==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 31-MAR-95 1HRN . COMPND 2 MOLECULE: RENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.TONG,P.C.ANDERSON . 667 4 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27353.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 476 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 211 31.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.7 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 . 73 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 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 . 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 . 3 8 8 5 8 4 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 3 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 70 0, 0.0 148,-0.2 0, 0.0 149,-0.2 0.000 360.0 360.0 360.0-161.4 6.3 71.4 52.6 2 -1 A N + 0 0 143 147,-0.3 2,-0.2 146,-0.1 148,-0.2 0.212 360.0 117.3-134.1 13.5 8.1 72.8 55.8 3 0 A T B -a 150 0A 63 146,-3.3 148,-3.0 145,-0.1 149,-0.4 -0.530 35.0-177.7 -87.6 147.6 10.5 70.1 56.6 4 1 A T - 0 0 68 -2,-0.2 2,-0.4 146,-0.2 170,-0.2 -0.979 9.2-167.3-141.1 128.8 14.3 70.4 56.7 5 2 A S E -B 173 0B 12 168,-2.1 168,-5.6 -2,-0.4 2,-0.4 -0.905 2.8-158.9-121.5 140.2 16.5 67.4 57.4 6 3 A S E -B 172 0B 53 -2,-0.4 2,-0.5 166,-0.3 166,-0.3 -0.951 5.7-151.8-123.8 149.0 20.1 67.3 58.2 7 4 A V E -B 171 0B 7 164,-3.1 164,-1.9 -2,-0.4 2,-0.3 -0.966 16.3-139.5-114.6 121.5 22.6 64.5 58.0 8 5 A I E -B 170 0B 98 -2,-0.5 12,-0.4 162,-0.2 2,-0.3 -0.641 24.0-155.6 -79.5 141.7 25.5 64.5 60.4 9 6 A L E -B 169 0B 4 160,-2.5 160,-1.1 -2,-0.3 159,-1.0 -0.853 12.4-132.8-117.8 157.2 28.8 63.4 58.7 10 7 A T E -G 18 0C 67 8,-2.8 8,-2.0 -2,-0.3 2,-0.7 -0.788 16.3-144.9-103.4 133.0 32.1 62.0 59.9 11 8 A N E -G 17 0C 18 -2,-0.4 2,-0.8 6,-0.2 152,-0.3 -0.916 12.7-166.9-101.3 106.9 35.3 63.5 58.6 12 9 A Y E >> S-G 16 0C 78 4,-2.6 3,-2.1 -2,-0.7 4,-1.8 -0.807 71.0 -38.0 -96.1 109.2 38.0 60.9 58.1 13 10 A M T 34 S- 0 0 89 -2,-0.8 -1,-0.2 1,-0.3 4,-0.1 0.632 101.0 -75.5 48.9 28.0 41.4 62.5 57.6 14 11 A D T 34 S+ 0 0 23 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.517 128.3 79.3 68.6 7.1 40.0 65.5 55.6 15 12 A T T <4 S+ 0 0 18 -3,-2.1 2,-0.4 1,-0.3 -2,-0.2 0.565 87.2 45.9-120.2 -20.1 39.6 63.2 52.6 16 13 A Q E < -G 12 0C 28 -4,-1.8 -4,-2.6 209,-0.1 2,-0.5 -0.957 57.5-179.1-134.0 117.1 36.5 61.2 53.2 17 14 A Y E +G 11 0C 9 -2,-0.4 17,-0.5 -6,-0.2 2,-0.3 -0.958 20.5 157.7-112.0 123.9 33.2 62.7 54.5 18 15 A Y E -G 10 0C 10 -8,-2.0 -8,-2.8 -2,-0.5 2,-0.2 -0.942 22.3-166.9-146.4 164.3 30.3 60.3 55.0 19 16 A G E -H 32 0D 2 13,-2.4 13,-3.1 -2,-0.3 2,-0.3 -0.749 30.1 -91.9-138.2-175.4 27.0 59.8 56.8 20 17 A E E +H 31 0D 92 -12,-0.4 77,-0.4 -2,-0.2 2,-0.3 -0.854 29.5 179.9-115.9 144.0 24.7 57.0 57.5 21 18 A I E -H 30 0D 5 9,-1.7 9,-2.6 -2,-0.3 2,-0.4 -0.915 19.5-138.5-133.9 152.1 21.6 55.6 55.8 22 19 A G E -HI 29 95D 8 73,-1.8 73,-2.6 -2,-0.3 2,-0.4 -0.944 18.2-171.1-115.5 132.1 19.3 52.8 56.6 23 20 A I E > +HI 28 94D 0 5,-2.5 5,-1.4 -2,-0.4 71,-0.2 -0.979 44.7 1.8-125.3 128.9 18.1 50.5 54.0 24 21 A G T 5S- 0 0 5 69,-2.5 42,-0.1 -2,-0.4 71,-0.1 -0.288 90.4 -42.9 97.7 171.2 15.4 47.8 54.4 25 22 A T T 5S+ 0 0 58 1,-0.2 42,-2.5 2,-0.1 43,-0.2 -0.973 135.0 23.9-127.1 107.8 13.1 46.5 57.0 26 23 A P T 5S- 0 0 90 0, 0.0 -1,-0.2 0, 0.0 42,-0.1 0.676 121.1-100.4 -73.1 169.3 14.5 46.3 59.5 27 24 A P T 5 - 0 0 90 0, 0.0 2,-0.5 0, 0.0 -3,-0.2 -0.244 27.3-157.2 -63.6 132.7 17.1 48.9 58.6 28 25 A Q E < -H 23 0D 27 -5,-1.4 -5,-2.5 -4,-0.0 2,-0.3 -0.967 24.6-137.1-109.5 116.9 20.5 47.8 57.5 29 26 A T E +H 22 0D 61 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.642 25.9 176.2 -87.4 136.4 22.9 50.6 58.2 30 27 A F E -H 21 0D 0 -9,-2.6 -9,-1.7 -2,-0.3 2,-0.5 -0.990 28.9-129.6-138.5 150.6 25.6 51.9 55.8 31 28 A K E -H 20 0D 53 -2,-0.3 92,-2.3 -11,-0.2 91,-2.2 -0.838 38.8-179.9 -94.5 128.8 28.2 54.8 55.7 32 29 A V E -Hj 19 123D 0 -13,-3.1 -13,-2.4 -2,-0.5 2,-0.4 -0.983 31.7-128.6-134.4 148.2 27.9 56.6 52.4 33 30 A V E - j 0 124D 13 90,-2.1 92,-3.4 -2,-0.4 2,-0.7 -0.797 25.4-136.8 -89.4 131.8 29.6 59.5 50.7 34 31 A F E - j 0 125D 7 -17,-0.5 2,-0.6 -2,-0.4 92,-0.2 -0.860 28.2-164.7 -94.6 110.0 26.9 62.0 49.4 35 32 A D E > - j 0 126D 12 90,-2.3 92,-3.1 -2,-0.7 3,-1.4 -0.876 28.0-175.5-110.9 108.2 28.3 62.7 45.9 36 33 A T T 3 S+ 0 0 3 -2,-0.6 160,-0.5 1,-0.3 93,-0.2 0.568 85.6 71.1 -72.8 -6.6 27.1 65.8 43.8 37 34 A G T 3 S+ 0 0 26 91,-0.1 -1,-0.3 158,-0.1 2,-0.2 0.437 106.3 26.2 -88.5 3.2 29.3 64.4 41.0 38 35 A S < - 0 0 16 -3,-1.4 90,-2.3 87,-0.1 89,-0.4 -0.910 61.8-141.3-157.2 169.1 27.0 61.4 40.3 39 36 A S + 0 0 1 93,-0.4 2,-0.3 -2,-0.2 101,-0.2 0.358 63.1 94.3-125.9 7.5 23.3 60.3 40.6 40 37 A N - 0 0 7 92,-0.1 86,-1.9 99,-0.1 2,-0.4 -0.668 57.9-140.5-102.2 152.5 23.2 56.6 41.7 41 38 A V E +K 125 0D 3 63,-0.4 65,-2.7 -2,-0.3 2,-0.3 -0.903 31.6 162.3-104.8 141.5 22.8 55.1 45.0 42 39 A W E +Kl 124 106D 0 82,-2.1 82,-2.0 -2,-0.4 65,-0.2 -0.963 17.6 177.2-154.7 148.3 24.8 51.9 45.8 43 40 A V E - l 0 107D 0 63,-2.3 65,-2.4 -2,-0.3 80,-0.1 -0.943 45.8 -85.0-137.9 161.4 26.1 49.8 48.7 44 41 A P E - l 0 108D 0 0, 0.0 17,-2.9 0, 0.0 2,-0.3 -0.298 48.7-130.8 -64.1 148.0 28.1 46.5 48.8 45 42 A S B > -o 61 0E 0 63,-2.5 3,-1.8 15,-0.3 17,-0.2 -0.790 16.2-129.5-105.1 152.5 25.9 43.4 48.5 46 43 A S T 3 S+ 0 0 24 15,-3.1 16,-0.1 -2,-0.3 -1,-0.1 0.684 113.1 64.8 -68.9 -13.4 25.8 40.1 50.4 47 44 A K T 3 S+ 0 0 108 14,-0.4 2,-0.5 61,-0.1 -1,-0.3 0.522 76.3 114.0 -86.6 3.4 26.0 38.6 46.9 48 45 A a S < S- 0 0 0 -3,-1.8 62,-0.1 60,-0.2 61,-0.1 -0.567 78.5-110.5 -75.0 122.9 29.5 40.1 46.5 49 46 A S > - 0 0 53 60,-0.8 3,-1.9 -2,-0.5 6,-0.2 -0.295 14.8-135.3 -49.5 137.0 32.1 37.4 46.3 50 46AA R T 3 S+ 0 0 128 1,-0.3 -1,-0.2 5,-0.1 6,-0.1 0.551 100.6 81.9 -74.4 -2.4 34.3 37.3 49.4 51 46BA L T 3 S+ 0 0 159 1,-0.1 2,-0.9 4,-0.1 -1,-0.3 0.749 77.3 80.1 -71.9 -16.2 37.2 36.9 46.9 52 47 A Y S X> S- 0 0 74 -3,-1.9 3,-1.3 1,-0.2 4,-0.7 -0.780 74.3-161.2 -87.1 103.0 36.7 40.7 46.8 53 48 A T H >> S+ 0 0 64 -2,-0.9 4,-1.7 1,-0.3 3,-1.4 0.875 87.2 64.1 -56.6 -37.1 38.5 41.8 50.0 54 49 A A H 34 S+ 0 0 0 57,-0.5 -1,-0.3 1,-0.3 4,-0.2 0.840 101.8 51.7 -56.6 -30.0 36.7 45.1 49.9 55 50 A a H <4 S+ 0 0 2 -3,-1.3 -1,-0.3 56,-0.3 -2,-0.2 0.698 104.7 55.0 -76.6 -20.8 33.5 43.2 50.5 56 51 A V H << S+ 0 0 80 -3,-1.4 -2,-0.2 -4,-0.7 -1,-0.2 0.851 113.5 42.9 -77.9 -33.0 35.1 41.3 53.4 57 52 A Y S < S+ 0 0 161 -4,-1.7 2,-0.3 2,-0.1 -2,-0.2 0.242 107.6 70.9 -97.4 1.4 35.8 44.8 55.0 58 53 A H S S- 0 0 23 -4,-0.2 2,-0.2 -3,-0.2 64,-0.1 -0.807 88.3 -96.0-117.9 160.3 32.5 46.5 54.3 59 54 A K - 0 0 90 -2,-0.3 2,-0.5 -28,-0.1 -2,-0.1 -0.552 44.4-146.8 -67.1 133.1 28.9 46.4 55.5 60 55 A L - 0 0 31 -2,-0.2 2,-0.4 -17,-0.1 -15,-0.3 -0.942 7.4-129.0-113.9 131.4 26.9 44.2 53.1 61 56 A F B -o 45 0E 0 -17,-2.9 -15,-3.1 -2,-0.5 2,-0.7 -0.548 21.0-164.4 -74.2 126.2 23.2 44.6 52.1 62 57 A D > - 0 0 44 -2,-0.4 3,-1.8 -17,-0.2 4,-0.1 -0.897 9.6-171.6-115.9 100.4 21.3 41.3 52.5 63 58 A A G > S+ 0 0 5 -2,-0.7 3,-2.1 1,-0.3 6,-0.2 0.851 82.4 69.1 -60.2 -28.6 18.0 41.4 50.6 64 59 A S G 3 S+ 0 0 96 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.649 98.3 49.0 -73.6 -2.9 17.1 38.2 52.2 65 60 A D G < S+ 0 0 101 -3,-1.8 2,-0.5 -39,-0.0 -1,-0.3 0.273 96.4 89.7-109.8 8.2 16.8 39.8 55.6 66 61 A S < - 0 0 14 -3,-2.1 3,-0.3 1,-0.1 -42,-0.1 -0.927 52.0-170.0-114.5 125.3 14.6 42.6 54.3 67 62 A S S S+ 0 0 102 -42,-2.5 -1,-0.1 -2,-0.5 -43,-0.0 0.515 88.6 51.8 -90.3 0.6 10.9 42.5 54.2 68 63 A S S S+ 0 0 20 -43,-0.2 -1,-0.2 -42,-0.1 -44,-0.1 0.501 81.8 122.0-111.0 -4.4 10.4 45.6 52.2 69 64 A Y - 0 0 58 -3,-0.3 2,-0.4 -6,-0.2 23,-0.2 -0.163 43.7-161.6 -57.3 144.0 12.8 44.7 49.4 70 65 A K E -M 91 0D 129 21,-3.1 21,-2.3 0, 0.0 -1,-0.1 -0.985 18.9-126.3-131.1 124.5 11.7 44.5 45.8 71 66 A H E +M 90 0D 138 -2,-0.4 19,-0.2 19,-0.2 21,-0.0 -0.259 41.9 148.9 -67.2 150.3 13.7 42.6 43.2 72 67 A N E - 0 0 64 17,-0.7 18,-0.2 2,-0.0 -1,-0.2 0.332 20.0-173.1-138.0 -68.7 14.9 44.1 40.0 73 68 A G E + 0 0 27 16,-3.5 17,-0.1 1,-0.3 2,-0.1 0.392 24.4 149.7 88.6 -1.9 18.1 42.6 39.0 74 69 A T E - 0 0 78 15,-0.2 15,-2.4 14,-0.1 -1,-0.3 -0.433 48.3-113.7 -62.5 141.9 19.1 44.6 36.1 75 70 A E E +M 88 0D 169 13,-0.2 2,-0.3 -2,-0.1 13,-0.3 -0.470 38.3 173.3 -79.1 148.1 22.8 44.9 35.7 76 71 A L E -M 87 0D 16 11,-1.9 11,-2.7 -2,-0.1 2,-0.4 -0.998 20.2-158.1-150.3 150.9 24.8 48.1 36.1 77 72 A T E -M 86 0D 48 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.985 12.7-152.8-122.5 138.6 28.3 49.3 36.3 78 73 A L E -M 85 0D 6 7,-3.3 7,-2.0 -2,-0.4 2,-0.6 -0.949 7.8-160.9-119.0 113.1 29.3 52.6 37.9 79 74 A R E +M 84 0D 202 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.786 13.5 175.3 -97.3 115.6 32.4 54.3 36.6 80 75 A Y E > -M 83 0D 50 3,-3.0 3,-0.6 -2,-0.6 -42,-0.0 -0.742 45.8-104.2-113.5 166.5 34.0 56.9 38.8 81 76 A S T 3 S+ 0 0 99 -2,-0.3 218,-0.1 1,-0.2 3,-0.1 0.860 120.4 31.9 -56.0 -37.0 37.2 58.8 38.3 82 77 A T T 3 S- 0 0 108 1,-0.2 2,-0.3 33,-0.0 -1,-0.2 0.381 129.7 -17.0-103.4 1.0 39.1 56.6 40.8 83 78 A G E < -M 80 0D 14 -3,-0.6 -3,-3.0 32,-0.1 2,-0.4 -0.979 56.1-117.1 173.8 174.8 37.4 53.3 40.4 84 79 A T E -M 79 0D 49 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.981 15.1-164.9-136.8 143.5 34.5 51.3 39.2 85 80 A V E -M 78 0D 1 -7,-2.0 -7,-3.3 -2,-0.4 2,-0.3 -0.936 9.1-163.4-122.8 154.1 31.8 49.2 40.9 86 81 A S E +MN 77 110D 24 24,-1.9 23,-2.6 -2,-0.3 24,-1.7 -0.984 29.6 98.6-136.6 153.9 29.5 46.7 39.3 87 82 A G E -MN 76 108D 5 -11,-2.7 -11,-1.9 -2,-0.3 2,-0.3 -0.800 55.9 -66.7 171.3-140.4 26.3 44.9 40.3 88 83 A F E -MN 75 107D 32 19,-1.9 19,-3.2 -13,-0.3 2,-0.2 -0.968 40.3 -97.5-148.2 158.6 22.6 45.0 39.9 89 84 A L E + N 0 106D 10 -15,-2.4 -16,-3.5 -2,-0.3 -17,-0.7 -0.616 36.4 168.3 -83.7 145.5 19.5 47.0 40.9 90 85 A S E -MN 71 105D 0 15,-2.2 15,-2.8 -2,-0.2 2,-0.4 -0.909 24.5-132.1-137.2 168.1 17.2 46.4 43.8 91 86 A Q E +MN 70 104D 62 -21,-2.3 -21,-3.1 -2,-0.3 2,-0.3 -0.971 36.8 137.6-128.7 139.7 14.5 48.5 45.4 92 87 A D E - 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