# -------------- SUMMARY OF RESTRAINTS --------------- # TOTAL NUMBER OF NOE RESTRAINTS : 712 # INTRA-RESIDUE RESTRAINTS (I=J) : 80 # SEQUENTIAL RESTRAINTS (I-J)=1 : 245 # BACKBONE-BACKBONE : 62 # BACKBONE-SIDE CHAIN : 13 # SIDE CHAIN-SIDE CHAIN : 170 # MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 236 # BACKBONE-BACKBONE : 74 # BACKBONE-SIDE CHAIN : 73 # SIDE CHAIN-SIDE CHAIN : 89 # LONG RANGE RESTRAINTS (I-J)>=5 : 151 # TOTAL HYDROGEN BOND RESTRAINTS : 0 # LONG RANGE H-BOND RESTR. (I-J)>=5 : 0 # DISULFIDE RESTRAINTS : 0 # INTRA-CHAIN RESTRAINTS : 712 # INTER-CHAIN RESTRAINTS : 0 # AMBIGUOUS RESTRAINTS : 0 # ----------------------------------------------------- # ----------------------------------------------------- # ----------------------------------------------------- # RES # INTRA INTER seq med lng InterChain MET 1 0 0.0 0.0 0.0 0.0 0.0 GLY 2 0 0.0 0.0 0.0 0.0 0.0 HIS 3 0 0.0 0.0 0.0 0.0 0.0 HIS 4 0 0.0 0.0 0.0 0.0 0.0 HIS 5 0 0.0 0.0 0.0 0.0 0.0 HIS 6 0 0.0 0.0 0.0 0.0 0.0 HIS 7 0 0.0 0.0 0.0 0.0 0.0 HIS 8 0 0.0 0.0 0.0 0.0 0.0 SER 9 0 0.0 0.0 0.0 0.0 0.0 HIS 10 0 0.0 0.0 0.0 0.0 0.0 MET 11 0 0.0 0.0 0.0 0.0 0.0 LEU 12 1 3.0 1.0 0.0 2.0 0.0 PRO 13 0 2.0 2.0 0.0 0.0 0.0 PRO 14 0 3.5 2.0 1.5 0.0 0.0 GLU 15 0 1.5 1.5 0.0 0.0 0.0 GLN 16 0 3.0 2.5 0.5 0.0 0.0 TRP 17 3 13.0 3.0 3.5 6.5 0.0 SER 18 0 4.0 1.0 3.0 0.0 0.0 HIS 19 1 3.0 1.0 1.0 1.0 0.0 THR 20 0 7.0 3.0 4.0 0.0 0.0 THR 21 0 10.0 4.0 6.0 0.0 0.0 VAL 22 0 21.0 4.5 5.5 11.0 0.0 ARG 23 1 13.0 4.5 5.5 3.0 0.0 ASN 24 1 6.5 3.0 3.5 0.0 0.0 ALA 25 0 8.5 2.0 4.5 2.0 0.0 LEU 26 0 25.5 3.5 12.5 9.5 0.0 LYS 27 2 9.0 5.0 4.0 0.0 0.0 ASP 28 0 7.5 4.0 3.5 0.0 0.0 LEU 29 1 12.5 3.5 6.5 2.5 0.0 LEU 30 1 15.0 3.5 5.5 6.0 0.0 LYS 31 6 5.5 2.5 3.0 0.0 0.0 ASP 32 0 5.0 4.0 1.0 0.0 0.0 MET 33 5 13.5 6.5 3.0 4.0 0.0 ASN 34 0 7.5 5.0 2.5 0.0 0.0 GLN 35 1 13.0 2.5 2.5 8.0 0.0 SER 36 0 5.5 2.0 2.5 1.0 0.0 SER 37 1 6.0 2.0 4.0 0.0 0.0 LEU 38 1 21.0 4.5 3.0 13.5 0.0 ALA 39 0 12.5 4.5 4.5 3.5 0.0 LYS 40 3 3.5 1.5 2.0 0.0 0.0 GLU 41 0 5.5 2.5 1.0 2.0 0.0 CYS 42 0 8.0 3.5 2.5 2.0 0.0 PRO 43 0 10.5 5.5 0.0 5.0 0.0 LEU 44 0 22.0 6.0 3.5 12.5 0.0 SER 45 0 6.5 3.0 3.0 0.5 0.0 GLN 46 0 12.5 3.0 5.0 4.5 0.0 SER 47 0 4.0 2.5 1.5 0.0 0.0 MET 48 4 14.5 3.5 11.0 0.0 0.0 ILE 49 2 23.5 6.5 8.0 9.0 0.0 SER 50 0 11.0 4.5 5.5 1.0 0.0 SER 51 0 9.5 4.0 5.5 0.0 0.0 ILE 52 0 15.0 6.0 4.0 5.0 0.0 VAL 53 0 12.5 6.0 6.0 0.5 0.0 ASN 54 0 6.0 4.0 2.0 0.0 0.0 SER 55 0 4.5 2.0 2.5 0.0 0.0 THR 56 0 3.5 3.0 0.5 0.0 0.0 TYR 57 2 5.5 4.5 1.0 0.0 0.0 TYR 58 2 4.5 3.5 0.5 0.5 0.0 ALA 59 0 1.5 1.5 0.0 0.0 0.0 ASN 60 2 2.5 2.5 0.0 0.0 0.0 VAL 61 0 9.5 3.5 3.5 2.5 0.0 SER 62 0 5.5 2.5 3.0 0.0 0.0 ALA 63 0 2.5 1.5 1.0 0.0 0.0 ALA 64 0 5.5 1.0 4.5 0.0 0.0 LYS 65 7 12.0 3.5 6.5 2.0 0.0 CYS 66 0 8.0 4.5 2.0 1.5 0.0 GLN 67 4 7.0 4.0 3.0 0.0 0.0 GLU 68 0 9.5 3.5 4.5 1.5 0.0 PHE 69 1 25.0 4.0 5.5 15.5 0.0 GLY 70 0 7.0 3.5 3.0 0.5 0.0 ARG 71 6 5.0 2.0 3.0 0.0 0.0 TRP 72 2 18.0 4.0 6.5 7.5 0.0 TYR 73 1 15.5 4.5 9.0 2.0 0.0 LYS 74 4 7.5 4.5 3.0 0.0 0.0 HIS 75 0 7.5 4.0 3.5 0.0 0.0 PHE 76 1 9.5 4.5 4.5 0.5 0.0 LYS 77 4 11.0 5.0 4.5 1.5 0.0 LYS 78 4 5.0 3.0 2.0 0.0 0.0 THR 79 0 3.0 2.5 0.5 0.0 0.0 LYS 80 1 5.0 4.0 1.0 0.0 0.0 ASP 81 0 4.0 4.0 0.0 0.0 0.0 MET 82 2 3.5 3.0 0.5 0.0 0.0 MET 83 3 1.5 1.5 0.0 0.0 0.0 # TOTAL 80 632.0 245.0 236.0 151.0 0.0 # TOTAL NUMBER OF RESTRAINTS (CHECKING): 712.0