==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-AUG-00 1FIZ . COMPND 2 MOLECULE: BETA-ACROSIN HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR R.TRANTER,J.A.READ,R.JONES,R.L.BRADY . 276 2 6 4 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 31.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 1 3 5 1 2 0 1 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 2 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 16 A V 0 0 1 0, 0.0 2,-0.7 0, 0.0 193,-0.2 0.000 360.0 360.0 360.0 120.7 117.8 45.2 60.1 2 17 A V B -A 193 0A 17 191,-1.8 191,-1.6 154,-0.1 2,-0.2 -0.622 360.0 -0.4 -75.9 117.1 117.7 46.3 63.7 3 18 A G S S+ 0 0 35 -2,-0.7 154,-0.1 141,-0.4 189,-0.1 -0.628 94.2 86.7 98.3-163.6 121.3 46.8 64.8 4 19 A G - 0 0 36 -2,-0.2 -1,-0.2 155,-0.1 154,-0.2 0.226 69.0 -97.1 56.2 166.3 124.2 46.2 62.6 5 20 A M E -B 157 0B 146 152,-0.8 152,-2.3 1,-0.2 2,-0.0 -0.526 42.5 -71.9-116.0 179.0 125.9 48.5 60.1 6 21 A S E -B 156 0B 61 150,-0.2 150,-0.3 -2,-0.2 2,-0.2 -0.289 48.1-121.1 -69.1 159.3 125.8 49.3 56.4 7 22 A A - 0 0 7 148,-2.4 -1,-0.1 58,-0.2 148,-0.1 -0.640 19.2-116.4-102.4 162.9 127.3 46.9 53.9 8 23 A E > - 0 0 129 -2,-0.2 3,-3.2 1,-0.1 4,-0.3 -0.799 43.2 -86.1-100.6 139.4 130.1 47.5 51.4 9 24 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 268,-0.1 -0.008 115.9 13.3 -39.2 129.1 129.5 47.3 47.7 10 25 A G T 3 S+ 0 0 10 106,-0.2 265,-2.7 54,-0.1 266,-0.4 0.360 91.2 117.5 80.7 -5.4 129.9 43.7 46.5 11 26 A A S < S+ 0 0 2 -3,-3.2 54,-0.0 1,-0.2 105,-0.0 0.876 89.9 17.4 -63.2 -34.6 129.8 42.4 50.0 12 27 A W > + 0 0 14 -4,-0.3 3,-2.1 262,-0.1 -1,-0.2 -0.471 68.6 171.6-138.9 73.5 126.6 40.4 49.2 13 28 A P T 3 S+ 0 0 7 0, 0.0 105,-1.8 0, 0.0 50,-0.2 0.406 74.1 63.9 -64.2 -5.0 126.1 40.0 45.5 14 29 A W T 3 S+ 0 0 3 103,-0.2 22,-2.6 105,-0.1 2,-0.3 0.443 74.2 115.8 -97.2 -1.9 123.2 37.5 45.8 15 30 A M E < -I 35 0C 4 -3,-2.1 48,-0.5 20,-0.2 49,-0.4 -0.529 43.9-175.0 -67.5 125.7 121.0 40.1 47.5 16 31 A V E -IJ 34 62C 0 18,-1.9 18,-0.8 -2,-0.3 2,-0.7 -0.937 19.0-139.9-119.9 144.9 117.9 41.0 45.4 17 32 A S E -IJ 33 61C 0 44,-2.1 44,-1.4 -2,-0.4 2,-0.5 -0.889 12.5-149.5-106.9 105.2 115.4 43.6 46.3 18 33 A L E -IJ 32 60C 0 14,-1.9 13,-2.6 -2,-0.7 14,-1.8 -0.625 23.9-165.4 -73.9 122.8 111.8 42.6 45.6 19 34 A Q E -IJ 30 59C 4 40,-2.4 40,-1.9 -2,-0.5 2,-0.6 -0.881 22.6-135.3-117.5 147.7 109.7 45.7 44.7 20 37 A I E -IJ 29 58C 27 9,-3.2 9,-2.7 -2,-0.4 2,-0.7 -0.837 20.4-153.2 -96.6 125.7 106.2 46.6 44.4 21 37AA F E -I 28 0C 23 36,-2.1 2,-0.7 -2,-0.6 7,-0.2 -0.863 2.7-153.1-103.7 104.5 105.4 48.6 41.4 22 37BA M E > > -I 27 0C 65 5,-2.4 5,-0.7 -2,-0.7 3,-0.7 -0.704 6.5-163.0 -75.6 113.6 102.4 50.9 41.6 23 37CA Y T 3 5S+ 0 0 193 -2,-0.7 3,-0.3 1,-0.2 -1,-0.2 0.761 80.0 73.1 -71.5 -25.7 101.2 51.2 38.0 24 37DA H T 3 5S+ 0 0 138 1,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.135 123.2 4.9 -77.7 26.8 99.1 54.3 38.7 25 37EA N T < 5S- 0 0 65 -3,-0.7 -1,-0.2 -2,-0.1 -2,-0.2 0.321 97.6-110.9 168.4 10.7 102.3 56.5 39.0 26 37FA N T 5 + 0 0 86 -4,-0.5 2,-0.3 -3,-0.3 -3,-0.2 0.552 64.1 150.3 48.7 19.6 105.4 54.3 38.1 27 37GA R E < -I 22 0C 102 -5,-0.7 -5,-2.4 43,-0.1 2,-0.4 -0.556 34.2-151.1 -84.6 140.5 106.7 54.3 41.7 28 38 A R E -IK 21 71C 20 43,-0.9 43,-0.7 -2,-0.3 2,-0.5 -0.907 9.3-166.4-109.1 132.4 108.7 51.3 43.0 29 39 A Y E -I 20 0C 58 -9,-2.7 -9,-3.2 -2,-0.4 2,-0.3 -0.950 19.7-132.3-127.1 122.2 108.7 50.2 46.6 30 40 A H E +I 19 0C 4 -2,-0.5 -11,-0.2 -11,-0.2 3,-0.1 -0.495 40.8 153.0 -61.9 119.3 111.1 47.8 48.3 31 41 A T E + 0 0 45 -13,-2.6 166,-0.4 1,-0.3 2,-0.3 0.657 57.7 19.4-123.5 -24.7 109.0 45.4 50.3 32 42 A a E -I 18 0C 5 -14,-1.8 -14,-1.9 166,-0.1 -1,-0.3 -0.941 61.7-128.8-143.9 167.4 111.0 42.2 50.5 33 43 A G E -I 17 0C 1 166,-4.5 12,-0.4 -2,-0.3 2,-0.3 -0.422 26.6-177.3-105.5-176.6 114.4 40.7 50.1 34 44 A G E -I 16 0C 0 -18,-0.8 -18,-1.9 -2,-0.2 2,-0.5 -0.971 22.9-114.1-174.2 165.8 115.4 37.7 48.0 35 45 A I E -IL 15 43C 1 8,-2.5 8,-3.2 -2,-0.3 2,-0.6 -0.946 20.3-132.5-125.9 120.8 118.3 35.4 47.0 36 46 A L E + L 0 42C 0 -22,-2.6 84,-1.2 -2,-0.5 6,-0.2 -0.508 29.9 167.7 -70.4 112.5 119.9 35.1 43.6 37 47 A L E - 0 0 3 4,-2.0 2,-0.3 -2,-0.6 -1,-0.2 0.862 63.0 -27.2 -91.4 -51.1 120.2 31.3 42.8 38 48 A N E > S- L 0 41C 23 3,-1.5 3,-0.7 81,-0.1 -1,-0.3 -0.891 83.5 -62.2-152.6-169.8 121.0 31.7 39.2 39 49 A S T 3 S+ 0 0 36 -2,-0.3 72,-2.0 1,-0.2 3,-0.0 0.673 132.6 18.7 -48.8 -23.9 120.8 33.7 36.1 40 50 A H T 3 S+ 0 0 69 70,-0.2 67,-2.2 1,-0.1 2,-0.4 0.396 110.4 69.3-134.0 2.7 117.0 33.2 36.2 41 51 A W E < -LM 38 106C 13 -3,-0.7 -4,-2.0 65,-0.2 -3,-1.5 -0.957 46.7-170.3-125.3 149.1 115.7 32.2 39.7 42 52 A V E -LM 36 105C 0 63,-1.6 63,-1.8 -2,-0.4 2,-0.4 -0.998 18.7-138.2-133.2 130.2 115.5 34.1 43.0 43 53 A L E +LM 35 104C 0 -8,-3.2 -8,-2.5 -2,-0.4 2,-0.3 -0.729 37.8 152.3 -88.7 136.1 114.6 32.4 46.3 44 54 A T E - M 0 103C 0 59,-2.7 59,-2.9 -2,-0.4 2,-0.3 -0.816 44.7 -76.0-146.5-172.7 112.3 34.3 48.5 45 55 A A - 0 0 0 -12,-0.4 3,-0.4 -2,-0.3 4,-0.4 -0.655 29.7-138.2 -86.8 147.9 109.6 34.2 51.1 46 56 A A S > S+ 0 0 2 -2,-0.3 3,-1.7 1,-0.2 -1,-0.1 0.949 96.3 63.1 -71.7 -46.6 106.1 33.2 50.3 47 57 A H G > S+ 0 0 44 1,-0.3 3,-1.4 2,-0.1 -1,-0.2 0.707 84.8 77.7 -52.9 -20.4 104.3 35.8 52.4 48 58 A a G 3 S+ 0 0 15 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.936 88.0 54.9 -55.2 -48.9 105.8 38.5 50.4 49 59 A F G X S+ 0 0 2 -3,-1.7 3,-1.9 -4,-0.4 -1,-0.2 0.066 73.9 146.3 -77.2 25.6 103.3 38.0 47.5 50 60 A K T < S- 0 0 139 -3,-1.4 -3,-0.0 1,-0.3 -4,-0.0 -0.424 83.6 -8.0 -63.1 132.8 100.1 38.4 49.8 51 61 A N T 3 S+ 0 0 149 1,-0.1 -1,-0.3 -2,-0.1 2,-0.2 0.687 126.6 89.0 50.7 16.6 97.4 40.1 47.8 52 61AA K < + 0 0 56 -3,-1.9 -1,-0.1 1,-0.1 5,-0.0 -0.610 38.0 130.6-140.9 76.8 100.0 40.5 45.2 53 61BA K + 0 0 150 -2,-0.2 2,-0.7 3,-0.0 34,-0.1 0.307 36.1 108.3-115.4 15.5 100.2 37.6 42.9 54 61CA K > - 0 0 152 1,-0.1 3,-3.7 -3,-0.1 4,-0.4 -0.757 69.4-134.3 -90.9 116.4 100.1 39.2 39.5 55 61DA V T 3 S+ 0 0 54 -2,-0.7 29,-0.7 1,-0.3 3,-0.5 0.681 102.9 59.9 -40.0 -17.0 103.5 38.9 37.8 56 61EA T T 3 S+ 0 0 95 1,-0.2 -1,-0.3 27,-0.1 -3,-0.0 0.444 83.4 75.3 -99.4 6.5 103.3 42.6 36.9 57 62 A D S < S+ 0 0 36 -3,-3.7 -36,-2.1 -37,-0.1 2,-0.3 0.387 93.4 73.1 -89.4 1.9 103.0 44.0 40.4 58 63 A W E -J 20 0C 2 -3,-0.5 26,-0.5 -4,-0.4 2,-0.3 -0.880 50.7-177.7-122.8 159.9 106.7 43.4 40.8 59 64 A R E -J 19 0C 36 -40,-1.9 -40,-2.4 -2,-0.3 2,-0.4 -0.992 20.1-142.5-144.0 139.4 110.1 44.6 39.7 60 65 A L E -JN 18 82C 1 22,-2.9 22,-2.5 -2,-0.3 2,-0.6 -0.910 7.8-161.2-109.2 131.9 113.4 43.1 40.7 61 65AA I E -JN 17 81C 6 -44,-1.4 -44,-2.1 -2,-0.4 2,-0.3 -0.939 12.2-177.0-115.3 119.5 116.6 45.0 41.5 62 66 A F E +JN 16 80C 2 18,-2.6 18,-3.5 -2,-0.6 -46,-0.1 -0.802 60.5 26.1-110.4 154.1 120.0 43.2 41.4 63 69 A G S S+ 0 0 10 -48,-0.5 2,-0.2 -2,-0.3 16,-0.2 0.738 87.5 144.1 75.1 27.6 123.5 44.4 42.1 64 70 A A + 0 0 13 -49,-0.4 -1,-0.2 -3,-0.3 3,-0.1 -0.648 32.2 163.8-101.7 158.6 122.3 47.0 44.5 65 71 A N S S+ 0 0 38 1,-0.3 90,-3.7 -2,-0.2 2,-0.5 0.445 78.2 48.5-131.1 -30.1 123.6 48.5 47.8 66 72 A E B -P 154 0D 131 88,-0.2 2,-0.5 2,-0.0 -1,-0.3 -0.956 68.4-172.4-119.3 126.7 121.6 51.6 47.9 67 73 A V - 0 0 14 86,-4.2 2,-0.4 -2,-0.5 -3,-0.0 -0.969 11.2-145.8-123.1 133.1 117.9 51.4 47.4 68 74 A V - 0 0 87 -2,-0.5 3,-0.3 1,-0.1 -38,-0.2 -0.756 19.9-115.8-100.5 141.8 115.5 54.4 47.1 69 75 A W S S- 0 0 137 -2,-0.4 -41,-0.2 1,-0.2 -40,-0.1 0.008 86.4 -11.9 -57.4 176.5 111.9 54.5 48.3 70 75AA G S S+ 0 0 14 -43,-0.1 2,-0.3 -40,-0.1 -1,-0.2 0.346 88.4 165.8 -14.4 101.3 109.2 55.0 45.6 71 75BA S B -K 28 0C 19 -43,-0.7 -43,-0.9 -3,-0.3 -1,-0.1 -0.937 34.3-174.9-132.0 153.2 111.3 55.9 42.6 72 75CA N + 0 0 78 -2,-0.3 -1,-0.1 -45,-0.2 -2,-0.1 0.646 53.6 108.8-114.3 -23.8 110.6 56.0 38.9 73 75DA K S S- 0 0 152 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.211 76.3-110.5 -52.6 139.5 114.1 56.8 37.6 74 75EA P - 0 0 88 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.170 33.2-105.2 -68.5 168.6 115.6 53.8 35.7 75 76 A V - 0 0 33 3,-0.0 6,-0.2 4,-0.0 0, 0.0 -0.868 29.0-146.1-101.6 128.5 118.5 51.9 37.3 76 77 A K > - 0 0 152 -2,-0.5 3,-1.0 1,-0.1 4,-0.1 -0.765 40.1 -52.9 -96.5 138.2 122.0 52.5 35.9 77 78 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.066 117.5 35.4 -45.6 155.3 124.6 49.7 35.8 78 79 A P T 3 S+ 0 0 68 0, 0.0 -14,-0.1 0, 0.0 38,-0.1 -0.980 110.4 80.0 -70.8 -12.6 126.0 47.7 37.4 79 80 A L < - 0 0 48 -3,-1.0 2,-0.3 -16,-0.2 -16,-0.3 -0.163 70.0-156.1 -51.4 138.9 122.5 47.7 39.1 80 81 A Q E -N 62 0C 36 -18,-3.5 -18,-2.6 -3,-0.1 2,-0.4 -0.905 10.3-159.7-122.4 154.0 120.0 45.6 37.2 81 82 A E E +N 61 0C 53 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.989 17.6 175.3-131.6 139.8 116.2 45.7 37.1 82 83 A R E -N 60 0C 34 -22,-2.5 -22,-2.9 -2,-0.4 2,-0.3 -0.934 25.2-118.4-146.2 165.7 114.0 42.9 36.0 83 84 A F E -O 108 0C 101 25,-2.2 25,-2.5 -2,-0.3 2,-0.4 -0.754 31.2-112.9-105.0 154.7 110.5 41.5 35.5 84 85 A V E +O 107 0C 3 -29,-0.7 23,-0.2 -26,-0.5 3,-0.1 -0.682 29.2 174.9 -83.2 126.2 108.8 38.6 37.1 85 86 A E E + 0 0 93 21,-3.7 2,-0.3 -2,-0.4 22,-0.2 0.748 69.8 16.2-100.8 -32.0 108.0 35.8 34.8 86 87 A E E -O 106 0C 77 20,-1.4 20,-1.2 -31,-0.1 2,-0.4 -0.985 51.1-161.3-141.0 150.2 106.8 33.4 37.4 87 88 A I E -O 105 0C 36 -2,-0.3 2,-0.8 18,-0.2 18,-0.2 -0.916 13.6-177.9-127.5 106.7 105.7 33.3 41.0 88 89 A I E -O 104 0C 21 16,-3.0 16,-1.8 -2,-0.4 2,-0.1 -0.795 3.6-172.5-105.5 95.9 105.8 29.8 42.6 89 90 A I E -O 103 0C 41 -2,-0.8 14,-0.2 14,-0.2 2,-0.2 -0.565 44.6 -89.1 -77.4 152.9 104.5 29.9 46.2 90 91 A H > - 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