==== 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 HYDROLASE 12-MAY-07 2PWR . COMPND 2 MOLECULE: GAG-POL POLYPROTEIN (PR160GAG-POL); . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR B.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) . 9665.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 66.7 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 . 25 12.6 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 2 3 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 81 0, 0.0 198,-2.1 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 163.0 29.0 -4.1 -18.2 2 2 A Q E -A 198 0A 138 196,-0.2 2,-0.6 194,-0.0 196,-0.2 -0.980 360.0-156.5-112.6 121.6 28.8 -6.4 -21.1 3 3 A I E -A 197 0A 29 194,-3.6 194,-2.1 -2,-0.5 0, 0.0 -0.895 4.7-142.1-111.6 120.6 27.8 -9.8 -20.0 4 4 A T - 0 0 55 -2,-0.6 3,-0.1 192,-0.2 192,-0.1 -0.244 5.3-144.3 -66.2 157.6 28.7 -12.9 -22.1 5 5 A L S S+ 0 0 2 190,-0.4 186,-0.2 1,-0.1 -1,-0.1 0.226 75.6 101.3-114.0 13.9 26.2 -15.8 -22.4 6 6 A W S S+ 0 0 179 185,-0.1 2,-0.3 184,-0.1 -1,-0.1 0.841 96.9 24.4 -56.0 -34.6 28.8 -18.5 -22.4 7 7 A Q S S- 0 0 122 -3,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.853 111.6 -74.5-122.3 168.0 27.8 -19.0 -18.8 8 8 A R - 0 0 103 -2,-0.3 2,-2.1 1,-0.1 119,-0.1 -0.388 49.9-117.7 -60.8 134.4 24.7 -18.2 -17.0 9 9 A P + 0 0 4 0, 0.0 15,-2.9 0, 0.0 2,-0.4 -0.516 48.6 172.5 -78.8 78.1 24.6 -14.4 -16.4 10 10 A L E +D 23 0B 70 -2,-2.1 2,-0.3 13,-0.2 13,-0.2 -0.761 4.3 175.0 -91.1 133.5 24.6 -14.5 -12.7 11 11 A V E -D 22 0B 16 11,-2.8 11,-2.8 -2,-0.4 2,-0.4 -0.890 32.3-108.7-133.2 163.0 25.0 -11.4 -10.7 12 12 A T E -D 21 0B 89 -2,-0.3 55,-1.6 9,-0.2 2,-0.3 -0.785 36.6-174.8 -90.3 135.8 25.0 -10.3 -7.1 13 13 A I E -DE 20 66B 2 7,-3.2 7,-2.6 -2,-0.4 2,-0.4 -0.904 18.8-142.9-122.6 161.0 22.0 -8.4 -5.9 14 14 A K E +DE 19 65B 95 51,-2.3 51,-2.5 -2,-0.3 2,-0.3 -0.995 31.0 158.1-122.8 124.2 21.2 -6.7 -2.7 15 15 A I E > -DE 18 64B 2 3,-2.5 3,-2.3 -2,-0.4 49,-0.1 -0.980 66.1 -2.6-149.6 132.3 17.6 -6.8 -1.5 16 16 A G T 3 S- 0 0 51 47,-0.5 3,-0.1 -2,-0.3 21,-0.1 0.820 129.6 -58.0 55.3 30.5 16.0 -6.5 1.9 17 17 A G T 3 S+ 0 0 65 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.529 115.5 117.2 79.7 5.2 19.5 -6.1 3.3 18 18 A Q E < -D 15 0B 77 -3,-2.3 -3,-2.5 2,-0.0 2,-0.5 -0.838 60.5-138.5-109.2 143.5 20.5 -9.5 1.9 19 19 A L E +D 14 0B 136 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.920 35.1 168.8 -99.1 127.5 23.1 -10.3 -0.7 20 20 A K E -D 13 0B 31 -7,-2.6 -7,-3.2 -2,-0.5 2,-0.4 -0.873 35.0-120.9-134.0 162.0 21.9 -12.9 -3.2 21 21 A E E +D 12 0B 119 -2,-0.3 2,-0.3 -9,-0.2 62,-0.3 -0.898 37.5 175.8 -99.0 133.9 22.9 -14.4 -6.5 22 22 A A E -D 11 0B 1 -11,-2.8 -11,-2.8 -2,-0.4 2,-0.4 -0.981 29.1-118.7-145.5 155.2 20.5 -14.0 -9.3 23 23 A L E -Df 10 84B 2 60,-2.7 62,-3.1 -2,-0.3 2,-0.8 -0.760 22.7-129.6 -94.7 127.9 20.2 -14.8 -13.0 24 24 A L E - f 0 85B 0 -15,-2.9 2,-0.6 -2,-0.4 62,-0.2 -0.731 38.4-175.2 -77.4 111.0 19.6 -12.0 -15.5 25 25 A D > + 0 0 16 60,-2.9 3,-0.9 -2,-0.8 62,-0.3 -0.903 28.4 180.0-124.8 103.3 16.7 -13.5 -17.3 26 26 A T T 3 S+ 0 0 0 -2,-0.6 98,-0.1 1,-0.2 -1,-0.1 0.586 85.4 62.2 -77.6 -11.4 15.2 -11.9 -20.3 27 27 A G T 3 S+ 0 0 14 81,-0.1 2,-0.6 96,-0.1 -1,-0.2 0.609 88.1 85.2 -83.9 -16.0 12.6 -14.7 -20.6 28 28 A A < - 0 0 18 -3,-0.9 59,-3.1 57,-0.2 60,-0.3 -0.779 62.9-160.2 -91.1 120.8 11.2 -13.8 -17.2 29 29 A D S S+ 0 0 62 -2,-0.6 59,-1.6 57,-0.2 2,-0.3 0.917 79.3 23.2 -62.0 -40.9 8.5 -11.0 -17.3 30 30 A D S S- 0 0 40 57,-0.2 2,-0.2 56,-0.1 57,-0.2 -0.852 89.6 -97.3-127.9 158.4 9.1 -10.4 -13.6 31 31 A T E -g 75 0B 0 43,-0.6 45,-2.5 -2,-0.3 2,-0.4 -0.551 36.9-168.2 -71.5 135.8 11.7 -11.0 -11.0 32 32 A V E -gH 76 84B 10 52,-2.1 52,-3.2 -2,-0.2 2,-0.3 -0.988 5.2-176.8-137.5 120.4 11.3 -14.1 -8.9 33 33 A L E -g 77 0B 0 43,-3.3 45,-2.4 -2,-0.4 47,-0.2 -0.873 31.4 -99.2-118.9 153.3 13.3 -14.8 -5.7 34 34 A E S S- 0 0 80 -2,-0.3 -1,-0.1 43,-0.2 50,-0.0 -0.116 71.1 -55.9 -56.4 159.6 13.5 -17.7 -3.3 35 35 A E S S+ 0 0 109 43,-0.3 2,-0.3 42,-0.1 -1,-0.2 -0.103 79.0 137.6 -50.4 131.8 11.6 -17.4 -0.1 36 36 A M - 0 0 14 -3,-0.2 2,-0.4 2,-0.0 -3,-0.1 -0.956 53.1 -95.4-164.5 161.2 12.4 -14.3 1.9 37 37 A S + 0 0 100 -2,-0.3 0, 0.0 -21,-0.1 0, 0.0 -0.739 38.9 179.6 -85.0 138.8 10.7 -11.7 3.9 38 38 A L - 0 0 18 -2,-0.4 2,-0.1 2,-0.1 24,-0.0 -0.982 27.5-109.0-136.0 155.1 9.9 -8.4 2.2 39 39 A P S S+ 0 0 96 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.413 71.1 18.4 -79.0 153.6 8.1 -5.3 3.5 40 40 A G S S- 0 0 66 -2,-0.1 -2,-0.1 19,-0.1 2,-0.1 -0.306 95.6 -25.0 94.7-173.9 4.7 -4.2 2.6 41 41 A R - 0 0 88 -2,-0.1 19,-0.5 19,-0.1 2,-0.3 -0.369 55.1-177.4 -72.3 154.5 1.6 -5.6 1.1 42 42 A W E -I 59 0B 129 17,-0.2 17,-0.2 -2,-0.1 15,-0.0 -0.957 12.8-156.3-144.7 164.4 1.6 -8.6 -1.2 43 43 A K E -I 58 0B 121 15,-1.4 15,-2.9 -2,-0.3 2,-0.1 -0.989 29.7-102.6-138.8 149.9 -0.8 -10.6 -3.2 44 44 A P E +I 57 0B 80 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.334 39.7 171.9 -74.6 152.1 -0.6 -14.1 -4.5 45 45 A K E -I 56 0B 75 11,-2.3 11,-3.1 -2,-0.1 2,-0.4 -0.974 25.2-136.0-147.3 156.1 0.2 -15.1 -8.0 46 46 A M E +I 55 0B 118 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.980 22.9 179.1-115.4 134.5 1.0 -18.2 -10.0 47 47 A I E +I 54 0B 34 7,-2.2 7,-2.7 -2,-0.4 2,-0.3 -0.940 9.3 165.0-130.3 155.6 3.8 -18.3 -12.4 48 48 A G E +I 53 0B 33 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.930 17.8 149.8-159.6-179.8 4.9 -21.1 -14.5 49 49 A G E > +I 52 0B 21 3,-1.6 3,-2.5 -2,-0.3 100,-0.1 -0.871 69.0 9.1 171.4-152.7 6.8 -22.5 -17.4 50 50 A I T 3 S+ 0 0 21 -2,-0.3 101,-2.1 1,-0.3 102,-0.7 -0.314 131.6 19.5 -55.6 130.7 8.5 -25.9 -18.0 51 51 A G T 3 S- 0 0 38 100,-0.3 -1,-0.3 99,-0.2 2,-0.3 0.273 121.4 -86.9 92.6 -6.9 7.5 -28.3 -15.3 52 52 A G E < -I 49 0B 26 -3,-2.5 -3,-1.6 100,-0.1 2,-0.3 -0.716 58.1 -37.5 115.4-165.5 4.5 -26.3 -14.2 53 53 A F E -I 48 0B 146 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.785 35.1-164.8-113.0 150.2 3.4 -23.5 -11.9 54 54 A I E -I 47 0B 22 -7,-2.7 -7,-2.2 -2,-0.3 2,-0.4 -0.936 24.3-118.1-127.2 154.7 4.3 -22.3 -8.5 55 55 A K E +I 46 0B 133 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.784 37.4 176.1 -91.9 137.4 2.6 -19.9 -6.2 56 56 A V E -I 45 0B 2 -11,-3.1 -11,-2.3 -2,-0.4 2,-0.5 -0.883 31.2-116.9-133.0 163.4 4.4 -16.8 -5.3 57 57 A R E -IJ 44 77B 47 20,-2.6 20,-2.3 -2,-0.3 2,-0.7 -0.922 27.2-143.2-103.2 128.1 3.8 -13.6 -3.3 58 58 A Q E -IJ 43 76B 26 -15,-2.9 -15,-1.4 -2,-0.5 2,-0.5 -0.827 19.2-178.6 -96.2 114.0 3.9 -10.5 -5.3 59 59 A Y E -IJ 42 75B 10 16,-2.7 16,-2.6 -2,-0.7 3,-0.3 -0.941 12.0-155.0-107.0 130.6 5.4 -7.5 -3.6 60 60 A D E + 0 0 74 -19,-0.5 14,-0.2 -2,-0.5 -19,-0.1 -0.675 65.8 25.1-104.0 165.0 5.5 -4.2 -5.5 61 61 A Q E S+ 0 0 170 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.895 77.9 160.2 55.8 48.2 7.8 -1.2 -5.3 62 62 A I E - J 0 73B 11 11,-2.5 11,-2.2 -3,-0.3 2,-0.4 -0.824 38.1-128.6-101.3 135.8 10.7 -3.1 -3.8 63 63 A L E + J 0 72B 60 -2,-0.4 -47,-0.5 9,-0.2 2,-0.4 -0.704 31.4 173.8 -84.5 128.3 14.2 -1.7 -4.0 64 64 A I E -EJ 15 71B 1 7,-2.9 7,-2.4 -2,-0.4 2,-0.5 -0.972 22.7-146.5-130.3 144.2 16.8 -4.0 -5.4 65 65 A E E -EJ 14 70B 70 -51,-2.5 -51,-2.3 -2,-0.4 2,-0.5 -0.992 16.6-174.8-111.0 127.1 20.4 -3.2 -6.1 66 66 A I E > S-EJ 13 69B 0 3,-2.9 3,-2.1 -2,-0.5 -53,-0.2 -0.973 73.7 -23.6-121.9 109.4 21.8 -5.1 -9.2 67 67 A C T 3 S- 0 0 52 -55,-1.6 -1,-0.2 -2,-0.5 3,-0.1 0.909 127.5 -50.1 53.9 44.5 25.4 -4.6 -9.8 68 68 A G T 3 S+ 0 0 62 1,-0.2 2,-0.6 -3,-0.0 -1,-0.3 0.426 114.8 122.0 75.1 -2.4 25.4 -1.3 -8.0 69 69 A H E < - J 0 66B 65 -3,-2.1 -3,-2.9 2,-0.0 2,-0.2 -0.833 56.7-141.8 -99.7 125.6 22.4 -0.2 -10.0 70 70 A K E + J 0 65B 167 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.496 27.1 170.3 -82.0 145.2 19.4 0.7 -7.9 71 71 A A E - J 0 64B 6 -7,-2.4 -7,-2.9 -2,-0.2 2,-0.4 -0.994 22.3-148.3-154.1 148.1 16.1 -0.3 -9.3 72 72 A I E + J 0 63B 96 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.949 41.6 102.9-119.4 134.6 12.5 -0.4 -8.0 73 73 A G E - 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