==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-MAR-05 1Z1R . COMPND 2 MOLECULE: POL POLYPROTEIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.L.MARTIN,J.BEGUN,A.SCHINDELER,W.A.WICKRAMASINGHE, . 198 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9731.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 133 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 36.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 26 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 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 RESIDUES PER ALPHA HELIX . 0 3 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 PARALLEL BRIDGES PER LADDER . 2 0 5 0 0 3 1 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 . 0 0 1 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 1 A P 0 0 87 0, 0.0 198,-1.8 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 179.8 -2.5 7.0 34.7 2 2 A Q E -A 198 0A 133 196,-0.2 2,-0.5 194,-0.0 196,-0.2 -0.977 360.0-162.6-114.9 119.5 1.3 6.4 34.7 3 3 A I E -A 197 0A 31 194,-3.2 194,-2.6 -2,-0.5 2,-0.2 -0.907 4.4-154.9-111.6 124.5 2.2 3.3 32.8 4 4 A T E -A 196 0A 74 -2,-0.5 3,-0.3 192,-0.2 192,-0.1 -0.533 16.6-131.9 -89.6 162.9 5.6 1.6 33.1 5 5 A L S S+ 0 0 1 190,-0.5 186,-0.2 -2,-0.2 185,-0.1 0.120 74.5 106.0-108.7 23.1 7.0 -0.5 30.3 6 6 A W S S+ 0 0 186 185,-0.1 2,-0.3 184,-0.1 -1,-0.2 0.766 93.4 33.8 -70.6 -22.6 8.2 -3.8 31.9 7 7 A K S S- 0 0 68 -3,-0.3 0, 0.0 3,-0.0 0, 0.0 -0.875 111.4 -80.8-125.4 158.6 5.1 -5.3 30.4 8 8 A R - 0 0 110 -2,-0.3 2,-2.4 1,-0.1 119,-0.1 -0.386 46.9-117.8 -58.7 131.7 3.4 -4.5 27.1 9 9 A P + 0 0 5 0, 0.0 15,-2.7 0, 0.0 2,-0.3 -0.440 52.4 164.8 -75.1 76.8 1.2 -1.4 27.6 10 10 A L E +D 23 0B 75 -2,-2.4 2,-0.3 13,-0.2 13,-0.2 -0.750 8.1 173.3 -95.6 140.0 -2.1 -3.2 26.9 11 11 A V E -D 22 0B 15 11,-2.5 11,-2.4 -2,-0.3 2,-0.4 -0.941 34.1-102.9-141.7 164.4 -5.4 -1.5 27.8 12 12 A T E -D 21 0B 72 -2,-0.3 55,-1.9 9,-0.2 2,-0.3 -0.743 38.3-176.0 -91.6 134.6 -9.1 -2.2 27.3 13 13 A I E -DE 20 66B 3 7,-3.2 7,-2.4 -2,-0.4 2,-0.5 -0.866 19.6-138.8-124.9 162.1 -10.8 -0.1 24.7 14 14 A R E +DE 19 65B 117 51,-2.1 51,-2.2 -2,-0.3 2,-0.3 -0.991 31.3 159.6-124.3 122.6 -14.4 0.2 23.7 15 15 A I E > +DE 18 64B 2 3,-2.9 3,-2.6 -2,-0.5 49,-0.1 -0.995 65.9 5.2-143.8 142.0 -15.2 0.5 20.0 16 16 A G T 3 S- 0 0 50 47,-0.5 3,-0.1 -2,-0.3 48,-0.1 0.739 130.6 -61.8 56.7 22.3 -18.4 -0.2 18.0 17 17 A G T 3 S+ 0 0 58 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.452 118.4 105.1 83.9 2.6 -20.0 -0.9 21.4 18 18 A Q E < -D 15 0B 97 -3,-2.6 -3,-2.9 0, 0.0 2,-0.4 -0.823 68.7-120.4-118.1 153.7 -17.7 -3.8 22.1 19 19 A L E +D 14 0B 118 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.764 35.1 165.3 -95.5 137.7 -14.6 -4.2 24.4 20 20 A K E -D 13 0B 38 -7,-2.4 -7,-3.2 -2,-0.4 2,-0.4 -0.940 34.5-117.6-143.7 161.9 -11.2 -5.1 23.0 21 21 A E E +D 12 0B 104 -2,-0.3 62,-0.3 -9,-0.2 2,-0.3 -0.836 37.6 174.7-101.1 139.2 -7.6 -5.2 24.2 22 22 A A E -D 11 0B 0 -11,-2.4 -11,-2.5 -2,-0.4 2,-0.4 -0.991 29.6-117.2-146.3 155.8 -5.1 -2.9 22.4 23 23 A L E -Df 10 84B 4 60,-3.3 62,-3.0 -2,-0.3 2,-0.8 -0.784 23.7-127.7 -95.9 130.3 -1.5 -1.9 22.7 24 24 A L E - f 0 85B 0 -15,-2.7 2,-0.6 -2,-0.4 62,-0.1 -0.689 36.2-171.1 -76.2 112.5 -0.6 1.8 23.3 25 25 A D > + 0 0 18 60,-2.5 3,-1.8 -2,-0.8 62,-0.3 -0.806 25.9 175.8-117.7 93.9 1.9 2.2 20.5 26 26 A T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.703 84.4 62.0 -69.2 -15.9 3.9 5.4 20.3 27 27 A G T 3 S+ 0 0 21 81,-0.1 2,-0.5 96,-0.1 -1,-0.3 0.345 89.8 86.6 -89.2 7.1 5.8 4.0 17.3 28 28 A A < - 0 0 13 -3,-1.8 59,-2.8 57,-0.2 60,-0.2 -0.912 58.4-162.4-111.9 128.4 2.6 3.8 15.3 29 29 A D S S+ 0 0 53 -2,-0.5 59,-1.1 57,-0.2 2,-0.2 0.877 78.1 37.9 -71.0 -34.7 1.2 6.7 13.2 30 30 A D S S- 0 0 65 57,-0.2 2,-0.6 56,-0.1 57,-0.2 -0.616 80.5-113.8-115.9 170.7 -2.2 5.1 13.0 31 31 A T - 0 0 1 43,-0.4 45,-2.7 -2,-0.2 2,-0.5 -0.932 36.3-173.5-104.6 120.1 -4.7 3.1 15.0 32 32 A V E -gH 76 84B 2 52,-1.2 52,-2.7 -2,-0.6 2,-0.3 -0.977 2.4-168.8-123.3 125.8 -5.1 -0.4 13.5 33 33 A I E -g 77 0B 1 43,-3.6 45,-2.6 -2,-0.5 3,-0.1 -0.876 30.6-100.5-116.3 147.5 -7.7 -2.9 14.7 34 34 A E - 0 0 77 -2,-0.3 -1,-0.0 43,-0.2 49,-0.0 -0.279 64.4 -71.9 -60.8 149.6 -8.1 -6.6 13.9 35 35 A E S S+ 0 0 135 43,-0.4 2,-0.3 45,-0.1 -1,-0.2 -0.135 76.8 137.8 -48.7 129.2 -10.7 -7.2 11.3 36 36 A M - 0 0 26 -3,-0.1 2,-0.6 2,-0.0 -3,-0.1 -0.956 57.1 -86.3-162.6 169.8 -14.2 -6.7 12.7 37 37 A N + 0 0 150 -2,-0.3 -2,-0.0 -21,-0.0 0, 0.0 -0.807 44.0 174.3 -92.6 123.0 -17.5 -5.1 11.7 38 38 A L - 0 0 12 -2,-0.6 2,-0.0 2,-0.1 -2,-0.0 -0.966 33.3-111.9-123.5 141.3 -17.8 -1.4 12.4 39 39 A P S S+ 0 0 97 0, 0.0 2,-0.1 0, 0.0 -23,-0.1 -0.366 74.2 44.4 -72.4 155.5 -20.8 0.6 11.3 40 40 A G S S- 0 0 61 19,-0.1 2,-0.2 2,-0.0 -2,-0.1 -0.285 92.2 -52.9 104.9 170.0 -20.4 3.2 8.6 41 41 A K - 0 0 92 -2,-0.1 19,-0.4 19,-0.1 2,-0.3 -0.486 50.6-164.4 -81.0 153.8 -18.7 3.5 5.2 42 42 A W - 0 0 111 -2,-0.2 17,-0.2 17,-0.1 34,-0.0 -0.961 9.8-142.7-138.2 155.9 -15.0 2.7 4.8 43 43 A K E -I 58 0B 47 15,-1.7 15,-2.9 -2,-0.3 2,-0.1 -0.934 28.5-107.4-120.4 142.5 -12.4 3.4 2.1 44 44 A P E +I 57 0B 104 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.455 47.5 166.7 -67.9 140.4 -9.6 1.1 1.0 45 45 A K E -I 56 0B 25 11,-2.2 11,-3.3 -2,-0.1 2,-0.4 -0.963 28.6-137.7-149.5 161.8 -6.2 2.1 2.2 46 46 A M E -I 55 0B 122 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.994 20.8-179.5-127.1 130.8 -2.7 0.7 2.5 47 47 A I E -I 54 0B 17 7,-1.8 7,-2.4 -2,-0.4 2,-0.3 -0.909 16.9-133.1-126.8 156.8 -0.4 1.2 5.4 48 48 A G E +I 53 0B 42 -2,-0.3 5,-0.3 5,-0.2 2,-0.2 -0.770 23.1 168.5-112.9 156.6 3.1 -0.1 6.1 49 49 A G - 0 0 27 3,-2.5 3,-0.5 -2,-0.3 102,-0.1 -0.602 57.8 -61.1-138.9-158.8 4.8 -1.7 9.0 50 50 A I S S+ 0 0 34 1,-0.2 101,-0.1 -2,-0.2 3,-0.1 0.846 132.7 36.4 -63.6 -36.5 8.1 -3.5 9.8 51 51 A G S S- 0 0 26 99,-1.9 2,-0.3 1,-0.3 100,-0.2 0.448 122.7 -79.0-100.4 -0.7 7.5 -6.2 7.3 52 52 A G - 0 0 27 98,-0.7 -3,-2.5 -3,-0.5 2,-0.3 -0.938 63.5 -37.4 140.1-162.6 5.8 -4.4 4.4 53 53 A F E -I 48 0B 144 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.2 -0.776 43.3-173.7-105.5 148.1 2.4 -3.0 3.4 54 54 A I E -I 47 0B 25 -7,-2.4 -7,-1.8 -2,-0.3 2,-0.4 -0.869 28.0-110.7-130.5 165.0 -1.1 -4.4 4.0 55 55 A K E +I 46 0B 156 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.833 39.7 176.4 -99.5 133.7 -4.5 -3.4 2.8 56 56 A V E -I 45 0B 6 -11,-3.3 -11,-2.2 -2,-0.4 2,-0.5 -0.842 32.0-115.9-131.1 168.4 -6.9 -2.0 5.4 57 57 A R E -IJ 44 77B 82 20,-2.8 20,-2.9 -2,-0.3 2,-0.6 -0.918 31.3-142.4-105.1 130.0 -10.4 -0.5 5.6 58 58 A Q E -IJ 43 76B 59 -15,-2.9 -15,-1.7 -2,-0.5 2,-0.4 -0.848 17.2-174.9 -99.7 125.4 -10.4 3.1 6.7 59 59 A Y E - J 0 75B 5 16,-2.7 16,-2.6 -2,-0.6 3,-0.3 -0.959 13.5-150.1-114.9 132.2 -13.2 4.3 9.0 60 60 A D E + 0 0 92 -19,-0.4 14,-0.2 -2,-0.4 13,-0.1 -0.684 66.9 10.6-103.3 157.5 -13.4 8.0 9.9 61 61 A Q E S+ 0 0 162 -2,-0.3 -1,-0.2 1,-0.2 13,-0.2 0.853 78.4 166.8 48.6 45.6 -14.7 9.9 12.9 62 62 A I E - J 0 73B 20 11,-2.7 11,-2.5 -3,-0.3 2,-0.3 -0.792 35.8-126.5 -94.2 130.0 -15.1 6.7 15.0 63 63 A P E + J 0 72B 87 0, 0.0 -47,-0.5 0, 0.0 2,-0.4 -0.581 33.1 177.4 -74.2 128.2 -15.6 7.1 18.8 64 64 A V E -EJ 15 71B 5 7,-3.1 7,-1.7 -2,-0.3 2,-0.6 -0.999 19.2-151.9-135.6 130.5 -13.1 5.0 20.8 65 65 A E E -EJ 14 70B 59 -51,-2.2 -51,-2.1 -2,-0.4 2,-0.6 -0.921 11.8-167.4-105.9 121.2 -12.9 5.0 24.5 66 66 A I E > S-EJ 13 69B 0 3,-3.3 3,-2.3 -2,-0.6 -53,-0.2 -0.930 71.7 -31.8-112.9 110.1 -9.4 4.2 25.8 67 67 A X T 3 S- 0 0 52 -55,-1.9 -1,-0.2 -2,-0.6 -54,-0.1 0.890 127.6 -44.4 47.7 44.3 -9.2 3.4 29.5 68 68 A G T 3 S+ 0 0 53 1,-0.2 2,-0.4 -56,-0.2 -1,-0.3 0.408 117.1 113.5 84.9 -3.7 -12.1 5.7 30.2 69 69 A H E < - J 0 66B 73 -3,-2.3 -3,-3.3 2,-0.0 2,-0.3 -0.860 61.3-130.8-105.3 137.1 -10.9 8.5 28.0 70 70 A K E + J 0 65B 157 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.613 29.0 166.3 -92.0 146.4 -12.8 9.5 24.8 71 71 A A E - J 0 64B 2 -7,-1.7 -7,-3.1 -2,-0.3 2,-0.4 -0.957 16.9-161.9-147.0 153.6 -11.3 9.9 21.4 72 72 A I E + J 0 63B 93 -2,-0.3 2,-0.3 -9,-0.3 -11,-0.1 -0.937 43.0 102.0-141.0 114.0 -13.1 10.2 18.0 73 73 A G E - 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