==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-JUN-11 3S9A . COMPND 2 MOLECULE: VIPERA RUSSELLI PROTEINASE RVV-V GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII SIAMENSIS; . AUTHOR D.NAKAYAMA,Y.BEN AMMAR,S.TAKEDA . 234 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10659.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 57.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 30.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.6 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 . 1 0.4 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 . 13 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 0 0 0 0 1 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 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 0 0 PARALLEL BRIDGES PER LADDER . 3 2 3 6 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 1 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 16 A V 0 0 1 0, 0.0 3,-0.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 128.6 24.8 26.2 26.3 2 17 A V B +A 174 0A 17 172,-2.2 172,-1.4 1,-0.2 127,-0.1 -0.821 360.0 26.2-107.8 149.1 27.3 29.0 25.4 3 18 A G S S+ 0 0 49 125,-0.4 -1,-0.2 -2,-0.3 2,-0.1 0.626 104.9 91.1 80.2 14.0 28.0 30.3 21.9 4 19 A G - 0 0 32 -3,-0.3 2,-0.3 136,-0.1 -1,-0.3 -0.369 64.8-122.4-121.8-158.2 24.5 29.3 20.6 5 20 A D E -B 139 0B 117 134,-2.3 134,-3.7 -2,-0.1 2,-0.0 -0.877 47.8 -60.2-142.9 172.4 21.0 30.7 20.2 6 21 A E E -B 138 0B 95 -2,-0.3 132,-0.3 132,-0.3 3,-0.1 -0.354 63.6-115.2 -57.1 132.4 17.5 29.9 21.2 7 22 A a - 0 0 3 130,-2.7 2,-0.1 117,-0.1 -1,-0.1 -0.292 33.3 -92.2 -67.9 156.9 16.6 26.5 19.8 8 23 A N > - 0 0 89 1,-0.1 3,-1.3 2,-0.0 4,-0.3 -0.489 38.6-123.1 -66.3 138.2 13.9 26.1 17.2 9 24 A I T 3 S+ 0 0 67 1,-0.2 3,-0.2 -2,-0.1 -1,-0.1 0.678 108.1 43.1 -61.9 -16.8 10.7 25.4 19.2 10 25 A N T 3 S+ 0 0 87 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.478 94.3 78.6-107.2 -3.1 10.0 22.1 17.3 11 26 A E S < S+ 0 0 52 -3,-1.3 -2,-0.1 1,-0.2 -1,-0.1 0.440 93.5 46.6 -88.0 2.4 13.6 20.7 17.3 12 27 A H > + 0 0 7 -4,-0.3 3,-1.8 -3,-0.2 -1,-0.2 -0.109 56.9 137.6-136.9 43.0 13.6 19.4 20.9 13 28 A P T 3 S+ 0 0 23 0, 0.0 92,-1.4 0, 0.0 41,-0.3 0.731 79.5 52.4 -61.2 -20.9 10.4 17.5 21.6 14 29 A F T 3 S+ 0 0 22 90,-0.2 18,-2.8 92,-0.1 2,-0.5 0.497 85.4 108.2 -91.6 -7.0 12.3 14.8 23.4 15 30 A L E < -I 31 0C 2 -3,-1.8 39,-0.4 16,-0.2 40,-0.4 -0.604 47.1-176.2 -79.3 123.4 14.1 17.3 25.7 16 31 A V E -I 30 0C 2 14,-2.4 14,-1.6 -2,-0.5 2,-0.4 -0.862 18.5-134.0-117.3 152.7 13.0 17.2 29.3 17 32 A A E -IJ 29 52C 0 35,-2.2 35,-2.4 -2,-0.3 2,-0.4 -0.872 16.0-146.7-107.1 139.4 14.1 19.5 32.1 18 33 A L E +IJ 28 51C 0 10,-3.0 9,-1.4 -2,-0.4 10,-1.1 -0.896 32.3 138.6-110.7 135.5 15.0 18.1 35.6 19 34 A Y E - J 0 50C 29 31,-2.3 31,-2.4 -2,-0.4 2,-0.3 -0.698 39.6-107.4-146.9-163.6 14.4 19.9 38.9 20 35 A T E - J 0 49C 22 3,-2.2 29,-0.2 29,-0.2 5,-0.0 -0.895 26.9-106.2-136.8 168.4 13.2 18.8 42.4 21 36 A S S S+ 0 0 55 27,-1.7 3,-0.1 -2,-0.3 28,-0.1 0.607 123.2 45.2 -67.8 -9.0 10.3 19.1 44.7 22 36AA A S S+ 0 0 95 1,-0.3 2,-0.4 26,-0.2 -1,-0.2 0.754 117.4 36.1-102.9 -33.8 12.4 21.6 46.6 23 37 A S - 0 0 49 2,-0.1 -3,-2.2 1,-0.1 -1,-0.3 -0.981 52.6-156.6-130.6 137.0 13.8 23.8 43.8 24 38 A S + 0 0 109 -2,-0.4 2,-0.2 -5,-0.2 -1,-0.1 0.443 63.3 119.5 -83.2 -2.0 12.4 25.0 40.5 25 39 A T - 0 0 80 1,-0.1 2,-1.0 2,-0.0 -5,-0.2 -0.458 69.5-128.1 -67.7 132.9 16.0 25.4 39.3 26 40 A I + 0 0 14 -2,-0.2 -7,-0.2 1,-0.2 -1,-0.1 -0.738 34.1 171.1 -84.6 103.7 16.8 23.2 36.3 27 41 A H - 0 0 27 -9,-1.4 151,-0.4 -2,-1.0 2,-0.3 0.602 64.4 -5.9 -90.3 -12.1 19.9 21.3 37.4 28 42 A b E -I 18 0C 2 -10,-1.1 -10,-3.0 151,-0.1 2,-0.2 -0.958 60.7-134.2-164.9 176.0 19.9 19.0 34.4 29 43 A A E -I 17 0C 0 151,-2.5 12,-0.4 -2,-0.3 2,-0.3 -0.669 18.6-169.5-129.2-175.9 18.0 17.9 31.3 30 44 A G E -I 16 0C 0 -14,-1.6 -14,-2.4 -2,-0.2 2,-0.4 -0.952 20.5-108.2-165.6 176.7 17.2 14.5 29.8 31 45 A A E -IK 15 39C 1 8,-3.1 8,-3.2 -2,-0.3 2,-0.4 -0.978 22.6-126.6-128.1 130.4 15.8 12.7 26.7 32 46 A L E + K 0 38C 0 -18,-2.8 75,-2.5 -2,-0.4 6,-0.3 -0.581 24.4 179.0 -73.1 123.3 12.5 11.0 26.2 33 47 A I E - 0 0 21 4,-2.8 2,-0.2 -2,-0.4 -1,-0.2 0.816 66.1 -29.3 -92.4 -40.7 13.0 7.5 24.9 34 48 A N E > S- K 0 37C 45 3,-1.2 3,-0.6 72,-0.1 -1,-0.3 -0.851 89.2 -60.1-157.4-167.9 9.3 6.4 24.8 35 49 A R T 3 S+ 0 0 131 -2,-0.2 63,-2.0 1,-0.2 61,-0.1 0.698 133.0 25.4 -62.2 -17.7 6.1 7.2 26.5 36 50 A E T 3 S+ 0 0 55 61,-0.2 58,-2.8 1,-0.1 2,-0.4 0.395 109.2 74.4-126.9 2.6 7.4 6.0 29.9 37 51 A W E < -KL 34 93C 7 -3,-0.6 -4,-2.8 56,-0.2 -3,-1.2 -0.959 45.1-173.2-130.3 143.3 11.2 6.4 29.9 38 52 A V E -KL 32 92C 0 54,-2.2 54,-2.7 -2,-0.4 2,-0.5 -0.988 13.5-150.2-128.8 134.6 13.7 9.2 30.1 39 53 A L E +KL 31 91C 1 -8,-3.2 -8,-3.1 -2,-0.4 2,-0.2 -0.893 33.7 141.1-106.0 134.1 17.5 8.9 29.6 40 54 A T E - L 0 90C 0 50,-2.4 50,-2.3 -2,-0.5 2,-0.3 -0.798 52.7 -64.9-151.3-169.6 19.8 11.3 31.5 41 55 A A > - 0 0 0 -12,-0.4 3,-1.6 48,-0.3 48,-0.3 -0.704 35.9-130.6 -91.2 144.1 23.1 11.4 33.4 42 56 A A G > S+ 0 0 19 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.869 107.1 59.5 -59.2 -38.0 23.5 9.5 36.6 43 57 A H G 3 S+ 0 0 68 1,-0.3 -1,-0.3 42,-0.1 137,-0.0 0.579 91.4 71.7 -70.7 -4.6 24.9 12.5 38.4 44 58 A b G < S+ 0 0 0 -3,-1.6 -1,-0.3 -15,-0.1 -2,-0.2 0.539 73.2 117.5 -84.2 -7.7 21.7 14.3 37.7 45 59 A D < + 0 0 51 -3,-1.9 2,-0.3 -4,-0.2 3,-0.1 -0.298 39.6 174.9 -63.4 143.3 19.9 12.1 40.2 46 60 A R > - 0 0 102 -27,-0.1 3,-0.7 1,-0.1 -2,-0.0 -0.932 43.6-102.3-142.7 164.1 18.3 13.9 43.2 47 62 A R T 3 S+ 0 0 228 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.924 115.6 20.7 -57.7 -49.2 16.2 12.7 46.2 48 63 A N T 3 S- 0 0 92 -3,-0.1 -27,-1.7 2,-0.0 -1,-0.3 -0.604 84.0-168.5-124.5 74.0 12.9 14.0 44.8 49 64 A I E < -J 20 0C 4 -3,-0.7 2,-0.4 -2,-0.3 -29,-0.2 -0.275 3.7-166.5 -63.2 140.8 13.3 14.4 41.0 50 65 A R E -J 19 0C 103 -31,-2.4 -31,-2.3 19,-0.1 2,-0.5 -0.984 6.3-154.2-128.1 138.6 10.6 16.3 39.0 51 66 A I E -JM 18 68C 0 17,-3.1 17,-2.7 -2,-0.4 2,-0.6 -0.969 4.7-161.4-124.1 125.0 10.5 16.2 35.3 52 67 A K E -JM 17 67C 35 -35,-2.4 -35,-2.2 -2,-0.5 2,-0.3 -0.899 14.3-174.3-104.6 120.1 9.0 18.8 32.9 53 68 A L E + M 0 66C 1 13,-3.2 13,-2.6 -2,-0.6 -37,-0.1 -0.833 61.8 27.7-113.2 152.9 8.2 17.6 29.4 54 69 A G S S+ 0 0 2 -39,-0.4 2,-0.3 49,-0.4 10,-0.2 0.621 86.2 140.7 76.7 14.6 6.9 19.7 26.4 55 70 A M + 0 0 9 -40,-0.4 -1,-0.2 -3,-0.2 3,-0.1 -0.649 18.8 150.7 -97.0 147.6 8.6 22.9 27.6 56 71 A H S S+ 0 0 8 1,-0.6 2,-0.2 4,-0.3 -1,-0.1 0.367 71.9 35.5-127.8 -82.0 10.4 25.6 25.7 57 72 A S - 0 0 13 3,-0.5 -1,-0.6 79,-0.2 5,-0.3 -0.562 65.2-149.5 -79.1 141.9 10.1 28.9 27.4 58 73 A K S S+ 0 0 80 77,-2.9 3,-0.2 -2,-0.2 -1,-0.1 0.663 100.5 38.1 -82.4 -17.3 10.0 28.9 31.2 59 74 A N S S+ 0 0 108 76,-0.4 2,-0.6 1,-0.2 -1,-0.2 0.638 114.2 54.2-105.8 -21.4 7.8 31.9 31.3 60 75 A I S S- 0 0 127 75,-0.2 -3,-0.5 0, 0.0 -4,-0.3 -0.852 85.0-144.1-118.1 93.3 5.5 31.1 28.3 61 76 A R - 0 0 186 -2,-0.6 2,-0.1 -3,-0.2 -3,-0.1 -0.312 9.2-128.9 -61.8 128.8 4.0 27.7 28.9 62 77 A N > - 0 0 23 -5,-0.3 3,-1.4 -8,-0.2 -1,-0.1 -0.500 24.9-119.7 -70.9 148.2 3.5 25.4 25.9 63 78 A E T 3 S+ 0 0 200 1,-0.3 -1,-0.1 -2,-0.1 -8,-0.1 0.808 109.5 49.6 -61.6 -30.1 -0.1 24.1 25.9 64 79 A D T 3 S+ 0 0 33 -10,-0.2 -1,-0.3 2,-0.0 -9,-0.1 0.131 76.0 139.7 -99.8 22.7 1.1 20.5 26.0 65 80 A E < - 0 0 32 -3,-1.4 2,-0.3 -11,-0.2 -11,-0.2 -0.314 30.8-167.6 -63.2 149.2 3.6 20.7 28.9 66 81 A Q E -M 53 0C 72 -13,-2.6 -13,-3.2 2,-0.0 2,-0.4 -0.976 12.9-148.4-139.0 149.9 3.5 17.8 31.3 67 82 A I E +M 52 0C 91 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.977 23.1 173.1-121.2 133.5 5.0 17.2 34.8 68 83 A R E -M 51 0C 16 -17,-2.7 -17,-3.1 -2,-0.4 26,-0.0 -0.947 19.7-152.1-139.5 159.3 6.1 13.8 36.0 69 84 A V - 0 0 32 -2,-0.3 26,-2.7 -19,-0.2 27,-0.3 -0.866 34.4 -95.8-124.6 159.3 7.9 12.1 38.9 70 85 A P E +N 94 0C 31 0, 0.0 24,-0.2 0, 0.0 3,-0.1 -0.350 27.0 179.4 -75.9 160.2 9.9 8.8 38.8 71 86 A R E S+ 0 0 141 22,-2.1 2,-0.3 1,-0.4 23,-0.2 0.308 80.7 14.0-128.4 -14.3 8.6 5.4 39.8 72 87 A G E -N 93 0C 13 21,-1.1 21,-2.9 2,-0.0 -1,-0.4 -0.954 60.1-162.4-164.3 143.0 11.9 3.8 39.1 73 88 A K E -N 92 0C 69 -2,-0.3 2,-0.4 19,-0.2 19,-0.2 -0.998 12.3-164.3-132.2 130.5 15.6 4.8 38.5 74 89 A Y E +N 91 0C 51 17,-2.9 17,-2.2 -2,-0.4 2,-0.3 -0.945 8.6 176.4-124.2 138.5 18.2 2.5 36.9 75 90 A F E -N 90 0C 74 -2,-0.4 2,-0.4 15,-0.2 15,-0.1 -0.794 38.3 -95.3-129.3 170.2 22.0 2.7 36.9 76 91 A c - 0 0 12 13,-0.5 3,-0.1 11,-0.4 11,-0.1 -0.720 30.9-170.0 -83.2 134.5 25.1 0.9 35.7 77 92 A L S S+ 0 0 159 -2,-0.4 2,-0.9 1,-0.2 -1,-0.1 0.582 70.3 72.7-103.6 -12.9 26.4 -1.2 38.5 78 93 A N + 0 0 56 155,-0.1 2,-0.3 6,-0.1 -1,-0.2 -0.665 67.1 151.5-103.5 76.8 29.7 -2.3 37.0 79 94 A T - 0 0 39 -2,-0.9 6,-0.1 -3,-0.1 5,-0.0 -0.796 52.0-134.4-109.9 151.0 31.7 0.9 37.1 80 95 A K S S+ 0 0 148 -2,-0.3 -1,-0.1 76,-0.1 5,-0.0 0.857 96.7 47.5 -67.5 -33.7 35.5 1.4 37.3 81 95AA F S > S- 0 0 44 75,-0.1 3,-1.9 1,-0.1 5,-0.2 -0.874 83.4-128.4-112.8 142.7 34.9 4.1 40.0 82 96 A P T 3 S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.769 108.3 58.3 -57.4 -30.8 32.7 3.8 43.1 83 97 A N T 3 S- 0 0 75 1,-0.1 -3,-0.0 -3,-0.0 0, 0.0 0.580 105.7-132.1 -76.4 -6.9 30.8 7.1 42.4 84 98 A G X + 0 0 13 -3,-1.9 3,-1.5 1,-0.1 5,-0.2 0.520 65.0 133.2 70.8 9.0 29.9 5.5 39.1 85 99 A L G > + 0 0 48 1,-0.3 3,-0.7 3,-0.1 -1,-0.1 0.586 56.9 70.5 -69.4 -11.4 30.8 8.6 37.1 86 100 A D G 3 S+ 0 0 12 1,-0.3 -1,-0.3 -5,-0.2 76,-0.3 0.663 109.6 37.0 -77.8 -14.5 32.8 6.7 34.4 87 101 A K G < S+ 0 0 11 -3,-1.5 2,-1.8 -6,-0.1 -11,-0.4 -0.613 82.2 179.1-132.6 68.3 29.4 5.4 33.2 88 102 A D < + 0 0 8 -3,-0.7 2,-0.3 -2,-0.1 123,-0.2 -0.537 35.4 114.0 -77.3 80.6 27.4 8.6 33.8 89 103 A I + 0 0 1 -2,-1.8 -13,-0.5 -48,-0.3 2,-0.3 -0.994 35.8 178.5-150.3 147.0 24.0 7.4 32.6 90 104 A M E -LN 40 75C 0 -50,-2.3 -50,-2.4 -2,-0.3 2,-0.4 -0.987 18.6-143.5-154.4 141.7 20.6 6.7 34.2 91 105 A L E -LN 39 74C 0 -17,-2.2 -17,-2.9 -2,-0.3 2,-0.5 -0.903 14.8-162.9-107.4 133.8 17.1 5.6 33.1 92 106 A I E -LN 38 73C 0 -54,-2.7 -54,-2.2 -2,-0.4 2,-0.6 -0.967 7.4-151.5-116.6 127.5 14.1 7.1 34.7 93 107 A R E -LN 37 72C 61 -21,-2.9 -22,-2.1 -2,-0.5 -21,-1.1 -0.885 23.7-127.1 -97.5 128.5 10.7 5.4 34.4 94 108 A L E - 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