ROTAMER LIBRARY BASED ON JANIN, WODAK, LEVITT AND MAIGRET RESIDUE CHI1 CHI2 CHI3 CHI4 SIG1 SIG2 SIG3 SIG4 1 GLY 2 ALA 3 VAL 70.0 24.0 4 VAL 171.0 21.0 5 VAL -59.0 25.0 6 LEU -170.0 65.0 24.0 20.0 7 LEU -170.0 180.0 24.0 20.0 8 LEU -70.0 180.0 21.0 20.0 9 ILE 61.0 180.0 25.0 20.0 10 ILE -170.0 180.0 24.0 20.0 11 ILE -69.0 180.0 21.0 20.0 12 ILE -69.0 -65.0 21.0 20.0 13 SER 61.0 20.0 14 SER -170.0 20.0 15 SER -70.0 20.0 16 THR 61.0 20.0 17 THR -170.0 20.0 18 THR -70.0 20.0 19 CYS 61.0 20.0 20 CYS -170.0 20.0 21 CYS -70.0 20.0 22 PRO 25.0 -34.0 0.0 0.0 23 PRO 0.0 0.0 0.0 0.0 24 PRO -25.0 34.0 0.0 0.0 25 PHE 68.0 91.0 18.0 16.0 26 PHE -176.0 76.0 16.0 21.0 27 PHE -69.0 96.0 16.0 16.0 28 TYR 68.0 91.0 18.0 16.0 29 TYR -176.0 76.0 16.0 21.0 30 TYR -69.0 96.0 16.0 16.0 31 TRP 68.0 91.0 18.0 16.0 32 TRP 68.0 -89.0 18.0 16.0 33 TRP -176.0 76.0 16.0 21.0 34 TRP -176.0 -104.0 16.0 21.0 35 TRP -69.0 96.0 16.0 16.0 36 TRP -69.0 -84.0 16.0 16.0 37 HIS 68.0 91.0 18.0 16.0 38 HIS 68.0 -89.0 18.0 16.0 39 HIS -176.0 76.0 16.0 21.0 40 HIS -176.0 -104.0 16.0 21.0 41 HIS -69.0 96.0 16.0 16.0 42 HIS -69.0 -84.0 16.0 16.0 43 ASP 61.0 -24.0 25.0 38.0 44 ASP -170.0 -24.0 24.0 38.0 45 ASP -70.0 -24.0 21.0 38.0 46 ASN 61.0 -24.0 25.0 38.0 47 ASN 61.0 156.0 25.0 38.0 48 ASN -170.0 -24.0 24.0 38.0 49 ASN -170.0 156.0 24.0 38.0 50 ASN -70.0 -24.0 21.0 38.0 51 ASN -70.0 156.0 21.0 38.0 52 GLU 61.0 180.0 -24.0 25.0 20.0 38.0 53 GLU -170.0 180.0 -24.0 24.0 20.0 38.0 54 GLU -170.0 -65.0 -24.0 24.0 20.0 38.0 55 GLU -70.0 180.0 -24.0 21.0 20.0 38.0 56 GLU -70.0 -65.0 -24.0 21.0 20.0 38.0 57 GLN 61.0 180.0 -24.0 25.0 20.0 38.0 58 GLN 61.0 180.0 156.0 25.0 20.0 38.0 59 GLN -170.0 180.0 -24.0 24.0 20.0 38.0 60 GLN -170.0 180.0 156.0 24.0 20.0 38.0 61 GLN -170.0 -65.0 -24.0 24.0 20.0 38.0 62 GLN -170.0 -65.0 156.0 24.0 20.0 38.0 63 GLN -70.0 180.0 -24.0 21.0 20.0 38.0 64 GLN -70.0 180.0 156.0 21.0 20.0 38.0 65 GLN -70.0 -65.0 -24.0 21.0 20.0 38.0 66 GLN -70.0 -65.0 156.0 21.0 20.0 38.0 67 MET 61.0 180.0 180.0 25.0 20.0 20.0 68 MET -170.0 65.0 180.0 24.0 20.0 20.0 69 MET -170.0 180.0 65.0 24.0 20.0 20.0 70 MET -170.0 180.0 180.0 24.0 20.0 20.0 71 MET -170.0 180.0 -65.0 24.0 20.0 20.0 72 MET -170.0 -65.0 180.0 24.0 20.0 20.0 73 MET -70.0 65.0 180.0 21.0 20.0 20.0 74 MET -70.0 180.0 65.0 21.0 20.0 20.0 75 MET -70.0 180.0 180.0 21.0 20.0 20.0 76 MET -70.0 180.0 -65.0 21.0 20.0 20.0 77 MET -70.0 -65.0 65.0 21.0 20.0 20.0 78 MET -70.0 -65.0 180.0 21.0 20.0 20.0 79 MET -70.0 -65.0 -65.0 21.0 20.0 20.0 80 LYS 61.0 180.0 180.0 180.0 25.0 20.0 20.0 20.0 81 LYS -170.0 65.0 180.0 180.0 24.0 20.0 20.0 20.0 82 LYS -170.0 180.0 65.0 180.0 24.0 20.0 20.0 20.0 83 LYS -170.0 180.0 180.0 65.0 24.0 20.0 20.0 20.0 84 LYS -170.0 180.0 180.0 180.0 24.0 20.0 20.0 20.0 85 LYS -170.0 180.0 -65.0 180.0 24.0 20.0 20.0 20.0 86 LYS -170.0 -65.0 180.0 180.0 24.0 20.0 20.0 20.0 87 LYS -70.0 65.0 180.0 180.0 21.0 20.0 20.0 20.0 88 LYS -70.0 180.0 65.0 180.0 21.0 20.0 20.0 20.0 89 LYS -70.0 180.0 180.0 180.0 21.0 20.0 20.0 20.0 80 LYS -70.0 180.0 180.0 -65.0 21.0 20.0 20.0 20.0 91 LYS -70.0 180.0 -65.0 180.0 21.0 20.0 20.0 20.0 92 LYS -70.0 -65.0 180.0 180.0 21.0 20.0 20.0 20.0 93 LYS -70.0 -65.0 180.0 -65.0 21.0 20.0 20.0 20.0 94 ARG 61.0 180.0 65.0 90.0 25.0 20.0 20.0 20.0 95 ARG 61.0 180.0 180.0 180.0 25.0 20.0 20.0 20.0 96 ARG -170.0 180.0 65.0 90.0 24.0 20.0 20.0 20.0 97 ARG -170.0 180.0 180.0 90.0 24.0 20.0 20.0 20.0 98 ARG -170.0 180.0 180.0 180.0 24.0 20.0 20.0 20.0 99 ARG -170.0 180.0 180.0 -90.0 24.0 20.0 20.0 20.0 100 ARG -170.0 180.0 -65.0 180.0 24.0 20.0 20.0 20.0 101 ARG -70.0 180.0 65.0 90.0 21.0 20.0 20.0 20.0 102 ARG -70.0 180.0 65.0 180.0 21.0 20.0 20.0 20.0 103 ARG -70.0 180.0 180.0 180.0 21.0 20.0 20.0 20.0 104 ARG -70.0 180.0 180.0 -90.0 21.0 20.0 20.0 20.0 105 ARG -70.0 180.0 -65.0 180.0 21.0 20.0 20.0 20.0