==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-AUG-10 3OOT . COMPND 2 MOLECULE: RENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.BOCSKEI . 674 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28364.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 465 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 203 30.1 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 . 71 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 58 8.6 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 5 1 2 2 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 . 4 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 . 6 8 6 4 8 4 2 0 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 2 0 4 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 -2 A G 0 0 66 0, 0.0 149,-0.2 0, 0.0 148,-0.2 0.000 360.0 360.0 360.0-176.2 -18.4 -35.8 28.9 2 -1 A N + 0 0 147 147,-0.6 148,-0.2 146,-0.1 2,-0.2 0.534 360.0 100.9-113.7 -20.2 -22.0 -36.9 28.0 3 0 A T B -a 150 0A 69 146,-2.6 148,-2.4 148,-0.0 2,-0.3 -0.455 42.2-171.2 -87.9 152.4 -22.8 -34.6 25.0 4 1 A T - 0 0 83 146,-0.2 2,-0.4 -2,-0.2 172,-0.2 -0.988 14.3-165.2-130.6 127.4 -22.9 -34.8 21.1 5 2 A S E -B 175 0B 13 170,-2.2 170,-3.5 -2,-0.3 2,-0.4 -0.986 1.9-159.2-123.5 128.2 -23.3 -31.6 19.1 6 3 A S E -B 174 0B 59 -2,-0.4 2,-0.5 168,-0.2 168,-0.2 -0.895 5.2-157.8-111.4 138.5 -24.3 -31.5 15.4 7 4 A V E -B 173 0B 8 166,-2.8 166,-2.2 -2,-0.4 2,-0.4 -0.968 17.5-139.0-111.9 120.7 -23.8 -28.7 12.9 8 5 A I E -B 172 0B 94 -2,-0.5 12,-0.4 164,-0.2 2,-0.3 -0.669 22.0-152.3 -78.8 132.8 -26.1 -28.7 9.8 9 6 A L E -B 171 0B 3 162,-2.4 162,-1.1 -2,-0.4 161,-0.8 -0.798 8.9-133.9-108.8 152.0 -24.2 -27.8 6.5 10 7 A T E -G 18 0C 70 8,-3.2 8,-1.8 -2,-0.3 2,-0.7 -0.855 17.6-140.6-102.0 132.2 -25.4 -26.2 3.3 11 8 A N E -G 17 0C 16 -2,-0.4 2,-0.7 6,-0.2 6,-0.2 -0.881 16.0-169.6 -97.8 114.3 -24.2 -27.9 0.1 12 9 A Y E >> S-G 16 0C 78 4,-3.0 3,-1.8 -2,-0.7 4,-1.7 -0.920 70.7 -39.5-107.7 105.6 -23.4 -25.3 -2.6 13 10 A M T 34 S- 0 0 95 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.656 99.7 -76.7 54.2 24.7 -22.8 -26.9 -6.0 14 11 A D T 34 S+ 0 0 2 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.510 127.8 81.6 67.2 6.3 -20.9 -29.9 -4.5 15 12 A T T <4 S+ 0 0 24 -3,-1.8 2,-0.4 1,-0.3 -2,-0.2 0.599 88.6 41.7-113.1 -21.2 -17.8 -27.6 -4.0 16 13 A Q E < -G 12 0C 26 -4,-1.7 -4,-3.0 211,-0.1 2,-0.5 -0.990 55.3-177.0-136.3 125.3 -18.6 -25.7 -0.8 17 14 A Y E +G 11 0C 7 -2,-0.4 17,-0.5 -6,-0.2 2,-0.3 -0.986 20.1 173.2-122.3 114.4 -20.1 -27.1 2.4 18 15 A Y E -G 10 0C 22 -8,-1.8 -8,-3.2 -2,-0.5 15,-0.2 -0.950 15.6-172.2-129.6 150.8 -20.7 -24.5 5.0 19 16 A G E -H 32 0D 2 13,-2.5 13,-2.6 -2,-0.3 2,-0.4 -0.509 29.7 -94.8-119.4-172.4 -22.3 -24.2 8.5 20 17 A E E +H 31 0D 117 -12,-0.4 77,-0.4 11,-0.2 2,-0.3 -0.908 30.8 178.0-115.9 143.9 -23.1 -21.3 10.9 21 18 A I E -H 30 0D 2 9,-1.8 9,-2.2 -2,-0.4 2,-0.4 -0.945 19.4-140.1-134.5 152.9 -21.3 -19.9 13.8 22 19 A G E -HI 29 95D 6 73,-1.7 73,-2.6 -2,-0.3 2,-0.4 -0.947 15.5-166.9-115.0 132.4 -22.1 -17.0 16.1 23 20 A I E > -HI 28 94D 0 5,-2.3 5,-1.9 -2,-0.4 71,-0.2 -0.995 46.7 -7.1-125.3 126.7 -19.4 -14.6 17.3 24 21 A G T 5S- 0 0 3 69,-2.3 42,-0.1 -2,-0.4 68,-0.1 -0.194 91.3 -36.7 91.2 180.0 -19.8 -12.1 20.2 25 22 A T T 5S+ 0 0 58 1,-0.2 42,-1.9 2,-0.1 43,-0.2 -0.969 135.4 22.4-127.3 110.1 -22.5 -10.7 22.4 26 23 A P T 5S- 0 0 95 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.630 120.5-104.2 -70.8 157.5 -25.1 -10.4 20.9 27 24 A P T 5 - 0 0 84 0, 0.0 2,-0.5 0, 0.0 -3,-0.2 -0.233 25.7-154.2 -59.7 138.4 -24.0 -13.0 18.3 28 25 A Q E < -H 23 0D 29 -5,-1.9 -5,-2.3 -4,-0.0 2,-0.3 -0.946 24.2-135.1-105.6 121.9 -22.9 -11.9 14.8 29 26 A T E -H 22 0D 61 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.696 24.6-179.0 -93.0 141.2 -23.6 -14.8 12.4 30 27 A F E -H 21 0D 2 -9,-2.2 -9,-1.8 -2,-0.3 2,-0.5 -0.984 28.9-127.0-135.7 145.0 -21.2 -16.1 9.8 31 28 A K E -H 20 0D 78 -2,-0.3 91,-2.8 -11,-0.2 92,-2.0 -0.822 42.9-178.2 -89.8 122.6 -21.2 -18.8 7.1 32 29 A V E -Hj 19 123D 0 -13,-2.6 -13,-2.5 -2,-0.5 2,-0.4 -0.963 30.2-133.9-130.1 152.5 -18.0 -20.9 7.6 33 30 A V E - j 0 124D 10 90,-1.5 92,-3.0 -2,-0.3 2,-0.9 -0.819 22.7-136.6 -97.3 133.6 -16.2 -23.9 6.1 34 31 A F E - j 0 125D 5 -17,-0.5 2,-0.5 -2,-0.4 92,-0.2 -0.885 30.5-166.8 -96.6 104.3 -15.0 -26.5 8.7 35 32 A D E > - j 0 126D 16 90,-2.6 92,-3.7 -2,-0.9 3,-0.9 -0.893 30.6-178.0-107.1 115.0 -11.5 -27.2 7.4 36 33 A T T 3 S+ 0 0 4 -2,-0.5 162,-0.5 1,-0.2 93,-0.2 0.550 85.6 69.9 -81.9 -9.9 -9.3 -30.1 8.5 37 34 A G T 3 S+ 0 0 32 91,-0.1 2,-0.3 160,-0.1 -1,-0.2 0.284 106.5 33.1 -88.7 5.2 -6.5 -28.8 6.2 38 35 A S < - 0 0 13 -3,-0.9 90,-2.2 87,-0.1 89,-0.5 -0.943 60.6-149.4-154.6 165.7 -5.9 -25.7 8.5 39 36 A S + 0 0 3 93,-0.4 2,-0.3 -2,-0.3 101,-0.2 0.354 63.7 93.5-124.7 0.6 -6.0 -24.8 12.2 40 37 A N - 0 0 8 92,-0.1 86,-0.6 99,-0.1 2,-0.5 -0.782 58.9-143.1-103.7 146.2 -7.0 -21.1 12.4 41 38 A V E +K 125 0D 4 63,-0.4 65,-3.4 -2,-0.3 2,-0.3 -0.886 31.8 162.4-101.6 131.6 -10.4 -19.4 12.8 42 39 A W E -Kl 124 106D 0 82,-2.0 82,-1.8 -2,-0.5 65,-0.2 -0.992 18.3-179.7-148.6 152.1 -11.0 -16.2 10.8 43 40 A V E - l 0 107D 0 63,-1.9 65,-2.8 -2,-0.3 80,-0.2 -0.952 45.2 -86.9-139.8 154.4 -13.8 -14.0 9.6 44 41 A P E - l 0 108D 0 0, 0.0 17,-2.9 0, 0.0 2,-0.3 -0.410 48.2-133.3 -64.5 140.8 -13.7 -10.8 7.5 45 42 A S B > -o 61 0E 0 63,-3.0 3,-1.5 15,-0.3 17,-0.2 -0.690 13.9-129.3 -95.9 152.2 -13.3 -7.7 9.8 46 43 A S T 3 S+ 0 0 19 15,-2.5 16,-0.1 1,-0.3 -1,-0.1 0.768 111.5 65.7 -66.4 -25.7 -15.3 -4.4 9.7 47 44 A K T 3 S+ 0 0 108 14,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.418 75.9 115.8 -76.9 -0.7 -11.7 -2.8 9.7 48 45 A a S < S- 0 0 3 -3,-1.5 62,-0.1 60,-0.2 61,-0.1 -0.595 77.7-110.1 -72.0 129.0 -11.2 -4.4 6.2 49 46 A S > - 0 0 56 60,-0.8 3,-2.0 -2,-0.3 6,-0.2 -0.373 16.8-132.8 -60.4 131.6 -10.8 -1.6 3.5 50 46AA R T 3 S+ 0 0 142 1,-0.3 -1,-0.1 5,-0.1 6,-0.1 0.471 99.2 83.3 -70.4 3.5 -13.8 -1.6 1.1 51 46BA L T 3 S+ 0 0 160 1,-0.1 2,-0.9 4,-0.1 -1,-0.3 0.605 75.8 79.6 -76.7 -13.5 -11.2 -1.5 -1.8 52 47 A Y S X> S- 0 0 79 -3,-2.0 3,-1.1 1,-0.2 4,-0.6 -0.888 74.5-161.7 -92.1 103.5 -11.2 -5.3 -1.2 53 48 A T H >> S+ 0 0 65 -2,-0.9 4,-1.6 1,-0.2 3,-0.9 0.817 87.1 65.8 -57.5 -34.2 -14.5 -6.2 -3.1 54 49 A A H 3> S+ 0 0 0 57,-0.5 4,-1.4 1,-0.3 -1,-0.2 0.804 100.7 51.5 -57.8 -31.9 -14.6 -9.6 -1.2 55 50 A a H <4 S+ 0 0 2 -3,-1.1 -1,-0.3 56,-0.3 -2,-0.2 0.681 105.2 55.3 -78.0 -22.4 -15.1 -7.5 2.0 56 51 A V H << S+ 0 0 83 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.853 114.2 40.4 -76.6 -35.7 -18.0 -5.6 0.3 57 52 A Y H < S+ 0 0 176 -4,-1.6 -2,-0.2 2,-0.1 2,-0.2 0.747 106.8 70.1 -86.7 -23.5 -19.8 -8.9 -0.4 58 53 A H S < S- 0 0 19 -4,-1.4 2,-0.3 -5,-0.2 64,-0.1 -0.556 90.3 -97.9 -97.1 159.3 -19.1 -10.8 2.8 59 54 A K - 0 0 95 -2,-0.2 2,-0.3 -28,-0.1 -1,-0.1 -0.571 43.0-146.8 -72.5 131.1 -20.5 -10.4 6.3 60 55 A L - 0 0 32 -2,-0.3 2,-0.5 -17,-0.1 -15,-0.3 -0.833 9.0-123.3-106.6 144.4 -18.0 -8.4 8.5 61 56 A F B -o 45 0E 0 -17,-2.9 -15,-2.5 -2,-0.3 2,-0.6 -0.724 21.4-161.9 -85.8 125.4 -17.3 -8.8 12.2 62 57 A D > - 0 0 50 -2,-0.5 3,-1.2 -17,-0.2 -17,-0.0 -0.938 10.5-170.3-113.3 110.1 -17.7 -5.5 14.1 63 58 A A G > S+ 0 0 6 -2,-0.6 3,-1.9 1,-0.2 6,-0.3 0.773 82.1 73.3 -65.2 -31.0 -15.9 -5.6 17.5 64 59 A S G 3 S+ 0 0 103 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 0.590 98.2 47.5 -55.2 -24.3 -17.7 -2.3 18.4 65 60 A D G < S+ 0 0 103 -3,-1.2 2,-0.5 -39,-0.0 -1,-0.3 0.168 94.4 90.8-107.1 8.9 -21.0 -4.2 18.8 66 61 A S < - 0 0 15 -3,-1.9 3,-0.2 1,-0.1 -42,-0.1 -0.956 49.0-172.6-112.7 125.7 -19.6 -7.0 21.0 67 62 A S S S+ 0 0 96 -42,-1.9 -1,-0.1 -2,-0.5 -4,-0.0 0.659 90.0 53.3 -84.3 -20.7 -19.6 -6.7 24.8 68 63 A S S S+ 0 0 18 -43,-0.2 -1,-0.2 25,-0.1 -44,-0.1 0.463 81.3 126.7 -92.3 -5.7 -17.6 -9.9 25.2 69 64 A Y - 0 0 52 -6,-0.3 2,-0.5 -3,-0.2 23,-0.2 -0.258 40.5-165.7 -59.5 134.4 -14.8 -8.8 22.8 70 65 A K E -M 91 0D 117 21,-3.1 21,-2.6 -2,-0.0 2,-0.1 -0.994 17.4-135.1-125.8 116.8 -11.2 -8.9 24.1 71 66 A H E +M 90 0D 138 -2,-0.5 19,-0.2 19,-0.2 21,-0.0 -0.342 40.0 149.0 -69.0 150.7 -8.6 -7.0 22.1 72 67 A N E - 0 0 65 17,-0.6 18,-0.2 -2,-0.1 -1,-0.2 0.229 23.6-167.9-141.9 -66.0 -5.2 -8.4 21.1 73 68 A G E + 0 0 29 16,-2.6 2,-0.2 1,-0.3 17,-0.1 0.458 25.0 153.5 84.9 5.1 -4.2 -6.9 17.7 74 69 A T E - 0 0 80 15,-0.1 15,-2.5 14,-0.1 -1,-0.3 -0.490 46.9-116.6 -64.9 132.4 -1.2 -9.2 16.9 75 70 A E E -M 88 0D 172 13,-0.3 2,-0.3 -2,-0.2 13,-0.3 -0.374 34.2-173.4 -73.1 146.3 -0.8 -9.3 13.1 76 71 A L E -M 87 0D 14 11,-2.6 11,-2.2 -2,-0.1 2,-0.5 -0.995 16.5-160.6-145.5 139.1 -1.3 -12.6 11.2 77 72 A T E -M 86 0D 47 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.992 9.9-163.2-118.3 121.1 -0.8 -13.8 7.6 78 73 A L E -M 85 0D 5 7,-3.0 7,-2.1 -2,-0.5 2,-0.5 -0.942 5.4-165.2-112.2 110.9 -2.6 -17.0 6.6 79 74 A R E +M 84 0D 187 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.827 11.6 175.8 -98.7 126.2 -1.2 -18.6 3.4 80 75 A Y - 0 0 59 3,-2.3 3,-0.4 -2,-0.5 -42,-0.0 -0.825 45.5-101.6-124.5 167.6 -3.3 -21.3 1.7 81 76 A S S S+ 0 0 75 -2,-0.3 220,-0.1 1,-0.2 3,-0.1 0.818 121.4 36.1 -56.8 -37.4 -3.0 -23.2 -1.6 82 77 A T S S- 0 0 91 1,-0.2 2,-0.3 218,-0.0 -1,-0.2 0.513 129.0 -35.9 -95.8 -13.6 -5.5 -21.0 -3.4 83 78 A G - 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