==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-FEB-06 2G21 . COMPND 2 MOLECULE: RENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.D.HOLSWORTH,M.JALAIEA,E.ZHANGA,P.MCCONNELLA . 658 4 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 471 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 210 31.9 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 . 84 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.1 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 7 0 2 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 . 2 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 9 4 9 6 4 1 1 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 . 1 1 1 0 1 0 1 2 0 0 0 0 1 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 3 A S 0 0 68 0, 0.0 167,-3.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 135.8 12.9 124.6 137.5 2 4 A S E -A 167 0A 59 165,-0.3 2,-0.4 91,-0.2 165,-0.2 -0.886 360.0-150.1-124.3 155.3 12.2 120.8 137.3 3 5 A V E -A 166 0A 8 163,-2.9 163,-2.2 -2,-0.3 2,-0.3 -0.990 16.4-134.0-125.4 127.1 12.2 118.3 134.5 4 6 A I E -A 165 0A 101 -2,-0.4 12,-0.5 161,-0.2 2,-0.3 -0.621 24.9-155.4 -79.9 137.8 10.0 115.2 134.5 5 7 A L E -A 164 0A 1 159,-2.6 159,-1.6 -2,-0.3 158,-0.7 -0.879 9.3-135.7-117.1 148.3 11.8 112.0 133.6 6 8 A T E -F 14 0B 74 8,-3.5 8,-1.7 -2,-0.3 2,-0.6 -0.756 16.9-140.2 -98.1 144.3 10.6 108.7 132.1 7 9 A N E -F 13 0B 16 -2,-0.3 2,-0.7 6,-0.2 152,-0.2 -0.930 14.4-167.6-111.8 113.1 11.9 105.4 133.5 8 10 A Y E >> S-F 12 0B 76 4,-3.0 3,-2.5 -2,-0.6 4,-1.9 -0.898 70.6 -37.6-104.1 111.8 12.6 102.7 131.0 9 11 A M T 34 S- 0 0 106 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.642 99.4 -78.6 50.7 21.6 13.2 99.3 132.5 10 12 A D T 34 S+ 0 0 28 2,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.687 127.7 82.0 64.8 14.1 15.0 100.8 135.5 11 13 A T T <4 S+ 0 0 23 -3,-2.5 2,-0.4 1,-0.3 -2,-0.2 0.540 86.8 43.3-123.2 -17.3 18.1 101.1 133.3 12 14 A Q E < -F 8 0B 32 -4,-1.9 -4,-3.0 208,-0.1 2,-0.4 -0.993 58.2-176.3-135.6 127.5 17.5 104.3 131.3 13 15 A Y E +F 7 0B 6 -2,-0.4 17,-0.4 -6,-0.2 2,-0.3 -0.988 18.7 155.2-125.2 125.2 16.1 107.6 132.7 14 16 A Y E -F 6 0B 18 -8,-1.7 -8,-3.5 -2,-0.4 2,-0.2 -0.976 21.8-168.3-148.6 160.7 15.5 110.6 130.5 15 17 A G E -G 28 0C 3 13,-2.3 13,-3.2 -2,-0.3 2,-0.3 -0.719 32.6 -92.1-134.3-176.5 13.5 113.8 130.1 16 18 A E E +G 27 0C 103 -12,-0.5 77,-0.5 -2,-0.2 2,-0.3 -0.795 31.1 177.6-112.0 150.6 12.9 116.1 127.2 17 19 A I E -G 26 0C 7 9,-1.7 9,-2.0 -2,-0.3 2,-0.4 -0.932 22.7-130.4-138.6 159.4 14.5 119.3 125.9 18 20 A G E -GH 25 91C 9 73,-1.7 73,-2.7 -2,-0.3 2,-0.4 -0.902 19.0-166.3-113.8 144.7 13.8 121.5 122.9 19 21 A I E > -GH 24 90C 0 5,-1.6 5,-1.6 -2,-0.4 71,-0.2 -0.995 47.1 -9.2-134.3 130.3 16.5 122.7 120.5 20 22 A G T 5S- 0 0 1 69,-2.2 42,-0.1 -2,-0.4 68,-0.1 -0.169 93.6 -34.3 84.6-177.4 16.3 125.4 117.9 21 23 A T T 5S+ 0 0 53 2,-0.1 42,-2.0 1,-0.1 43,-0.3 -0.976 135.2 24.2-132.3 115.8 13.5 127.5 116.5 22 24 A P T 5S- 0 0 90 0, 0.0 -3,-0.1 0, 0.0 42,-0.1 0.660 119.8-102.5 -68.0 168.5 10.9 126.2 116.3 23 25 A P T 5 - 0 0 88 0, 0.0 2,-0.5 0, 0.0 -3,-0.2 -0.321 27.4-151.5 -64.4 139.0 11.9 123.8 119.1 24 26 A Q E < -G 19 0C 29 -5,-1.6 -5,-1.6 -4,-0.1 2,-0.3 -0.969 22.9-131.7-110.3 121.3 12.9 120.3 118.0 25 27 A T E +G 18 0C 53 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.561 28.1 177.6 -82.0 137.8 12.2 117.8 120.8 26 28 A F E -G 17 0C 1 -9,-2.0 -9,-1.7 -2,-0.3 2,-0.5 -0.996 29.1-131.2-140.8 143.9 14.6 115.2 122.1 27 29 A K E +G 16 0C 70 -2,-0.3 91,-2.6 -11,-0.2 92,-2.5 -0.824 40.5 177.4 -91.3 125.3 14.7 112.6 124.8 28 30 A V E -Gi 15 119C 0 -13,-3.2 -13,-2.3 -2,-0.5 2,-0.5 -0.979 31.8-129.6-137.3 148.8 17.9 113.0 126.7 29 31 A V E - i 0 120C 12 90,-1.7 92,-2.8 -2,-0.3 2,-1.0 -0.798 22.3-136.8 -93.0 126.8 19.7 111.5 129.7 30 32 A F E - i 0 121C 4 -2,-0.5 2,-0.6 -17,-0.4 92,-0.2 -0.788 32.3-169.0 -86.7 109.3 20.9 114.0 132.3 31 33 A D E > - i 0 122C 8 90,-1.8 92,-3.3 -2,-1.0 3,-1.3 -0.896 31.1-174.7-113.7 110.6 24.3 112.6 132.9 32 34 A T T 3 S+ 0 0 4 -2,-0.6 159,-0.4 1,-0.2 93,-0.2 0.578 85.6 71.3 -74.5 -8.5 26.6 113.7 135.8 33 35 A G T 3 S+ 0 0 38 91,-0.1 2,-0.3 157,-0.1 -1,-0.2 0.462 103.4 33.4 -86.5 -3.6 29.2 111.3 134.3 34 36 A S < - 0 0 18 -3,-1.3 90,-2.7 87,-0.1 89,-0.5 -0.864 62.7-147.0-140.6 175.4 29.9 113.5 131.2 35 37 A S + 0 0 3 93,-0.4 2,-0.3 -2,-0.3 101,-0.2 0.385 64.0 86.1-130.4 3.9 30.0 117.2 130.4 36 38 A N - 0 0 9 92,-0.1 86,-1.9 99,-0.1 2,-0.4 -0.745 62.2-135.6-108.1 158.4 28.9 117.6 126.7 37 39 A V E +J 121 0C 4 63,-0.4 65,-3.5 -2,-0.3 2,-0.3 -0.871 34.2 158.8-107.3 140.0 25.5 118.0 125.2 38 40 A W E -Jk 120 102C 0 82,-2.2 82,-2.0 -2,-0.4 65,-0.2 -0.972 19.3-178.6-160.7 150.1 24.6 116.0 122.0 39 41 A V E - k 0 103C 0 63,-2.1 65,-2.6 -2,-0.3 80,-0.1 -0.931 46.5 -82.0-140.6 160.7 21.7 114.7 119.9 40 42 A P E - k 0 104C 0 0, 0.0 17,-3.0 0, 0.0 2,-0.3 -0.367 50.3-130.8 -64.9 147.6 21.6 112.7 116.7 41 43 A S B > -n 57 0D 0 63,-3.0 3,-1.7 15,-0.3 17,-0.2 -0.736 13.4-132.1-105.0 152.9 22.1 114.7 113.6 42 44 A S T 3 S+ 0 0 30 15,-2.4 16,-0.1 -2,-0.3 -1,-0.1 0.665 110.7 65.0 -70.2 -15.9 20.1 114.9 110.3 43 45 A K T 3 S+ 0 0 141 14,-0.3 2,-0.6 61,-0.1 -1,-0.3 0.370 75.8 114.9 -86.7 4.5 23.5 114.6 108.7 44 46 A a S < S- 0 0 2 -3,-1.7 62,-0.1 60,-0.2 61,-0.1 -0.671 77.8-112.7 -79.3 120.7 23.9 111.2 110.2 45 47 A S > - 0 0 52 60,-0.7 3,-1.7 -2,-0.6 6,-0.3 -0.196 15.3-132.5 -50.3 138.7 24.1 108.6 107.4 46 48 A R T 3 S+ 0 0 138 1,-0.3 -1,-0.2 5,-0.1 6,-0.1 0.483 100.8 82.1 -76.6 0.4 21.0 106.4 107.5 47 49 A L T 3 S+ 0 0 153 1,-0.1 2,-1.2 4,-0.1 -1,-0.3 0.731 77.1 80.0 -70.0 -23.8 23.4 103.4 107.1 48 50 A Y S X> S- 0 0 71 -3,-1.7 3,-2.1 1,-0.2 4,-0.7 -0.755 75.1-163.3 -82.7 98.4 23.6 104.0 110.9 49 51 A T H >> S+ 0 0 63 -2,-1.2 4,-1.6 1,-0.3 3,-1.0 0.814 84.8 67.3 -55.0 -31.1 20.4 102.3 111.8 50 52 A A H 34 S+ 0 0 0 57,-0.5 -1,-0.3 1,-0.3 4,-0.1 0.778 98.9 52.4 -61.1 -24.7 20.5 104.0 115.2 51 53 A a H <4 S+ 0 0 1 -3,-2.1 3,-0.3 -6,-0.3 -1,-0.3 0.695 103.4 56.1 -83.7 -20.0 19.9 107.3 113.3 52 54 A V H << S+ 0 0 86 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.841 110.6 46.5 -76.0 -33.2 16.9 105.8 111.5 53 55 A Y S < S+ 0 0 162 -4,-1.6 2,-0.3 2,-0.1 -1,-0.2 0.300 107.4 61.4 -93.4 6.2 15.3 105.0 115.0 54 56 A H S S- 0 0 22 -3,-0.3 2,-0.3 -4,-0.1 64,-0.1 -0.862 90.5 -88.5-130.0 167.5 15.9 108.3 116.8 55 57 A K - 0 0 84 -2,-0.3 2,-0.5 -28,-0.1 -2,-0.1 -0.573 43.8-151.0 -72.5 132.2 14.9 112.0 116.5 56 58 A L - 0 0 30 -2,-0.3 2,-0.5 -17,-0.1 -15,-0.3 -0.911 10.1-129.8-110.0 131.1 17.5 113.8 114.3 57 59 A F B -n 41 0D 0 -17,-3.0 -15,-2.4 -2,-0.5 2,-0.7 -0.670 20.5-161.2 -79.0 125.9 18.3 117.5 114.8 58 60 A D > - 0 0 46 -2,-0.5 3,-2.0 -17,-0.2 4,-0.3 -0.894 9.1-166.9-112.1 102.2 18.1 119.3 111.4 59 61 A A G > S+ 0 0 16 -2,-0.7 3,-1.9 1,-0.3 6,-0.2 0.831 84.3 69.1 -54.5 -35.8 19.9 122.6 111.5 60 62 A S G 3 S+ 0 0 97 1,-0.3 -1,-0.3 -3,-0.1 3,-0.0 0.483 98.4 51.4 -66.3 0.3 18.2 123.7 108.2 61 63 A D G < S+ 0 0 102 -3,-2.0 2,-0.5 -39,-0.1 -1,-0.3 0.414 94.7 82.9-113.4 -2.7 14.9 123.9 110.1 62 64 A S X - 0 0 13 -3,-1.9 3,-0.6 -4,-0.3 -42,-0.1 -0.915 53.2-169.4-108.8 122.6 16.2 126.2 112.9 63 65 A S T 3 S+ 0 0 102 -42,-2.0 -1,-0.1 -2,-0.5 -3,-0.0 0.603 89.8 56.5 -82.3 -12.7 16.4 129.9 112.4 64 66 A S T 3 S+ 0 0 22 -43,-0.3 -1,-0.2 -42,-0.1 -44,-0.1 0.362 81.3 124.7 -98.9 4.5 18.4 130.4 115.6 65 67 A Y < - 0 0 60 -3,-0.6 2,-0.4 -6,-0.2 23,-0.2 -0.325 42.7-163.6 -66.8 143.8 21.1 127.9 114.6 66 68 A K E -L 87 0C 118 21,-2.7 21,-1.9 -2,-0.0 -2,-0.0 -0.979 16.8-132.2-131.6 118.4 24.7 129.0 114.6 67 69 A H E +L 86 0C 136 -2,-0.4 19,-0.1 19,-0.2 18,-0.0 -0.299 39.8 148.7 -69.5 151.5 27.3 127.0 112.7 68 70 A N E - 0 0 67 17,-0.6 18,-0.2 2,-0.0 -1,-0.2 0.318 24.4-166.4-143.0 -61.7 30.6 125.9 114.2 69 71 A G E + 0 0 28 16,-2.6 2,-0.1 1,-0.2 17,-0.1 0.422 26.2 151.3 84.7 -1.7 31.6 122.6 112.7 70 72 A T E - 0 0 80 15,-0.1 15,-2.9 14,-0.1 -1,-0.2 -0.438 44.2-124.8 -66.2 135.3 34.4 121.5 115.0 71 73 A E E +L 84 0C 169 13,-0.2 2,-0.3 -2,-0.1 13,-0.3 -0.458 34.6 172.8 -80.4 151.8 34.6 117.7 115.1 72 74 A L E -L 83 0C 15 11,-2.3 11,-2.3 -2,-0.1 2,-0.4 -0.991 22.3-149.9-156.0 155.1 34.4 115.8 118.4 73 75 A T E -L 82 0C 61 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.993 10.2-154.9-129.7 134.5 34.2 112.3 119.7 74 76 A L E -L 81 0C 8 7,-3.1 7,-2.2 -2,-0.4 2,-0.6 -0.952 8.2-160.8-112.9 122.2 32.5 111.4 122.9 75 77 A R E +L 80 0C 214 -2,-0.5 2,-0.2 5,-0.2 5,-0.2 -0.897 11.7 176.8-110.9 114.3 33.6 108.2 124.7 76 78 A Y E > -L 79 0C 55 3,-2.9 3,-0.8 -2,-0.6 -42,-0.0 -0.639 44.4-105.5-105.1 166.3 31.4 106.5 127.2 77 79 A S T 3 S+ 0 0 92 1,-0.2 3,-0.1 -2,-0.2 217,-0.1 0.789 119.8 35.0 -63.0 -26.8 32.1 103.3 129.0 78 80 A T T 3 S- 0 0 98 1,-0.2 2,-0.3 33,-0.0 -1,-0.2 0.360 128.3 -16.6-110.7 6.2 29.5 101.4 126.9 79 81 A G E < -L 76 0C 15 -3,-0.8 -3,-2.9 32,-0.1 2,-0.3 -0.970 56.3-113.7 171.4 174.0 29.9 103.1 123.6 80 82 A T E -L 75 0C 54 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.955 14.0-169.4-135.1 148.8 31.0 106.0 121.4 81 83 A V E -L 74 0C 2 -7,-2.2 -7,-3.1 -2,-0.3 2,-0.3 -0.986 6.9-168.7-135.8 149.2 29.5 108.8 119.3 82 84 A S E +LM 73 106C 24 24,-1.7 23,-2.2 -2,-0.3 24,-1.9 -0.973 27.7 103.5-138.1 151.1 31.2 111.2 116.9 83 85 A G E -LM 72 104C 6 -11,-2.3 -11,-2.3 -2,-0.3 2,-0.3 -0.882 55.9 -64.3 176.5-144.2 30.1 114.3 115.1 84 86 A F E -LM 71 103C 20 19,-2.1 19,-3.4 -13,-0.3 -13,-0.2 -0.963 40.0-100.7-140.6 157.2 30.5 118.1 115.1 85 87 A L E + M 0 102C 9 -15,-2.9 -16,-2.6 -2,-0.3 -17,-0.6 -0.459 38.3 166.8 -79.3 145.5 29.7 121.1 117.2 86 88 A S E -LM 67 101C 0 15,-2.4 15,-2.9 -18,-0.2 2,-0.4 -0.915 23.7-134.3-146.6 166.7 26.8 123.5 116.7 87 89 A Q E +LM 66 100C 62 -21,-1.9 -21,-2.7 -2,-0.3 2,-0.3 -0.991 35.3 134.4-131.3 141.0 25.1 126.2 118.6 88 90 A D E - 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