# -------------- SUMMARY OF RESTRAINTS --------------- # TOTAL NUMBER OF NOE RESTRAINTS : 1844 # INTRA-RESIDUE RESTRAINTS (I=J) : 468 # SEQUENTIAL RESTRAINTS (I-J)=1 : 556 # BACKBONE-BACKBONE : 242 # BACKBONE-SIDE CHAIN : 10 # SIDE CHAIN-SIDE CHAIN : 304 # MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 140 # BACKBONE-BACKBONE : 38 # BACKBONE-SIDE CHAIN : 33 # SIDE CHAIN-SIDE CHAIN : 69 # LONG RANGE RESTRAINTS (I-J)>=5 : 680 # TOTAL HYDROGEN BOND RESTRAINTS : 0 # LONG RANGE H-BOND RESTR. (I-J)>=5 : 0 # DISULFIDE RESTRAINTS : 0 # INTRA-CHAIN RESTRAINTS : 1596 # INTER-CHAIN RESTRAINTS : 248 # AMBIGUOUS RESTRAINTS : 0 # ----------------------------------------------------- # ----------------------------------------------------- # ----------------------------------------------------- # RES # INTRA INTER seq med lng InterChain MET 1 0 1.5 1.5 0.0 0.0 0.0 LYS 2 5 3.0 3.0 0.0 0.0 0.0 LYS 3 3 3.0 3.0 0.0 0.0 0.0 MET 4 2 3.0 3.0 0.0 0.0 0.0 ALA 5 1 2.5 2.5 0.0 0.0 0.0 GLU 6 2 3.0 3.0 0.0 0.0 0.0 PHE 7 5 5.0 3.5 0.0 1.5 0.0 THR 8 3 5.5 3.0 0.0 2.5 0.0 PHE 9 2 8.5 4.0 0.0 4.5 0.0 GLU 10 2 8.0 5.0 0.0 3.0 0.0 ILE 11 11 13.5 4.5 1.0 8.0 0.0 GLU 12 4 9.5 4.5 0.0 5.0 0.0 GLU 13 4 11.5 5.0 1.5 5.0 0.0 HIS 14 2 4.5 3.5 0.0 1.0 0.0 LEU 15 7 18.5 3.0 0.5 15.0 2.5 LEU 16 0 19.5 4.0 0.0 15.5 9.5 THR 17 3 6.0 3.5 0.0 2.5 0.0 LEU 18 10 21.0 3.0 0.0 18.0 11.5 SER 19 0 4.0 3.0 0.0 1.0 0.0 GLU 20 3 8.0 4.0 0.5 3.5 0.0 ASN 21 0 6.0 4.5 0.5 1.0 0.0 GLU 22 3 3.5 3.5 0.0 0.0 0.0 LYS 23 2 2.5 2.5 0.0 0.0 0.0 GLY 24 0 3.0 1.5 0.5 1.0 0.0 TRP 25 1 12.0 2.5 0.5 9.0 0.0 THR 26 2 9.0 3.5 0.0 5.5 0.0 LYS 27 7 17.0 3.0 0.0 14.0 5.0 GLU 28 0 6.5 2.5 0.0 4.0 0.0 ILE 29 5 26.5 2.5 0.0 24.0 4.5 ASN 30 1 12.0 3.0 0.5 8.5 0.0 ARG 31 7 16.0 3.5 0.0 12.5 0.0 VAL 32 5 20.0 4.5 2.5 13.0 0.0 SER 33 0 9.5 3.5 0.0 6.0 0.0 PHE 34 2 7.5 2.5 2.0 3.0 0.0 ASN 35 1 7.5 3.0 0.0 4.5 0.0 GLY 36 0 2.5 2.5 0.0 0.0 0.0 ALA 37 1 2.5 2.5 0.0 0.0 0.0 PRO 38 0 3.5 3.5 0.0 0.0 0.0 ALA 39 1 12.5 4.0 0.0 8.5 0.0 LYS 40 5 8.0 4.5 0.0 3.5 0.0 PHE 41 4 14.5 5.0 0.0 9.5 0.5 ASP 42 0 10.0 3.0 0.0 7.0 0.0 ILE 43 8 16.5 1.5 0.0 15.0 0.5 ARG 44 0 5.0 2.5 0.0 2.5 0.5 ALA 45 1 10.0 2.5 0.0 7.5 1.0 TRP 46 1 5.0 2.5 0.0 2.5 0.0 SER 47 0 2.0 1.5 0.0 0.5 0.0 PRO 48 0 3.5 0.0 0.0 3.5 0.0 ASP 49 0 1.5 1.5 0.0 0.0 0.0 HIS 50 1 2.5 2.5 0.0 0.0 0.0 THR 51 2 3.0 3.0 0.0 0.0 0.0 LYS 52 12 8.5 4.5 0.0 4.0 0.0 MET 53 3 5.5 5.0 0.0 0.5 0.0 GLY 54 0 4.5 4.0 0.0 0.5 0.0 LYS 55 9 4.5 3.5 0.5 0.5 0.5 GLY 56 0 7.5 7.5 0.0 0.0 4.5 ILE 57 9 19.0 8.5 0.5 10.0 11.0 THR 58 3 8.5 5.0 0.0 3.5 0.0 LEU 59 7 11.5 3.5 0.0 8.0 2.0 SER 60 0 4.0 2.5 0.0 1.5 0.0 ASN 61 2 6.0 3.0 1.0 2.0 0.5 GLU 62 5 6.0 4.5 1.5 0.0 0.0 GLU 63 1 9.0 5.0 2.0 2.0 2.0 PHE 64 5 19.0 4.5 4.0 10.5 3.0 GLN 65 10 12.5 4.5 6.0 2.0 2.0 THR 66 3 12.5 4.5 3.5 4.5 4.5 MET 67 3 22.5 5.5 6.5 10.5 11.5 VAL 68 5 25.0 6.0 14.0 5.0 12.5 ASP 69 1 7.5 4.5 2.5 0.5 0.5 ALA 70 1 9.5 3.5 2.5 3.5 3.5 PHE 71 2 23.0 4.0 10.0 9.0 16.5 LYS 72 12 9.0 5.5 3.5 0.0 4.0 GLY 73 0 5.5 4.0 1.0 0.5 0.5 ASN 74 0 3.0 2.5 0.0 0.5 0.5 LEU 75 6 10.0 2.0 1.0 7.0 7.0 GLU 76 2 3.5 2.0 0.0 1.5 1.5 HIS 77 2 3.0 2.5 0.0 0.5 0.5 HIS 78 1 2.0 2.0 0.0 0.0 0.0 HIS 79 1 2.0 2.0 0.0 0.0 0.0 HIS 80 1 1.5 1.5 0.0 0.0 0.0 HIS 81 1 1.5 1.5 0.0 0.0 0.0 HIS 82 1 1.0 1.0 0.0 0.0 0.0 MET 1 0 1.5 1.5 0.0 0.0 0.0 LYS 2 5 3.0 3.0 0.0 0.0 0.0 LYS 3 3 3.0 3.0 0.0 0.0 0.0 MET 4 2 3.0 3.0 0.0 0.0 0.0 ALA 5 1 2.5 2.5 0.0 0.0 0.0 GLU 6 2 3.0 3.0 0.0 0.0 0.0 PHE 7 5 5.0 3.5 0.0 1.5 0.0 THR 8 3 5.5 3.0 0.0 2.5 0.0 PHE 9 2 8.5 4.0 0.0 4.5 0.0 GLU 10 2 8.0 5.0 0.0 3.0 0.0 ILE 11 11 13.5 4.5 1.0 8.0 0.0 GLU 12 4 9.5 4.5 0.0 5.0 0.0 GLU 13 4 11.5 5.0 1.5 5.0 0.0 HIS 14 2 4.5 3.5 0.0 1.0 0.0 LEU 15 7 18.5 3.0 0.5 15.0 2.5 LEU 16 0 19.5 4.0 0.0 15.5 9.5 THR 17 3 6.0 3.5 0.0 2.5 0.0 LEU 18 10 21.0 3.0 0.0 18.0 11.5 SER 19 0 4.0 3.0 0.0 1.0 0.0 GLU 20 3 8.0 4.0 0.5 3.5 0.0 ASN 21 0 6.0 4.5 0.5 1.0 0.0 GLU 22 3 3.5 3.5 0.0 0.0 0.0 LYS 23 2 2.5 2.5 0.0 0.0 0.0 GLY 24 0 3.0 1.5 0.5 1.0 0.0 TRP 25 1 12.0 2.5 0.5 9.0 0.0 THR 26 2 9.0 3.5 0.0 5.5 0.0 LYS 27 7 17.0 3.0 0.0 14.0 5.0 GLU 28 0 6.5 2.5 0.0 4.0 0.0 ILE 29 5 26.5 2.5 0.0 24.0 4.5 ASN 30 1 12.0 3.0 0.5 8.5 0.0 ARG 31 7 16.0 3.5 0.0 12.5 0.0 VAL 32 5 20.0 4.5 2.5 13.0 0.0 SER 33 0 9.5 3.5 0.0 6.0 0.0 PHE 34 2 7.5 2.5 2.0 3.0 0.0 ASN 35 1 7.5 3.0 0.0 4.5 0.0 GLY 36 0 2.5 2.5 0.0 0.0 0.0 ALA 37 1 2.5 2.5 0.0 0.0 0.0 PRO 38 0 3.5 3.5 0.0 0.0 0.0 ALA 39 1 12.5 4.0 0.0 8.5 0.0 LYS 40 5 8.0 4.5 0.0 3.5 0.0 PHE 41 4 14.5 5.0 0.0 9.5 0.5 ASP 42 0 10.0 3.0 0.0 7.0 0.0 ILE 43 8 16.5 1.5 0.0 15.0 0.5 ARG 44 0 5.0 2.5 0.0 2.5 0.5 ALA 45 1 10.0 2.5 0.0 7.5 1.0 TRP 46 1 5.0 2.5 0.0 2.5 0.0 SER 47 0 2.0 1.5 0.0 0.5 0.0 PRO 48 0 3.5 0.0 0.0 3.5 0.0 ASP 49 0 1.5 1.5 0.0 0.0 0.0 HIS 50 1 2.5 2.5 0.0 0.0 0.0 THR 51 2 3.0 3.0 0.0 0.0 0.0 LYS 52 12 8.5 4.5 0.0 4.0 0.0 MET 53 3 5.5 5.0 0.0 0.5 0.0 GLY 54 0 4.5 4.0 0.0 0.5 0.0 LYS 55 9 4.5 3.5 0.5 0.5 0.5 GLY 56 0 7.5 7.5 0.0 0.0 4.5 ILE 57 7 19.0 8.5 0.5 10.0 11.0 THR 58 3 8.5 5.0 0.0 3.5 0.0 LEU 59 7 11.5 3.5 0.0 8.0 2.0 SER 60 0 4.0 2.5 0.0 1.5 0.0 ASN 61 2 6.0 3.0 1.0 2.0 0.5 GLU 62 5 6.0 4.5 1.5 0.0 0.0 GLU 63 1 9.0 5.0 2.0 2.0 2.0 PHE 64 5 19.0 4.5 4.0 10.5 3.0 GLN 65 10 12.5 4.5 6.0 2.0 2.0 THR 66 3 12.5 4.5 3.5 4.5 4.5 MET 67 3 22.5 5.5 6.5 10.5 11.5 VAL 68 5 25.0 6.0 14.0 5.0 12.5 ASP 69 1 7.5 4.5 2.5 0.5 0.5 ALA 70 1 9.5 3.5 2.5 3.5 3.5 PHE 71 2 23.0 4.0 10.0 9.0 16.5 LYS 72 8 9.0 5.5 3.5 0.0 4.0 GLY 73 0 5.5 4.0 1.0 0.5 0.5 ASN 74 0 3.0 2.5 0.0 0.5 0.5 LEU 75 6 10.0 2.0 1.0 7.0 7.0 GLU 76 2 3.5 2.0 0.0 1.5 1.5 HIS 77 2 3.0 2.5 0.0 0.5 0.5 HIS 78 1 2.0 2.0 0.0 0.0 0.0 HIS 79 1 2.0 2.0 0.0 0.0 0.0 HIS 80 1 1.5 1.5 0.0 0.0 0.0 HIS 81 1 1.5 1.5 0.0 0.0 0.0 HIS 82 1 1.0 1.0 0.0 0.0 0.0 # TOTAL 468 1376.0 556.0 140.0 680.0 248.0 # TOTAL NUMBER OF RESTRAINTS (CHECKING): 1844.0