Pentapeptide 1 CFM Rank 10 CFMs Rank 1 CFM score 10 CFMs AV score 10 CFMs SD% score
QHWWW 47 1 -13.4 -9.4 13.9
YWWHF 29 2 -15.1 -7.8 15.5
YHWWW 45 3 -13.7 -7.8 16.9
YWWHY 4 4 -20.7 -7.5 14.4
YWWYY 31 5 -14.7 -7.2 13.0
YWWYH 49 6 -13.3 -7.1 17.1
YWWDW 20 7 -16.5 -6.3 12.8
YRWWW 30 8 -14.8 -6.1 15.3
YWIWW 387 9 -2.7 -5.9 17.4
YWWDF 53 10 -13.0 -5.8 13.0
YWYDW 24 11 -15.8 -4.9 13.2
QWWYF 43 12 -14.0 -4.8 11.0
YHWHW 50 13 -13.3 -4.6 11.2
YWYHY 13 14 -17.9 -4.3 15.7
QWWYY 35 15 -14.6 -4.3 12.0
QHWDY 746 16 9.9 -4.0 17.4
QWWHW 40 17 -14.3 -4.0 11.1
EWWWF 52 18 -13.2 -3.9 17.1
QWWYW 25 19 -15.7 -3.6 12.6
QRWYY 23 20 -16.1 -3.5 15.3
ERWWH 2 21 -21.6 -3.5 16.2
QWSWY 11 22 -18.2 -3.4 14.5
YWIHF 758 23 13.7 -3.4 14.5
EHIWW 33 24 -14.7 -3.3 13.8
ERWYY 5 25 -19.5 -3.3 14.6
Table 2: The 25 pentapeptides with the lower conformers average score selected to generate the 3000 hexapeptides library. The pentapeptides score and rank position in the first 768 library run using one conformer was also reported. AV=average; SD%=relative standard deviation.