==== 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 11-MAY-07 2PWC . 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) . 9671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 62.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 6.1 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 . 19 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 3.0 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 . 0 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 . 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 79 0, 0.0 198,-1.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 158.9 0.7 4.2 -5.0 2 2 A Q E -A 198 0A 142 196,-0.2 2,-0.6 197,-0.1 196,-0.2 -0.991 360.0-156.1-111.5 122.9 0.5 6.5 -1.9 3 3 A I E -A 197 0A 31 194,-3.6 194,-2.3 -2,-0.5 2,-0.0 -0.892 3.5-142.2-113.9 123.5 -0.5 9.9 -3.0 4 4 A T - 0 0 60 -2,-0.6 3,-0.2 192,-0.2 192,-0.1 -0.295 5.3-145.0 -70.5 155.3 0.4 13.1 -1.0 5 5 A L S S+ 0 0 2 190,-0.4 186,-0.2 1,-0.1 -1,-0.1 0.178 74.2 102.3-114.4 17.9 -2.0 16.0 -0.6 6 6 A W S S+ 0 0 179 185,-0.1 2,-0.3 184,-0.1 -1,-0.1 0.865 97.8 21.2 -60.7 -35.1 0.6 18.8 -0.6 7 7 A Q S S- 0 0 124 -3,-0.2 -1,-0.0 1,-0.0 0, 0.0 -0.828 111.1 -69.9-125.5 169.2 -0.5 19.3 -4.2 8 8 A R - 0 0 106 -2,-0.3 2,-2.0 1,-0.1 119,-0.1 -0.382 49.6-118.7 -57.3 131.8 -3.6 18.4 -6.1 9 9 A P + 0 0 3 0, 0.0 15,-2.7 0, 0.0 2,-0.4 -0.544 47.6 172.9 -79.1 80.1 -3.8 14.6 -6.7 10 10 A L E +D 23 0B 71 -2,-2.0 2,-0.3 13,-0.2 13,-0.2 -0.763 2.9 173.0 -91.9 131.6 -3.6 14.7 -10.4 11 11 A V E -D 22 0B 14 11,-2.8 11,-2.7 -2,-0.4 2,-0.4 -0.874 33.0-106.5-132.8 165.0 -3.3 11.4 -12.4 12 12 A T E -D 21 0B 84 -2,-0.3 55,-2.0 9,-0.2 2,-0.3 -0.751 36.5-176.2 -91.9 137.6 -3.4 10.3 -16.0 13 13 A I E -DE 20 66B 2 7,-3.2 7,-2.4 -2,-0.4 2,-0.4 -0.892 18.0-143.5-126.4 163.8 -6.4 8.4 -17.2 14 14 A K E +DE 19 65B 96 51,-2.4 51,-2.6 -2,-0.3 2,-0.3 -0.999 30.4 155.4-128.1 126.3 -7.3 6.8 -20.5 15 15 A I E > +D 18 0B 1 3,-2.5 3,-2.2 -2,-0.4 49,-0.1 -0.975 65.6 1.5-152.6 134.3 -10.8 6.9 -21.7 16 16 A G T 3 S- 0 0 53 47,-0.5 3,-0.1 -2,-0.3 21,-0.1 0.785 129.7 -59.2 58.1 27.4 -12.4 6.7 -25.2 17 17 A G T 3 S+ 0 0 66 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.536 115.3 118.1 80.8 6.7 -8.9 6.2 -26.5 18 18 A Q E < -D 15 0B 78 -3,-2.2 -3,-2.5 2,-0.0 2,-0.4 -0.868 60.8-137.1-112.0 139.6 -7.8 9.5 -25.1 19 19 A L E +D 14 0B 138 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.811 34.7 169.2 -89.9 132.7 -5.2 10.4 -22.5 20 20 A K E -D 13 0B 27 -7,-2.4 -7,-3.2 -2,-0.4 2,-0.4 -0.970 34.8-121.5-142.9 155.9 -6.4 13.0 -20.0 21 21 A E E +D 12 0B 124 -2,-0.3 2,-0.3 -9,-0.2 62,-0.3 -0.808 38.4 175.8 -94.1 135.9 -5.3 14.5 -16.7 22 22 A A E -D 11 0B 1 -11,-2.7 -11,-2.8 -2,-0.4 2,-0.4 -0.993 28.5-118.6-146.4 152.1 -7.9 14.1 -13.9 23 23 A L E -Df 10 84B 3 60,-2.8 62,-3.2 -2,-0.3 2,-0.8 -0.769 20.6-132.0 -89.6 125.5 -8.2 14.9 -10.1 24 24 A L E - f 0 85B 0 -15,-2.7 2,-0.6 -2,-0.4 62,-0.2 -0.710 36.7-175.7 -76.1 110.0 -8.8 12.1 -7.6 25 25 A D > - 0 0 18 60,-2.6 3,-0.8 -2,-0.8 62,-0.3 -0.883 26.7-178.3-122.6 103.1 -11.7 13.7 -5.7 26 26 A T T 3 S+ 0 0 0 -2,-0.6 98,-0.1 1,-0.2 -1,-0.1 0.634 86.1 60.4 -74.2 -14.5 -13.1 12.1 -2.6 27 27 A G T 3 S+ 0 0 12 81,-0.1 2,-0.5 96,-0.1 -1,-0.2 0.687 87.4 88.0 -83.0 -20.5 -15.7 14.8 -2.3 28 28 A A < - 0 0 20 -3,-0.8 59,-2.8 57,-0.2 60,-0.2 -0.681 58.2-164.9 -83.4 119.8 -17.2 14.1 -5.7 29 29 A D S S+ 0 0 52 -2,-0.5 59,-1.0 57,-0.2 2,-0.3 0.876 77.2 37.4 -66.1 -34.2 -19.9 11.4 -5.7 30 30 A D S S- 0 0 47 57,-0.2 2,-0.4 56,-0.1 57,-0.2 -0.811 83.7-112.1-122.6 155.9 -19.6 11.1 -9.5 31 31 A T - 0 0 0 43,-0.5 45,-2.6 -2,-0.3 2,-0.4 -0.741 36.8-176.1 -82.8 128.7 -16.9 11.2 -12.2 32 32 A V E -gH 76 84B 9 52,-1.6 52,-2.9 -2,-0.4 2,-0.3 -0.984 1.9-175.3-135.5 122.8 -17.2 14.2 -14.4 33 33 A L E -g 77 0B 0 43,-3.1 45,-2.0 -2,-0.4 47,-0.2 -0.842 31.5 -96.6-119.1 155.3 -15.1 15.0 -17.4 34 34 A E S S- 0 0 79 -2,-0.3 -1,-0.1 43,-0.2 50,-0.0 -0.120 71.4 -55.7 -58.8 165.4 -14.8 17.9 -19.8 35 35 A E S S+ 0 0 113 43,-0.2 2,-0.3 45,-0.1 -1,-0.2 -0.166 78.8 135.8 -55.9 133.1 -16.7 17.7 -23.1 36 36 A M - 0 0 17 -3,-0.2 2,-0.4 2,-0.0 -3,-0.1 -0.940 53.1 -96.4-161.2 169.8 -15.9 14.6 -25.1 37 37 A S - 0 0 99 -2,-0.3 -2,-0.0 -21,-0.1 0, 0.0 -0.782 37.4-178.9 -97.0 138.9 -17.6 11.9 -27.1 38 38 A L - 0 0 11 -2,-0.4 2,-0.1 2,-0.1 24,-0.0 -0.981 27.7-106.2-133.3 154.3 -18.5 8.6 -25.6 39 39 A P S S+ 0 0 96 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.392 72.0 15.1 -76.9 151.1 -20.2 5.5 -27.0 40 40 A G S S- 0 0 68 -2,-0.1 -2,-0.1 19,-0.1 2,-0.1 -0.336 95.6 -23.1 95.5-169.5 -23.7 4.4 -26.2 41 41 A R - 0 0 90 -2,-0.1 19,-0.5 19,-0.1 2,-0.3 -0.402 55.2-178.5 -79.9 155.7 -26.8 5.9 -24.7 42 42 A W E -I 59 0B 128 17,-0.1 17,-0.2 -2,-0.1 15,-0.0 -0.960 12.7-157.5-144.6 165.7 -26.9 8.8 -22.3 43 43 A K E -I 58 0B 111 15,-1.4 15,-3.1 -2,-0.3 2,-0.1 -0.995 30.4 -98.5-141.9 152.6 -29.3 10.8 -20.3 44 44 A P E +I 57 0B 74 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.330 39.4 170.8 -73.1 152.5 -29.1 14.3 -18.8 45 45 A K E -I 56 0B 73 11,-2.1 11,-3.1 -2,-0.1 2,-0.4 -0.965 24.4-135.6-149.0 154.1 -28.3 15.1 -15.2 46 46 A M E -I 55 0B 118 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.975 20.7-177.4-116.8 134.4 -27.5 18.3 -13.2 47 47 A I E +I 54 0B 26 7,-2.4 7,-3.2 -2,-0.4 2,-0.3 -0.956 8.9 176.9-127.8 151.0 -24.7 18.5 -10.8 48 48 A G E +I 53 0B 36 -2,-0.3 5,-0.3 5,-0.3 2,-0.3 -0.933 17.3 150.6-150.9 167.0 -23.7 21.4 -8.6 49 49 A G E > -I 52 0B 24 3,-2.0 3,-2.6 -2,-0.3 100,-0.1 -0.839 67.8 -15.1-171.0-155.0 -21.5 22.8 -5.9 50 50 A I T 3 S+ 0 0 23 1,-0.3 101,-1.1 -2,-0.3 102,-0.4 -0.382 132.2 33.7 -63.2 137.9 -20.3 26.2 -4.9 51 51 A G T 3 S- 0 0 34 100,-0.2 -1,-0.3 99,-0.1 2,-0.3 0.151 122.0 -93.5 104.4 -24.2 -20.9 28.4 -7.9 52 52 A G E < -I 49 0B 26 -3,-2.6 -3,-2.0 100,-0.1 99,-0.4 -0.732 55.6 -40.9 113.6-165.0 -24.1 26.6 -8.9 53 53 A F E -I 48 0B 135 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.3 -0.723 36.6-160.6-111.1 153.7 -25.1 23.7 -11.1 54 54 A I E -I 47 0B 22 -7,-3.2 -7,-2.4 -2,-0.3 2,-0.4 -0.962 23.0-118.8-129.1 155.4 -24.2 22.5 -14.6 55 55 A K E +I 46 0B 143 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.760 38.5 175.5 -89.8 133.2 -26.0 20.2 -17.0 56 56 A V E -I 45 0B 3 -11,-3.1 -11,-2.1 -2,-0.4 2,-0.5 -0.880 31.2-115.2-131.7 164.7 -24.1 17.0 -18.0 57 57 A R E -IJ 44 77B 49 20,-2.9 20,-2.2 -2,-0.3 2,-0.6 -0.906 27.4-142.4-101.1 130.8 -24.6 13.9 -20.0 58 58 A Q E -IJ 43 76B 26 -15,-3.1 -15,-1.4 -2,-0.5 2,-0.5 -0.826 18.1-177.1 -99.7 118.4 -24.6 10.6 -18.1 59 59 A Y E -IJ 42 75B 10 16,-2.8 16,-3.0 -2,-0.6 3,-0.3 -0.943 11.6-153.2-110.5 130.1 -23.1 7.6 -19.7 60 60 A D E + 0 0 74 -19,-0.5 14,-0.2 -2,-0.5 -19,-0.1 -0.598 65.9 20.6-101.7 162.9 -23.1 4.2 -18.0 61 61 A Q E S+ 0 0 171 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.890 78.3 162.7 52.1 50.2 -20.9 1.2 -18.1 62 62 A I E - J 0 73B 11 11,-2.9 11,-1.9 -3,-0.3 2,-0.4 -0.798 35.2-130.3-100.3 139.0 -17.9 3.1 -19.5 63 63 A L E + J 0 72B 71 -2,-0.4 -47,-0.5 9,-0.2 2,-0.3 -0.726 32.2 171.3 -89.4 132.4 -14.4 1.6 -19.3 64 64 A I E - J 0 71B 3 7,-2.6 7,-2.9 -2,-0.4 2,-0.5 -0.997 26.0-143.1-140.5 144.1 -11.7 3.8 -17.9 65 65 A E E -EJ 14 70B 86 -51,-2.6 -51,-2.4 -2,-0.3 2,-0.5 -0.967 17.1-172.0-110.4 128.9 -8.0 3.3 -17.0 66 66 A I E > S-EJ 13 69B 0 3,-2.8 3,-2.9 -2,-0.5 -53,-0.2 -0.984 72.0 -28.4-123.9 108.6 -6.8 5.2 -13.9 67 67 A C T 3 S- 0 0 55 -55,-2.0 -1,-0.1 -2,-0.5 -54,-0.1 0.895 128.0 -47.2 51.8 43.1 -3.1 5.1 -13.1 68 68 A G T 3 S+ 0 0 66 -56,-0.2 2,-0.6 1,-0.2 -1,-0.3 0.396 115.9 118.1 81.3 -8.4 -2.9 1.8 -14.8 69 69 A H E < - J 0 66B 69 -3,-2.9 -3,-2.8 1,-0.0 2,-0.3 -0.807 57.6-140.2 -98.5 128.9 -6.0 0.4 -13.0 70 70 A K E + J 0 65B 78 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.593 28.5 168.6 -82.9 137.1 -8.9 -0.6 -15.1 71 71 A A E - J 0 64B 3 -7,-2.9 -7,-2.6 -2,-0.3 2,-0.4 -0.980 25.2-143.0-144.7 163.9 -12.5 0.2 -14.0 72 72 A I E + J 0 63B 105 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.979 42.8 101.0-127.0 138.4 -16.0 0.3 -15.2 73 73 A G E - 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