Molecular docking of peptides (belonging to α₁ chain) profile of the fraction from yak bone collagen peptides (YBCP) identified by HPLC-MS/MS^a.

Rank	Amino acid sequence	Mr Calc.	Site range	Length	Score	-CE (kcal mol−1)
1	GKSGDRGETGPAGPAGPIGPVGAR	2160.1036	1060–1083	24	75.43	158.080
2	GKSGDRGETGPAGPAGPIGPVGA	2004.0025	1060–1082	23	63.23	132.928
3	SGDRGETGPAGPAGPIGPVGA	1818.8861	1062–1082	21	75.10	131.953
4	GKSGDRGETGPAGPAGPIGP	1776.8755	1060–1079	20	42.04	119.609
5	GKSGDRGETGPAGPAGPIGPV	1875.9439	1060–1080	21	69.04	117.383
6	GADGAPGKDGVRGL	1268.6473	751–764	14	42.97	117.184
7	GDRGETGPAGPAGPIGPVGA	1731.8540	1063–1082	20	69.81	108.143
8	SGDRGETGPAGPAGPIGPV	1690.8275	1062–1080	19	91.32	107.348
9	KSGDRGETGPAGPAGPIGPV	1818.9224	1061–1080	20	77.53	105.362
10	GDRGETGPAGPAGPIGPV	1603.7955	1063–1080	18	99.84	98.992
11	GPPGPAGPAGERGEQGPA	1600.7594	619–636	18	56.78	98.003
12	GAPGADGPAGAPGTPGPQG	1530.7063	934–952	19	62.80	89.869
13	DRGETGPAGPAGPIGPV	1546.7740	1064–1080	17	76.90	86.238
14	STGISVPGPMGPSGPR	1511.7403	171–186	16	58.51	85.072
15	RGETGPAGPAGPIGPVGA	1559.8056	1065–1082	18	45.22	83.832
16	TGPAGPAGPIGPVGA	1217.6405	1068–1082	15	51.32	75.836
17	RGETGPAGPAGPIGPV	1431.7470	1065–1080	16	56.63	65.216
18	GERGFPGLPGPS	1169.5829	967–978	12	45.82	62.140
19	GISVPGPMGPSGPR	1307.6656	173–186	14	73.13	59.186
20	ISVPGPMGPSGPR	1266.6391	174–186	13	76.32	58.233
21	TGPAGPAGPIGPV	1089.5819	1068–1080	13	50.86	54.586
22	SVPGPMGPSGPR	1153.5550	175–186	12	60.96	48.188
23	GISVPGPMGPS	997.4903	173–183	11	41.83	46.853
24	GPAGPAGPIGPV	988.5342	1069–1080	12	63.19	45.080
25	GPAGPPGPIGNV	1031.5400	844–855	12	93.84	42.997
26	GPAGPIGPV	763.4229	1072–1080	9	42.18	34.299
27	ISVPGPM	715.3575	174–180	7	51.80	29.412
28	GLPGPPGAPGPQ	1043.5400	187–198	12	47.00	29.395

^aMr Calc., molecular calculation; CE, CDOCKER_energy.