==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 31-MAY-13 4L0D . COMPND 2 MOLECULE: CYSTATHIONINE BETA-SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.ERENO,T.MAJTAN,I.OYENARTE,J.P.KRAUS,L.A.MARTINEZ-CRUZ . 991 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 653 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 94 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 4.6 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 . 2 0.2 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-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 . 3 0.3 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 . 64 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 270 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.4 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 2 2 1 3 4 3 4 1 7 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 4 0 8 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 PARALLEL BRIDGES PER LADDER . 8 0 2 4 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 2 4 0 0 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 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 41 A P 0 0 179 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.2 -14.0 -38.6 -0.6 2 42 A L + 0 0 127 2,-0.0 2,-0.3 167,-0.0 170,-0.1 -0.874 360.0 101.1-112.9 107.3 -13.0 -37.3 -4.0 3 43 A W - 0 0 83 -2,-0.7 2,-0.4 2,-0.0 162,-0.1 -0.893 48.1-147.0-159.5 157.5 -14.8 -34.4 -5.5 4 44 A I - 0 0 66 -2,-0.3 180,-0.1 4,-0.0 164,-0.0 -0.919 22.6-122.1-134.5 116.7 -13.8 -30.7 -5.7 5 45 A R > - 0 0 115 -2,-0.4 3,-1.3 1,-0.2 268,-0.1 -0.295 12.2-159.3 -58.6 118.7 -16.4 -28.0 -5.6 6 46 A P T 3 S+ 0 0 0 0, 0.0 267,-1.7 0, 0.0 268,-0.2 0.563 94.1 58.2 -68.4 -15.2 -16.2 -25.8 -8.7 7 47 A D T 3 S+ 0 0 45 265,-0.2 264,-0.1 266,-0.1 3,-0.1 0.341 77.8 133.4 -95.9 3.9 -18.0 -23.1 -6.7 8 48 A A < - 0 0 33 -3,-1.3 3,-0.1 1,-0.1 2,-0.1 -0.090 66.9 -93.9 -53.9 150.5 -15.4 -23.0 -4.0 9 49 A P - 0 0 113 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.385 45.4-101.2 -68.2 149.7 -14.2 -19.5 -2.9 10 50 A S - 0 0 74 265,-0.2 264,-0.0 1,-0.1 174,-0.0 -0.547 24.3-164.8 -77.1 130.0 -11.1 -18.1 -4.6 11 51 A R + 0 0 227 -2,-0.3 2,-0.1 -3,-0.1 -1,-0.1 0.369 47.9 129.2 -90.8 3.7 -7.9 -18.3 -2.6 12 52 A C - 0 0 48 1,-0.1 -2,-0.1 2,-0.0 0, 0.0 -0.405 47.6-159.6 -68.2 133.2 -6.3 -15.8 -4.9 13 53 A T + 0 0 95 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.0 0.345 48.9 127.9 -93.9 3.1 -4.6 -13.0 -3.1 14 54 A W + 0 0 57 3,-0.0 2,-0.3 4,-0.0 -2,-0.0 -0.313 30.4 167.8 -56.6 140.8 -4.6 -10.8 -6.2 15 55 A Q > - 0 0 113 0, 0.0 3,-1.8 0, 0.0 2,-0.1 -0.971 44.1 -79.5-153.3 155.5 -6.1 -7.3 -5.7 16 56 A L T 3 S+ 0 0 110 -2,-0.3 210,-0.0 1,-0.2 214,-0.0 -0.306 114.1 27.3 -60.1 128.0 -6.2 -4.1 -7.7 17 57 A G T 3 S+ 0 0 70 1,-0.4 -1,-0.2 -2,-0.1 3,-0.0 0.274 82.0 138.1 105.9 -10.4 -2.9 -2.2 -7.5 18 58 A R < - 0 0 78 -3,-1.8 -1,-0.4 1,-0.1 2,-0.1 -0.479 62.9-107.1 -68.3 134.9 -0.6 -5.1 -6.7 19 59 A P > - 0 0 66 0, 0.0 3,-2.3 0, 0.0 4,-0.2 -0.455 23.5-127.3 -61.0 134.2 2.7 -4.9 -8.6 20 60 A A G > S+ 0 0 72 1,-0.3 3,-0.9 2,-0.2 -2,-0.1 0.636 104.4 73.7 -61.1 -14.2 2.7 -7.5 -11.3 21 61 A S G 3 S+ 0 0 111 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.583 83.0 68.3 -75.1 -9.5 6.0 -8.8 -9.9 22 62 A E G < S+ 0 0 96 -3,-2.3 -1,-0.2 2,-0.0 -2,-0.2 0.585 70.7 119.2 -87.4 -9.8 4.2 -10.4 -6.9 23 63 A S < - 0 0 44 -3,-0.9 4,-0.1 -4,-0.2 -3,-0.0 -0.396 46.0-166.2 -68.3 123.1 2.5 -13.1 -9.0 24 64 A P + 0 0 109 0, 0.0 -1,-0.2 0, 0.0 2,-0.0 0.708 64.8 98.5 -71.6 -25.8 3.3 -16.7 -8.0 25 65 A H S S- 0 0 73 1,-0.1 2,-0.6 161,-0.0 -2,-0.0 -0.338 82.2-116.9 -68.4 146.1 1.7 -17.8 -11.3 26 66 A H - 0 0 96 -2,-0.0 2,-0.4 2,-0.0 -1,-0.1 -0.750 32.7-157.3 -85.1 123.4 3.9 -18.5 -14.2 27 67 A H - 0 0 68 -2,-0.6 2,-0.5 -4,-0.1 164,-0.0 -0.807 11.6-164.8-104.6 141.2 3.2 -16.2 -17.1 28 68 A T - 0 0 42 -2,-0.4 3,-0.1 3,-0.0 -2,-0.0 -0.994 17.2-143.3-120.5 125.6 4.0 -16.7 -20.8 29 69 A A - 0 0 84 -2,-0.5 166,-0.1 1,-0.1 165,-0.1 -0.574 29.1 -93.1 -87.2 149.4 3.8 -13.6 -23.0 30 70 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.214 49.1-170.2 -54.9 148.1 2.5 -13.7 -26.6 31 71 A A - 0 0 85 -3,-0.1 2,-0.5 0, 0.0 -3,-0.0 -0.709 26.9 -83.8-132.8-176.1 5.2 -14.2 -29.2 32 72 A K - 0 0 206 -2,-0.2 0, 0.0 1,-0.0 0, 0.0 -0.829 42.1-124.9 -99.3 129.8 5.7 -14.1 -33.0 33 73 A S - 0 0 74 -2,-0.5 4,-0.1 1,-0.1 10,-0.0 -0.436 24.3-115.3 -72.5 142.5 4.7 -17.2 -35.0 34 74 A P - 0 0 73 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.267 31.4-105.4 -67.3 163.2 7.3 -18.8 -37.3 35 75 A K S S+ 0 0 113 1,-0.2 513,-0.6 666,-0.1 2,-0.6 0.895 113.2 42.8 -57.1 -40.6 6.6 -18.8 -41.1 36 76 A I E S-a 548 0A 21 511,-0.1 -1,-0.2 513,-0.1 513,-0.2 -0.937 84.7-138.6-116.1 117.1 5.7 -22.4 -40.8 37 77 A L E -a 549 0A 9 511,-2.2 513,-2.8 -2,-0.6 3,-0.1 -0.587 6.2-146.6 -73.5 126.3 3.6 -23.7 -37.9 38 78 A P S S- 0 0 45 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.745 82.3 -2.6 -67.3 -27.3 4.9 -27.0 -36.6 39 79 A D S > S- 0 0 26 512,-0.1 3,-1.7 513,-0.1 4,-0.1 -0.967 79.6-100.5-156.7 164.8 1.3 -28.0 -35.8 40 80 A I G > S+ 0 0 3 761,-0.5 3,-2.2 -2,-0.3 34,-0.2 0.720 108.2 78.3 -60.3 -22.1 -2.1 -26.5 -36.0 41 81 A L G > S+ 0 0 2 1,-0.3 3,-1.0 2,-0.2 -1,-0.3 0.716 83.1 63.7 -62.0 -23.2 -2.1 -25.7 -32.3 42 82 A K G < S+ 0 0 80 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.537 85.7 75.0 -78.3 -5.7 0.1 -22.7 -32.9 43 83 A K G < S+ 0 0 37 -3,-2.2 2,-0.5 -4,-0.1 -1,-0.2 0.424 71.9 109.2 -85.0 0.6 -2.8 -21.2 -34.9 44 84 A I S < S+ 0 0 30 -3,-1.0 2,-0.1 29,-0.2 29,-0.1 -0.676 71.4 14.0 -81.1 124.6 -4.6 -20.5 -31.7 45 85 A G S S+ 0 0 10 -2,-0.5 29,-0.0 25,-0.1 151,-0.0 -0.431 72.3 92.5 105.5 177.5 -4.7 -16.8 -30.8 46 86 A D - 0 0 118 1,-0.2 -1,-0.0 -2,-0.1 -2,-0.0 0.844 58.6-179.4 60.2 38.5 -4.0 -13.5 -32.6 47 87 A T - 0 0 2 1,-0.1 -1,-0.2 21,-0.0 23,-0.1 -0.420 28.0-105.2 -70.5 143.5 -7.7 -13.2 -33.5 48 88 A P - 0 0 13 0, 0.0 21,-2.3 0, 0.0 2,-0.4 -0.372 18.7-136.0 -73.7 145.3 -8.7 -10.2 -35.6 49 89 A M E -Gh 68 535B 0 485,-0.7 487,-2.3 19,-0.2 2,-0.4 -0.854 27.3-166.8 -97.1 137.4 -10.6 -7.1 -34.2 50 90 A V E -Gh 67 536B 1 17,-2.5 17,-2.0 -2,-0.4 2,-0.2 -0.983 19.5-124.1-136.0 127.8 -13.3 -6.0 -36.6 51 91 A R E -G 66 0B 74 485,-2.7 2,-0.8 -2,-0.4 15,-0.2 -0.454 20.5-136.6 -67.8 135.0 -15.4 -2.9 -36.8 52 92 A I + 0 0 10 13,-3.6 13,-0.4 -2,-0.2 4,-0.2 -0.845 29.3 175.0 -93.7 111.1 -19.2 -3.4 -36.7 53 93 A N > + 0 0 46 -2,-0.8 4,-0.8 3,-0.1 -1,-0.2 0.972 64.3 25.3 -84.2 -61.0 -20.6 -1.1 -39.3 54 94 A K H > S+ 0 0 69 2,-0.2 4,-1.7 1,-0.1 3,-0.1 0.924 117.6 51.0 -76.9 -46.8 -24.3 -1.4 -39.8 55 95 A I H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 6,-0.2 0.871 104.8 55.3 -68.5 -40.0 -25.6 -2.8 -36.5 56 96 A G H 4>S+ 0 0 4 1,-0.2 5,-2.2 -4,-0.2 -1,-0.2 0.919 114.3 41.9 -56.0 -44.5 -24.0 -0.2 -34.2 57 97 A K H ><5S+ 0 0 155 -4,-0.8 3,-0.6 1,-0.2 -1,-0.2 0.758 105.7 65.4 -75.1 -26.4 -25.6 2.6 -36.2 58 98 A K H 3<5S+ 0 0 127 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.904 105.8 41.7 -63.3 -41.1 -28.9 0.7 -36.5 59 99 A F T 3<5S- 0 0 58 -4,-1.6 -1,-0.2 -3,-0.1 -2,-0.2 0.372 123.1 -98.4 -94.1 3.5 -29.6 0.9 -32.7 60 100 A G T < 5 + 0 0 36 -3,-0.6 2,-0.4 1,-0.3 -3,-0.2 0.651 65.0 157.3 95.4 16.4 -28.4 4.4 -32.3 61 101 A L < - 0 0 11 -5,-2.2 -1,-0.3 -6,-0.2 261,-0.1 -0.624 24.1-169.2 -75.1 129.5 -24.9 3.9 -31.0 62 102 A K + 0 0 145 262,-0.4 265,-0.3 -2,-0.4 -1,-0.1 0.539 62.0 80.9 -91.9 -8.4 -22.8 7.0 -31.6 63 103 A C S S- 0 0 12 263,-0.2 2,-0.5 258,-0.2 266,-0.2 -0.286 90.7 -88.6 -98.2 178.1 -19.6 5.2 -30.7 64 104 A E E - i 0 329B 44 264,-2.3 266,-3.3 261,-0.2 2,-0.6 -0.757 38.0-155.4 -89.5 125.1 -17.2 2.8 -32.5 65 105 A L E - i 0 330B 3 -2,-0.5 -13,-3.6 -13,-0.4 2,-0.3 -0.894 13.9-178.2-108.3 116.3 -18.2 -0.8 -32.1 66 106 A L E -Gi 51 331B 0 264,-2.5 266,-2.8 -2,-0.6 2,-0.4 -0.832 10.3-157.2-111.8 151.0 -15.4 -3.4 -32.4 67 107 A A E -Gi 50 332B 0 -17,-2.0 -17,-2.5 -2,-0.3 2,-0.8 -0.991 11.9-144.8-129.6 129.8 -15.7 -7.1 -32.1 68 108 A K E -Gi 49 333B 0 264,-2.9 266,-2.1 -2,-0.4 2,-0.9 -0.829 22.8-148.1 -91.9 111.8 -12.9 -9.5 -31.3 69 109 A C E > + i 0 334B 0 -21,-2.3 3,-0.6 -2,-0.8 264,-0.1 -0.696 25.2 171.7 -93.1 108.5 -13.7 -12.5 -33.4 70 110 A E G > + 0 0 0 264,-2.2 3,-0.9 -2,-0.9 -1,-0.2 0.323 60.7 85.1 -97.0 3.4 -12.6 -15.6 -31.6 71 111 A F G 3 S+ 0 0 21 265,-0.2 -1,-0.2 1,-0.2 266,-0.1 0.394 72.9 76.2 -88.7 3.9 -14.1 -18.1 -34.0 72 112 A F G < S+ 0 0 11 -3,-0.6 -1,-0.2 -24,-0.1 -2,-0.1 0.421 72.7 110.1 -89.2 -0.0 -11.0 -17.9 -36.2 73 113 A N S < S- 0 0 3 -3,-0.9 -29,-0.2 -29,-0.1 5,-0.1 -0.269 89.7 -98.0 -67.9 161.9 -9.2 -20.1 -33.8 74 114 A A S S+ 0 0 13 1,-0.3 730,-0.1 -34,-0.2 -1,-0.1 0.946 127.2 34.4 -45.4 -64.8 -8.3 -23.6 -34.7 75 115 A G S S- 0 0 0 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.691 114.4-119.0 -68.1 -18.0 -11.2 -25.2 -33.0 76 116 A G S S+ 0 0 5 1,-0.3 261,-1.1 -6,-0.1 2,-0.3 0.661 80.8 89.0 89.3 15.0 -13.3 -22.1 -33.9 77 117 A S B > S-M 336 0C 0 259,-0.2 3,-1.0 32,-0.1 -1,-0.3 -0.940 84.3-115.7-137.6 166.1 -14.0 -21.1 -30.3 78 118 A V T >> S+ 0 0 7 257,-1.5 3,-1.9 -2,-0.3 4,-0.7 0.804 108.4 73.9 -69.6 -22.4 -12.4 -19.0 -27.6 79 119 A K H 3> S+ 0 0 29 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.784 75.6 76.8 -66.2 -23.5 -12.0 -22.2 -25.5 80 120 A D H <> S+ 0 0 1 -3,-1.0 4,-1.8 1,-0.2 -1,-0.3 0.822 92.9 55.8 -56.4 -32.1 -9.1 -23.3 -27.8 81 121 A R H <> S+ 0 0 13 -3,-1.9 4,-2.2 -4,-0.3 5,-0.2 1.000 110.0 40.0 -60.8 -62.0 -7.1 -20.8 -25.9 82 122 A I H X S+ 0 0 1 -4,-0.7 4,-2.2 1,-0.2 -2,-0.2 0.742 111.8 58.9 -67.0 -21.3 -7.6 -22.1 -22.5 83 123 A S H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.997 108.7 43.0 -64.7 -57.6 -7.4 -25.6 -23.6 84 124 A L H X S+ 0 0 21 -4,-1.8 4,-2.8 1,-0.2 3,-0.4 0.926 117.0 46.4 -56.2 -55.6 -3.9 -25.2 -25.0 85 125 A R H X S+ 0 0 11 -4,-2.2 4,-3.0 1,-0.3 5,-0.4 0.913 109.4 54.1 -49.7 -53.4 -2.7 -23.2 -22.0 86 126 A M H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.3 -1,-0.3 0.874 112.8 44.2 -56.1 -38.1 -4.2 -25.6 -19.5 87 127 A I H X S+ 0 0 1 -4,-2.4 4,-1.4 -3,-0.4 -1,-0.3 0.944 112.5 49.9 -71.5 -47.0 -2.4 -28.5 -21.0 88 128 A E H >X S+ 0 0 39 -4,-2.8 4,-1.8 1,-0.2 3,-0.7 0.934 112.9 46.4 -60.5 -48.5 0.9 -26.8 -21.5 89 129 A D H 3X S+ 0 0 15 -4,-3.0 4,-2.2 1,-0.3 3,-0.4 0.946 110.3 55.1 -54.2 -46.4 1.0 -25.6 -17.9 90 130 A A H 3<>S+ 0 0 7 -4,-2.0 6,-2.4 -5,-0.4 5,-0.5 0.745 106.8 51.3 -61.1 -24.9 -0.1 -29.1 -16.9 91 131 A E H X<5S+ 0 0 61 -4,-1.4 3,-0.5 -3,-0.7 -1,-0.3 0.833 107.3 51.8 -79.5 -34.4 2.9 -30.4 -18.8 92 132 A R H 3<5S+ 0 0 121 -4,-1.8 -2,-0.2 -3,-0.4 -3,-0.1 0.900 105.5 54.7 -68.2 -41.3 5.3 -28.1 -17.0 93 133 A D T 3<5S- 0 0 119 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.636 108.4-126.3 -65.8 -15.8 4.1 -29.1 -13.6 94 134 A G T < 5S+ 0 0 45 -3,-0.5 -3,-0.1 -5,-0.2 -1,-0.1 0.450 81.3 118.0 79.0 0.1 4.9 -32.7 -14.5 95 135 A T < + 0 0 66 -5,-0.5 2,-0.7 -6,-0.2 -4,-0.2 0.891 66.7 54.8 -63.5 -39.8 1.3 -33.4 -13.6 96 136 A L S S- 0 0 7 -6,-2.4 -1,-0.2 -9,-0.2 -2,-0.2 -0.853 70.7-171.3-107.1 107.9 0.4 -34.5 -17.1 97 137 A K > - 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