==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIPID BINDING PROTEIN 10-MAY-12 4F4B . COMPND 2 MOLECULE: PROTEIN KES1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.C.KOAG,A.F.MONZINGO,Y.CHEUN,S.LEE . 846 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37759.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 579 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 202 23.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 2 0.2 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 . 46 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 131 15.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 19.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.8 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 2 4 0 0 0 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 5 0 4 4 10 6 4 2 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 . 4 0 1 1 0 0 0 0 0 0 0 0 2 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 0 128 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.7 -6.8 27.7 17.2 2 0 A D > - 0 0 39 1,-0.1 3,-2.1 2,-0.0 4,-0.4 -0.450 360.0-115.5 -68.0 146.7 -9.2 25.0 18.3 3 1 A P G > S+ 0 0 19 0, 0.0 3,-1.1 0, 0.0 4,-0.5 0.754 114.1 64.5 -59.2 -24.4 -10.4 22.6 15.4 4 2 A S G 3 S+ 0 0 59 1,-0.3 4,-0.1 2,-0.1 702,-0.1 0.609 99.6 54.8 -75.4 -11.8 -14.0 23.8 15.8 5 3 A Q G < S+ 0 0 79 -3,-2.1 3,-0.4 1,-0.1 4,-0.3 0.525 89.5 85.4 -90.1 -7.7 -12.8 27.3 14.8 6 4 A Y S X S+ 0 0 19 -3,-1.1 3,-1.7 -4,-0.4 6,-0.4 0.912 78.5 54.2 -62.4 -51.2 -11.2 25.9 11.5 7 5 A A T 3 S+ 0 0 39 -4,-0.5 -1,-0.2 203,-0.4 204,-0.1 0.740 116.1 37.4 -65.2 -25.1 -14.1 25.9 9.0 8 6 A S T 3 S+ 0 0 104 -3,-0.4 -1,-0.3 -4,-0.1 -2,-0.2 0.288 89.0 116.9-108.2 11.8 -15.0 29.5 9.4 9 7 A S S <> S- 0 0 16 -3,-1.7 4,-1.9 -4,-0.3 5,-0.1 -0.344 76.2-118.4 -69.1 157.9 -11.5 30.9 9.8 10 8 A S H > S+ 0 0 103 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.897 115.2 58.2 -58.9 -43.8 -10.2 33.4 7.2 11 9 A S H > S+ 0 0 44 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.923 107.6 44.4 -54.7 -46.7 -7.5 30.9 6.4 12 10 A W H > S+ 0 0 1 -6,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.899 112.2 49.9 -70.3 -44.4 -9.9 28.1 5.6 13 11 A T H X S+ 0 0 62 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.923 111.6 50.5 -53.9 -45.1 -12.2 30.2 3.5 14 12 A S H X S+ 0 0 80 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.872 110.4 51.5 -61.1 -39.7 -9.2 31.4 1.5 15 13 A F H X S+ 0 0 14 -4,-2.1 4,-0.8 -5,-0.2 3,-0.3 0.966 109.8 46.8 -60.4 -54.7 -8.1 27.8 1.1 16 14 A L H >X S+ 0 0 33 -4,-2.5 3,-1.0 1,-0.2 4,-0.7 0.876 109.6 55.2 -53.0 -44.7 -11.5 26.7 -0.3 17 15 A K H >< S+ 0 0 152 -4,-2.4 3,-0.9 1,-0.3 4,-0.2 0.877 103.2 54.9 -59.4 -39.9 -11.7 29.6 -2.6 18 16 A S H >< S+ 0 0 34 -4,-1.5 3,-0.9 -3,-0.3 -1,-0.3 0.624 91.3 73.0 -72.3 -14.3 -8.3 28.7 -4.1 19 17 A I H X< S+ 0 0 8 -3,-1.0 3,-2.8 -4,-0.8 -1,-0.2 0.895 86.5 67.0 -57.7 -40.4 -9.7 25.2 -4.9 20 18 A A T << S+ 0 0 96 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.714 108.5 36.5 -51.3 -28.5 -11.7 26.9 -7.7 21 19 A S T < S+ 0 0 92 -3,-0.9 -1,-0.3 -4,-0.2 -2,-0.2 0.080 84.4 157.7-115.4 16.3 -8.4 27.6 -9.5 22 20 A F < - 0 0 44 -3,-2.8 -3,-0.1 1,-0.1 4,-0.1 -0.188 33.2-151.8 -46.4 127.6 -6.7 24.4 -8.5 23 21 A N - 0 0 112 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.433 42.1-101.8 -92.3 1.3 -4.0 23.7 -11.1 24 22 A G S S+ 0 0 55 1,-0.2 2,-0.7 2,-0.0 147,-0.3 0.353 94.2 105.4 98.2 -5.6 -4.0 19.9 -10.8 25 23 A D > - 0 0 68 1,-0.2 3,-1.0 145,-0.1 -2,-0.3 -0.919 53.1-163.8-112.8 108.4 -0.9 19.7 -8.6 26 24 A L G > S+ 0 0 41 -2,-0.7 3,-2.9 1,-0.2 -1,-0.2 0.891 85.5 67.1 -58.2 -40.1 -1.8 18.9 -5.1 27 25 A S G 3 S+ 0 0 43 1,-0.3 -1,-0.2 3,-0.1 87,-0.1 0.817 96.9 56.7 -52.1 -32.2 1.6 19.9 -3.7 28 26 A S G < S+ 0 0 58 -3,-1.0 -1,-0.3 2,-0.1 -2,-0.2 0.458 74.1 127.0 -79.0 -4.5 0.7 23.6 -4.7 29 27 A L < - 0 0 30 -3,-2.9 2,-1.8 -4,-0.2 -14,-0.1 -0.394 62.6-136.6 -47.8 121.7 -2.5 23.5 -2.5 30 28 A S + 0 0 82 -15,-0.2 -1,-0.1 -2,-0.1 -12,-0.1 -0.555 36.6 175.0 -90.0 75.7 -2.1 26.6 -0.3 31 29 A A - 0 0 17 -2,-1.8 -19,-0.1 1,-0.1 5,-0.1 -0.593 34.1-110.3 -77.2 134.5 -3.2 24.9 2.9 32 30 A P > - 0 0 8 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.316 33.8-107.6 -61.4 149.2 -3.1 26.7 6.2 33 31 A P G > S+ 0 0 14 0, 0.0 3,-2.0 0, 0.0 287,-0.1 0.830 116.5 64.3 -44.6 -43.4 -0.4 25.5 8.7 34 32 A F G 3 S+ 0 0 33 1,-0.3 -28,-0.0 286,-0.1 283,-0.0 0.632 103.7 48.1 -59.9 -15.8 -3.1 23.9 11.0 35 33 A I G < S+ 0 0 8 -3,-2.2 76,-3.5 75,-0.1 2,-0.4 0.281 91.6 108.2-106.4 6.8 -4.0 21.4 8.1 36 34 A L E < -a 111 0A 24 -3,-2.0 77,-0.1 74,-0.3 284,-0.0 -0.716 59.6-143.7 -87.2 133.1 -0.3 20.5 7.4 37 35 A S E - 0 0 2 74,-3.6 -2,-0.1 -2,-0.4 72,-0.0 -0.757 8.5-147.0 -87.1 142.3 1.2 17.1 8.2 38 36 A P E S+ 0 0 28 0, 0.0 2,-0.4 0, 0.0 276,-0.1 0.304 73.9 94.8 -90.3 18.2 4.8 16.9 9.4 39 37 A I E - 0 0 43 72,-0.1 74,-2.3 275,-0.1 2,-0.2 -0.879 69.4-134.5-112.6 139.3 5.1 13.4 7.6 40 38 A S E > -a 113 0A 1 -2,-0.4 3,-1.7 72,-0.2 4,-0.3 -0.580 21.7-119.6 -87.1 148.9 6.5 12.8 4.1 41 39 A L G > S+ 0 0 54 72,-1.9 3,-1.2 1,-0.3 4,-0.4 0.681 108.2 72.7 -59.9 -22.7 4.7 10.5 1.7 42 40 A T G 3 S+ 0 0 0 1,-0.2 3,-0.5 2,-0.2 -1,-0.3 0.777 91.5 60.2 -64.5 -19.5 7.8 8.2 1.5 43 41 A E G X S+ 0 0 13 -3,-1.7 3,-1.6 1,-0.2 -1,-0.2 0.698 83.7 79.1 -75.7 -17.4 6.9 7.1 5.0 44 42 A F G X S+ 0 0 32 -3,-1.2 3,-2.5 -4,-0.3 -1,-0.2 0.829 75.6 75.4 -64.7 -26.2 3.4 5.7 3.9 45 43 A S G > S+ 0 0 4 -3,-0.5 3,-1.6 -4,-0.4 -1,-0.3 0.767 82.1 68.7 -55.6 -26.9 5.1 2.6 2.5 46 44 A Q G X S+ 0 0 10 -3,-1.6 3,-1.6 1,-0.3 -1,-0.3 0.698 81.9 77.3 -62.1 -22.9 5.5 1.3 6.2 47 45 A Y G < S+ 0 0 17 -3,-2.5 3,-0.4 1,-0.3 51,-0.4 0.564 76.0 74.4 -70.2 -9.0 1.7 1.0 6.2 48 46 A W G < S+ 0 0 19 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.1 0.465 110.2 22.8 -73.5 -8.7 1.9 -2.3 4.2 49 47 A A < + 0 0 1 -3,-1.6 -1,-0.2 45,-0.1 -2,-0.1 0.122 67.3 131.2-152.9 36.9 3.1 -4.3 7.2 50 48 A E S S+ 0 0 6 -3,-0.4 241,-2.9 1,-0.2 3,-0.1 0.486 76.4 60.7 -72.4 0.5 2.3 -2.8 10.6 51 49 A H S >> S- 0 0 7 239,-0.2 4,-2.1 1,-0.1 3,-1.4 -0.757 70.3-176.8-123.2 85.1 1.0 -6.2 11.7 52 50 A P H 3> S+ 0 0 3 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.778 77.6 56.0 -56.7 -35.8 4.2 -8.2 11.4 53 51 A E H 3> S+ 0 0 63 1,-0.2 4,-1.3 2,-0.2 37,-0.1 0.810 109.8 46.2 -68.0 -29.0 2.5 -11.5 12.4 54 52 A L H <4 S+ 0 0 20 -3,-1.4 36,-0.3 2,-0.2 -1,-0.2 0.826 109.6 54.6 -83.2 -34.0 -0.1 -11.2 9.6 55 53 A F H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.894 118.3 34.6 -58.2 -38.8 2.5 -10.2 7.1 56 54 A L H >< S+ 0 0 0 -4,-1.6 3,-1.6 -5,-0.2 4,-0.4 0.687 92.1 94.0 -96.2 -20.4 4.5 -13.4 7.8 57 55 A E G >< S+ 0 0 55 -4,-1.3 3,-1.9 1,-0.3 4,-0.2 0.796 78.9 56.0 -49.9 -47.2 1.6 -15.8 8.5 58 56 A P G > S+ 0 0 2 0, 0.0 3,-1.3 0, 0.0 -1,-0.3 0.810 98.3 63.4 -57.7 -30.6 1.2 -17.3 5.0 59 57 A S G < S+ 0 0 7 -3,-1.6 -2,-0.2 1,-0.2 -3,-0.1 0.705 101.3 52.8 -64.8 -15.4 4.9 -18.4 5.0 60 58 A F G < S+ 0 0 45 -3,-1.9 2,-0.5 -4,-0.4 -1,-0.2 0.391 87.9 92.7-101.2 -1.1 4.1 -20.7 7.9 61 59 A I < + 0 0 5 -3,-1.3 2,-0.2 -4,-0.2 22,-0.0 -0.859 53.1 152.4 -93.7 120.8 1.2 -22.5 6.3 62 60 A N >> - 0 0 74 -2,-0.5 4,-1.3 21,-0.0 3,-0.6 -0.736 59.9 -81.3-133.0-171.5 2.2 -25.7 4.5 63 61 A D T 34 S+ 0 0 115 -2,-0.2 4,-0.1 1,-0.2 -2,-0.0 0.730 124.5 50.0 -57.5 -27.6 0.8 -29.2 3.4 64 62 A D T 34 S+ 0 0 147 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.553 124.4 20.9 -97.7 -6.0 1.5 -30.6 6.8 65 63 A N T X4 S+ 0 0 31 -3,-0.6 3,-2.0 2,-0.0 4,-0.2 0.382 79.7 116.4-136.4 2.9 -0.1 -28.0 9.0 66 64 A Y G >< S+ 0 0 51 -4,-1.3 3,-1.3 1,-0.3 10,-0.1 0.737 75.0 56.6 -59.6 -29.4 -2.7 -25.9 7.0 67 65 A K G 3 S+ 0 0 104 1,-0.3 3,-0.4 -4,-0.1 -1,-0.3 0.672 103.5 57.4 -71.8 -16.6 -5.9 -26.9 8.9 68 66 A E G < S+ 0 0 142 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.294 104.3 53.5 -94.7 1.7 -4.2 -25.6 12.0 69 67 A H S < S+ 0 0 54 -3,-1.3 -1,-0.2 -4,-0.2 2,-0.1 -0.299 86.5 81.8-131.4 44.4 -3.7 -22.1 10.5 70 68 A C > + 0 0 8 -3,-0.4 3,-1.0 1,-0.1 6,-0.2 -0.621 52.0 178.4-145.0 83.9 -7.2 -21.3 9.4 71 69 A L T 3 S+ 0 0 63 1,-0.3 -1,-0.1 -2,-0.1 211,-0.0 0.864 82.0 46.5 -57.8 -42.4 -9.0 -20.0 12.5 72 70 A I T 3 S+ 0 0 27 1,-0.2 -1,-0.3 210,-0.1 202,-0.0 0.635 126.0 26.1 -79.0 -10.8 -12.3 -19.3 10.7 73 71 A D X + 0 0 13 -3,-1.0 3,-1.6 1,-0.1 -1,-0.2 -0.580 54.4 179.8-153.5 86.7 -12.4 -22.7 8.8 74 72 A P T 3 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.607 91.0 51.6 -61.9 -17.1 -10.6 -25.8 10.3 75 73 A E T 3 S+ 0 0 146 -5,-0.0 -8,-0.1 3,-0.0 2,-0.1 -0.298 77.1 157.9-106.5 41.2 -11.8 -27.8 7.3 76 74 A V < - 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