Table 5.

Overview of the prediction accuracy of the Small Dataset (242 Residues) II. Three tables show the accuracy of the predictions to the measured pK_exp. This is taken as the number of residues predicted within each range. Figures marked in bold indicate significant results (P = 0.05).

TOTAL (242)
	AMBER		PARSE		MCCE		UHBD		PROPKA
		%		%		%		%		%
<2	195	81	191	79	216	89	225	93	230	95
<1.5	174	72	171	71	201	83	209	86	220	91
<1	131	54	135	56	172	71	161	67	195	81
<0.5	63	26	87	36	110	45	97	40	125	52
SURFACE (209)
	AMBER		PARSE		MCCE		UHBD		PROPKA
		%		%		%		%		%
<2	179	86	176	84	193	92	199	95	205	98
<1.5	163	78	159	76	181	87	186	89	199	95
<1	126	60	125	60	156	75	152	73	181	87
<0.5	60	29	83	40	100	48	94	45	122	58
BURIED (33)
	AMBER		PARSE		MCCE		UHBD		PROPKA
		%		%		%		%		%
<2	16	48	15	45	23	70	26	79	25	76
<1.5	11	33	12	36	20	61	23	70	21	64
<1	5	15	10	30	16	48	9	27	14	42
<0.5	3	9	4	12	16	30	3	9	3	9