==== 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 03-MAY-07 2PQZ . 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) . 9924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 62.6 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 . 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 . 21 10.6 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 . 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 4 1 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,-1.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 160.7 29.5 -4.3 -18.4 2 2 A Q E -A 198 0A 142 196,-0.2 2,-0.6 197,-0.1 196,-0.2 -0.990 360.0-154.3-110.4 119.3 29.3 -6.5 -21.5 3 3 A I E -A 197 0A 31 194,-3.5 194,-2.5 -2,-0.5 2,-0.1 -0.867 3.5-142.5-108.5 120.0 28.2 -10.0 -20.3 4 4 A T - 0 0 58 -2,-0.6 3,-0.2 192,-0.2 192,-0.1 -0.335 5.1-144.8 -69.4 153.0 29.1 -13.0 -22.3 5 5 A L S S+ 0 0 1 190,-0.4 186,-0.2 1,-0.1 -1,-0.1 0.229 74.8 102.0-110.8 15.9 26.7 -15.9 -22.6 6 6 A W S S+ 0 0 179 185,-0.1 2,-0.3 184,-0.1 -1,-0.1 0.807 97.2 21.6 -59.2 -33.1 29.4 -18.7 -22.7 7 7 A Q S S- 0 0 125 -3,-0.2 0, 0.0 3,-0.0 0, 0.0 -0.827 111.6 -70.6-125.0 165.9 28.3 -19.2 -19.0 8 8 A R - 0 0 108 -2,-0.3 2,-1.8 1,-0.1 119,-0.1 -0.427 50.1-118.4 -57.8 134.7 25.1 -18.4 -17.1 9 9 A P + 0 0 3 0, 0.0 15,-2.5 0, 0.0 2,-0.3 -0.600 47.6 173.2 -79.2 80.1 24.9 -14.6 -16.6 10 10 A L E +D 23 0B 70 -2,-1.8 2,-0.3 13,-0.2 13,-0.2 -0.731 4.1 173.6 -93.8 138.3 25.0 -14.6 -12.8 11 11 A V E -D 22 0B 16 11,-2.7 11,-2.8 -2,-0.3 2,-0.4 -0.899 32.4-108.2-138.7 161.9 25.3 -11.4 -10.8 12 12 A T E -D 21 0B 88 -2,-0.3 55,-1.8 9,-0.2 2,-0.3 -0.783 35.3-174.7 -92.4 136.6 25.2 -10.3 -7.2 13 13 A I E -DE 20 66B 2 7,-2.8 7,-2.7 -2,-0.4 2,-0.4 -0.911 17.5-143.5-125.4 157.6 22.1 -8.4 -6.0 14 14 A K E +DE 19 65B 116 51,-2.3 51,-2.3 -2,-0.3 2,-0.3 -0.995 30.1 158.7-123.4 126.4 21.3 -6.7 -2.7 15 15 A I E > -D 18 0B 2 3,-2.9 3,-1.8 -2,-0.4 49,-0.1 -0.964 64.5 -1.9-151.9 131.3 17.7 -6.9 -1.5 16 16 A G T 3 S- 0 0 54 47,-0.5 3,-0.1 -2,-0.3 21,-0.1 0.826 129.4 -57.6 58.0 32.8 16.2 -6.5 1.8 17 17 A G T 3 S+ 0 0 65 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.568 117.1 113.2 77.4 7.2 19.6 -6.1 3.3 18 18 A Q E < -D 15 0B 77 -3,-1.8 -3,-2.9 2,-0.0 2,-0.4 -0.901 61.4-137.2-116.4 141.0 20.7 -9.4 1.9 19 19 A L E +D 14 0B 134 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.818 32.5 168.2 -92.4 136.7 23.2 -10.3 -0.8 20 20 A K E -D 13 0B 30 -7,-2.7 -7,-2.8 -2,-0.4 2,-0.4 -0.956 34.5-119.9-142.3 160.1 22.2 -13.0 -3.2 21 21 A E E +D 12 0B 126 -2,-0.3 2,-0.3 -9,-0.2 62,-0.3 -0.851 38.4 175.6 -96.0 137.5 23.3 -14.5 -6.6 22 22 A A E -D 11 0B 2 -11,-2.8 -11,-2.7 -2,-0.4 2,-0.4 -0.987 29.5-117.2-148.8 155.4 20.8 -14.2 -9.4 23 23 A L E -Df 10 84B 3 60,-2.9 62,-2.9 -2,-0.3 2,-0.7 -0.771 22.0-132.5 -91.8 124.8 20.4 -15.0 -13.1 24 24 A L E - f 0 85B 0 -15,-2.5 2,-0.6 -2,-0.4 62,-0.2 -0.745 35.5-175.3 -76.9 113.0 19.8 -12.2 -15.6 25 25 A D > - 0 0 19 60,-2.7 3,-1.3 -2,-0.7 62,-0.3 -0.893 26.2-177.0-125.8 102.7 17.0 -13.7 -17.6 26 26 A T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.684 86.7 61.3 -74.3 -14.7 15.6 -12.0 -20.7 27 27 A G T 3 S+ 0 0 15 81,-0.1 2,-0.5 96,-0.1 -1,-0.3 0.553 87.6 88.8 -84.1 -12.0 13.0 -14.7 -21.1 28 28 A A < - 0 0 18 -3,-1.3 59,-3.1 57,-0.2 60,-0.2 -0.779 57.0-165.3 -91.9 122.7 11.5 -13.9 -17.7 29 29 A D S S+ 0 0 54 -2,-0.5 59,-1.0 57,-0.2 2,-0.3 0.877 77.4 35.2 -67.6 -35.4 8.7 -11.3 -17.6 30 30 A D S S- 0 0 50 57,-0.2 2,-0.4 56,-0.1 57,-0.1 -0.765 82.3-112.8-120.2 159.3 9.1 -11.1 -13.8 31 31 A T - 0 0 1 43,-0.5 45,-2.8 -2,-0.3 2,-0.4 -0.800 35.7-175.3 -89.9 128.9 11.8 -11.2 -11.1 32 32 A V E -gH 76 84B 9 52,-1.6 52,-2.7 -2,-0.4 2,-0.3 -0.992 2.6-175.6-134.4 129.7 11.4 -14.3 -8.9 33 33 A L E -g 77 0B 0 43,-3.0 45,-2.2 -2,-0.4 47,-0.2 -0.864 31.0 -97.7-123.7 153.7 13.5 -15.0 -5.8 34 34 A E S S- 0 0 84 -2,-0.3 -1,-0.1 43,-0.2 49,-0.0 -0.125 71.4 -53.4 -57.9 165.8 13.7 -18.0 -3.4 35 35 A E S S+ 0 0 114 43,-0.3 2,-0.3 45,-0.1 -1,-0.2 -0.145 79.9 134.6 -55.3 130.8 11.9 -17.7 -0.0 36 36 A M - 0 0 16 -3,-0.2 2,-0.3 2,-0.0 -3,-0.1 -0.944 53.8 -95.3-162.9 163.2 12.8 -14.6 1.9 37 37 A S - 0 0 103 -2,-0.3 0, 0.0 -21,-0.1 0, 0.0 -0.750 37.6-179.6 -86.5 140.7 11.0 -11.8 3.8 38 38 A L - 0 0 17 -2,-0.3 2,-0.1 2,-0.1 24,-0.0 -0.973 27.6-107.6-136.8 154.9 10.1 -8.6 2.2 39 39 A P S S+ 0 0 93 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.431 70.7 15.0 -78.0 149.5 8.3 -5.5 3.6 40 40 A G S S- 0 0 67 -2,-0.1 2,-0.1 19,-0.1 -2,-0.1 -0.385 94.6 -22.3 99.3-169.1 4.8 -4.4 2.8 41 41 A R - 0 0 89 -2,-0.1 19,-0.5 19,-0.1 2,-0.3 -0.465 55.7-179.2 -80.0 154.4 1.7 -5.8 1.3 42 42 A W E -I 59 0B 135 17,-0.2 17,-0.2 -2,-0.1 15,-0.0 -0.949 13.4-157.8-145.6 167.1 1.6 -8.8 -1.1 43 43 A K E -I 58 0B 103 15,-1.3 15,-3.0 -2,-0.3 2,-0.1 -0.978 30.8 -97.8-141.9 155.9 -0.8 -10.9 -3.1 44 44 A P E +I 57 0B 84 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.330 40.0 172.9 -76.1 151.2 -0.6 -14.4 -4.5 45 45 A K E -I 56 0B 70 11,-2.2 11,-2.6 -2,-0.1 2,-0.4 -0.978 23.7-135.9-144.7 154.9 0.3 -15.2 -8.1 46 46 A M E -I 55 0B 107 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.976 21.0-178.7-111.8 136.9 1.1 -18.3 -10.2 47 47 A I E +I 54 0B 23 7,-2.3 7,-2.8 -2,-0.4 2,-0.3 -0.956 9.5 173.7-132.7 149.4 4.0 -18.5 -12.6 48 48 A G E +I 53 0B 35 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.934 17.6 143.4-153.8 168.1 4.9 -21.4 -14.8 49 49 A G E > +I 52 0B 23 3,-2.0 3,-2.6 -2,-0.3 100,-0.1 -0.846 67.9 0.6-175.7-151.9 7.0 -22.9 -17.5 50 50 A I T 3 S+ 0 0 24 1,-0.3 101,-1.8 -2,-0.3 102,-0.6 -0.327 131.7 23.2 -54.4 129.6 8.5 -26.2 -18.3 51 51 A G T 3 S- 0 0 39 128,-0.2 2,-0.3 100,-0.2 -1,-0.3 0.253 122.3 -87.0 96.6 -12.7 7.6 -28.6 -15.5 52 52 A G E < -I 49 0B 26 -3,-2.6 -3,-2.0 100,-0.1 2,-0.3 -0.759 58.8 -38.3 118.0-162.0 4.5 -26.7 -14.5 53 53 A F E -I 48 0B 147 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.3 -0.793 35.8-161.6-114.2 152.2 3.5 -23.8 -12.2 54 54 A I E -I 47 0B 22 -7,-2.8 -7,-2.3 -2,-0.3 2,-0.4 -0.934 22.3-121.2-126.9 154.2 4.5 -22.5 -8.8 55 55 A K E +I 46 0B 146 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.826 36.6 175.3 -94.3 135.3 2.7 -20.2 -6.4 56 56 A V E -I 45 0B 3 -11,-2.6 -11,-2.2 -2,-0.4 2,-0.5 -0.848 31.6-114.9-132.2 162.6 4.6 -17.1 -5.4 57 57 A R E -IJ 44 77B 49 20,-2.7 20,-2.1 -2,-0.3 2,-0.6 -0.917 27.7-143.1-102.3 129.2 4.0 -13.9 -3.3 58 58 A Q E -IJ 43 76B 28 -15,-3.0 -15,-1.3 -2,-0.5 2,-0.4 -0.845 17.8-176.6 -97.8 116.6 4.0 -10.7 -5.3 59 59 A Y E -IJ 42 75B 11 16,-2.8 16,-2.5 -2,-0.6 3,-0.3 -0.937 12.6-152.1-108.2 131.0 5.5 -7.6 -3.6 60 60 A D E + 0 0 69 -19,-0.5 14,-0.2 -2,-0.4 -19,-0.1 -0.658 66.2 20.5-101.3 161.7 5.4 -4.3 -5.4 61 61 A Q E S+ 0 0 164 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.897 77.4 162.8 54.0 51.8 7.7 -1.2 -5.2 62 62 A I E - J 0 73B 10 11,-2.7 11,-1.9 -3,-0.3 2,-0.3 -0.822 35.7-127.8-100.0 135.4 10.7 -3.1 -3.8 63 63 A L E + J 0 72B 131 -2,-0.4 -47,-0.5 9,-0.2 2,-0.3 -0.640 33.4 173.4 -81.4 136.9 14.2 -1.6 -3.9 64 64 A I E - J 0 71B 6 7,-2.5 7,-2.5 -2,-0.3 2,-0.5 -0.991 25.4-146.1-143.0 150.1 16.9 -3.7 -5.3 65 65 A E E -EJ 14 70B 29 -51,-2.3 -51,-2.3 -2,-0.3 2,-0.5 -0.990 17.4-177.6-120.2 123.7 20.6 -3.2 -6.3 66 66 A I E > S-EJ 13 69B 0 3,-2.9 3,-2.4 -2,-0.5 -53,-0.2 -0.988 73.0 -25.3-124.1 113.7 21.9 -5.2 -9.3 67 67 A C T 3 S- 0 0 59 -55,-1.8 -1,-0.1 -2,-0.5 -54,-0.1 0.817 128.2 -47.7 50.9 35.6 25.6 -4.9 -10.2 68 68 A G T 3 S+ 0 0 75 1,-0.2 2,-0.6 -56,-0.2 -1,-0.3 0.436 114.8 119.9 86.9 -0.1 25.7 -1.5 -8.5 69 69 A H E < - J 0 66B 68 -3,-2.4 -3,-2.9 2,-0.0 2,-0.3 -0.886 55.3-143.5-106.6 127.6 22.6 -0.3 -10.2 70 70 A K E + J 0 65B 191 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.546 29.7 159.2 -81.4 137.6 19.6 0.8 -8.1 71 71 A A E - J 0 64B 11 -7,-2.5 -7,-2.5 -2,-0.3 2,-0.4 -0.980 28.8-140.2-149.6 169.8 16.2 0.0 -9.3 72 72 A I E + J 0 63B 80 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.994 40.3 111.6-134.7 140.5 12.6 -0.4 -8.0 73 73 A G E - 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