0345 | −191.497 | 874 | 48 | 31 | 64.583 | 8 |
| domain2_5x0mS_0279 | −191.085 | 876 | 48 | 31 | 64.583 | 8 |
| domain2_5x0mS_0715 | −190.996 | 903 | 48 | 32 | 66.666 | 9 |
| domain2_5x0mS_0442 | −190.847 | 903 | 48 | 32 | 66.666 | 8 |
| domain2_5x0mS_0285 | −190.438 | 903 | 48 | 33 | 68.750 | 8 |
| domain2_5x0mS_0561 | −190.080 | 879 | 48 | 31 | 64.583 | 8 |
| DIII structure | ||||||
| domain3_5x0mS_0433 | −233.286 | 1289 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0501 | −235.480 | 1277 | 69 | 47 | 68.115 | 6 |
| domain3_5x0mS_0084 | −232.065 | 1287 | 69 | 48 | 69.565 | 6 |
| domain3_5x0mS_0453 | −230.977 | 1216 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0270 | −228.602 | 1253 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0259 | −228.583 | 1231 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0034 | −227.736 | 1270 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0716 | −223.270 | 1253 | 69 | 48 | 69.565 | 6 |
| domain3_5x0mS_0250 | −220.025 | 1277 | 69 | 50 | 72.463 | 6 |
| domain3_5x0mS_0688 | −219.165 | 1243 | 69 | 50 | 72.463 | 6 |
| DIV structure | ||||||
| domain4_5x0mS_0219 | −193.494 | 968 | 51 | 39 | 76.470 | 9 |
| domain4_5x0mS_0838 | −188.711 | 942 | 51 | 38 | 74.509 | 9 |
| domain4_5x0mS_0226 | −186.353 | 930 | 51 | 38 | 74.509 | 9 |
| domain4_5x0mS_0120 | −185.934 | 936 | 51 | 40 | 78.431 | 9 |
| domain4_5x0mS_0531 | −185.682 | 904 | 51 | 39 | 76.470 | 9 |
| domain4_5x0mS_0878 | −185.430 | 943 | 51 | 39 | 76.470 | 9 |
| domain4_5x0mS_0087 | −184.725 | 937 | 51 | 40 | 78.431 | 9 |
| domain4_5x0mS_0430 | −184.024 | 916 | 51 | 38 | 74.509 | 9 |
| domain4_5x0mS_0011 | −183.128 | 892 | 51 | 36 | 70.588 | 9 |
| domain4_5x0mS_0318 | −182.277 | 925 | 51 | 38 | 74.509 | 9 |