Table 1. Proteins used for the analysis of molecular surfaces.

Dataset No. RMSD(residues)	No.	Protein name	PDB code	Atoms	Residues	Chains
1	1	α lactalbumin	1A4V	1092	123	1
2	2	porcine β-lactoglobulin	1EXS	1248	160	1
	3	bovine β-lactoglobulin	1BEB	2473	324	2
3, Subset 3.1 RMSD(129) = 0.6481	4	hen egg-white lysozyme	1LYZ	1001	129	1
	5	turkey egg-white lysozyme	135L	994	129	1
	6	hen egg-white lysozyme	2LYM	1001	129	1
	7	triciclic lysozyme	2LZT	1001	129	1
3, Subset 3.2 RMSD(164) = 0.24	8	mutant of phage T4 lysozyme	1L35	1305	164	1
	9	T4 lysozyme	1LYD	1309	164	1
4 RMSD(124) = 0.1655	10	ribonuclease-A	8RAT	951	124	1
	11	ribonuclease-A	1RBX	956	124	1
	12	bovine ribonuclease-A	3RN3	957	124	1
	13	ribonuclease-A	1AFU	1894	248	2
5, Subset 5.1 RMSD(287)  = 0.8877	14	human oxyhemoglobin	1HHO	2192	287	2
	15	human carbonmonoxy hemoglobin	2HCO	2192	287	2
	16	horse deoxyhemoglobin	2DHB	2201	287	2
5, Subset 5.2 RMSD(574)  = 1.501	17	human hemoglobin A	1BUW	4342	574	4
	18	human hemoglobin (W37A)	1Y4F	4368	574	4
	19	hemoglobin mutant (W37A)	1A01	4368	574	4
	20	human hemoglobin (W37E)	1Y4P	4376	574	4
	21	hemoglobin mutant (W37Y)	1A00	4382	574	4
	22	human hemoglobin (W37Y)	1Y46	4382	574	4
	23	human deoxyhemoglobin	2HHB	4384	574	4
	24	human hemoglobin (W37G)	1Y4G	4366	574	4
	25	hemoglobin mutant (V1M)	1A0U	4386	574	4
	26	hemoglobin mutant (V1M)	1A0Z	4386	574	4
	27	recombinant hemoglobin	1C7D	4396	576	3
6 RMSD(585) = 2.3740	28	human serum albumin complexed with octadecanoic acid	1E7I	4496	585	1
	29	recombinant human serum albumin	1UOR	4617	585	1
	30	human serum albumin	1E78	4302	585	1
	31	human serum albumin	1AO6	4600	585	1
	32	human serum albumin	1BM0	4600	585	1
7	33	immunoglobulin	1IGY	10002	1294	4
	34	immunoglobulin	1IGT	10196	1316	4
	35	intact human IgG B12	1HZH	10355	1344	4