==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PEPTIDE-BINDING PROTEIN 01-FEB-07 2OQS . COMPND 2 MOLECULE: DISKS LARGE HOMOLOG 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.LIU,J.D.BALEJA,G.D.HENRY,R.S.HEGDE . 98 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6092.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 59 60.2 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 . 28 28.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 1.0 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 . 8 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 10.2 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+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 1 0 0 0 1 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 . 3 2 1 1 1 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 1 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 M 0 0 112 0, 0.0 84,-2.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 103.3 -8.4 1.7 -7.1 2 2 A E E -A 84 0A 100 82,-0.2 2,-0.3 2,-0.0 82,-0.2 -0.689 360.0-169.8-100.4 154.2 -5.4 3.7 -8.2 3 3 A I E -A 83 0A 9 80,-1.5 80,-1.8 -2,-0.3 2,-1.2 -0.978 18.3-141.8-145.3 127.1 -4.0 6.9 -6.7 4 4 A K E -A 82 0A 145 -2,-0.3 2,-0.4 78,-0.2 78,-0.2 -0.723 26.7-175.3 -94.3 91.3 -1.3 9.2 -8.1 5 5 A L E -A 81 0A 24 76,-1.7 76,-2.0 -2,-1.2 2,-0.5 -0.729 19.1-135.5 -89.9 130.9 0.8 10.3 -5.1 6 6 A I E -A 80 0A 111 -2,-0.4 2,-0.3 74,-0.2 74,-0.2 -0.745 24.7-114.3 -89.4 125.9 3.6 12.9 -5.6 7 7 A K - 0 0 72 72,-2.0 5,-0.1 -2,-0.5 -1,-0.1 -0.410 39.4-167.3 -61.2 118.9 6.9 12.1 -3.9 8 8 A G - 0 0 24 3,-0.4 33,-0.1 -2,-0.3 -1,-0.0 -0.663 34.7-107.0-107.3 164.1 7.5 14.7 -1.2 9 9 A P S S+ 0 0 148 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.882 118.2 50.9 -53.8 -42.4 10.7 15.6 0.8 10 10 A K S S- 0 0 194 1,-0.2 2,-0.3 2,-0.1 3,-0.1 0.994 104.0-137.4 -59.7 -68.1 9.1 14.0 3.9 11 11 A G - 0 0 17 1,-0.2 -3,-0.4 2,-0.0 30,-0.3 -0.997 42.4 -32.8 148.2-140.9 8.2 10.7 2.5 12 12 A L - 0 0 18 87,-0.6 29,-1.6 -2,-0.3 30,-1.0 0.930 60.3-150.4 -83.4 -52.2 5.2 8.3 2.6 13 13 A G + 0 0 18 1,-0.3 24,-2.6 27,-0.3 30,-0.3 0.804 61.5 66.7 85.2 31.9 4.0 9.0 6.2 14 14 A F B -G 36 0B 5 22,-0.3 85,-3.2 28,-0.1 -1,-0.3 -0.911 69.2-115.8-161.0-174.7 2.5 5.6 7.0 15 15 A S E -B 98 0A 2 20,-1.4 20,-0.4 83,-0.3 2,-0.3 -0.793 20.7-167.8-129.9 172.9 3.2 1.9 7.5 16 16 A I E -B 97 0A 0 81,-2.4 81,-1.7 17,-0.3 2,-0.3 -0.964 10.0-149.4-154.9 169.5 2.4 -1.5 5.8 17 17 A A E +BC 96 32A 0 15,-1.9 15,-1.0 -2,-0.3 2,-0.2 -0.890 25.2 150.5-136.5 164.1 2.4 -5.2 6.2 18 18 A G + 0 0 0 4,-1.3 52,-0.2 77,-0.6 12,-0.2 -0.593 26.9 38.7 165.4 134.5 2.8 -8.1 3.7 19 19 A G S > S- 0 0 1 10,-0.7 3,-1.3 11,-0.4 -1,-0.2 -0.167 84.1 -45.0 104.1 160.5 4.0 -11.6 2.9 20 20 A V T 3 S+ 0 0 110 1,-0.2 47,-0.2 2,-0.2 9,-0.0 -0.388 127.0 16.4 -65.1 137.5 4.1 -15.0 4.6 21 21 A G T 3 S+ 0 0 60 -2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.154 132.7 49.7 85.2 -20.1 5.2 -14.8 8.3 22 22 A N S < S+ 0 0 14 -3,-1.3 -4,-1.3 72,-0.2 73,-0.9 0.073 79.6 152.7-133.2 17.7 4.6 -11.1 8.3 23 23 A Q - 0 0 42 -4,-0.2 6,-0.1 -6,-0.2 72,-0.1 -0.178 36.9-155.2 -55.2 143.8 1.0 -11.0 6.8 24 24 A H S S+ 0 0 42 6,-0.5 -1,-0.1 4,-0.4 5,-0.1 0.741 82.7 29.8 -89.8 -29.3 -1.3 -8.2 7.7 25 25 A I B > S-H 28 0C 63 3,-0.9 3,-2.2 5,-0.2 -1,-0.3 -0.995 90.5-108.8-137.2 129.1 -4.5 -10.1 7.2 26 26 A P T 3 S+ 0 0 125 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.327 106.2 13.6 -57.3 125.1 -5.1 -13.9 7.6 27 27 A G T 3 S+ 0 0 70 -2,-0.1 2,-0.5 1,-0.1 0, 0.0 0.261 114.9 83.8 92.3 -11.7 -5.5 -15.5 4.1 28 28 A D B < -H 25 0C 49 -3,-2.2 -3,-0.9 2,-0.1 -4,-0.4 -0.940 48.8-176.9-130.3 110.3 -4.2 -12.5 2.3 29 29 A N + 0 0 50 -2,-0.5 -10,-0.7 34,-0.3 36,-0.5 0.187 49.6 121.2 -88.2 17.2 -0.4 -12.0 1.8 30 30 A S S S- 0 0 3 -12,-0.2 2,-0.7 -5,-0.1 -6,-0.5 -0.028 75.9 -88.2 -70.0-179.6 -1.0 -8.6 0.1 31 31 A I E + D 0 54A 2 31,-0.9 23,-1.8 23,-0.7 2,-0.3 -0.841 49.5 179.4-100.3 109.8 0.3 -5.3 1.3 32 32 A Y E -CD 17 53A 9 -15,-1.0 -15,-1.9 -2,-0.7 2,-0.4 -0.856 31.0-115.3-110.3 145.4 -2.0 -3.5 3.8 33 33 A V + 0 0 3 19,-1.0 18,-1.1 -2,-0.3 -17,-0.3 -0.629 29.0 179.4 -79.6 126.2 -1.5 -0.2 5.6 34 34 A T + 0 0 31 -2,-0.4 2,-0.3 1,-0.3 -18,-0.1 0.689 67.8 10.0 -99.5 -25.9 -1.1 -0.7 9.4 35 35 A K - 0 0 94 -20,-0.4 -20,-1.4 2,-0.0 2,-0.5 -0.842 60.2-155.0-161.1 120.3 -0.6 2.9 10.6 36 36 A I B -G 14 0B 25 -22,-0.3 -22,-0.3 -2,-0.3 2,-0.2 -0.861 18.6-139.4-101.8 124.6 -0.9 6.3 8.8 37 37 A I > - 0 0 47 -24,-2.6 3,-1.3 -2,-0.5 6,-0.4 -0.498 30.2 -96.4 -79.8 148.2 1.1 9.2 10.2 38 38 A E T 3 S+ 0 0 138 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.265 107.0 14.2 -62.6 148.8 -0.4 12.7 10.4 39 39 A G T 3 S+ 0 0 42 1,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.679 99.3 140.8 59.3 17.9 0.4 15.1 7.6 40 40 A G <> - 0 0 8 -3,-1.3 4,-3.5 -27,-0.3 5,-0.4 -0.398 69.9 -99.0 -88.9 168.3 1.7 12.1 5.5 41 41 A A H > S+ 0 0 22 -29,-1.6 4,-2.0 -30,-0.3 -28,-0.2 0.924 125.3 34.6 -48.5 -54.7 1.3 11.4 1.8 42 42 A A H > S+ 0 0 0 -30,-1.0 4,-3.1 2,-0.2 6,-0.4 0.950 117.6 52.9 -67.2 -50.9 -1.6 9.0 2.4 43 43 A H H 4 S+ 0 0 96 -6,-0.4 -2,-0.2 -30,-0.3 -1,-0.2 0.889 114.8 42.3 -51.2 -45.6 -3.1 10.9 5.4 44 44 A K H < S+ 0 0 159 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.872 113.2 53.2 -70.8 -38.6 -3.2 14.1 3.3 45 45 A D H < S- 0 0 54 -4,-2.0 -2,-0.2 -5,-0.4 -1,-0.2 0.943 85.1-159.0 -62.0 -50.4 -4.5 12.3 0.2 46 46 A G < + 0 0 53 -4,-3.1 -1,-0.1 2,-0.3 -3,-0.1 0.043 69.5 93.9 92.2 -26.3 -7.4 10.8 2.1 47 47 A K S S+ 0 0 114 -5,-0.1 2,-0.5 1,-0.1 -4,-0.1 0.894 75.3 67.3 -65.1 -41.3 -7.9 8.0 -0.5 48 48 A L + 0 0 15 -6,-0.4 2,-0.3 4,-0.0 -2,-0.3 -0.730 65.3 165.6 -87.8 123.9 -5.7 5.6 1.4 49 49 A Q > - 0 0 95 -2,-0.5 3,-1.8 1,-0.0 -16,-0.2 -0.979 46.5 -77.7-136.6 147.7 -7.1 4.4 4.7 50 50 A I T 3 S+ 0 0 119 -2,-0.3 -16,-0.1 1,-0.2 3,-0.1 -0.053 114.8 38.8 -42.2 138.8 -6.2 1.6 7.1 51 51 A G T 3 S+ 0 0 44 -18,-1.1 -1,-0.2 1,-0.4 -17,-0.1 0.104 83.6 125.4 103.9 -21.8 -7.5 -1.8 5.9 52 52 A D < - 0 0 15 -3,-1.8 -19,-1.0 -19,-0.1 -1,-0.4 -0.366 51.3-137.5 -71.7 152.4 -6.8 -1.3 2.2 53 53 A K E -DE 32 86A 20 33,-0.6 2,-0.9 -21,-0.2 33,-0.8 -0.840 11.0-123.6-112.9 148.3 -4.7 -3.8 0.3 54 54 A L E +DE 31 85A 5 -23,-1.8 -23,-0.7 -2,-0.3 31,-0.3 -0.784 26.4 176.2 -95.8 102.7 -1.9 -3.1 -2.2 55 55 A L E - 0 0 54 29,-1.3 7,-1.5 -2,-0.9 8,-0.5 0.956 69.9 -21.2 -66.5 -52.1 -2.7 -4.8 -5.5 56 56 A A E -FE 61 84A 13 28,-2.4 28,-3.6 5,-0.3 2,-0.3 -0.988 53.2-158.9-156.8 159.4 0.4 -3.3 -7.3 57 57 A V E > S-FE 60 83A 0 3,-3.5 3,-1.1 -2,-0.3 26,-0.2 -0.909 78.7 -6.3-149.4 117.1 2.9 -0.5 -7.1 58 58 A N T 3 S- 0 0 52 24,-1.9 3,-0.1 -2,-0.3 25,-0.1 0.874 131.6 -52.0 67.8 38.9 5.1 0.9 -9.9 59 59 A N T 3 S+ 0 0 168 23,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.218 119.2 111.0 82.7 -13.4 3.9 -1.8 -12.3 60 60 A V E < S-F 57 0A 58 -3,-1.1 -3,-3.5 13,-0.1 2,-0.4 -0.725 71.9-119.0 -94.7 143.8 4.9 -4.5 -9.7 61 61 A C E -F 56 0A 50 -2,-0.3 -5,-0.3 -5,-0.3 3,-0.3 -0.663 19.0-168.2 -82.6 129.9 2.2 -6.6 -7.9 62 62 A L S S+ 0 0 0 -7,-1.5 -31,-0.9 -2,-0.4 -8,-0.3 -0.033 73.9 76.8-103.9 27.3 2.2 -6.2 -4.1 63 63 A E S S+ 0 0 65 -8,-0.5 -34,-0.3 -33,-0.2 -1,-0.2 0.595 96.2 40.1-110.3 -18.0 -0.1 -9.2 -3.5 64 64 A E S S+ 0 0 159 -3,-0.3 2,-0.3 -9,-0.2 -34,-0.1 -0.242 97.9 94.3-126.1 44.3 2.3 -12.1 -3.9 65 65 A V S S- 0 0 28 -36,-0.5 -3,-0.0 -3,-0.1 0, 0.0 -0.922 70.8-108.6-134.0 160.2 5.5 -10.7 -2.2 66 66 A T > - 0 0 64 -2,-0.3 4,-1.3 -47,-0.2 -47,-0.2 0.057 46.0 -92.7 -70.9-171.8 7.2 -10.8 1.2 67 67 A H H > S+ 0 0 2 -47,-0.2 4,-2.3 2,-0.2 5,-0.3 0.900 124.0 61.0 -73.4 -39.8 7.3 -7.9 3.6 68 68 A E H > S+ 0 0 107 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.906 106.7 46.3 -51.3 -45.9 10.7 -6.7 2.2 69 69 A E H > S+ 0 0 58 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.871 108.0 57.3 -65.5 -37.4 9.1 -6.3 -1.2 70 70 A A H X S+ 0 0 0 -4,-1.3 4,-1.2 -52,-0.2 -2,-0.2 0.900 116.5 34.7 -59.6 -42.3 6.1 -4.5 0.4 71 71 A V H X S+ 0 0 25 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.847 115.6 56.0 -80.7 -37.1 8.5 -1.9 1.9 72 72 A T H X S+ 0 0 67 -4,-3.0 4,-0.8 -5,-0.3 -2,-0.2 0.868 111.9 43.3 -62.8 -38.6 10.9 -1.9 -1.1 73 73 A A H < S+ 0 0 4 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.861 113.9 49.8 -76.3 -36.6 8.1 -1.0 -3.5 74 74 A L H < S+ 0 0 4 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.828 115.9 44.1 -69.7 -31.5 6.7 1.6 -1.2 75 75 A K H < S+ 0 0 137 -4,-2.2 2,-2.3 1,-0.2 -1,-0.2 0.642 90.1 90.0 -86.0 -17.4 10.1 3.1 -0.8 76 76 A N < + 0 0 107 -4,-0.8 2,-0.5 -5,-0.2 -1,-0.2 -0.381 58.9 132.2 -79.1 62.2 10.9 2.8 -4.6 77 77 A T + 0 0 19 -2,-2.3 4,-0.1 1,-0.1 -3,-0.0 -0.961 23.3 164.6-121.6 118.1 9.5 6.3 -5.3 78 78 A S S S- 0 0 104 2,-0.7 -1,-0.1 -2,-0.5 3,-0.1 0.866 78.8 -25.2 -91.3 -86.1 11.4 8.8 -7.4 79 79 A D S S+ 0 0 120 1,-0.3 -72,-2.0 -73,-0.1 2,-0.3 0.827 131.3 9.5 -98.3 -44.1 9.2 11.7 -8.6 80 80 A F E -A 6 0A 90 -74,-0.2 -2,-0.7 2,-0.0 2,-0.4 -0.821 62.9-143.1-130.7 170.8 5.8 10.1 -8.4 81 81 A V E -A 5 0A 19 -76,-2.0 -76,-1.7 -2,-0.3 2,-1.0 -0.958 4.6-153.5-142.2 120.1 4.2 6.8 -7.2 82 82 A Y E -A 4 0A 88 -2,-0.4 -24,-1.9 -78,-0.2 2,-0.5 -0.792 18.3-165.3 -97.1 99.0 1.5 4.8 -8.9 83 83 A L E -AE 3 57A 9 -80,-1.8 -80,-1.5 -2,-1.0 2,-0.6 -0.726 4.8-162.0 -88.5 128.3 -0.3 2.9 -6.2 84 84 A K E -AE 2 56A 46 -28,-3.6 -28,-2.4 -2,-0.5 -29,-1.3 -0.940 8.4-170.1-112.8 113.8 -2.7 0.1 -7.2 85 85 A V E - E 0 54A 10 -84,-2.3 2,-0.3 -2,-0.6 -31,-0.2 -0.893 12.6-140.3-108.5 133.6 -5.2 -1.1 -4.6 86 86 A A E - E 0 53A 15 -33,-0.8 -33,-0.6 -2,-0.4 -2,-0.0 -0.641 16.5-123.6 -90.8 147.6 -7.3 -4.2 -5.0 87 87 A K - 0 0 175 -2,-0.3 2,-0.5 -35,-0.1 -35,-0.0 -0.808 23.7-132.0 -93.9 115.6 -11.0 -4.3 -3.9 88 88 A P + 0 0 89 0, 0.0 -1,-0.0 0, 0.0 -36,-0.0 -0.531 55.2 127.3 -70.1 117.7 -11.7 -7.1 -1.3 89 89 A T - 0 0 120 -2,-0.5 0, 0.0 0, 0.0 0, 0.0 0.530 32.8-178.2-132.4 -64.0 -14.7 -9.1 -2.4 90 90 A G - 0 0 65 1,-0.1 0, 0.0 0, 0.0 0, 0.0 0.193 34.1-114.8 73.6 162.3 -14.1 -12.9 -2.5 91 91 A S 0 0 136 1,-0.0 -1,-0.1 0, 0.0 0, 0.0 0.821 360.0 360.0 -99.8 -45.4 -16.5 -15.7 -3.6 92 92 A H 0 0 241 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.560 360.0 360.0 -75.3 360.0 -16.9 -17.6 -0.3 93 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 94 301 B R 0 0 248 0, 0.0 2,-0.4 0, 0.0 -72,-0.2 0.000 360.0 360.0 360.0 137.2 2.9 -10.9 11.5 95 302 B R - 0 0 97 -73,-0.9 -77,-0.6 -76,-0.2 2,-0.5 -0.988 360.0-172.5-142.1 129.2 5.1 -7.9 10.8 96 303 B E E +B 17 0A 119 -2,-0.4 2,-0.4 -79,-0.1 -79,-0.2 -0.949 11.9 178.4-125.2 110.1 4.2 -4.2 10.4 97 304 B T E -B 16 0A 52 -81,-1.7 -81,-2.4 -2,-0.5 -63,-0.2 -0.879 26.3-120.3-113.5 145.0 7.0 -1.8 9.3 98 305 B Q E B 15 0A 128 -2,-0.4 -83,-0.3 -83,-0.3 -62,-0.1 -0.461 360.0 360.0 -80.0 152.3 6.7 1.9 8.6 99 306 B V 0 0 42 -85,-3.2 -87,-0.6 -2,-0.1 -84,-0.2 0.521 360.0 360.0-140.0 360.0 7.7 3.4 5.2