==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(CARBOXYPEPTIDASE) 08-MAR-94 1YSC . COMPND 2 MOLECULE: SERINE CARBOXYPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.A.ENDRIZZI,S.J.REMINGTON . 421 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16655.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 290 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 24 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.9 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 4 1 1 0 2 2 0 0 1 1 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 1 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 . 4 3 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 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 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 K 0 0 117 0, 0.0 19,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 114.2 63.4 18.4 20.8 2 2 A I - 0 0 69 17,-0.2 17,-0.2 288,-0.0 2,-0.2 -0.949 360.0-168.7-128.8 143.7 61.7 15.7 18.9 3 3 A K - 0 0 44 285,-0.7 15,-1.9 -2,-0.4 285,-0.1 -0.661 25.3-113.0-114.4 171.6 62.5 13.1 16.2 4 4 A D > - 0 0 37 13,-0.2 3,-2.0 -2,-0.2 4,-0.2 -0.865 13.2-133.0-108.7 146.5 60.4 10.9 14.0 5 5 A P T 3 S+ 0 0 10 0, 0.0 12,-0.1 0, 0.0 3,-0.1 0.462 92.2 101.4 -70.4 1.8 60.2 7.1 14.1 6 6 A K T 3 S+ 0 0 90 10,-0.4 11,-0.1 1,-0.2 281,-0.0 0.745 81.0 51.0 -53.8 -29.1 60.6 7.8 10.5 7 7 A I S < S+ 0 0 87 -3,-2.0 -1,-0.2 280,-0.1 277,-0.0 0.831 104.4 64.0 -75.7 -46.1 64.3 6.7 11.4 8 8 A L S S- 0 0 22 -4,-0.2 276,-0.0 -3,-0.1 -4,-0.0 -0.090 88.6-112.5 -72.9 172.3 63.4 3.3 13.3 9 9 A G S S+ 0 0 48 1,-0.0 -1,-0.1 -2,-0.0 67,-0.0 0.990 79.1 102.3 -68.1 -72.9 61.7 0.2 11.7 10 10 A I S S+ 0 0 19 1,-0.1 60,-0.1 60,-0.1 -4,-0.0 0.198 84.6 1.8 25.1-127.6 58.4 0.1 13.4 11 11 A D - 0 0 28 1,-0.2 4,-0.4 68,-0.0 5,-0.4 -0.788 66.5-179.9 -94.9 105.0 55.3 1.3 11.5 12 12 A P > + 0 0 101 0, 0.0 3,-0.9 0, 0.0 4,-0.3 0.808 61.0 37.7 -59.0-115.8 56.1 2.4 7.9 13 13 A N T 3 S+ 0 0 105 1,-0.2 -2,-0.0 2,-0.1 25,-0.0 0.378 107.1 56.2 2.4 -81.3 53.3 3.7 5.6 14 14 A V T 3 S- 0 0 32 22,-0.1 -1,-0.2 1,-0.1 23,-0.1 0.765 104.3-104.6 -34.6 -66.6 51.0 5.8 8.0 15 15 A T < - 0 0 55 -3,-0.9 21,-0.4 -4,-0.4 2,-0.2 0.468 34.2-162.5 124.0 91.3 53.4 8.5 9.5 16 16 A Q - 0 0 17 -5,-0.4 -10,-0.4 -4,-0.3 2,-0.3 -0.610 4.7-170.6 -97.1 157.3 54.7 8.3 13.1 17 17 A Y E +A 34 0A 26 17,-1.3 17,-2.9 -2,-0.2 -13,-0.2 -0.997 10.0 170.7-145.0 136.1 56.3 11.0 15.2 18 18 A T E +A 33 0A 3 -15,-1.9 2,-0.3 -2,-0.3 15,-0.2 -0.734 21.3 86.3-136.3-172.7 58.0 10.8 18.6 19 19 A G E -A 32 0A 0 13,-1.7 13,-2.6 -17,-0.2 2,-0.3 -0.932 64.9 -36.2 126.8-148.3 60.1 12.7 21.1 20 20 A Y E -A 31 0A 17 -19,-0.5 2,-0.4 -2,-0.3 11,-0.2 -0.930 22.4-160.4-129.2 148.7 59.4 15.1 24.1 21 21 A L E -A 30 0A 15 9,-1.3 9,-1.7 -2,-0.3 2,-0.3 -0.990 30.9-151.2-121.0 122.8 57.1 17.9 25.3 22 22 A D E -A 29 0A 77 -2,-0.4 2,-0.5 7,-0.2 7,-0.2 -0.688 16.4-148.9-106.6 160.6 58.7 19.9 28.1 23 23 A V E >> -A 28 0A 29 5,-1.5 4,-2.4 -2,-0.3 5,-1.4 -0.866 13.4-162.7-128.3 95.6 57.4 21.9 31.1 24 24 A E T >45S+ 0 0 95 -2,-0.5 3,-1.0 1,-0.2 -1,-0.2 0.897 81.0 36.9 -33.0 -88.8 59.7 24.9 31.9 25 25 A D T 345S+ 0 0 150 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.747 124.7 41.1 -47.0 -37.7 58.9 26.0 35.4 26 26 A E T 345S- 0 0 23 2,-0.1 -1,-0.3 -3,-0.1 80,-0.2 0.705 99.6-134.7 -91.9 -13.8 58.3 22.5 36.7 27 27 A D T <<5 + 0 0 63 -4,-2.4 78,-0.6 -3,-1.0 2,-0.5 0.917 49.1 151.2 65.7 44.9 61.2 20.9 34.9 28 28 A K E < -AB 23 104A 36 -5,-1.4 -5,-1.5 76,-0.1 2,-0.8 -0.905 33.7-155.5-113.2 132.6 59.3 17.9 33.7 29 29 A H E -AB 22 103A 24 74,-2.7 74,-1.1 -2,-0.5 69,-0.2 -0.743 8.6-163.0-113.2 94.1 60.1 16.0 30.5 30 30 A F E -A 21 0A 7 -9,-1.7 -9,-1.3 -2,-0.8 2,-0.4 -0.412 4.7-156.5 -69.9 142.7 57.2 14.1 29.0 31 31 A F E +A 20 0A 0 63,-0.3 63,-1.7 -11,-0.2 2,-0.3 -0.975 16.8 169.5-122.8 136.6 58.0 11.5 26.4 32 32 A F E -A 19 0A 1 -13,-2.6 -13,-1.7 -2,-0.4 2,-0.2 -0.876 23.7-158.7-139.6 170.0 55.6 10.2 23.7 33 33 A W E -A 18 0A 9 -2,-0.3 59,-0.5 -15,-0.2 -15,-0.2 -0.767 24.7-167.4-153.8 95.1 55.6 8.1 20.6 34 34 A T E -A 17 0A 3 -17,-2.9 -17,-1.3 -2,-0.2 2,-0.3 -0.496 12.5-166.8 -95.4 160.5 52.7 8.7 18.3 35 35 A F B -C 90 0B 4 55,-2.0 55,-0.8 -19,-0.2 2,-0.3 -0.998 17.0-133.3-143.5 137.4 51.2 7.0 15.3 36 36 A E - 0 0 42 -21,-0.4 -21,-0.1 -2,-0.3 -22,-0.1 -0.646 46.3 -76.8 -90.5 146.9 48.7 8.2 12.7 37 37 A S - 0 0 3 -2,-0.3 49,-0.2 8,-0.2 -1,-0.1 -0.074 26.3-136.6 -49.0 137.0 45.8 6.1 11.6 38 38 A R S S+ 0 0 92 47,-2.6 -1,-0.2 50,-0.2 49,-0.2 0.611 104.4 32.0 -66.3 -12.7 46.4 3.2 9.2 39 39 A N S S- 0 0 105 46,-0.4 3,-0.1 1,-0.1 48,-0.1 0.458 134.5 -23.7-108.2-108.9 43.2 4.5 7.6 40 40 A D > - 0 0 79 1,-0.1 4,-1.9 2,-0.0 3,-0.4 -0.929 45.8-167.6-117.5 115.5 42.5 8.3 7.6 41 41 A P T 4 S+ 0 0 22 0, 0.0 48,-0.2 0, 0.0 -1,-0.1 0.864 88.3 62.3 -66.3 -31.7 44.0 10.3 10.4 42 42 A A T 4 S+ 0 0 41 -3,-0.1 -2,-0.0 1,-0.1 0, 0.0 0.847 118.8 23.0 -61.2 -39.3 41.8 13.2 9.6 43 43 A K T 4 S+ 0 0 62 -3,-0.4 96,-0.2 95,-0.1 -1,-0.1 0.902 104.6 91.6 -89.9 -63.3 38.6 11.3 10.3 44 44 A D S < S- 0 0 9 -4,-1.9 45,-0.2 94,-0.1 44,-0.2 0.155 79.7-110.8 -34.9 132.2 39.9 8.7 12.7 45 45 A P - 0 0 6 0, 0.0 44,-1.5 0, 0.0 2,-0.4 0.234 25.2-110.6 -57.2-176.2 39.8 9.5 16.4 46 46 A V E -de 89 140B 1 93,-3.1 95,-3.2 42,-0.2 2,-0.4 -0.949 29.1-158.0-124.0 142.2 42.7 10.2 18.8 47 47 A I E -de 90 141B 13 42,-1.9 44,-3.6 -2,-0.4 2,-0.7 -0.981 15.4-158.7-134.9 134.3 43.8 7.9 21.6 48 48 A L E -de 91 142B 2 93,-2.2 95,-3.2 -2,-0.4 2,-0.4 -0.832 19.0-159.3-103.9 106.3 45.7 8.2 24.8 49 49 A W E - e 0 143B 3 42,-2.5 44,-0.4 -2,-0.7 2,-0.4 -0.765 9.2-171.8 -91.8 135.9 47.1 4.8 26.0 50 50 A L E - e 0 144B 2 93,-2.3 95,-1.9 -2,-0.4 98,-0.2 -0.965 9.0-166.1-132.2 121.0 48.0 4.4 29.6 51 51 A N - 0 0 10 -2,-0.4 4,-0.2 42,-0.3 5,-0.1 -0.368 18.5-138.5 -91.6 169.3 49.8 1.6 31.4 52 52 A G >> + 0 0 3 5,-0.1 4,-2.1 1,-0.1 3,-0.7 0.503 45.3 120.4 -97.8-114.6 49.9 1.2 35.2 53 53 A G T 34 S- 0 0 31 1,-0.4 2,-0.1 2,-0.2 -1,-0.1 -0.811 85.2 -99.8 138.3 -98.6 52.3 0.3 37.8 54 54 A P T 34 S+ 0 0 1 0, 0.0 -1,-0.4 0, 0.0 249,-0.2 0.504 116.6 17.0 -76.2 159.1 52.3 2.4 39.2 55 55 A G T <4 S+ 0 0 0 -3,-0.7 244,-2.0 1,-0.3 2,-0.4 0.845 89.6 137.8 87.8 34.2 55.4 3.7 37.6 56 56 A a B < -L 298 0C 27 -4,-2.1 -1,-0.3 242,-0.2 242,-0.3 -0.916 54.4-111.7-114.8 139.1 55.5 1.5 34.5 57 57 A S - 0 0 0 240,-3.1 3,-0.2 -2,-0.4 4,-0.2 -0.294 13.2-141.9 -66.0 151.0 56.3 2.7 30.9 58 58 A S S >> S+ 0 0 0 1,-0.2 3,-1.9 35,-0.2 4,-1.3 0.678 90.3 82.8 -86.6 -17.9 53.5 2.8 28.3 59 59 A L H 3> S+ 0 0 1 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.835 80.2 71.8 -51.3 -34.5 55.8 1.6 25.4 60 60 A T H 34 S+ 0 0 26 1,-0.3 -1,-0.3 -3,-0.2 5,-0.3 0.871 96.0 45.8 -52.8 -41.5 55.1 -1.8 26.9 61 61 A G H X>>S+ 0 0 0 -3,-1.9 5,-2.4 3,-0.2 4,-2.3 0.936 111.7 57.1 -70.2 -35.5 51.6 -1.7 25.6 62 62 A L H 3<>S+ 0 0 3 -4,-1.3 5,-1.4 1,-0.3 -2,-0.2 0.988 118.8 26.0 -52.9 -74.2 53.0 -0.5 22.3 63 63 A F T 3<5S+ 0 0 5 -4,-2.6 8,-0.6 1,-0.2 -1,-0.3 0.095 131.6 37.5 -81.3 28.7 55.4 -3.4 21.7 64 64 A F T <45S+ 0 0 21 -3,-1.2 -3,-0.2 -5,-0.2 -1,-0.2 0.630 122.6 7.8-149.1 -20.3 53.5 -5.9 23.7 65 65 A E T <5S- 0 0 10 -4,-2.3 -3,-0.2 -5,-0.3 -4,-0.1 0.645 128.5 -3.3-135.6 -35.3 49.8 -5.9 23.6 66 66 A L T - 0 0 8 4,-1.0 3,-4.8 -2,-0.5 4,-0.4 -0.707 46.8-104.5-102.0 156.8 61.5 -10.8 18.6 73 73 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.824 123.7 67.7 -43.4 -36.9 64.7 -12.3 20.1 74 74 A D T 3 S- 0 0 97 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.605 109.2-128.0 -60.2 -16.7 66.2 -10.7 17.1 75 75 A L < + 0 0 47 -3,-4.8 -1,-0.1 1,-0.3 -4,-0.1 0.916 67.9 138.4 59.9 36.8 65.4 -7.3 18.7 76 76 A K - 0 0 115 -4,-0.4 -4,-1.0 1,-0.1 -1,-0.3 -0.956 58.2-106.0-119.3 131.1 63.9 -6.7 15.4 77 77 A P - 0 0 38 0, 0.0 2,-0.3 0, 0.0 -6,-0.1 0.010 31.7-160.4 -52.6 162.2 60.6 -5.1 14.9 78 78 A I - 0 0 76 -8,-0.3 -8,-0.5 -6,-0.0 2,-0.4 -0.995 16.8-119.0-146.9 145.4 57.4 -6.9 14.0 79 79 A G B -M 69 0D 56 -2,-0.3 -10,-0.2 -10,-0.2 -68,-0.0 -0.680 26.0-126.0 -89.5 138.0 54.1 -5.9 12.4 80 80 A N > - 0 0 31 -12,-1.6 3,-1.0 -2,-0.4 -11,-0.1 -0.719 8.2-155.0 -87.9 127.0 51.0 -6.3 14.3 81 81 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.415 98.8 24.8 -73.4 -0.4 48.3 -8.3 12.5 82 82 A Y T 3 S+ 0 0 84 -15,-0.2 326,-0.2 -14,-0.1 4,-0.0 0.007 88.5 173.7-154.9 34.3 45.6 -6.6 14.5 83 83 A S X - 0 0 2 -3,-1.0 3,-0.6 -15,-0.1 -16,-0.2 0.175 35.9-125.5 -48.2 160.5 47.2 -3.2 15.7 84 84 A W G > S+ 0 0 17 -18,-1.7 3,-0.7 1,-0.2 -17,-0.1 0.847 106.9 54.4 -79.5 -34.4 45.2 -0.6 17.5 85 85 A N G > S+ 0 0 3 -19,-0.3 -47,-2.6 1,-0.2 3,-1.5 0.260 71.9 112.8 -84.2 9.2 45.9 2.3 15.3 86 86 A S G < S+ 0 0 29 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.848 101.4 12.0 -48.8 -34.4 44.6 0.2 12.4 87 87 A N G < S+ 0 0 53 -3,-0.7 -1,-0.3 -49,-0.2 2,-0.2 -0.185 130.7 45.3-138.5 41.3 41.7 2.7 12.3 88 88 A A S < S- 0 0 2 -3,-1.5 2,-0.6 -44,-0.2 -50,-0.2 -0.758 77.5-106.4 177.0 137.2 42.9 5.6 14.7 89 89 A T E - d 0 46B 1 -44,-1.5 -42,-1.9 -2,-0.2 2,-0.3 -0.572 44.3-159.2 -73.0 113.5 45.9 7.9 15.6 90 90 A V E -Cd 35 47B 10 -55,-0.8 -55,-2.0 -2,-0.6 2,-0.4 -0.730 11.9-150.2-101.6 147.1 47.4 6.7 19.0 91 91 A I E - d 0 48B 0 -44,-3.6 -42,-2.5 -2,-0.3 2,-0.6 -0.960 2.1-161.7-114.2 127.3 49.6 8.4 21.7 92 92 A F - 0 0 6 -59,-0.5 -34,-0.2 -2,-0.4 -33,-0.1 -0.641 19.2-174.8-111.2 71.4 52.0 6.4 23.9 93 93 A L - 0 0 0 -2,-0.6 2,-0.8 -44,-0.4 -42,-0.3 -0.340 21.6-139.1 -70.9 144.5 52.8 8.7 26.9 94 94 A D - 0 0 0 -63,-1.7 5,-0.4 -37,-0.1 -63,-0.3 -0.738 39.1-165.1-111.5 79.5 55.4 7.9 29.6 95 95 A Q + 0 0 2 -2,-0.8 -39,-0.2 -39,-0.2 2,-0.2 -0.844 48.9 44.7-118.0 150.7 53.9 8.9 32.7 96 96 A P S > S- 0 0 2 0, 0.0 3,-1.7 0, 0.0 2,-0.3 0.493 97.0 -87.2 -79.7-163.5 54.4 9.4 35.4 97 97 A V T 3 S+ 0 0 1 1,-0.3 -2,-0.1 -2,-0.2 7,-0.1 -0.520 116.3 22.5 -70.6 126.7 57.5 11.5 35.5 98 98 A N T 3 S+ 0 0 66 1,-0.4 2,-0.3 -2,-0.3 -1,-0.3 0.476 97.3 130.6 93.6 8.1 60.7 9.4 35.6 99 99 A V S X S- 0 0 1 -3,-1.7 3,-2.7 -5,-0.4 -1,-0.4 -0.701 77.4 -35.6 -93.4 145.0 58.8 6.6 34.0 100 100 A G T 3 S- 0 0 12 197,-0.4 196,-0.5 196,-0.3 -43,-0.1 -0.262 134.5 -15.7 47.6 -98.8 60.1 4.6 31.0 101 101 A F T 3 S+ 0 0 5 -2,-0.4 -1,-0.3 194,-0.1 190,-0.1 0.584 113.7 98.4-107.3 -18.7 61.7 7.5 29.1 102 102 A S < + 0 0 3 -3,-2.7 2,-0.3 -6,-0.2 -72,-0.2 -0.120 51.2 166.9 -65.5 172.2 60.3 10.6 30.8 103 103 A Y E -B 29 0A 60 -74,-1.1 -74,-2.7 -5,-0.1 2,-0.3 -0.981 22.6-174.3-168.9-178.6 62.4 12.3 33.5 104 104 A S E -B 28 0A 17 -2,-0.3 -76,-0.1 -76,-0.2 3,-0.1 -0.952 29.9-126.8-177.0 167.7 63.1 15.2 35.7 105 105 A G S S+ 0 0 68 -78,-0.6 2,-0.2 -2,-0.3 -1,-0.1 0.814 94.7 1.9 -98.3 -35.5 65.7 16.5 38.2 106 106 A S S S+ 0 0 95 -79,-0.3 -1,-0.2 -80,-0.2 2,-0.0 -0.721 83.8 121.3-155.0 96.9 63.4 17.2 41.2 107 107 A S - 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