==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 24-NOV-08 2KB9 . COMPND 2 MOLECULE: JAGGED-1; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.PINTAR,C.GUARNACCIA,S.PONGOR . 44 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4124.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 15 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 2 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A R 0 0 274 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.7 2.1 -0.0 -1.2 2 2 A a + 0 0 46 4,-0.0 3,-0.1 1,-0.0 4,-0.0 -0.890 360.0 127.5-174.8 143.1 -1.0 0.1 -3.5 3 3 A Q > + 0 0 171 1,-0.3 3,-0.8 -2,-0.3 2,-0.7 0.234 60.0 79.7-166.4 -42.3 -4.8 -0.3 -3.3 4 4 A Y T 3 S- 0 0 194 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 -0.751 114.2 -2.3 -88.4 116.9 -6.5 2.7 -4.9 5 5 A G T 3 S+ 0 0 5 -2,-0.7 2,-0.3 1,-0.1 24,-0.3 0.773 114.1 98.6 76.6 26.4 -6.6 2.3 -8.7 6 6 A W < + 0 0 63 -3,-0.8 8,-0.2 8,-0.1 2,-0.2 -0.839 42.6 158.7-150.3 107.4 -4.7 -1.0 -8.6 7 7 A Q > + 0 0 91 6,-1.7 5,-1.3 -2,-0.3 6,-0.2 -0.448 20.8 88.7-115.1-170.9 -6.3 -4.4 -8.8 8 8 A G T 5S- 0 0 47 1,-0.2 5,-0.1 3,-0.2 -2,-0.0 -0.455 93.1 -47.2 109.8 175.7 -5.2 -7.9 -9.8 9 9 A L T 5S- 0 0 169 -2,-0.2 -1,-0.2 3,-0.1 0, 0.0 0.831 131.3 -18.8 -52.0 -34.0 -3.7 -10.9 -8.0 10 10 A Y T 5S- 0 0 201 -3,-0.2 -2,-0.1 0, 0.0 2,-0.1 0.435 117.1 -49.3-135.9 -74.2 -1.2 -8.5 -6.4 11 11 A a T 5S+ 0 0 45 1,-0.0 -3,-0.2 3,-0.0 3,-0.1 -0.356 83.9 109.2-179.3 89.2 -0.7 -5.1 -8.1 12 12 A D < + 0 0 137 -5,-1.3 2,-0.3 1,-0.2 -4,-0.1 -0.092 61.4 73.2-162.5 47.1 -0.1 -4.7 -11.9 13 13 A K - 0 0 105 -6,-0.2 -6,-1.7 -8,-0.1 -1,-0.2 -0.842 49.6-160.1-167.9 126.8 -3.3 -3.2 -13.5 14 14 A b - 0 0 0 -2,-0.3 15,-0.7 -8,-0.2 16,-0.3 0.026 60.3-101.0 -96.7 26.0 -4.8 0.3 -13.5 15 15 A I - 0 0 35 1,-0.1 5,-0.1 14,-0.1 -2,-0.1 0.981 43.2-171.8 51.8 77.4 -8.2 -1.2 -14.5 16 16 A P S > S+ 0 0 35 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.730 72.3 79.1 -69.8 -22.7 -8.2 -0.4 -18.3 17 17 A H T >4 S+ 0 0 163 1,-0.2 2,-1.9 2,-0.2 3,-1.0 0.960 83.1 61.8 -48.6 -63.5 -11.8 -1.5 -18.5 18 18 A P T 34 S+ 0 0 83 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.466 126.8 6.9 -69.8 83.2 -13.2 1.8 -17.1 19 19 A G T 34 S+ 0 0 42 -2,-1.9 2,-0.3 1,-0.4 -2,-0.2 0.139 131.6 36.3 130.3 -18.8 -12.0 4.2 -19.8 20 20 A c << - 0 0 9 -4,-1.7 -1,-0.4 -3,-1.0 22,-0.2 -0.871 56.2-145.0-149.1-179.6 -10.5 1.8 -22.3 21 21 A V S S- 0 0 59 20,-1.8 2,-0.3 1,-0.5 21,-0.1 0.685 76.8 -5.4-119.9 -47.0 -11.0 -1.6 -24.0 22 22 A H S S+ 0 0 94 20,-0.8 -1,-0.5 19,-0.7 2,-0.4 -0.868 87.6 64.8-143.8 176.0 -7.5 -3.0 -24.6 23 23 A G S S- 0 0 49 -2,-0.3 2,-0.2 -3,-0.1 10,-0.2 -0.863 71.4 -78.1 112.2-145.2 -3.8 -2.1 -24.4 24 24 A I B -A 32 0A 123 8,-2.7 8,-1.7 -2,-0.4 2,-0.3 -0.811 29.6-161.0-147.1-173.5 -1.8 -1.4 -21.3 25 25 A b - 0 0 23 -2,-0.2 -11,-0.1 6,-0.2 -10,-0.1 -0.932 18.2-166.6-174.2 151.2 -1.0 1.3 -18.7 26 26 A N S S+ 0 0 129 -2,-0.3 -1,-0.1 -13,-0.1 -13,-0.1 0.612 77.3 56.5-116.5 -26.1 1.7 2.2 -16.1 27 27 A E S S- 0 0 112 1,-0.1 3,-0.4 -13,-0.0 2,-0.2 -0.710 95.2 -88.7-108.9 160.6 -0.2 4.9 -14.2 28 28 A P S S+ 0 0 51 0, 0.0 -22,-0.1 0, 0.0 -13,-0.1 -0.485 106.2 5.1 -69.8 128.9 -3.6 4.8 -12.3 29 29 A W S S+ 0 0 136 -15,-0.7 2,-0.3 -24,-0.3 -14,-0.1 0.997 100.9 124.9 61.0 69.8 -6.6 5.7 -14.5 30 30 A Q - 0 0 86 -3,-0.4 2,-0.4 -16,-0.3 -1,-0.2 -0.897 52.6-131.3-147.2 174.8 -4.9 6.0 -17.9 31 31 A c + 0 0 42 -2,-0.3 2,-0.5 2,-0.0 -6,-0.2 -0.947 21.8 173.1-139.9 116.4 -4.9 4.7 -21.5 32 32 A L B +A 24 0A 60 -8,-1.7 -8,-2.7 -2,-0.4 2,-0.2 -0.959 18.0 141.3-128.0 115.1 -1.9 3.4 -23.4 33 33 A d - 0 0 54 -2,-0.5 -10,-0.1 -10,-0.2 9,-0.1 -0.761 46.9 -83.1-138.0-176.6 -2.3 1.8 -26.8 34 34 A E - 0 0 147 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.162 40.6-105.7 -83.3-178.6 -0.6 1.6 -30.2 35 35 A T S S+ 0 0 142 1,-0.2 -1,-0.1 3,-0.0 -2,-0.0 0.827 115.0 65.6 -78.0 -33.6 -0.9 4.0 -33.1 36 36 A N S S+ 0 0 163 2,-0.1 2,-0.3 6,-0.0 -1,-0.2 0.823 88.9 82.9 -57.7 -31.8 -3.1 1.7 -35.2 37 37 A W S S- 0 0 89 -3,-0.1 2,-0.4 5,-0.1 7,-0.1 -0.589 73.2-149.8 -78.4 132.5 -5.8 2.1 -32.5 38 38 A G B > +B 43 0B 49 5,-0.6 5,-0.9 -2,-0.3 4,-0.2 -0.836 52.5 22.5-107.0 141.9 -7.9 5.2 -32.8 39 39 A G T 5S- 0 0 53 -2,-0.4 3,-0.2 3,-0.2 -2,-0.0 -0.036 89.7 -81.8 93.4 160.8 -9.5 7.1 -30.0 40 40 A Q T 5S+ 0 0 163 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.898 129.3 53.8 -66.6 -41.7 -8.8 7.4 -26.3 41 41 A L T 5S- 0 0 100 -21,-0.1 -20,-1.8 -20,-0.1 -19,-0.7 0.770 100.4-143.7 -63.9 -25.5 -10.5 4.1 -25.4 42 42 A d T 5 + 0 0 3 -4,-0.2 -20,-0.8 -22,-0.2 -21,-0.3 0.993 37.9 159.2 57.3 72.9 -8.4 2.4 -28.1 43 43 A D B < B 38 0B 80 -5,-0.9 -5,-0.6 1,-0.2 -1,-0.1 -0.580 360.0 360.0-116.3 180.0 -10.9 -0.0 -29.5 44 44 A K 0 0 202 -2,-0.2 -1,-0.2 -7,-0.1 -2,-0.0 -0.074 360.0 360.0 -84.3 360.0 -11.2 -2.0 -32.8