==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-SEP-09 3JVW . COMPND 2 MOLECULE: GAG-POL POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 . AUTHOR Y.TIE,I.T.WEBER . 198 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 35.9 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 . 23 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 3.5 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 1 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 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 3 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 90 0, 0.0 198,-2.3 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0-167.3 -0.5 39.0 18.4 2 2 A Q E -A 198 0A 124 196,-0.2 2,-0.6 197,-0.1 196,-0.2 -0.994 360.0-156.8-120.1 119.4 -0.2 36.6 21.4 3 3 A I E -A 197 0A 33 194,-3.7 194,-3.3 -2,-0.5 2,-0.1 -0.879 2.7-158.7-101.2 113.6 1.0 33.2 20.5 4 4 A T - 0 0 71 -2,-0.6 3,-0.3 192,-0.2 192,-0.1 -0.403 16.4-133.7 -82.6 165.8 0.1 30.3 22.9 5 5 A L S S+ 0 0 2 190,-0.4 186,-0.2 1,-0.2 185,-0.1 0.109 72.3 111.6-121.5 26.4 2.2 27.1 22.8 6 6 A W S S+ 0 0 200 185,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.758 94.3 20.4 -60.4 -27.9 -0.4 24.4 22.7 7 7 A K S S- 0 0 152 -3,-0.3 -1,-0.0 180,-0.0 0, 0.0 -0.894 109.9 -68.1-135.8 162.3 0.9 23.9 19.2 8 8 A R - 0 0 96 -2,-0.3 2,-1.8 1,-0.1 119,-0.1 -0.318 50.9-120.4 -48.3 126.6 4.0 24.7 17.1 9 9 A P + 0 0 7 0, 0.0 15,-2.6 0, 0.0 2,-0.4 -0.576 46.1 175.3 -78.3 82.9 4.2 28.5 16.7 10 10 A L E +D 23 0B 75 -2,-1.8 2,-0.3 13,-0.2 13,-0.2 -0.735 3.3 176.4 -90.4 128.9 4.1 28.4 12.9 11 11 A V E -D 22 0B 21 11,-3.7 11,-2.9 -2,-0.4 2,-0.4 -0.904 31.1-109.8-132.5 165.8 3.9 31.7 10.9 12 12 A T E -D 21 0B 84 -2,-0.3 55,-2.5 9,-0.2 2,-0.3 -0.734 38.0-179.5 -92.7 136.7 3.9 32.8 7.3 13 13 A I E -DE 20 66B 0 7,-3.0 7,-2.1 -2,-0.4 2,-0.4 -0.877 21.2-142.7-125.5 165.4 7.0 34.6 6.1 14 14 A K E +DE 19 65B 83 51,-2.0 51,-2.2 -2,-0.3 2,-0.4 -0.986 25.8 166.2-127.6 124.7 8.1 36.2 2.9 15 15 A I E > -DE 18 64B 2 3,-2.7 3,-2.2 -2,-0.4 49,-0.1 -0.999 68.5 -7.0-140.5 135.4 11.8 36.0 1.8 16 16 A G T 3 S- 0 0 52 47,-0.6 -1,-0.1 -2,-0.4 21,-0.1 0.881 129.7 -56.1 45.6 47.5 13.3 36.7 -1.5 17 17 A G T 3 S+ 0 0 54 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.601 115.9 116.9 68.0 7.3 9.8 37.1 -3.0 18 18 A Q E < -D 15 0B 83 -3,-2.2 -3,-2.7 2,-0.0 2,-0.4 -0.908 59.1-138.7-112.4 138.4 8.9 33.6 -1.8 19 19 A L E +D 14 0B 115 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.750 33.1 164.0 -90.7 138.7 6.2 32.8 0.8 20 20 A K E -D 13 0B 29 -7,-2.1 -7,-3.0 -2,-0.4 2,-0.4 -0.967 38.6-112.8-146.6 159.7 7.0 30.1 3.3 21 21 A E E +D 12 0B 120 -2,-0.3 62,-0.4 -9,-0.2 2,-0.3 -0.788 40.2 179.7 -90.7 139.0 5.9 28.6 6.6 22 22 A A E -D 11 0B 1 -11,-2.9 -11,-3.7 -2,-0.4 2,-0.4 -0.989 26.8-122.7-145.2 156.1 8.4 29.0 9.5 23 23 A L E -Df 10 84B 5 60,-2.9 62,-3.1 -2,-0.3 2,-0.7 -0.759 21.8-133.5 -94.3 127.8 8.7 28.2 13.2 24 24 A L E - f 0 85B 0 -15,-2.6 2,-0.6 -2,-0.4 62,-0.2 -0.767 31.8-175.1 -83.6 117.7 9.2 31.0 15.7 25 25 A D > - 0 0 17 60,-3.0 3,-1.1 -2,-0.7 62,-0.4 -0.883 27.5-178.3-124.8 105.9 12.1 29.7 17.9 26 26 A T T 3 S+ 0 0 0 -2,-0.6 98,-0.1 1,-0.2 -1,-0.1 0.650 85.3 66.1 -70.4 -13.2 13.4 31.5 21.1 27 27 A G T 3 S+ 0 0 13 81,-0.1 2,-0.3 96,-0.1 -1,-0.2 0.737 86.3 78.4 -84.9 -14.4 16.0 28.8 21.4 28 28 A A < - 0 0 21 -3,-1.1 59,-2.4 57,-0.2 60,-0.2 -0.772 60.0-156.0 -98.0 144.4 18.0 29.4 18.3 29 29 A D S S+ 0 0 58 -2,-0.3 59,-1.5 57,-0.2 2,-0.3 0.923 79.1 35.0 -72.0 -52.0 20.6 32.2 17.9 30 30 A D S S- 0 0 51 57,-0.2 2,-0.2 58,-0.1 -1,-0.1 -0.845 85.2-108.7-120.4 141.4 20.4 32.5 14.0 31 31 A T E -g 75 0B 0 43,-0.6 45,-2.7 -2,-0.3 2,-0.4 -0.420 32.5-162.9 -71.0 134.6 17.6 32.2 11.5 32 32 A V E -gH 76 84B 6 52,-2.0 52,-3.3 43,-0.2 2,-0.3 -0.981 6.9-174.7-126.7 128.5 17.8 29.1 9.3 33 33 A I E -g 77 0B 0 43,-2.8 45,-2.5 -2,-0.4 47,-0.2 -0.921 31.0-102.4-124.3 144.4 15.9 28.6 6.0 34 34 A E - 0 0 73 -2,-0.3 -1,-0.0 43,-0.2 49,-0.0 -0.196 65.7 -61.8 -59.6 157.2 15.5 25.6 3.6 35 35 A E S S+ 0 0 106 43,-0.3 2,-0.3 45,-0.2 -1,-0.2 -0.167 79.2 131.9 -51.0 127.8 17.6 25.6 0.4 36 36 A M - 0 0 16 -3,-0.2 2,-0.3 2,-0.0 -3,-0.1 -0.922 56.7 -90.1-161.4 168.6 16.8 28.5 -1.9 37 37 A S + 0 0 103 -2,-0.3 0, 0.0 -21,-0.1 0, 0.0 -0.747 38.6 178.7 -93.2 144.2 18.6 31.2 -3.8 38 38 A L - 0 0 19 -2,-0.3 2,-0.1 2,-0.1 24,-0.0 -0.969 28.2-114.5-135.7 147.0 19.4 34.6 -2.3 39 39 A P S S+ 0 0 104 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.461 71.3 36.4 -79.8 155.2 21.2 37.5 -3.8 40 40 A G S S- 0 0 64 -2,-0.1 -2,-0.1 19,-0.1 2,-0.1 -0.397 93.3 -39.5 105.5-178.1 24.6 38.7 -2.5 41 41 A R - 0 0 238 -2,-0.1 19,-0.5 19,-0.1 2,-0.3 -0.412 53.1-174.6 -83.5 164.2 27.7 37.2 -1.0 42 42 A W - 0 0 135 17,-0.1 17,-0.2 -2,-0.1 -2,-0.0 -0.983 12.8-149.3-154.6 156.3 27.7 34.4 1.4 43 43 A K E -I 58 0B 104 15,-1.6 15,-3.4 -2,-0.3 2,-0.1 -0.943 29.6-101.6-130.9 152.6 30.2 32.4 3.6 44 44 A P E +I 57 0B 83 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.404 41.6 171.5 -74.5 152.3 30.2 28.8 4.8 45 45 A K E -I 56 0B 70 11,-1.5 11,-2.8 -2,-0.1 2,-0.4 -0.979 25.4-138.3-153.8 148.6 29.1 27.9 8.3 46 46 A M E -I 55 0B 109 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.973 19.7-173.8-113.3 133.7 28.4 24.8 10.3 47 47 A I E -I 54 0B 29 7,-2.2 7,-2.9 -2,-0.4 2,-0.4 -0.939 5.6-161.6-127.3 148.0 25.4 24.6 12.7 48 48 A G E +I 53 0B 40 -2,-0.3 5,-0.3 5,-0.3 2,-0.2 -0.963 20.0 141.4-135.2 138.6 24.6 21.8 15.1 49 49 A G E > -I 52 0B 40 3,-3.2 3,-2.3 -2,-0.4 2,-0.1 -0.733 62.1 -21.9-146.7-159.0 21.6 20.6 17.0 50 50 A I T 3 S+ 0 0 34 1,-0.3 101,-1.6 -2,-0.2 102,-0.8 -0.400 132.2 20.8 -50.1 125.4 19.9 17.5 18.0 51 51 A G T 3 S- 0 0 40 100,-0.2 2,-0.3 99,-0.1 -1,-0.3 0.250 123.8 -71.1 97.2 -13.3 21.0 14.9 15.5 52 52 A G E < -I 49 0B 28 -3,-2.3 -3,-3.2 100,-0.1 99,-0.3 -0.853 62.2 -46.2 130.0-168.7 24.2 16.5 14.3 53 53 A F E -I 48 0B 141 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.3 -0.744 37.8-164.1-110.4 153.7 25.6 19.4 12.3 54 54 A I E -I 47 0B 19 -7,-2.9 -7,-2.2 -2,-0.3 2,-0.4 -0.973 23.6-117.1-135.1 151.7 24.8 20.7 8.8 55 55 A K E +I 46 0B 144 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.753 38.7 178.5 -87.1 134.6 26.6 22.9 6.4 56 56 A V E -I 45 0B 4 -11,-2.8 -11,-1.5 -2,-0.4 2,-0.5 -0.872 30.1-120.6-127.2 163.4 24.8 26.2 5.6 57 57 A R E -IJ 44 77B 50 20,-3.1 20,-2.8 -2,-0.3 2,-0.6 -0.954 26.7-142.9-100.3 128.7 25.4 29.4 3.6 58 58 A Q E -IJ 43 76B 36 -15,-3.4 -15,-1.6 -2,-0.5 2,-0.4 -0.828 19.5-177.4 -95.8 120.7 25.5 32.6 5.6 59 59 A Y E - J 0 75B 9 16,-2.5 16,-2.6 -2,-0.6 3,-0.3 -0.918 12.2-149.7-111.0 136.5 23.9 35.6 3.9 60 60 A D E + 0 0 77 -19,-0.5 14,-0.1 -2,-0.4 -19,-0.1 -0.635 68.5 19.9-105.0 165.8 23.9 39.0 5.7 61 61 A Q E S+ 0 0 145 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.845 77.8 160.2 50.3 46.0 21.5 41.9 5.5 62 62 A I E - J 0 73B 17 11,-2.4 11,-1.6 -3,-0.3 2,-0.4 -0.831 34.7-132.9 -98.6 139.9 18.6 39.8 4.1 63 63 A I E + J 0 72B 91 -2,-0.4 -47,-0.6 9,-0.2 2,-0.4 -0.765 25.2 179.5 -96.1 137.4 15.1 41.2 4.5 64 64 A I E -EJ 15 71B 0 7,-2.6 7,-2.2 -2,-0.4 2,-0.6 -0.997 21.9-145.5-133.3 134.3 12.3 39.0 5.8 65 65 A E E -EJ 14 70B 84 -51,-2.2 -51,-2.0 -2,-0.4 2,-0.6 -0.931 20.7-164.7 -99.0 119.6 8.7 39.8 6.4 66 66 A I E > -EJ 13 69B 0 3,-2.7 3,-2.6 -2,-0.6 -53,-0.2 -0.959 68.7 -33.2-117.0 113.1 7.5 37.9 9.4 67 67 A A T 3 S- 0 0 41 -55,-2.5 -1,-0.2 -2,-0.6 -54,-0.1 0.825 128.2 -44.9 42.2 43.8 3.8 37.6 9.9 68 68 A G T 3 S+ 0 0 57 -56,-0.2 2,-0.6 1,-0.2 -1,-0.3 0.351 117.5 114.0 87.2 -2.1 3.5 41.1 8.4 69 69 A H E < - J 0 66B 73 -3,-2.6 -3,-2.7 2,-0.0 -1,-0.2 -0.869 61.7-137.9-103.7 113.7 6.5 42.6 10.4 70 70 A K E + J 0 65B 138 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.383 30.1 168.9 -73.3 146.5 9.5 43.5 8.3 71 71 A A E - 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