==== 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 09-FEB-09 3G72 . COMPND 2 MOLECULE: RENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR O.BEZENCON,D.BUR,L.PRADE,T.WELLER,C.BOSS,W.FISCHLI . 669 4 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27734.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 467 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 209 31.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 69 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 4 0 3 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 6 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 PARALLEL BRIDGES PER LADDER . 4 8 6 4 9 4 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 1 1 2 0 2 1 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 4 A G 0 0 72 0, 0.0 149,-0.2 0, 0.0 148,-0.2 0.000 360.0 360.0 360.0-162.5 20.5 32.5 4.4 2 5 A N + 0 0 149 147,-0.6 2,-0.3 146,-0.1 148,-0.2 0.386 360.0 103.7-124.3 -1.8 17.5 34.2 6.2 3 6 A T B +a 150 0A 51 146,-3.3 148,-3.5 2,-0.0 149,-0.4 -0.620 33.7 178.0 -93.9 143.6 14.4 32.1 5.5 4 7 A T - 0 0 79 -2,-0.3 2,-0.5 146,-0.2 169,-0.2 -0.972 15.9-165.6-124.7 137.8 12.3 29.7 7.5 5 8 A S E -B 172 0B 12 167,-2.4 167,-3.7 -2,-0.3 2,-0.3 -0.982 0.4-162.4-122.5 124.8 9.2 28.3 5.7 6 9 A S E -B 171 0B 59 -2,-0.5 2,-0.4 165,-0.3 165,-0.3 -0.828 2.4-160.8-104.5 149.3 6.4 26.5 7.5 7 10 A V E -B 170 0B 12 163,-3.0 163,-2.7 -2,-0.3 2,-0.2 -0.999 20.3-127.9-128.4 124.3 3.8 24.2 5.9 8 11 A I E -B 169 0B 98 -2,-0.4 12,-0.5 161,-0.2 2,-0.3 -0.543 23.9-151.0 -69.2 134.6 0.5 23.4 7.8 9 12 A L E -B 168 0B 2 159,-2.7 159,-0.9 -2,-0.2 158,-0.8 -0.801 6.5-138.8-107.7 146.9 -0.3 19.7 8.0 10 13 A T E -G 18 0C 75 8,-2.6 8,-1.6 -2,-0.3 2,-0.7 -0.898 17.8-139.6 -97.7 134.3 -3.7 18.1 8.3 11 14 A N E -G 17 0C 15 -2,-0.5 2,-0.7 6,-0.2 6,-0.2 -0.886 14.0-165.7 -92.7 114.1 -3.9 15.2 10.7 12 15 A Y E >> S-G 16 0C 68 4,-3.2 3,-2.2 -2,-0.7 4,-1.6 -0.915 70.6 -39.1 -99.8 110.1 -6.0 12.4 9.4 13 16 A M T 34 S- 0 0 114 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.719 102.1 -72.4 54.8 28.5 -6.9 10.0 12.3 14 17 A D T 34 S+ 0 0 26 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.598 128.7 79.4 65.2 7.9 -3.5 10.3 13.9 15 18 A T T <4 S+ 0 0 25 -3,-2.2 2,-0.4 1,-0.3 -2,-0.2 0.580 86.0 44.0-117.3 -19.9 -2.0 8.2 11.1 16 19 A Q E < -G 12 0C 29 -4,-1.6 -4,-3.2 208,-0.1 2,-0.5 -0.993 55.2-179.7-133.2 124.6 -1.4 10.5 8.1 17 20 A Y E +G 11 0C 4 -2,-0.4 17,-0.5 -6,-0.2 2,-0.3 -0.986 20.3 158.4-126.0 116.0 -0.0 14.0 8.4 18 21 A Y E -G 10 0C 18 -8,-1.6 -8,-2.6 -2,-0.5 2,-0.2 -0.926 19.3-172.6-140.7 160.1 0.3 15.8 5.1 19 22 A G E -H 32 0D 6 13,-2.0 13,-3.0 -2,-0.3 2,-0.2 -0.818 34.0 -84.6-144.4-179.4 0.5 19.3 3.7 20 23 A E E +H 31 0D 120 -12,-0.5 77,-0.4 -2,-0.2 2,-0.3 -0.608 34.3 175.4-100.7 151.9 0.4 20.8 0.3 21 24 A I E -H 30 0D 2 9,-1.7 9,-2.1 -2,-0.2 2,-0.4 -0.911 22.5-134.5-128.8 167.4 3.2 21.4 -2.3 22 25 A G E -HI 29 95D 2 73,-2.3 73,-3.3 -2,-0.3 2,-0.4 -0.992 17.4-169.5-125.0 134.1 2.8 22.8 -5.8 23 26 A I E > +HI 28 94D 0 5,-2.8 5,-2.8 -2,-0.4 71,-0.2 -0.981 46.7 3.5-121.0 132.7 4.4 21.3 -8.9 24 27 A G T 5S- 0 0 5 69,-2.5 42,-0.1 -2,-0.4 68,-0.1 -0.279 92.0 -43.6 98.7 178.2 4.7 22.7 -12.4 25 28 A T T 5S+ 0 0 58 1,-0.2 42,-2.4 2,-0.1 43,-0.3 -0.987 135.1 24.0-130.6 113.4 3.7 26.0 -14.1 26 29 A P T 5S- 0 0 91 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.740 121.3-101.4 -76.0 167.8 1.1 26.9 -13.2 27 30 A P T 5 - 0 0 81 0, 0.0 2,-0.6 0, 0.0 -3,-0.2 -0.323 26.1-157.0 -69.1 128.0 1.2 24.9 -10.0 28 31 A Q E < -H 23 0D 33 -5,-2.8 -5,-2.8 -2,-0.1 2,-0.2 -0.938 25.4-139.8 -94.0 120.4 -0.6 21.6 -9.7 29 32 A T E -H 22 0D 71 -2,-0.6 2,-0.3 -7,-0.2 -7,-0.2 -0.593 22.9-180.0 -93.0 147.0 -1.1 21.1 -5.9 30 33 A F E -H 21 0D 3 -9,-2.1 -9,-1.7 -2,-0.2 2,-0.5 -0.995 28.9-127.0-142.7 141.7 -0.8 17.9 -4.1 31 34 A K E +H 20 0D 79 -2,-0.3 92,-2.2 -11,-0.2 91,-2.1 -0.788 42.2 179.6 -87.2 130.2 -1.2 16.8 -0.5 32 35 A V E -Hj 19 123D 0 -13,-3.0 -13,-2.0 -2,-0.5 2,-0.4 -0.973 32.2-127.2-135.5 146.9 2.0 15.0 0.5 33 36 A V E - j 0 124D 10 90,-2.4 92,-2.6 -2,-0.4 2,-0.7 -0.798 24.3-137.2 -84.5 133.0 3.5 13.3 3.5 34 37 A F E - j 0 125D 1 -17,-0.5 2,-0.6 -2,-0.4 92,-0.2 -0.870 29.9-166.9 -88.4 113.0 7.0 14.7 4.4 35 38 A D E > - j 0 126D 23 90,-2.4 92,-3.2 -2,-0.7 3,-1.2 -0.890 30.1-174.5-119.4 107.2 8.9 11.5 5.1 36 39 A T T 3 S+ 0 0 3 -2,-0.6 159,-0.5 1,-0.2 93,-0.2 0.696 87.9 67.5 -69.2 -14.9 12.3 11.3 6.8 37 40 A G T 3 S+ 0 0 34 91,-0.1 2,-0.3 157,-0.1 -1,-0.2 0.378 103.6 45.4 -84.0 5.3 12.2 7.6 6.1 38 41 A S < - 0 0 31 -3,-1.2 90,-2.8 87,-0.1 89,-0.2 -0.952 60.1-154.2-149.9 163.8 12.5 8.1 2.4 39 42 A S + 0 0 4 93,-0.4 2,-0.3 -2,-0.3 101,-0.2 0.471 63.1 78.7-125.4 -3.5 14.4 10.1 -0.1 40 43 A N - 0 0 6 92,-0.1 86,-1.6 99,-0.1 2,-0.5 -0.777 67.8-126.9-109.3 150.6 12.4 10.6 -3.3 41 44 A V E +K 125 0D 2 63,-0.4 65,-3.6 -2,-0.3 2,-0.4 -0.848 35.3 178.8 -88.0 131.3 9.6 12.9 -4.3 42 45 A W E +Kl 124 106D 15 82,-1.8 82,-2.1 -2,-0.5 65,-0.2 -0.992 12.3 165.0-134.8 131.6 6.7 11.0 -5.7 43 46 A V E - l 0 107D 1 63,-2.2 65,-2.9 -2,-0.4 80,-0.2 -0.951 46.6 -90.6-129.5 162.8 3.3 12.0 -7.0 44 47 A P E - l 0 108D 4 0, 0.0 17,-3.8 0, 0.0 2,-0.3 -0.469 43.2-129.1 -68.3 142.0 0.8 10.1 -9.1 45 48 A S B > -o 61 0E 0 63,-3.2 3,-1.9 15,-0.3 17,-0.2 -0.625 11.3-131.4 -87.2 145.0 1.2 10.5 -12.8 46 49 A S T 3 S+ 0 0 38 15,-2.5 16,-0.1 1,-0.3 -1,-0.1 0.699 111.4 68.7 -62.3 -19.2 -1.6 11.5 -15.2 47 50 A K T 3 S+ 0 0 109 14,-0.3 2,-0.3 61,-0.1 -1,-0.3 0.512 75.1 113.0 -76.9 -2.0 -0.1 8.5 -17.1 48 51 A a S < S- 0 0 9 -3,-1.9 62,-0.1 60,-0.2 61,-0.1 -0.566 78.3-110.8 -74.5 127.7 -1.4 6.3 -14.3 49 52 A S > - 0 0 37 60,-0.8 3,-1.6 -2,-0.3 6,-0.2 -0.242 13.7-131.3 -52.4 141.0 -4.2 4.0 -15.5 50 53 A R T 3 S+ 0 0 162 1,-0.3 -1,-0.1 5,-0.1 6,-0.1 0.469 104.5 77.5 -74.6 -2.1 -7.7 4.8 -14.1 51 54 A L T 3 S+ 0 0 11 305,-0.1 2,-0.7 4,-0.0 -1,-0.3 0.403 74.6 89.5 -85.9 5.3 -7.8 1.1 -13.4 52 55 A Y X> - 0 0 6 -3,-1.6 4,-2.5 1,-0.2 3,-1.0 -0.905 67.8-158.4 -94.1 113.4 -5.5 1.9 -10.4 53 56 A T H 3> S+ 0 0 15 -2,-0.7 4,-1.9 1,-0.3 -1,-0.2 0.914 93.7 56.9 -54.6 -43.0 -7.8 2.7 -7.5 54 57 A A H 34 S+ 0 0 0 57,-0.3 -1,-0.3 1,-0.2 4,-0.1 0.779 111.1 44.3 -58.5 -29.3 -4.9 4.6 -5.8 55 58 A a H X4 S+ 0 0 2 -3,-1.0 3,-1.3 -6,-0.2 -1,-0.2 0.879 107.9 55.7 -83.5 -37.4 -4.7 6.8 -8.9 56 59 A V H 3< S+ 0 0 72 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.896 109.9 46.2 -63.5 -32.7 -8.4 7.4 -9.4 57 60 A Y T 3< S+ 0 0 158 -4,-1.9 -1,-0.3 -5,-0.2 2,-0.3 0.435 108.7 67.0 -92.0 3.1 -8.8 8.7 -5.9 58 61 A H S < S- 0 0 21 -3,-1.3 2,-0.2 -5,-0.2 64,-0.1 -0.747 88.7 -97.7-122.6 162.4 -5.8 11.0 -6.0 59 62 A K - 0 0 117 -2,-0.3 2,-0.4 -28,-0.1 -2,-0.1 -0.608 40.8-145.4 -75.1 145.7 -4.7 14.1 -7.9 60 63 A L - 0 0 58 -2,-0.2 2,-0.4 -17,-0.1 -15,-0.3 -0.947 9.5-124.8-120.4 130.6 -2.4 13.3 -10.8 61 64 A F B -o 45 0E 0 -17,-3.8 -15,-2.5 -2,-0.4 2,-0.7 -0.608 22.7-160.9 -71.2 128.1 0.5 15.3 -12.0 62 65 A D > - 0 0 43 -2,-0.4 3,-1.8 -17,-0.2 4,-0.1 -0.889 13.5-173.3-119.1 105.6 0.1 16.2 -15.7 63 66 A A G > S+ 0 0 6 -2,-0.7 3,-1.8 1,-0.3 6,-0.3 0.789 85.1 68.4 -64.0 -28.4 3.4 17.2 -17.4 64 67 A S G 3 S+ 0 0 96 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.546 100.6 50.6 -69.9 -7.7 1.4 18.2 -20.5 65 68 A D G < S+ 0 0 96 -3,-1.8 2,-0.5 -39,-0.0 -1,-0.3 0.338 95.4 81.7-107.2 0.5 -0.0 21.0 -18.4 66 69 A S X - 0 0 13 -3,-1.8 3,-0.6 1,-0.1 -42,-0.1 -0.942 55.5-163.3-116.1 130.7 3.2 22.4 -17.1 67 70 A S T 3 S+ 0 0 102 -42,-2.4 -1,-0.1 -2,-0.5 -4,-0.0 0.698 91.1 53.4 -83.3 -14.9 5.4 24.8 -19.1 68 71 A S T 3 S+ 0 0 27 -43,-0.3 -1,-0.2 25,-0.1 -44,-0.1 0.437 78.7 119.3-102.1 -2.0 8.3 24.3 -16.9 69 72 A Y < - 0 0 59 -3,-0.6 2,-0.4 -6,-0.3 23,-0.2 -0.335 45.2-159.9 -61.7 141.7 8.6 20.5 -17.0 70 73 A K E -M 91 0D 137 21,-2.6 21,-1.6 -2,-0.0 -2,-0.0 -0.986 21.1-125.3-125.7 117.1 11.7 18.8 -18.4 71 74 A H E +M 90 0D 138 -2,-0.4 19,-0.2 19,-0.2 18,-0.0 -0.159 41.6 152.8 -51.4 147.0 11.4 15.2 -19.5 72 75 A N E - 0 0 58 17,-0.7 18,-0.2 2,-0.0 -1,-0.1 0.233 20.8-168.8-133.4 -70.9 13.6 12.5 -18.2 73 76 A G E + 0 0 32 16,-2.5 2,-0.2 1,-0.3 17,-0.1 0.344 25.8 153.4 100.3 -3.4 11.7 9.2 -18.4 74 77 A T E - 0 0 80 15,-0.2 15,-2.6 14,-0.1 -1,-0.3 -0.417 46.5-122.7 -59.1 121.7 14.1 7.1 -16.3 75 78 A E E -M 88 0D 126 13,-0.3 2,-0.4 -2,-0.2 13,-0.3 -0.465 31.5-171.5 -65.0 135.9 12.0 4.3 -14.8 76 79 A L E -M 87 0D 8 11,-2.6 11,-2.5 -2,-0.2 2,-0.4 -0.986 2.8-167.1-134.4 147.7 12.1 4.1 -11.0 77 80 A T E -M 86 0D 37 -2,-0.4 2,-0.5 9,-0.2 9,-0.2 -0.997 14.8-164.9-138.1 137.8 10.7 1.5 -8.7 78 81 A L E -M 85 0D 59 7,-3.4 7,-3.5 -2,-0.4 2,-1.4 -0.995 19.5-144.4-115.1 120.0 10.0 1.0 -5.1 79 82 A R E -M 84 0D 134 -2,-0.5 5,-0.2 5,-0.2 2,-0.2 -0.714 30.1-172.8 -79.9 90.5 9.4 -2.6 -3.9 80 83 A Y E > -M 83 0D 83 -2,-1.4 3,-1.7 3,-1.1 -2,-0.0 -0.513 36.1-103.0 -85.4 157.8 6.7 -1.9 -1.3 81 84 A S T 3 S+ 0 0 106 1,-0.3 3,-0.1 -2,-0.2 -1,-0.1 0.857 120.3 36.8 -43.6 -52.0 5.4 -4.6 1.1 82 85 A T T 3 S- 0 0 35 1,-0.3 -1,-0.3 32,-0.1 2,-0.2 0.311 132.4 -50.8 -90.2 5.8 2.1 -5.1 -0.8 83 86 A G E < S-M 80 0D 15 -3,-1.7 -3,-1.1 29,-0.1 -1,-0.3 -0.724 75.6 -45.7 143.9 171.9 3.5 -4.7 -4.3 84 87 A T E -M 79 0D 10 -2,-0.2 2,-0.5 -5,-0.2 -5,-0.2 -0.467 34.1-161.3 -78.0 133.9 5.6 -2.5 -6.6 85 88 A V E +M 78 0D 6 -7,-3.5 -7,-3.4 -2,-0.2 2,-0.3 -0.945 32.0 158.2-100.8 127.7 5.3 1.3 -6.8 86 89 A S E +MN 77 110D 9 24,-2.6 23,-2.0 -2,-0.5 24,-1.5 -0.997 10.4 126.1-149.9 162.8 6.8 2.5 -10.0 87 90 A G E -MN 76 108D 3 -11,-2.5 -11,-2.6 -2,-0.3 2,-0.3 -0.823 47.8 -73.3-177.0-141.5 6.9 5.2 -12.5 88 91 A F E -MN 75 107D 27 19,-1.8 19,-3.2 -13,-0.3 -13,-0.3 -0.975 36.0 -99.0-147.1 159.5 9.4 7.5 -14.1 89 92 A L E + N 0 106D 13 -15,-2.6 -16,-2.5 -2,-0.3 -17,-0.7 -0.462 39.8 165.1 -83.6 142.7 11.6 10.6 -13.4 90 93 A S E -MN 71 105D 0 15,-2.1 15,-2.6 -18,-0.2 2,-0.4 -0.933 25.7-135.7-145.8 161.9 10.5 14.0 -14.4 91 94 A Q E +MN 70 104D 58 -21,-1.6 -21,-2.6 -2,-0.3 2,-0.3 -0.989 34.5 143.5-123.7 134.7 11.8 17.4 -13.5 92 95 A D E - 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