==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN, HYDROLASE 27-JUN-00 1F7N . COMPND 2 MOLECULE: POL POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: FELINE IMMUNODEFICIENCY VIRUS; . AUTHOR G.S.PRASAD,E.A.STURA,J.H.ELDER,C.D.STOUT . 234 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14728.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 31.2 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 . 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 . 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 . 35 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 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 . 2 3 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 2 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 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 99 0, 0.0 2,-0.4 0, 0.0 43,-0.1 0.000 360.0 360.0 360.0 163.5 7.1 16.4 43.2 2 2 A I E +A 43 0A 102 41,-0.5 41,-2.5 42,-0.0 2,-0.3 -0.636 360.0 169.9 -82.5 131.9 9.6 18.8 41.7 3 3 A I E -A 42 0A 72 -2,-0.4 2,-0.4 39,-0.2 39,-0.2 -0.909 22.8-148.8-136.0 163.4 9.3 19.4 37.9 4 4 A E E +A 41 0A 125 37,-1.9 37,-1.5 -2,-0.3 3,-0.2 -0.987 60.8 31.0-131.8 138.7 10.9 21.8 35.5 5 5 A G S S- 0 0 44 -2,-0.4 3,-0.2 35,-0.2 35,-0.1 -0.192 75.1-103.9 103.9 165.1 9.1 23.2 32.5 6 6 A D S S+ 0 0 85 32,-0.2 -1,-0.1 1,-0.1 34,-0.1 0.150 87.9 99.5-118.8 20.0 5.5 23.9 31.6 7 7 A G S S+ 0 0 3 -3,-0.2 14,-2.8 31,-0.1 2,-0.4 0.342 75.6 66.8 -87.5 8.2 4.8 20.9 29.4 8 8 A I B S-B 20 0B 15 12,-0.2 2,-0.4 -3,-0.2 12,-0.2 -0.993 72.9-143.2-130.5 137.5 3.0 19.2 32.2 9 9 A L - 0 0 10 10,-2.1 10,-0.4 -2,-0.4 205,-0.1 -0.818 17.8-114.0-110.0 140.9 -0.3 20.2 33.8 10 10 A D - 0 0 56 203,-0.4 2,-0.2 -2,-0.4 9,-0.2 -0.272 38.6-151.4 -58.4 148.5 -1.7 20.0 37.4 11 11 A K - 0 0 57 1,-0.1 2,-0.1 7,-0.1 7,-0.1 -0.704 13.6-102.8-120.8 172.7 -4.6 17.6 37.7 12 12 A R > - 0 0 56 -2,-0.2 3,-0.9 5,-0.2 -1,-0.1 -0.381 36.7-105.8 -86.5 172.6 -7.6 17.3 39.9 13 13 A S T 3 S+ 0 0 126 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 0.844 119.9 54.6 -66.2 -35.4 -7.8 14.8 42.8 14 14 A E T 3 S+ 0 0 139 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.478 91.6 88.2 -80.3 -3.9 -10.2 12.7 40.7 15 15 A D < - 0 0 61 -3,-0.9 -4,-0.1 1,-0.1 3,-0.0 -0.773 64.3-149.5 -98.4 144.8 -7.9 12.3 37.7 16 16 A A S S+ 0 0 68 -2,-0.3 87,-0.5 1,-0.1 2,-0.3 0.861 72.4 27.9 -78.9 -39.0 -5.4 9.6 37.4 17 17 A G S S- 0 0 3 85,-0.1 2,-0.4 -7,-0.0 85,-0.2 -0.822 70.8-112.8-130.7 169.2 -2.7 11.4 35.3 18 18 A Y E - C 0 101B 63 83,-2.4 83,-2.5 -2,-0.3 -8,-0.1 -0.809 38.3-118.1 -96.1 130.5 -1.1 14.7 34.3 19 19 A D E - C 0 100B 22 -2,-0.4 -10,-2.1 -10,-0.4 2,-0.4 -0.436 25.3-150.4 -69.1 139.1 -1.6 15.9 30.8 20 20 A L E -BC 8 99B 0 79,-3.0 78,-2.1 -12,-0.2 79,-1.2 -0.904 9.3-148.4-112.2 138.7 1.6 16.2 28.8 21 21 A L E - C 0 97B 2 -14,-2.8 2,-0.4 -2,-0.4 76,-0.2 -0.738 18.8-111.2-107.7 157.5 1.9 18.8 26.0 22 22 A A - 0 0 0 74,-1.7 73,-3.9 71,-0.3 16,-0.2 -0.740 18.8-148.9 -87.3 129.7 3.9 18.8 22.8 23 23 A A S S+ 0 0 40 14,-2.9 2,-0.3 -2,-0.4 15,-0.1 0.631 76.9 10.3 -73.9 -16.0 6.7 21.3 22.9 24 24 A K S S- 0 0 108 13,-0.4 72,-0.1 69,-0.1 71,-0.1 -0.980 93.8 -75.3-157.0 164.4 6.6 21.9 19.1 25 25 A E - 0 0 103 -2,-0.3 2,-0.4 69,-0.1 68,-0.2 -0.385 47.5-167.2 -65.7 138.7 4.4 21.2 16.1 26 26 A I E -F 92 0C 8 66,-2.4 66,-3.6 -2,-0.1 2,-0.4 -0.991 12.9-164.2-135.7 132.9 4.6 17.7 14.8 27 27 A H E -F 91 0C 96 -2,-0.4 2,-0.4 64,-0.2 64,-0.2 -0.910 10.6-171.8-112.1 139.2 3.5 16.1 11.5 28 28 A L E -F 90 0C 0 62,-2.9 62,-2.4 -2,-0.4 3,-0.1 -0.984 9.6-153.4-136.7 124.8 3.2 12.4 11.2 29 29 A L > - 0 0 102 -2,-0.4 3,-2.4 60,-0.2 55,-0.4 -0.561 50.1 -70.0 -89.6 158.0 2.5 10.4 8.0 30 30 A P T 3 S+ 0 0 58 0, 0.0 55,-0.2 0, 0.0 -1,-0.2 -0.193 124.7 13.7 -47.6 133.8 0.9 7.0 8.2 31 31 A G T 3 S+ 0 0 62 53,-3.2 2,-0.4 55,-0.3 54,-0.1 0.541 94.5 137.5 77.1 8.9 3.3 4.6 9.7 32 32 A E < - 0 0 60 -3,-2.4 52,-1.6 52,-0.2 2,-0.5 -0.741 38.4-156.4 -95.1 138.2 5.8 7.2 11.0 33 33 A V E +G 83 0D 87 -2,-0.4 2,-0.3 50,-0.2 50,-0.2 -0.934 19.3 166.7-111.9 127.4 7.4 7.1 14.4 34 34 A K E -G 82 0D 84 48,-2.4 48,-2.2 -2,-0.5 2,-0.9 -1.000 36.1-127.7-142.3 140.5 8.7 10.3 16.1 35 35 A V E -G 81 0D 94 -2,-0.3 46,-0.3 46,-0.2 -2,-0.0 -0.791 29.1-151.5 -89.5 106.4 9.8 11.1 19.6 36 36 A I E -G 80 0D 0 44,-3.1 44,-3.3 -2,-0.9 2,-0.2 -0.645 9.6-138.2 -80.9 126.3 7.7 14.1 20.6 37 37 A P E -G 79 0D 40 0, 0.0 -14,-2.9 0, 0.0 -13,-0.4 -0.571 19.6-175.2 -85.2 151.4 9.4 16.4 23.2 38 38 A T - 0 0 4 40,-1.2 -32,-0.2 -16,-0.2 -17,-0.2 0.592 33.5-131.2-116.5 -23.7 7.6 17.9 26.1 39 39 A G + 0 0 29 39,-0.5 2,-0.4 1,-0.3 -33,-0.1 0.501 66.9 120.9 82.7 2.9 10.3 20.1 27.6 40 40 A V - 0 0 0 38,-0.4 38,-3.3 -33,-0.1 2,-0.3 -0.807 37.0-179.7-108.0 145.6 9.6 18.7 31.1 41 41 A K E -A 4 0A 73 -37,-1.5 -37,-1.9 -2,-0.4 2,-0.3 -0.855 14.3-173.9-126.2 161.4 11.9 16.9 33.5 42 42 A L E -A 3 0A 9 34,-0.5 2,-0.7 -2,-0.3 -39,-0.2 -0.992 31.9-127.1-158.2 164.5 10.8 15.7 36.9 43 43 A M E -A 2 0A 91 -41,-2.5 -41,-0.5 -2,-0.3 3,-0.1 -0.839 32.2-151.0-115.2 90.0 11.9 14.1 40.2 44 44 A L - 0 0 10 -2,-0.7 3,-0.1 30,-0.4 6,-0.1 -0.284 29.9 -99.7 -58.3 142.6 9.6 11.2 40.6 45 45 A P > - 0 0 51 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.364 47.4 -90.3 -65.5 146.1 9.1 10.4 44.3 46 46 A K T 3 S+ 0 0 178 1,-0.3 3,-0.1 -3,-0.1 -3,-0.0 -0.309 113.8 29.6 -58.1 135.6 11.2 7.6 45.7 47 47 A G T 3 S+ 0 0 32 1,-0.3 59,-2.8 -3,-0.1 2,-0.3 0.442 107.6 85.8 96.1 1.5 9.4 4.3 45.4 48 48 A Y E < -D 105 0B 103 -3,-1.7 -1,-0.3 57,-0.3 2,-0.3 -0.916 52.8-160.6-135.3 159.4 7.4 5.2 42.3 49 49 A W E -D 104 0B 69 55,-2.9 55,-2.4 -2,-0.3 2,-0.4 -0.800 23.7-117.7-128.6 170.5 7.8 5.2 38.5 50 50 A G E -DE 103 70B 0 20,-2.1 20,-3.0 -2,-0.3 2,-0.5 -0.943 16.3-156.0-119.0 137.4 5.8 7.0 35.9 51 51 A L E -DE 102 69B 43 51,-3.3 51,-2.5 -2,-0.4 2,-0.5 -0.937 6.1-151.7-112.9 125.1 3.7 5.5 33.2 52 52 A I E +D 101 0B 7 16,-2.2 2,-0.3 -2,-0.5 49,-0.2 -0.823 27.8 169.2 -92.7 127.5 3.1 7.5 30.0 53 53 A I E -D 100 0B 72 47,-2.4 47,-2.2 -2,-0.5 13,-0.1 -0.971 31.5 -93.4-140.5 155.9 -0.2 6.4 28.5 54 54 A G - 0 0 35 -2,-0.3 2,-0.3 45,-0.2 45,-0.2 -0.156 25.2-129.9 -71.7 160.6 -2.5 7.6 25.8 55 55 A K > - 0 0 46 43,-0.4 4,-2.5 1,-0.1 3,-0.3 -0.813 21.0-124.3-103.9 147.0 -5.4 10.0 25.8 56 56 A S H > S+ 0 0 108 -2,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.808 105.7 59.5 -62.8 -29.8 -8.7 9.0 24.2 57 57 A S H 4 S+ 0 0 67 2,-0.2 -1,-0.2 1,-0.2 41,-0.0 0.917 114.7 32.9 -69.1 -40.9 -8.8 12.1 22.0 58 58 A I H >4>S+ 0 0 9 -3,-0.3 3,-1.9 1,-0.2 5,-1.2 0.878 117.3 55.9 -82.0 -35.1 -5.6 11.4 20.2 59 59 A G H ><5S+ 0 0 36 -4,-2.5 3,-2.4 1,-0.3 -2,-0.2 0.888 99.5 59.7 -61.7 -36.8 -6.0 7.7 20.3 60 60 A S T 3<5S+ 0 0 78 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.560 99.3 61.1 -68.7 -3.4 -9.3 8.0 18.6 61 61 A K T < 5S- 0 0 107 -3,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.344 126.2 -99.8-101.9 2.3 -7.3 9.6 15.8 62 62 A G T < 5S+ 0 0 22 -3,-2.4 23,-2.2 1,-0.3 24,-0.6 0.754 79.4 134.5 87.3 24.3 -5.2 6.5 15.3 63 63 A L E < -H 84 0D 8 -5,-1.2 2,-0.3 21,-0.2 -1,-0.3 -0.888 34.1-165.7-107.9 136.9 -2.2 7.6 17.2 64 64 A D E -H 83 0D 85 19,-2.1 19,-1.7 -2,-0.4 2,-0.5 -0.877 16.8-132.2-122.9 157.4 -0.5 5.3 19.7 65 65 A V E -H 82 0D 21 -2,-0.3 2,-0.2 17,-0.2 17,-0.2 -0.925 24.4-163.8-108.5 128.7 2.1 5.7 22.5 66 66 A L E +H 81 0D 61 15,-2.6 15,-0.6 -2,-0.5 2,-0.2 -0.694 58.7 2.8-108.6 164.0 5.1 3.3 22.5 67 67 A G + 0 0 71 -2,-0.2 -2,-0.1 1,-0.1 13,-0.0 -0.462 65.8 173.3 60.9-129.5 7.5 2.6 25.3 68 68 A G + 0 0 12 1,-0.2 -16,-2.2 -2,-0.2 2,-0.6 0.657 23.0 128.7 105.8 16.7 6.3 4.7 28.2 69 69 A V E -E 51 0B 83 -18,-0.2 2,-0.7 -20,-0.0 -1,-0.2 -0.906 33.4-168.8-113.8 114.1 8.3 3.8 31.3 70 70 A I E -E 50 0B 16 -20,-3.0 -20,-2.1 -2,-0.6 2,-0.2 -0.861 17.3-144.2 -98.0 116.4 9.9 6.6 33.3 71 71 A D > - 0 0 105 -2,-0.7 3,-2.0 -22,-0.2 -27,-0.2 -0.593 19.3-119.3 -82.1 145.4 12.3 5.3 35.8 72 72 A E T 3 S+ 0 0 68 1,-0.3 -28,-0.4 -2,-0.2 -1,-0.1 0.819 112.8 52.2 -50.5 -36.2 12.5 7.0 39.2 73 73 A G T 3 S+ 0 0 54 -30,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.619 82.1 111.2 -79.6 -11.8 16.2 7.8 38.6 74 74 A Y < + 0 0 105 -3,-2.0 -30,-0.4 1,-0.2 -32,-0.2 -0.399 31.9 166.9 -64.7 137.1 15.7 9.4 35.2 75 75 A R + 0 0 131 -32,-0.1 -1,-0.2 -34,-0.1 3,-0.1 0.386 42.4 104.0-127.5 -6.7 16.3 13.2 35.2 76 76 A G S S- 0 0 30 1,-0.2 -34,-0.5 -35,-0.1 2,-0.2 0.036 86.2 -71.5 -65.9-175.4 16.4 13.8 31.5 77 77 A E - 0 0 76 -36,-0.1 2,-0.4 1,-0.1 -36,-0.2 -0.558 51.4-113.0 -81.3 146.3 13.6 15.5 29.6 78 78 A I - 0 0 0 -38,-3.3 -40,-1.2 -2,-0.2 -39,-0.5 -0.636 34.4-171.9 -82.1 132.6 10.4 13.4 29.1 79 79 A G E -G 37 0D 31 -2,-0.4 2,-0.6 -42,-0.2 -11,-0.1 -0.960 16.8-140.5-126.7 143.7 9.6 12.4 25.5 80 80 A V E -G 36 0D 1 -44,-3.3 -44,-3.1 -2,-0.4 2,-0.9 -0.902 12.7-145.1-106.6 120.7 6.5 10.8 24.1 81 81 A I E -GH 35 66D 59 -2,-0.6 -15,-2.6 -15,-0.6 2,-0.3 -0.755 28.3-179.5 -86.8 108.9 7.1 8.2 21.5 82 82 A M E -GH 34 65D 0 -48,-2.2 -48,-2.4 -2,-0.9 2,-0.4 -0.866 14.3-171.7-114.8 144.8 4.2 8.4 19.0 83 83 A I E -GH 33 64D 18 -19,-1.7 -19,-2.1 -2,-0.3 2,-1.0 -0.996 25.0-132.2-133.8 141.2 3.3 6.6 15.9 84 84 A N E + H 0 63D 0 -52,-1.6 -53,-3.2 -55,-0.4 -52,-0.2 -0.807 32.2 167.0 -89.4 103.6 0.6 7.2 13.3 85 85 A V + 0 0 93 -23,-2.2 -22,-0.2 -2,-1.0 -1,-0.2 0.252 51.4 90.3-101.6 10.2 -1.0 3.7 13.0 86 86 A S S S- 0 0 21 -24,-0.6 -55,-0.3 2,-0.2 -24,-0.1 -0.294 86.4-115.5 -92.9-177.1 -3.9 5.2 11.1 87 87 A R S S+ 0 0 237 -57,-0.1 2,-0.3 -2,-0.1 -25,-0.1 0.290 88.8 71.5-106.0 10.7 -4.2 5.6 7.3 88 88 A K S S- 0 0 96 -59,-0.1 -2,-0.2 -26,-0.1 2,-0.1 -0.922 85.0-103.8-127.1 153.3 -4.4 9.4 7.3 89 89 A S - 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