==== 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 26-JUN-00 1F7A . COMPND 2 MOLECULE: POL POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR C.A.SCHIFFER . 207 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 36.2 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 . 6 2.9 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 . 25 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.9 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 . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 3 2 0 0 2 2 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 0 2 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,-1.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 161.2 12.1 15.4 28.7 2 2 A Q E -A 198 0A 134 196,-0.2 2,-0.5 194,-0.0 196,-0.2 -0.998 360.0-163.6-123.2 123.6 8.4 15.3 27.8 3 3 A I E -A 197 0A 35 194,-2.9 194,-2.3 -2,-0.5 2,-0.1 -0.945 5.2-150.7-116.4 120.2 7.6 14.4 24.2 4 4 A T - 0 0 76 -2,-0.5 3,-0.3 192,-0.2 192,-0.1 -0.379 13.8-133.1 -79.9 165.8 4.2 15.1 22.6 5 5 A L S S+ 0 0 2 190,-0.5 186,-0.2 1,-0.2 185,-0.1 0.100 71.9 110.2-112.1 23.4 2.9 12.9 19.8 6 6 A W S S+ 0 0 197 185,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.836 93.9 22.4 -62.7 -32.7 1.6 15.5 17.2 7 7 A K S S- 0 0 66 -3,-0.3 0, 0.0 1,-0.0 0, 0.0 -0.825 112.1 -70.2-127.7 166.5 4.6 14.3 15.1 8 8 A R - 0 0 115 -2,-0.3 2,-2.0 1,-0.1 119,-0.1 -0.363 51.1-117.1 -58.9 133.3 6.6 11.1 15.1 9 9 A P + 0 0 4 0, 0.0 15,-2.6 0, 0.0 2,-0.4 -0.484 48.0 169.8 -76.5 78.0 8.8 10.9 18.2 10 10 A L E +D 23 0B 80 -2,-2.0 2,-0.3 13,-0.2 13,-0.2 -0.749 4.1 172.5 -92.1 134.5 12.2 11.0 16.5 11 11 A V E -D 22 0B 14 11,-2.9 11,-3.1 -2,-0.4 2,-0.4 -0.856 33.7-100.4-135.4 170.3 15.3 11.5 18.7 12 12 A T E -D 21 0B 76 -2,-0.3 55,-1.9 9,-0.2 2,-0.3 -0.789 36.4-176.6 -96.7 134.7 19.1 11.4 18.3 13 13 A I E -DE 20 66B 3 7,-2.5 7,-2.3 -2,-0.4 2,-0.5 -0.955 16.2-140.7-129.3 150.5 21.0 8.3 19.4 14 14 A R E +DE 19 65B 112 51,-2.6 51,-2.2 -2,-0.3 2,-0.3 -0.944 26.5 161.6-115.8 128.6 24.7 7.6 19.5 15 15 A I E > -D 18 0B 3 3,-2.8 3,-3.0 -2,-0.5 49,-0.1 -0.973 68.9 -14.2-147.4 129.4 26.2 4.2 18.6 16 16 A G T 3 S- 0 0 75 47,-0.4 3,-0.1 -2,-0.3 48,-0.1 0.766 127.1 -54.2 52.1 29.7 29.8 3.3 17.6 17 17 A G T 3 S+ 0 0 66 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.449 116.7 115.9 86.0 -1.4 30.6 7.0 17.1 18 18 A Q E < -D 15 0B 97 -3,-3.0 -3,-2.8 2,-0.0 2,-0.6 -0.895 54.1-152.0-106.3 129.9 27.7 7.4 14.7 19 19 A L E +D 14 0B 118 -2,-0.5 2,-0.2 -5,-0.2 -5,-0.2 -0.889 24.5 171.6-101.6 121.3 24.7 9.6 15.6 20 20 A K E -D 13 0B 52 -7,-2.3 -7,-2.5 -2,-0.6 2,-0.5 -0.765 34.8-111.0-123.6 170.8 21.4 8.6 14.0 21 21 A E E -D 12 0B 122 -2,-0.2 62,-0.4 -9,-0.2 2,-0.3 -0.898 40.5-178.2-104.5 128.2 17.8 9.6 14.2 22 22 A A E -D 11 0B 1 -11,-3.1 -11,-2.9 -2,-0.5 2,-0.5 -0.956 26.6-119.9-132.8 151.7 15.5 7.0 15.8 23 23 A L E -Df 10 84B 9 60,-2.8 62,-2.8 -2,-0.3 2,-1.0 -0.739 21.5-133.1 -90.5 124.7 11.8 6.5 16.5 24 24 A L E - f 0 85B 0 -15,-2.6 2,-0.6 -2,-0.5 62,-0.1 -0.689 35.5-173.6 -75.6 106.9 10.8 6.0 20.2 25 25 A N > + 0 0 0 60,-2.5 3,-1.7 -2,-1.0 62,-0.3 -0.836 28.9 177.5-117.4 98.8 8.5 3.0 19.6 26 26 A T T 3 S+ 0 0 1 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.606 85.5 65.4 -70.2 -8.4 6.4 1.7 22.5 27 27 A G T 3 S+ 0 0 1 81,-0.1 178,-2.5 96,-0.1 2,-0.4 0.246 88.6 79.8 -96.9 12.2 5.0 -0.8 20.0 28 28 A A B < -L 204 0C 0 -3,-1.7 59,-2.4 176,-0.3 176,-0.3 -0.980 58.4-162.9-122.1 126.8 8.3 -2.5 19.4 29 29 A D S S+ 0 0 18 174,-2.5 59,-1.1 -2,-0.4 2,-0.2 0.869 80.0 36.7 -72.0 -35.8 9.7 -5.1 21.9 30 30 A D S S- 0 0 27 173,-0.3 2,-0.5 57,-0.2 57,-0.1 -0.693 84.5-110.2-116.0 168.1 13.1 -4.8 20.4 31 31 A T - 0 0 1 43,-0.4 45,-3.0 -2,-0.2 2,-0.5 -0.858 33.1-171.7 -99.5 123.9 15.4 -2.1 19.0 32 32 A V E -gH 76 84B 0 52,-1.5 52,-3.6 -2,-0.5 2,-0.3 -0.970 0.4-168.5-123.1 122.9 16.0 -2.3 15.2 33 33 A L E -g 77 0B 4 43,-3.0 45,-1.7 -2,-0.5 47,-0.2 -0.797 29.9-100.1-110.0 151.7 18.5 -0.2 13.4 34 34 A E S S- 0 0 84 -2,-0.3 -1,-0.1 1,-0.2 49,-0.0 -0.153 70.9 -55.9 -59.2 161.4 19.0 0.3 9.7 35 35 A E S S+ 0 0 93 43,-0.3 2,-0.3 45,-0.2 -1,-0.2 -0.142 77.2 150.1 -45.8 123.1 21.9 -1.6 8.1 36 36 A M - 0 0 14 -3,-0.2 2,-1.0 2,-0.0 -3,-0.1 -0.977 48.5-110.4-157.6 145.7 25.2 -0.9 9.9 37 37 A N + 0 0 154 -2,-0.3 -2,-0.0 40,-0.0 0, 0.0 -0.670 36.8 179.8 -85.6 99.8 28.4 -2.8 10.6 38 38 A L - 0 0 18 -2,-1.0 2,-0.2 2,-0.1 -2,-0.0 -0.762 25.5-123.6 -98.5 141.5 28.7 -3.7 14.3 39 39 A P + 0 0 111 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.526 68.2 50.0 -80.9 152.3 31.7 -5.6 15.6 40 40 A G S S- 0 0 60 -2,-0.2 2,-0.1 19,-0.1 -2,-0.1 -0.389 91.5 -50.7 111.6 169.0 31.2 -8.8 17.5 41 41 A K - 0 0 91 -2,-0.1 19,-0.5 19,-0.0 2,-0.3 -0.404 54.0-179.5 -78.1 156.9 29.4 -12.1 17.1 42 42 A W - 0 0 126 17,-0.1 17,-0.2 -2,-0.1 15,-0.0 -0.931 18.2-136.1-148.5 170.2 25.6 -12.2 16.2 43 43 A K E -I 58 0B 47 15,-1.1 15,-2.2 -2,-0.3 2,-0.1 -0.983 27.9-106.4-134.6 144.4 22.8 -14.6 15.6 44 44 A P E +I 57 0B 92 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.396 43.1 172.7 -69.0 145.2 20.1 -14.7 12.9 45 45 A K E -I 56 0B 67 11,-1.8 11,-2.9 -2,-0.1 2,-0.5 -0.991 27.4-138.1-152.3 153.8 16.6 -13.8 14.0 46 46 A M E -I 55 0B 104 -2,-0.3 156,-0.4 9,-0.2 2,-0.4 -0.962 20.6-173.5-115.4 131.4 13.1 -13.2 12.5 47 47 A I E -I 54 0B 0 7,-2.1 7,-2.0 -2,-0.5 2,-0.3 -0.964 11.9-142.8-124.6 144.0 11.0 -10.3 13.8 48 48 A G E +Ij 53 203B 1 154,-2.1 156,-2.4 -2,-0.4 5,-0.2 -0.767 24.2 157.5-110.4 154.3 7.4 -9.6 12.7 49 49 A G E > -I 52 0B 4 3,-2.7 3,-1.2 -2,-0.3 156,-0.2 -0.759 59.1 -53.9-149.6-166.5 5.5 -6.5 12.1 50 50 A I T 3 S+ 0 0 6 156,-0.4 101,-0.1 154,-0.3 3,-0.1 0.805 131.0 34.5 -51.1 -39.5 2.4 -5.2 10.3 51 51 A G T 3 S- 0 0 26 99,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.404 123.6 -82.2-101.3 5.2 3.3 -6.5 6.8 52 52 A G E < -I 49 0B 27 -3,-1.2 -3,-2.7 98,-0.6 2,-0.3 -0.957 63.9 -37.0 134.8-154.1 5.1 -9.8 7.8 53 53 A F E -I 48 0B 103 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.781 38.7-167.2-112.3 155.2 8.5 -10.8 9.0 54 54 A I E -I 47 0B 22 -7,-2.0 -7,-2.1 -2,-0.3 2,-0.4 -0.957 25.5-117.1-135.1 153.7 12.1 -9.8 8.1 55 55 A K E +I 46 0B 145 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.759 39.3 175.4 -92.4 137.8 15.4 -11.4 8.9 56 56 A V E -I 45 0B 4 -11,-2.9 -11,-1.8 -2,-0.4 2,-0.5 -0.878 31.9-113.6-137.4 169.4 17.8 -9.4 11.1 57 57 A R E -IK 44 77B 44 20,-2.8 20,-2.5 -2,-0.3 2,-0.6 -0.926 28.0-145.8-108.0 126.3 21.2 -9.7 12.9 58 58 A Q E -IK 43 76B 44 -15,-2.2 -15,-1.1 -2,-0.5 2,-0.4 -0.832 16.4-176.5 -98.4 119.7 21.1 -9.7 16.7 59 59 A Y E - K 0 75B 11 16,-2.9 16,-2.7 -2,-0.6 3,-0.3 -0.909 13.6-144.9-112.9 141.1 24.0 -8.1 18.5 60 60 A D E + 0 0 86 -19,-0.5 14,-0.2 -2,-0.4 13,-0.1 -0.682 67.3 11.6-107.0 159.2 24.3 -8.2 22.3 61 61 A Q E S+ 0 0 137 -2,-0.2 -1,-0.2 1,-0.2 13,-0.2 0.879 74.6 166.8 45.3 53.8 25.5 -5.7 24.9 62 62 A I E - K 0 73B 20 11,-2.6 11,-1.5 -3,-0.3 2,-0.3 -0.859 35.5-126.8 -99.6 122.9 25.8 -2.8 22.5 63 63 A P E + K 0 72B 91 0, 0.0 -47,-0.4 0, 0.0 2,-0.4 -0.517 34.4 177.8 -69.7 131.1 26.3 0.7 24.2 64 64 A V E - K 0 71B 11 7,-3.0 7,-2.8 -2,-0.3 2,-0.6 -1.000 20.3-152.5-137.6 136.9 23.8 3.2 23.0 65 65 A E E -EK 14 70B 63 -51,-2.2 -51,-2.6 -2,-0.4 2,-0.6 -0.942 10.5-170.7-113.0 118.3 23.2 6.8 24.0 66 66 A I E > S-EK 13 69B 0 3,-3.0 3,-2.1 -2,-0.6 -53,-0.2 -0.915 72.0 -31.5-111.8 108.5 19.7 8.1 23.7 67 67 A C T 3 S- 0 0 58 -55,-1.9 -1,-0.2 -2,-0.6 -54,-0.1 0.932 126.2 -43.8 49.0 55.3 19.3 11.9 24.2 68 68 A G T 3 S+ 0 0 63 1,-0.2 2,-0.4 -56,-0.1 -1,-0.3 0.287 116.7 117.6 77.7 -13.4 22.2 12.1 26.7 69 69 A H E < - 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