# -------------- SUMMARY OF RESTRAINTS --------------- # TOTAL NUMBER OF NOE RESTRAINTS : 2386 # INTRA-RESIDUE RESTRAINTS (I=J) : 572 # SEQUENTIAL RESTRAINTS (I-J)=1 : 588 # BACKBONE-BACKBONE : 150 # BACKBONE-SIDE CHAIN : 56 # SIDE CHAIN-SIDE CHAIN : 382 # MEDIUM RANGE RESTRAINTS 1<(I-J)<5 : 594 # BACKBONE-BACKBONE : 152 # BACKBONE-SIDE CHAIN : 194 # SIDE CHAIN-SIDE CHAIN : 248 # LONG RANGE RESTRAINTS (I-J)>=5 : 632 # TOTAL HYDROGEN BOND RESTRAINTS : 0 # LONG RANGE H-BOND RESTR. (I-J)>=5 : 0 # DISULFIDE RESTRAINTS : 0 # INTRA-CHAIN RESTRAINTS : 2260 # INTER-CHAIN RESTRAINTS : 126 # AMBIGUOUS RESTRAINTS : 0 # ----------------------------------------------------- # ----------------------------------------------------- # ----------------------------------------------------- # RES # INTRA INTER seq med lng InterChain MET 1 0 0.0 0.0 0.0 0.0 0.0 ALA 2 0 0.0 0.0 0.0 0.0 0.0 GLY 3 0 0.0 0.0 0.0 0.0 0.0 GLN 4 2 0.0 0.0 0.0 0.0 0.0 SER 5 0 1.0 1.0 0.0 0.0 0.0 ASP 6 1 3.5 2.5 1.0 0.0 0.0 ARG 7 5 3.5 2.5 1.0 0.0 0.0 LYS 8 7 2.5 1.5 1.0 0.0 0.0 ALA 9 1 3.0 0.5 2.5 0.0 0.0 ALA 10 1 5.5 2.0 3.5 0.0 0.0 LEU 11 3 8.0 4.0 2.0 2.0 2.0 LEU 12 8 16.5 4.0 3.5 9.0 9.0 ASP 13 1 7.0 3.5 3.5 0.0 0.0 GLN 14 3 10.5 2.5 3.0 5.0 5.0 VAL 15 4 8.5 3.0 1.5 4.0 4.0 ALA 16 1 7.5 3.5 2.0 2.0 2.0 ARG 17 3 8.0 2.0 4.5 1.5 0.5 VAL 18 5 6.5 3.5 2.5 0.5 0.0 GLY 19 0 9.0 3.0 6.0 0.0 2.0 LYS 20 10 9.5 3.0 6.5 0.0 3.0 ALA 21 1 9.5 4.0 4.0 1.5 0.5 LEU 22 8 12.0 3.5 4.0 4.5 1.5 ALA 23 1 10.5 3.5 7.0 0.0 4.0 ASN 24 1 2.0 1.0 1.0 0.0 0.0 GLY 25 0 3.0 0.0 2.5 0.5 0.5 ARG 26 1 1.5 0.0 1.5 0.0 0.0 ARG 27 2 4.5 0.5 1.5 2.5 0.0 LEU 28 4 17.0 1.0 7.5 8.5 5.0 GLN 29 4 11.0 2.0 2.5 6.5 3.5 ILE 30 5 20.0 4.0 5.5 10.5 0.0 LEU 31 7 25.0 5.0 5.5 14.5 0.0 ASP 32 1 10.0 4.0 2.5 3.5 2.5 LEU 33 8 14.0 3.0 7.0 4.0 0.0 LEU 34 7 8.5 1.5 3.5 3.5 0.0 ALA 35 1 7.5 2.0 3.0 2.5 0.0 GLN 36 3 6.0 3.0 3.0 0.0 0.0 GLY 37 0 5.5 3.0 2.5 0.0 0.0 GLU 38 2 6.0 3.5 0.0 2.5 0.0 ARG 39 2 8.0 3.5 1.0 3.5 0.0 ALA 40 1 13.5 5.0 4.0 4.5 0.0 VAL 41 5 19.5 5.0 5.0 9.5 0.0 GLU 42 3 14.0 4.5 4.0 5.5 0.0 ALA 43 1 10.5 4.5 5.5 0.5 0.0 ILE 44 5 19.5 5.0 7.5 7.0 0.0 ALA 45 1 12.0 4.5 4.5 3.0 0.0 THR 46 3 6.5 3.5 3.0 0.0 0.0 ALA 47 1 7.0 3.5 2.5 1.0 0.0 THR 48 2 11.5 2.5 6.0 3.0 0.0 GLY 49 0 2.0 1.0 1.0 0.0 0.0 MET 50 6 13.0 1.5 4.5 7.0 0.0 ASN 51 1 6.0 3.0 3.0 0.0 0.0 LEU 52 7 14.5 3.0 4.0 7.5 0.0 THR 53 2 4.5 3.0 1.5 0.0 0.0 THR 54 2 7.0 3.0 4.0 0.0 0.0 ALA 55 1 18.0 3.0 7.0 8.0 0.0 SER 56 1 10.0 3.5 4.5 2.0 0.0 ALA 57 1 6.0 3.0 3.0 0.0 0.0 ASN 58 1 8.5 2.0 4.0 2.5 0.0 LEU 59 6 23.0 3.5 5.0 14.5 0.0 GLN 60 4 9.0 6.0 3.0 0.0 0.0 ALA 61 1 6.5 4.5 1.5 0.5 0.0 LEU 62 7 12.5 2.5 2.0 8.0 0.0 LYS 63 4 14.0 3.0 2.0 9.0 0.0 SER 64 1 4.5 3.0 1.0 0.5 0.0 GLY 65 0 5.5 2.0 1.0 2.5 0.0 GLY 66 0 2.5 2.0 0.5 0.0 0.0 LEU 67 6 12.5 5.0 1.5 6.0 0.0 VAL 68 3 22.5 7.0 0.0 15.5 0.0 GLU 69 3 13.0 7.0 0.0 6.0 0.0 ALA 70 1 12.0 5.0 0.0 7.0 0.0 ARG 71 3 5.5 3.5 0.0 2.0 0.0 ARG 72 8 6.0 4.0 0.0 2.0 0.0 GLU 73 2 6.0 2.0 1.5 2.5 0.0 GLY 74 0 1.0 0.5 0.5 0.0 0.0 THR 75 2 2.0 2.0 0.0 0.0 0.0 ARG 76 8 8.5 4.5 3.5 0.5 0.0 GLN 77 6 10.5 4.5 1.5 4.5 0.0 TYR 78 1 12.0 2.0 2.0 8.0 0.0 TYR 79 2 16.0 1.0 1.0 14.0 0.0 ARG 80 3 7.5 1.5 0.0 6.0 0.0 ILE 81 7 18.5 3.5 1.0 14.0 0.0 ALA 82 0 12.0 3.5 1.5 7.0 0.0 GLY 83 0 4.5 1.5 3.0 0.0 0.0 GLU 84 2 5.5 1.0 4.5 0.0 0.0 ASP 85 0 4.5 2.0 2.5 0.0 0.0 VAL 86 3 16.0 3.5 6.0 6.5 0.0 ALA 87 1 11.5 4.0 3.5 4.0 0.0 ARG 88 7 9.0 2.0 6.5 0.5 1.0 LEU 89 4 9.5 1.5 7.5 0.5 2.5 PHE 90 2 19.5 5.0 4.0 10.5 1.5 ALA 91 1 8.5 4.0 4.5 0.0 0.0 LEU 92 0 11.0 2.5 8.5 0.0 3.5 VAL 93 5 9.0 4.0 4.0 1.0 0.0 GLN 94 3 8.5 3.0 4.5 1.0 1.0 VAL 95 5 10.5 3.5 7.0 0.0 0.0 VAL 96 4 7.0 4.5 2.5 0.0 0.0 ALA 97 1 11.0 3.5 3.0 4.5 4.5 ASP 98 2 7.5 2.5 3.0 2.0 2.0 GLU 99 3 5.5 3.0 2.5 0.0 0.0 HIS 100 1 3.5 2.0 1.5 0.0 0.0 LEU 101 6 4.5 1.5 1.0 2.0 2.0 GLU 102 1 1.5 1.5 0.0 0.0 0.0 HIS 103 0 0.0 0.0 0.0 0.0 0.0 HIS 104 0 0.0 0.0 0.0 0.0 0.0 HIS 105 0 0.0 0.0 0.0 0.0 0.0 HIS 106 0 0.0 0.0 0.0 0.0 0.0 HIS 107 0 0.5 0.5 0.0 0.0 0.0 HIS 108 0 0.5 0.5 0.0 0.0 0.0 MET 1 0 0.0 0.0 0.0 0.0 0.0 ALA 2 0 0.0 0.0 0.0 0.0 0.0 GLY 3 0 0.0 0.0 0.0 0.0 0.0 GLN 4 2 0.0 0.0 0.0 0.0 0.0 SER 5 0 1.0 1.0 0.0 0.0 0.0 ASP 6 1 3.5 2.5 1.0 0.0 0.0 ARG 7 5 3.5 2.5 1.0 0.0 0.0 LYS 8 7 2.5 1.5 1.0 0.0 0.0 ALA 9 1 3.0 0.5 2.5 0.0 0.0 ALA 10 1 5.5 2.0 3.5 0.0 0.0 LEU 11 3 8.0 4.0 2.0 2.0 2.0 LEU 12 8 16.5 4.0 3.5 9.0 9.0 ASP 13 1 7.0 3.5 3.5 0.0 0.0 GLN 14 3 10.5 2.5 3.0 5.0 5.0 VAL 15 4 8.5 3.0 1.5 4.0 4.0 ALA 16 1 7.5 3.5 2.0 2.0 2.0 ARG 17 3 8.0 2.0 4.5 1.5 0.5 VAL 18 5 6.5 3.5 2.5 0.5 0.0 GLY 19 0 9.0 3.0 6.0 0.0 2.0 LYS 20 10 9.5 3.0 6.5 0.0 3.0 ALA 21 1 9.5 4.0 4.0 1.5 0.5 LEU 22 8 12.0 3.5 4.0 4.5 1.5 ALA 23 1 10.5 3.5 7.0 0.0 4.0 ASN 24 1 2.0 1.0 1.0 0.0 0.0 GLY 25 0 3.0 0.0 2.5 0.5 0.5 ARG 26 1 1.5 0.0 1.5 0.0 0.0 ARG 27 2 4.5 0.5 1.5 2.5 0.0 LEU 28 4 17.0 1.0 7.5 8.5 5.0 GLN 29 4 11.0 2.0 2.5 6.5 3.5 ILE 30 5 20.0 4.0 5.5 10.5 0.0 LEU 31 7 25.0 5.0 5.5 14.5 0.0 ASP 32 1 10.0 4.0 2.5 3.5 2.5 LEU 33 8 14.0 3.0 7.0 4.0 0.0 LEU 34 7 8.5 1.5 3.5 3.5 0.0 ALA 35 1 7.5 2.0 3.0 2.5 0.0 GLN 36 3 6.0 3.0 3.0 0.0 0.0 GLY 37 0 5.5 3.0 2.5 0.0 0.0 GLU 38 2 6.0 3.5 0.0 2.5 0.0 ARG 39 2 8.0 3.5 1.0 3.5 0.0 ALA 40 1 13.5 5.0 4.0 4.5 0.0 VAL 41 5 19.5 5.0 5.0 9.5 0.0 GLU 42 3 14.0 4.5 4.0 5.5 0.0 ALA 43 1 10.5 4.5 5.5 0.5 0.0 ILE 44 5 19.5 5.0 7.5 7.0 0.0 ALA 45 1 12.0 4.5 4.5 3.0 0.0 THR 46 3 6.5 3.5 3.0 0.0 0.0 ALA 47 1 7.0 3.5 2.5 1.0 0.0 THR 48 2 11.5 2.5 6.0 3.0 0.0 GLY 49 0 2.0 1.0 1.0 0.0 0.0 MET 50 6 13.0 1.5 4.5 7.0 0.0 ASN 51 1 6.0 3.0 3.0 0.0 0.0 LEU 52 7 14.5 3.0 4.0 7.5 0.0 THR 53 2 4.5 3.0 1.5 0.0 0.0 THR 54 2 7.0 3.0 4.0 0.0 0.0 ALA 55 1 18.0 3.0 7.0 8.0 0.0 SER 56 1 10.0 3.5 4.5 2.0 0.0 ALA 57 1 6.0 3.0 3.0 0.0 0.0 ASN 58 1 8.5 2.0 4.0 2.5 0.0 LEU 59 6 23.0 3.5 5.0 14.5 0.0 GLN 60 4 9.0 6.0 3.0 0.0 0.0 ALA 61 1 6.5 4.5 1.5 0.5 0.0 LEU 62 7 12.5 2.5 2.0 8.0 0.0 LYS 63 4 14.0 3.0 2.0 9.0 0.0 SER 64 1 4.5 3.0 1.0 0.5 0.0 GLY 65 0 5.5 2.0 1.0 2.5 0.0 GLY 66 0 2.5 2.0 0.5 0.0 0.0 LEU 67 6 12.5 5.0 1.5 6.0 0.0 VAL 68 3 22.5 7.0 0.0 15.5 0.0 GLU 69 3 13.0 7.0 0.0 6.0 0.0 ALA 70 1 12.0 5.0 0.0 7.0 0.0 ARG 71 3 5.5 3.5 0.0 2.0 0.0 ARG 72 8 6.0 4.0 0.0 2.0 0.0 GLU 73 2 6.0 2.0 1.5 2.5 0.0 GLY 74 0 1.0 0.5 0.5 0.0 0.0 THR 75 2 2.0 2.0 0.0 0.0 0.0 ARG 76 8 8.5 4.5 3.5 0.5 0.0 GLN 77 6 10.5 4.5 1.5 4.5 0.0 TYR 78 1 12.0 2.0 2.0 8.0 0.0 TYR 79 2 16.0 1.0 1.0 14.0 0.0 ARG 80 3 7.5 1.5 0.0 6.0 0.0 ILE 81 7 18.5 3.5 1.0 14.0 0.0 ALA 82 0 12.0 3.5 1.5 7.0 0.0 GLY 83 0 4.5 1.5 3.0 0.0 0.0 GLU 84 2 5.5 1.0 4.5 0.0 0.0 ASP 85 0 4.5 2.0 2.5 0.0 0.0 VAL 86 3 16.0 3.5 6.0 6.5 0.0 ALA 87 1 11.5 4.0 3.5 4.0 0.0 ARG 88 7 9.0 2.0 6.5 0.5 1.0 LEU 89 4 9.5 1.5 7.5 0.5 2.5 PHE 90 2 19.5 5.0 4.0 10.5 1.5 ALA 91 1 8.5 4.0 4.5 0.0 0.0 LEU 92 0 11.0 2.5 8.5 0.0 3.5 VAL 93 5 9.0 4.0 4.0 1.0 0.0 GLN 94 3 8.5 3.0 4.5 1.0 1.0 VAL 95 5 10.5 3.5 7.0 0.0 0.0 VAL 96 4 7.0 4.5 2.5 0.0 0.0 ALA 97 1 11.0 3.5 3.0 4.5 4.5 ASP 98 2 7.5 2.5 3.0 2.0 2.0 GLU 99 3 5.5 3.0 2.5 0.0 0.0 HIS 100 1 3.5 2.0 1.5 0.0 0.0 LEU 101 6 4.5 1.5 1.0 2.0 2.0 GLU 102 1 1.5 1.5 0.0 0.0 0.0 HIS 103 0 0.0 0.0 0.0 0.0 0.0 HIS 104 0 0.0 0.0 0.0 0.0 0.0 HIS 105 0 0.0 0.0 0.0 0.0 0.0 HIS 106 0 0.0 0.0 0.0 0.0 0.0 HIS 107 0 0.5 0.5 0.0 0.0 0.0 HIS 108 0 0.5 0.5 0.0 0.0 0.0 # TOTAL 572 1814.0 588.0 594.0 632.0 126.0 # TOTAL NUMBER OF RESTRAINTS (CHECKING): 2386.0