==== 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 17-SEP-09 3JW2 . COMPND 2 MOLECULE: GAG-POL POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 (B . 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) . 10034.0 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 . 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 . 23 11.6 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 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 2 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 92 0, 0.0 198,-1.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 171.5 -0.6 39.0 18.5 2 2 A Q E -A 198 0A 128 196,-0.2 2,-0.6 197,-0.1 196,-0.2 -0.963 360.0-158.8-114.7 121.0 -0.4 36.4 21.3 3 3 A I E -A 197 0A 47 194,-3.6 194,-2.5 -2,-0.5 2,-0.1 -0.884 3.5-152.2-105.8 118.5 0.6 32.9 20.3 4 4 A T - 0 0 73 -2,-0.6 3,-0.3 192,-0.2 192,-0.1 -0.441 13.6-135.5 -80.3 161.3 -0.2 30.0 22.6 5 5 A L S S+ 0 0 3 190,-0.5 186,-0.2 1,-0.2 185,-0.1 0.069 71.4 111.7-109.2 25.2 2.1 27.0 22.5 6 6 A W S S+ 0 0 188 185,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.854 92.4 18.7 -62.5 -34.3 -0.5 24.2 22.5 7 7 A K S S- 0 0 161 -3,-0.3 0, 0.0 1,-0.0 0, 0.0 -0.823 110.5 -66.8-130.3 168.8 0.7 23.5 18.9 8 8 A R - 0 0 146 -2,-0.3 2,-1.8 1,-0.1 119,-0.1 -0.359 50.7-121.6 -59.2 131.2 3.8 24.4 16.9 9 9 A P + 0 0 6 0, 0.0 15,-2.7 0, 0.0 2,-0.3 -0.549 45.3 172.9 -78.6 82.5 3.9 28.2 16.3 10 10 A L E +D 23 0B 65 -2,-1.8 2,-0.3 13,-0.2 13,-0.2 -0.710 6.1 175.6 -95.4 143.4 4.0 28.2 12.5 11 11 A V E -D 22 0B 30 11,-2.6 11,-3.0 -2,-0.3 2,-0.4 -0.947 31.2-112.7-141.2 160.4 3.7 31.3 10.5 12 12 A T E -D 21 0B 91 -2,-0.3 55,-0.8 9,-0.2 2,-0.3 -0.817 37.0-178.7 -97.0 133.2 3.9 32.3 6.8 13 13 A I E -DE 20 66B 1 7,-3.0 7,-2.4 -2,-0.4 2,-0.5 -0.889 22.5-136.5-128.2 160.2 6.8 34.4 5.7 14 14 A K E +DE 19 65B 101 51,-2.0 51,-2.3 -2,-0.3 2,-0.3 -0.981 32.7 159.3-120.1 123.4 8.0 35.9 2.5 15 15 A I E > +DE 18 64B 1 3,-2.5 3,-1.9 -2,-0.5 49,-0.1 -0.996 65.4 0.4-145.3 134.0 11.6 35.6 1.6 16 16 A G T 3 S- 0 0 46 47,-0.5 21,-0.1 -2,-0.3 3,-0.1 0.789 130.3 -58.0 59.7 26.3 13.4 35.8 -1.8 17 17 A G T 3 S+ 0 0 73 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.516 117.5 101.5 83.5 4.3 10.1 36.5 -3.4 18 18 A Q E < -D 15 0B 78 -3,-1.9 -3,-2.5 2,-0.0 2,-0.4 -0.917 68.4-121.8-126.6 152.2 8.5 33.2 -2.2 19 19 A L E +D 14 0B 122 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.707 34.4 172.7 -90.0 138.3 6.1 32.2 0.6 20 20 A K E -D 13 0B 27 -7,-2.4 -7,-3.0 -2,-0.4 2,-0.4 -0.989 32.2-122.3-144.4 150.7 7.2 29.6 3.1 21 21 A E E -D 12 0B 121 -2,-0.3 62,-0.4 -9,-0.2 2,-0.3 -0.780 38.9-179.5 -91.8 135.3 5.9 28.2 6.3 22 22 A A E -D 11 0B 1 -11,-3.0 -11,-2.6 -2,-0.4 2,-0.5 -0.959 27.5-121.5-138.6 158.5 8.2 28.6 9.3 23 23 A L E -Df 10 84B 12 60,-2.8 62,-3.1 -2,-0.3 2,-0.7 -0.846 23.6-130.2-100.6 127.8 8.5 27.8 12.9 24 24 A L E - f 0 85B 1 -15,-2.7 2,-0.6 -2,-0.5 62,-0.2 -0.688 35.7-172.7 -76.8 114.4 8.9 30.7 15.5 25 25 A D > + 0 0 12 60,-3.1 3,-1.4 -2,-0.7 62,-0.3 -0.849 30.3 176.4-124.8 102.9 11.9 29.4 17.5 26 26 A T T 3 S+ 0 0 0 -2,-0.6 -1,-0.1 1,-0.3 98,-0.1 0.681 86.0 64.0 -70.6 -17.3 13.2 31.0 20.6 27 27 A G T 3 S+ 0 0 20 81,-0.1 2,-0.4 96,-0.1 -1,-0.3 0.376 88.3 86.7 -88.2 6.4 15.7 28.2 21.0 28 28 A A < - 0 0 15 -3,-1.4 59,-2.5 57,-0.2 60,-0.3 -0.916 58.0-161.3-112.6 131.8 17.5 29.1 17.8 29 29 A D S S+ 0 0 61 -2,-0.4 59,-0.8 1,-0.2 2,-0.4 0.886 79.5 20.3 -74.4 -41.8 20.3 31.6 17.5 30 30 A D S S- 0 0 40 57,-0.1 -1,-0.2 58,-0.1 2,-0.1 -0.976 86.7 -99.3-136.0 150.2 20.0 32.1 13.7 31 31 A T E -g 75 0B 0 43,-0.6 45,-2.7 -2,-0.4 2,-0.4 -0.351 33.8-166.1 -65.7 133.9 17.3 31.6 11.1 32 32 A V E -gH 76 84B 4 52,-1.7 52,-3.0 43,-0.2 2,-0.3 -0.987 6.1-177.0-128.6 126.9 17.6 28.4 8.9 33 33 A I E -g 77 0B 0 43,-3.0 45,-2.2 -2,-0.4 47,-0.2 -0.907 31.1-101.9-123.8 149.4 15.7 27.9 5.7 34 34 A E - 0 0 82 -2,-0.3 -1,-0.1 43,-0.2 49,-0.0 -0.135 68.2 -57.0 -60.5 161.6 15.4 24.9 3.3 35 35 A E S S+ 0 0 111 43,-0.3 2,-0.3 45,-0.1 -1,-0.2 -0.119 79.8 132.7 -47.7 128.3 17.4 25.1 0.1 36 36 A M - 0 0 18 -3,-0.2 2,-0.3 2,-0.0 -3,-0.1 -0.948 55.0 -95.8-166.8 165.4 16.5 28.1 -2.0 37 37 A S - 0 0 94 -2,-0.3 0, 0.0 -21,-0.1 0, 0.0 -0.743 36.9-179.3 -97.1 144.6 18.4 30.8 -3.9 38 38 A L - 0 0 18 -2,-0.3 2,-0.1 2,-0.1 24,-0.0 -0.966 27.2-109.5-138.3 151.0 19.1 34.2 -2.4 39 39 A P S S+ 0 0 99 0, 0.0 2,-0.1 0, 0.0 -23,-0.0 -0.414 71.8 26.9 -80.6 158.4 20.9 37.3 -3.8 40 40 A G S S- 0 0 65 -2,-0.1 -2,-0.1 19,-0.1 2,-0.1 -0.282 94.3 -33.5 92.1-176.3 24.3 38.5 -2.7 41 41 A R - 0 0 231 -2,-0.1 19,-0.5 19,-0.1 2,-0.3 -0.356 53.8-177.1 -80.5 163.1 27.4 37.1 -1.2 42 42 A W - 0 0 128 17,-0.1 17,-0.2 -2,-0.1 15,-0.0 -0.977 14.0-150.6-155.3 160.3 27.5 34.2 1.3 43 43 A K E -I 58 0B 104 15,-1.3 15,-2.7 -2,-0.3 13,-0.0 -0.982 30.0-102.8-136.7 148.4 30.0 32.2 3.3 44 44 A P E +I 57 0B 80 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.340 42.1 172.5 -70.4 153.6 29.9 28.6 4.5 45 45 A K E -I 56 0B 76 11,-1.8 11,-2.9 2,-0.0 2,-0.5 -0.983 27.1-134.7-157.8 153.8 29.0 27.7 8.1 46 46 A M E -I 55 0B 111 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.973 22.3-175.0-115.8 127.1 28.3 24.7 10.2 47 47 A I E -I 54 0B 18 7,-2.3 7,-2.4 -2,-0.5 2,-0.3 -0.960 6.2-166.0-123.3 142.1 25.3 24.7 12.6 48 48 A G E +I 53 0B 40 -2,-0.4 5,-0.3 5,-0.3 2,-0.2 -0.916 21.0 136.4-132.5 157.5 24.5 22.0 15.1 49 49 A G E > -I 52 0B 21 3,-2.5 3,-2.3 -2,-0.3 2,-0.2 -0.741 66.8 -10.0-161.5-151.8 21.7 20.8 17.3 50 50 A I T 3 S+ 0 0 26 1,-0.3 101,-1.8 -2,-0.2 102,-0.7 -0.438 133.0 23.5 -62.1 127.0 20.1 17.6 18.3 51 51 A G T 3 S- 0 0 34 128,-0.4 2,-0.3 100,-0.2 -1,-0.3 0.223 121.9 -86.2 101.7 -15.8 21.4 15.0 15.9 52 52 A G E < -I 49 0B 27 -3,-2.3 -3,-2.5 100,-0.1 2,-0.3 -0.835 63.8 -33.5 119.6-156.1 24.6 16.8 15.0 53 53 A F E -I 48 0B 137 -2,-0.3 2,-0.3 -5,-0.3 -5,-0.3 -0.719 37.4-163.7-111.7 158.9 25.7 19.5 12.5 54 54 A I E -I 47 0B 21 -7,-2.4 -7,-2.3 -2,-0.3 2,-0.4 -0.967 25.6-117.0-135.1 152.0 24.7 20.5 8.9 55 55 A K E +I 46 0B 144 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.758 40.0 173.5 -91.3 134.9 26.5 22.7 6.5 56 56 A V E -I 45 0B 4 -11,-2.9 -11,-1.8 -2,-0.4 2,-0.5 -0.849 33.2-115.2-134.5 170.5 24.7 25.8 5.4 57 57 A R E -IJ 44 77B 51 20,-2.4 20,-2.5 -2,-0.3 2,-0.6 -0.930 28.6-143.3-107.7 131.3 25.2 29.0 3.4 58 58 A Q E -IJ 43 76B 29 -15,-2.7 -15,-1.3 -2,-0.5 2,-0.4 -0.861 18.7-178.9-102.2 118.4 25.1 32.2 5.3 59 59 A Y E - J 0 75B 10 16,-2.7 16,-2.8 -2,-0.6 3,-0.3 -0.946 11.9-155.3-112.7 132.5 23.6 35.3 3.7 60 60 A D E + 0 0 66 -19,-0.5 14,-0.2 -2,-0.4 -19,-0.1 -0.633 66.5 25.2-105.1 164.5 23.5 38.6 5.6 61 61 A Q E S+ 0 0 167 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.905 76.6 160.2 51.6 52.9 21.2 41.5 5.3 62 62 A I E - J 0 73B 13 11,-2.8 11,-2.2 -3,-0.3 2,-0.4 -0.873 37.0-129.8-105.2 135.4 18.2 39.6 3.8 63 63 A I E - J 0 72B 106 -2,-0.4 -47,-0.5 9,-0.2 2,-0.4 -0.702 26.2-176.9 -87.6 131.5 14.7 41.1 4.0 64 64 A I E -EJ 15 71B 0 7,-3.2 7,-2.7 -2,-0.4 2,-0.6 -0.996 17.5-146.5-130.6 129.3 12.0 38.8 5.4 65 65 A E E +EJ 14 70B 62 -51,-2.3 -51,-2.0 -2,-0.4 2,-0.4 -0.840 25.9 170.7 -96.0 123.2 8.3 39.7 5.7 66 66 A I E > -EJ 13 69B 0 3,-3.2 3,-1.9 -2,-0.6 -53,-0.1 -0.959 66.0 -18.3-139.5 119.2 6.7 38.2 8.8 67 67 A A T 3 S- 0 0 51 -55,-0.8 3,-0.1 -2,-0.4 -1,-0.1 0.885 126.5 -53.5 55.4 41.5 3.2 38.9 10.1 68 68 A G T 3 S+ 0 0 61 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.155 116.7 114.9 83.2 -22.3 3.2 42.1 8.0 69 69 A H E < - J 0 66B 77 -3,-1.9 -3,-3.2 24,-0.0 2,-0.7 -0.632 59.4-143.8 -85.0 139.4 6.4 43.3 9.6 70 70 A K E + J 0 65B 164 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.908 27.6 174.0-105.0 113.3 9.5 43.7 7.3 71 71 A A E - 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