==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-JUL-07 2QNP . COMPND 2 MOLECULE: GAG-POL POLYPROTEIN (PR160GAG-POL); . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR J.BOETTCHER,A.BLUM,A.HEINE,W.E.DIEDERICH,G.KLEBE . 198 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9842.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 64.6 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 . 72 36.4 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 . 22 11.1 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 . 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 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 3 2 0 0 2 1 3 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 75 0, 0.0 198,-2.0 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 165.9 -0.7 38.7 -5.0 2 2 A Q E -A 198 0A 142 196,-0.2 2,-0.6 197,-0.2 196,-0.2 -0.982 360.0-157.6-109.9 116.4 -0.6 36.4 -2.0 3 3 A I E -A 197 0A 30 194,-3.4 194,-2.2 -2,-0.5 2,-0.0 -0.884 5.0-140.7-109.9 125.4 0.5 32.9 -3.1 4 4 A T - 0 0 61 -2,-0.6 3,-0.2 192,-0.2 192,-0.1 -0.291 5.6-143.8 -71.9 157.2 -0.2 29.8 -1.1 5 5 A L S S+ 0 0 2 190,-0.4 186,-0.2 1,-0.1 -1,-0.1 0.261 77.1 99.8-111.4 14.4 2.2 27.0 -0.7 6 6 A W S S+ 0 0 185 185,-0.1 2,-0.3 184,-0.1 -1,-0.1 0.807 97.1 25.6 -61.8 -30.7 -0.3 24.2 -0.7 7 7 A Q S S- 0 0 122 -3,-0.2 0, 0.0 180,-0.0 0, 0.0 -0.855 110.7 -75.4-122.9 165.3 0.7 23.8 -4.4 8 8 A R - 0 0 111 -2,-0.3 2,-1.9 1,-0.1 119,-0.1 -0.406 50.4-117.0 -58.9 134.2 3.9 24.6 -6.3 9 9 A P + 0 0 3 0, 0.0 15,-2.8 0, 0.0 2,-0.4 -0.526 48.9 171.1 -78.7 79.7 4.0 28.4 -6.8 10 10 A L E +D 23 0B 71 -2,-1.9 2,-0.3 13,-0.2 13,-0.2 -0.749 4.0 172.3 -93.6 137.0 3.9 28.4 -10.6 11 11 A V E -D 22 0B 14 11,-2.6 11,-2.6 -2,-0.4 2,-0.4 -0.897 34.1-101.4-136.8 165.5 3.5 31.6 -12.5 12 12 A T E -D 21 0B 86 -2,-0.3 55,-2.5 9,-0.2 2,-0.3 -0.771 37.3-174.2 -90.8 136.9 3.6 32.8 -16.1 13 13 A I E -DE 20 66B 2 7,-2.9 7,-2.3 -2,-0.4 2,-0.4 -0.883 17.1-144.9-123.0 156.8 6.6 34.6 -17.3 14 14 A K E +DE 19 65B 92 51,-2.4 51,-2.0 -2,-0.3 2,-0.3 -0.998 30.1 156.2-124.0 123.7 7.5 36.3 -20.6 15 15 A I E > +D 18 0B 1 3,-2.4 3,-2.1 -2,-0.4 49,-0.1 -0.973 67.5 0.5-151.0 134.2 11.0 36.1 -21.8 16 16 A G T 3 S- 0 0 54 47,-0.5 3,-0.1 -2,-0.3 21,-0.1 0.826 128.5 -63.0 56.7 33.5 12.5 36.4 -25.3 17 17 A G T 3 S+ 0 0 73 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.566 113.8 118.3 63.4 15.0 8.9 37.1 -26.4 18 18 A Q E < -D 15 0B 77 -3,-2.1 -3,-2.4 2,-0.0 2,-0.5 -0.885 61.3-135.0-105.4 141.7 7.9 33.6 -25.3 19 19 A L E +D 14 0B 131 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.899 36.2 166.2 -93.5 123.9 5.3 32.7 -22.5 20 20 A K E -D 13 0B 36 -7,-2.3 -7,-2.9 -2,-0.5 2,-0.4 -0.875 35.6-118.4-133.3 163.6 6.5 30.0 -20.1 21 21 A E E +D 12 0B 121 -2,-0.3 62,-0.3 -9,-0.2 2,-0.3 -0.870 37.0 175.9-100.6 136.2 5.5 28.6 -16.7 22 22 A A E -D 11 0B 1 -11,-2.6 -11,-2.6 -2,-0.4 2,-0.5 -0.987 28.9-116.5-145.6 156.0 8.1 28.9 -13.9 23 23 A L E -Df 10 84B 3 60,-3.0 62,-3.0 -2,-0.3 2,-0.7 -0.775 21.8-131.4 -92.9 124.1 8.4 28.1 -10.2 24 24 A L E - f 0 85B 0 -15,-2.8 2,-0.6 -2,-0.5 62,-0.2 -0.687 36.6-174.3 -75.8 111.0 8.9 30.9 -7.7 25 25 A D > + 0 0 17 60,-2.8 3,-1.5 -2,-0.7 62,-0.4 -0.859 27.3 179.8-126.8 97.2 11.9 29.4 -5.8 26 26 A T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.684 85.6 61.7 -72.8 -16.7 13.3 31.0 -2.7 27 27 A G T 3 S+ 0 0 19 81,-0.1 2,-0.5 96,-0.1 -1,-0.3 0.478 89.2 86.3 -83.4 -6.6 15.9 28.2 -2.3 28 28 A A < - 0 0 18 -3,-1.5 59,-3.0 57,-0.2 60,-0.2 -0.854 58.0-164.7 -97.9 124.4 17.4 29.1 -5.7 29 29 A D S S+ 0 0 49 -2,-0.5 59,-1.3 57,-0.2 2,-0.3 0.869 78.0 36.6 -62.5 -40.2 20.1 31.8 -5.8 30 30 A D S S- 0 0 48 57,-0.2 2,-0.4 56,-0.1 57,-0.2 -0.801 83.4-111.7-120.8 152.7 19.7 32.1 -9.6 31 31 A T E -g 75 0B 0 43,-0.5 45,-2.6 -2,-0.3 2,-0.4 -0.729 35.9-173.6 -85.2 131.1 17.0 31.9 -12.3 32 32 A V E -gH 76 84B 8 52,-1.8 52,-3.0 -2,-0.4 2,-0.3 -0.989 2.9-176.2-134.7 124.2 17.3 28.8 -14.4 33 33 A L E -g 77 0B 0 43,-2.9 45,-2.3 -2,-0.4 47,-0.2 -0.859 32.0 -97.9-120.9 151.5 15.3 28.0 -17.5 34 34 A E S S- 0 0 87 -2,-0.3 -1,-0.1 43,-0.2 49,-0.0 -0.141 71.2 -53.5 -56.0 162.1 15.1 25.1 -19.9 35 35 A E S S+ 0 0 116 43,-0.2 2,-0.3 45,-0.1 -1,-0.2 -0.097 79.7 135.5 -48.2 127.1 17.0 25.3 -23.2 36 36 A M - 0 0 18 -3,-0.2 2,-0.3 2,-0.0 -3,-0.1 -0.930 54.0 -97.3-161.7 160.8 16.2 28.4 -25.2 37 37 A S + 0 0 102 -2,-0.3 0, 0.0 -21,-0.1 0, 0.0 -0.698 37.6 179.7 -83.8 144.7 18.0 31.1 -27.2 38 38 A L - 0 0 20 -2,-0.3 2,-0.1 2,-0.1 24,-0.0 -0.977 28.4-107.7-139.5 152.1 18.8 34.4 -25.6 39 39 A P S S+ 0 0 93 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.405 71.0 19.3 -77.5 154.3 20.6 37.4 -27.0 40 40 A G S S- 0 0 66 -2,-0.1 2,-0.1 19,-0.1 -2,-0.1 -0.379 94.4 -24.7 98.5-171.8 24.1 38.5 -26.1 41 41 A R - 0 0 89 -2,-0.1 19,-0.6 19,-0.1 2,-0.3 -0.423 55.0-177.8 -81.5 157.2 27.2 37.1 -24.5 42 42 A W E -I 59 0B 131 17,-0.2 17,-0.2 -2,-0.1 15,-0.0 -0.975 14.4-155.6-151.3 158.5 27.2 34.2 -22.1 43 43 A K E -I 58 0B 119 15,-1.4 15,-3.0 -2,-0.3 2,-0.1 -0.966 30.7-103.2-134.2 149.8 29.6 32.1 -20.0 44 44 A P E +I 57 0B 77 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.446 39.2 173.2 -76.4 154.3 29.3 28.6 -18.8 45 45 A K E -I 56 0B 71 11,-2.1 11,-2.8 -2,-0.1 2,-0.4 -0.969 24.1-135.0-147.9 154.1 28.5 27.7 -15.2 46 46 A M E -I 55 0B 99 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.981 20.4-177.2-114.4 135.0 27.7 24.5 -13.2 47 47 A I E +I 54 0B 22 7,-2.3 7,-2.9 -2,-0.4 2,-0.3 -0.943 11.2 171.3-127.2 148.8 24.8 24.4 -10.7 48 48 A G E +I 53 0B 37 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.918 17.8 136.5-154.3 174.3 23.9 21.5 -8.5 49 49 A G E > +I 52 0B 22 3,-1.9 3,-2.2 -2,-0.3 100,-0.1 -0.886 69.1 6.9 175.2-150.3 22.0 20.0 -5.7 50 50 A I T 3 S+ 0 0 19 -2,-0.3 101,-2.2 1,-0.3 102,-0.6 -0.361 131.2 22.5 -55.0 129.8 20.1 16.7 -5.1 51 51 A G T 3 S- 0 0 38 100,-0.2 2,-0.3 99,-0.2 -1,-0.3 0.174 122.0 -88.5 97.9 -18.5 20.9 14.4 -8.1 52 52 A G E < -I 49 0B 24 -3,-2.2 -3,-1.9 100,-0.1 2,-0.3 -0.846 59.5 -37.9 119.4-158.2 24.1 16.2 -9.0 53 53 A F E -I 48 0B 142 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.3 -0.824 36.6-160.4-117.2 150.0 25.1 19.0 -11.2 54 54 A I E -I 47 0B 19 -7,-2.9 -7,-2.3 -2,-0.3 2,-0.4 -0.942 21.1-122.7-126.3 151.5 24.2 20.5 -14.6 55 55 A K E +I 46 0B 138 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.808 36.1 176.0 -90.0 132.9 26.0 22.7 -17.0 56 56 A V E -I 45 0B 3 -11,-2.8 -11,-2.1 -2,-0.4 2,-0.5 -0.841 31.0-118.9-131.0 163.3 24.2 25.9 -17.9 57 57 A R E -IJ 44 77B 50 20,-2.5 20,-2.2 -2,-0.3 2,-0.6 -0.934 27.1-141.8-104.8 129.7 24.9 29.1 -20.0 58 58 A Q E -IJ 43 76B 29 -15,-3.0 -15,-1.4 -2,-0.5 2,-0.5 -0.862 18.0-175.6 -97.6 117.0 24.8 32.3 -18.0 59 59 A Y E -IJ 42 75B 11 16,-2.8 16,-2.9 -2,-0.6 3,-0.3 -0.927 11.5-154.0-109.3 129.8 23.3 35.4 -19.7 60 60 A D E + 0 0 75 -19,-0.6 14,-0.2 -2,-0.5 -19,-0.1 -0.644 66.1 21.8-102.2 161.6 23.4 38.7 -18.0 61 61 A Q E S+ 0 0 162 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.902 77.8 163.2 52.5 51.9 21.1 41.7 -18.2 62 62 A I E - J 0 73B 10 11,-2.6 11,-1.8 -3,-0.3 2,-0.3 -0.847 35.6-128.4-101.9 132.9 18.1 39.9 -19.6 63 63 A L E + J 0 72B 130 -2,-0.4 -47,-0.5 9,-0.2 2,-0.3 -0.586 34.4 171.1 -79.1 136.0 14.7 41.4 -19.6 64 64 A I E - J 0 71B 7 7,-2.3 7,-2.8 -2,-0.3 2,-0.4 -0.981 27.4-146.1-143.8 153.5 11.9 39.3 -18.1 65 65 A E E -EJ 14 70B 12 -51,-2.0 -51,-2.4 -2,-0.3 2,-0.5 -1.000 17.1-169.7-122.8 122.5 8.3 39.7 -17.1 66 66 A I E > S-EJ 13 69B 0 3,-2.6 3,-2.1 -2,-0.4 -53,-0.2 -0.972 71.8 -30.1-123.7 109.7 7.1 37.7 -14.0 67 67 A C T 3 S- 0 0 54 -55,-2.5 -1,-0.1 -2,-0.5 -54,-0.1 0.850 130.2 -43.8 45.9 43.9 3.4 37.6 -13.2 68 68 A G T 3 S+ 0 0 74 -56,-0.2 2,-0.6 1,-0.2 -1,-0.3 0.395 114.4 118.0 82.9 8.5 3.1 41.1 -14.8 69 69 A H E < - J 0 66B 72 -3,-2.1 -3,-2.6 2,-0.0 2,-0.3 -0.905 56.5-139.3-108.9 122.3 6.2 42.6 -13.2 70 70 A K E + J 0 65B 184 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.518 34.0 152.9 -79.3 137.5 9.1 43.8 -15.3 71 71 A A E - J 0 64B 15 -7,-2.8 -7,-2.3 -2,-0.3 2,-0.3 -0.948 31.0-141.2-149.7 174.8 12.6 43.1 -14.2 72 72 A I E + J 0 63B 81 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.998 39.5 112.6-140.6 143.7 16.2 42.6 -15.5 73 73 A G E - 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