==== 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 3S9B . 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) . 10606.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 5 2.1 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 . 10 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 5.1 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 1 0 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 3 5 2 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 0 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 16 A V 0 0 0 0, 0.0 3,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 125.3 4.7 -35.4 -0.1 2 17 A V B +A 174 0A 17 172,-2.2 172,-1.2 1,-0.2 127,-0.1 -0.763 360.0 29.9-104.6 152.5 5.7 -39.0 -0.6 3 18 A G S S+ 0 0 50 125,-0.5 -1,-0.2 -2,-0.3 2,-0.1 0.544 104.7 82.6 83.4 7.1 6.4 -40.7 -3.9 4 19 A G - 0 0 19 -3,-0.4 2,-0.3 136,-0.1 -1,-0.3 -0.257 67.6-122.4-119.6-151.5 7.6 -37.5 -5.6 5 20 A D E -B 139 0B 128 134,-1.7 134,-2.7 -2,-0.1 -3,-0.0 -0.907 49.2 -54.0-149.5 172.7 10.8 -35.5 -6.0 6 21 A E E -B 138 0B 109 -2,-0.3 132,-0.3 132,-0.2 3,-0.1 -0.266 65.6-113.3 -53.3 135.0 12.0 -31.9 -5.4 7 22 A a - 0 0 4 130,-2.8 2,-0.2 117,-0.1 -1,-0.1 -0.306 33.5 -93.1 -69.8 156.8 9.6 -29.5 -7.2 8 23 A N > - 0 0 87 1,-0.1 3,-1.2 2,-0.0 4,-0.3 -0.506 39.0-123.6 -65.9 138.1 10.9 -27.4 -10.2 9 24 A I T 3 S+ 0 0 69 1,-0.2 3,-0.3 -2,-0.2 -1,-0.1 0.755 107.2 42.8 -60.3 -24.5 12.0 -24.1 -8.6 10 25 A N T 3 S+ 0 0 85 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.466 95.7 78.5-100.8 -1.3 9.7 -22.1 -10.8 11 26 A E S < S+ 0 0 54 -3,-1.2 -1,-0.1 1,-0.2 -2,-0.1 0.520 90.7 47.9 -89.3 -2.7 6.5 -24.2 -10.7 12 27 A H > + 0 0 5 -4,-0.3 3,-1.7 -3,-0.3 -1,-0.2 -0.224 56.8 139.7-131.2 47.7 5.1 -23.2 -7.3 13 28 A P T 3 S+ 0 0 25 0, 0.0 92,-1.5 0, 0.0 41,-0.3 0.712 77.1 54.3 -64.1 -18.4 5.2 -19.4 -7.1 14 29 A F T 3 S+ 0 0 24 90,-0.2 18,-2.8 -3,-0.1 2,-0.4 0.520 86.0 106.4 -90.7 -8.3 1.8 -19.4 -5.4 15 30 A L E < -J 31 0C 2 -3,-1.7 39,-0.5 16,-0.2 40,-0.4 -0.587 48.2-175.1 -79.7 127.1 3.0 -21.8 -2.7 16 31 A V E -JK 30 53C 2 14,-2.3 14,-1.7 -2,-0.4 2,-0.4 -0.881 17.5-135.6-120.3 154.6 3.5 -20.3 0.8 17 32 A A E -JK 29 52C 0 35,-2.3 35,-2.9 -2,-0.3 2,-0.4 -0.919 15.2-150.1-111.4 133.8 4.9 -21.9 3.9 18 33 A L E +JK 28 51C 1 10,-2.7 9,-1.3 -2,-0.4 10,-1.1 -0.865 30.0 141.2-107.8 134.3 3.3 -21.3 7.3 19 34 A Y E - K 0 50C 36 31,-2.7 31,-2.7 -2,-0.4 2,-0.3 -0.691 39.3-106.7-144.5-162.6 5.2 -21.3 10.6 20 35 A T E - K 0 49C 26 3,-2.0 29,-0.2 5,-0.3 3,-0.0 -0.864 25.7-108.7-134.0 170.0 5.0 -19.3 13.9 21 36 A S S S+ 0 0 68 27,-1.6 3,-0.1 -2,-0.3 28,-0.1 0.641 121.6 46.8 -71.7 -11.1 7.0 -16.7 15.7 22 36AA A S S+ 0 0 96 1,-0.2 2,-0.4 26,-0.2 -1,-0.2 0.715 118.1 34.5-100.4 -26.5 7.9 -19.4 18.2 23 37 A S - 0 0 50 2,-0.1 -3,-2.0 1,-0.1 -1,-0.2 -0.992 52.9-156.6-135.7 140.0 9.0 -22.1 15.8 24 38 A S + 0 0 103 -2,-0.4 2,-0.2 -5,-0.2 -1,-0.1 0.393 62.5 119.0 -90.0 1.8 10.6 -22.1 12.4 25 39 A T S S- 0 0 89 1,-0.1 2,-1.0 2,-0.0 -5,-0.3 -0.496 70.5-126.3 -70.0 134.5 9.1 -25.5 11.7 26 40 A I + 0 0 13 -2,-0.2 -7,-0.2 1,-0.2 -1,-0.1 -0.736 34.0 173.2 -83.9 103.6 6.7 -25.5 8.6 27 41 A H - 0 0 29 -9,-1.3 151,-0.4 -2,-1.0 2,-0.3 0.647 63.3 -5.3 -87.7 -13.3 3.5 -26.9 10.1 28 42 A b E -J 18 0C 2 -10,-1.1 -10,-2.7 151,-0.1 2,-0.2 -0.970 61.1-128.2-164.8 173.7 1.5 -26.2 6.9 29 43 A A E -J 17 0C 0 151,-2.6 12,-0.5 -2,-0.3 2,-0.3 -0.644 20.3-174.2-122.3 179.8 1.4 -24.7 3.5 30 44 A G E -J 16 0C 0 -14,-1.7 -14,-2.3 -2,-0.2 2,-0.4 -0.931 20.8-114.3-162.2 178.2 -1.0 -22.2 1.8 31 45 A A E -JL 15 39C 0 8,-2.6 8,-3.2 -2,-0.3 2,-0.5 -0.995 20.4-125.2-133.4 135.2 -1.7 -20.6 -1.6 32 46 A L E + L 0 38C 1 -18,-2.8 75,-2.5 -2,-0.4 6,-0.3 -0.661 24.5 179.6 -78.0 123.6 -1.4 -17.0 -2.6 33 47 A I E - 0 0 21 4,-3.0 2,-0.3 -2,-0.5 5,-0.2 0.764 67.0 -25.9 -93.8 -35.0 -4.8 -15.8 -4.2 34 48 A N E > S- L 0 37C 40 3,-1.2 3,-0.8 71,-0.1 -1,-0.3 -0.881 93.7 -57.2-160.3-170.9 -3.8 -12.3 -5.0 35 49 A R T 3 S+ 0 0 133 -2,-0.3 63,-2.3 1,-0.2 61,-0.1 0.657 132.0 18.0 -57.5 -19.4 -1.3 -9.7 -3.6 36 50 A E T 3 S+ 0 0 53 61,-0.2 58,-2.9 1,-0.1 2,-0.4 0.315 108.0 81.5-138.3 16.4 -2.6 -9.7 -0.1 37 51 A W E < -LM 34 93C 7 -3,-0.8 -4,-3.0 56,-0.2 -3,-1.2 -0.981 46.8-171.4-130.2 135.9 -4.6 -12.9 0.4 38 52 A V E -LM 32 92C 0 54,-2.5 54,-2.6 -2,-0.4 2,-0.5 -0.968 11.8-149.3-123.6 137.5 -3.6 -16.5 1.2 39 53 A L E +LM 31 91C 0 -8,-3.2 -8,-2.6 -2,-0.4 2,-0.2 -0.901 34.5 137.8-108.3 131.6 -5.9 -19.6 1.2 40 54 A T E - M 0 90C 0 50,-2.3 50,-2.5 -2,-0.5 2,-0.3 -0.814 53.4 -65.4-152.6-169.9 -5.1 -22.4 3.5 41 55 A A > - 0 0 0 -12,-0.5 3,-1.4 48,-0.3 48,-0.3 -0.689 35.3-130.6 -91.1 145.4 -6.7 -25.0 5.9 42 56 A A G > S+ 0 0 17 -2,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.887 106.8 60.4 -60.4 -40.0 -8.4 -23.8 9.1 43 57 A H G 3 S+ 0 0 64 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.607 92.1 69.7 -66.7 -7.4 -6.6 -26.3 11.2 44 58 A b G < S+ 0 0 0 -3,-1.4 -1,-0.3 -15,-0.1 -2,-0.2 0.517 75.2 116.6 -84.6 -7.1 -3.3 -24.7 10.1 45 59 A D < + 0 0 51 -3,-2.1 2,-0.3 -4,-0.2 3,-0.1 -0.285 39.2 172.7 -63.0 148.8 -4.2 -21.6 12.2 46 60 A R > - 0 0 100 1,-0.1 3,-0.8 -27,-0.1 -2,-0.0 -0.955 43.6-102.4-150.6 160.6 -1.9 -20.7 15.1 47 62 A R T 3 S+ 0 0 225 -2,-0.3 2,-0.5 1,-0.3 -1,-0.1 0.933 114.9 23.5 -53.1 -56.6 -1.7 -17.8 17.5 48 63 A N T 3 S- 0 0 73 -3,-0.1 -27,-1.6 21,-0.0 -1,-0.3 -0.612 85.0-169.9-115.6 71.7 1.3 -16.0 15.9 49 64 A I E < -K 20 0C 2 -3,-0.8 2,-0.4 -2,-0.5 -29,-0.3 -0.316 5.1-165.9 -63.9 139.7 1.3 -17.2 12.3 50 65 A R E -K 19 0C 66 -31,-2.7 -31,-2.7 19,-0.1 2,-0.5 -0.982 5.7-155.2-125.7 137.7 4.3 -16.3 10.1 51 66 A I E -KN 18 68C 0 17,-2.7 17,-2.3 -2,-0.4 2,-0.5 -0.967 3.8-158.9-121.7 128.7 4.1 -16.7 6.3 52 67 A K E -KN 17 67C 42 -35,-2.9 -35,-2.3 -2,-0.5 2,-0.3 -0.909 15.2-173.9-105.0 122.9 7.0 -17.3 4.0 53 68 A L E +KN 16 66C 2 13,-3.1 13,-2.9 -2,-0.5 -37,-0.1 -0.881 63.2 22.8-116.4 151.1 6.4 -16.4 0.3 54 69 A G S S+ 0 0 2 -39,-0.5 2,-0.3 49,-0.5 8,-0.3 0.701 89.0 140.7 72.0 20.2 8.7 -16.9 -2.7 55 70 A M + 0 0 10 -40,-0.4 -1,-0.2 -3,-0.2 3,-0.1 -0.734 21.6 155.1-102.3 146.4 10.6 -19.7 -0.9 56 71 A H S S+ 0 0 9 1,-0.5 2,-0.2 4,-0.3 -1,-0.1 0.410 72.6 34.9-123.0 -84.1 11.9 -23.0 -2.3 57 72 A S - 0 0 14 3,-0.5 -1,-0.5 79,-0.2 79,-0.2 -0.533 66.3-147.1 -77.2 139.7 14.8 -24.2 -0.1 58 73 A K S S+ 0 0 78 77,-2.7 -1,-0.1 -2,-0.2 3,-0.1 0.603 101.6 43.0 -77.5 -10.7 14.6 -23.4 3.6 59 74 A N S S+ 0 0 116 76,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.528 113.6 47.1-112.3 -10.7 18.4 -23.0 3.6 60 75 A I S S- 0 0 124 -3,-0.1 -3,-0.5 0, 0.0 -4,-0.3 -0.915 82.3-144.3-132.8 104.8 19.1 -21.0 0.5 61 76 A R - 0 0 154 -2,-0.4 -6,-0.1 -3,-0.1 -3,-0.1 -0.481 12.4-122.6 -79.0 138.5 16.7 -18.0 0.2 62 77 A N > - 0 0 18 -8,-0.3 3,-1.5 -2,-0.2 -1,-0.1 -0.376 27.6-112.9 -69.5 154.9 15.4 -16.9 -3.2 63 78 A E T 3 S+ 0 0 189 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.835 117.6 41.9 -58.8 -34.2 16.2 -13.3 -4.1 64 79 A D T 3 S+ 0 0 30 -10,-0.2 -1,-0.3 2,-0.0 -9,-0.1 0.219 80.5 139.6-101.0 15.1 12.5 -12.4 -3.8 65 80 A E < - 0 0 13 -3,-1.5 2,-0.3 -11,-0.2 -11,-0.2 -0.307 31.3-170.8 -60.2 139.0 11.7 -14.4 -0.7 66 81 A Q E -N 53 0C 70 -13,-2.9 -13,-3.1 2,-0.0 2,-0.4 -0.945 17.9-147.6-134.6 155.6 9.3 -12.4 1.7 67 82 A I E +N 52 0C 76 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.971 22.8 173.1-123.3 137.7 7.9 -12.8 5.2 68 83 A R E -N 51 0C 15 -17,-2.3 -17,-2.7 -2,-0.4 26,-0.0 -0.972 20.1-149.9-143.4 156.6 4.5 -11.6 6.2 69 84 A V - 0 0 33 -2,-0.3 26,-2.7 -19,-0.2 27,-0.3 -0.850 36.1 -95.8-120.4 159.2 2.1 -11.8 9.2 70 85 A P E -O 94 0C 33 0, 0.0 24,-0.2 0, 0.0 3,-0.1 -0.419 24.6-175.0 -76.1 152.6 -1.7 -11.7 9.1 71 86 A R E S+ 0 0 141 22,-3.2 2,-0.3 1,-0.5 23,-0.2 0.382 82.0 8.1-115.6 -9.1 -3.8 -8.6 9.5 72 87 A G E -O 93 0C 13 21,-1.1 21,-3.1 2,-0.0 -1,-0.5 -0.944 59.9-160.8-168.7 146.8 -6.9 -10.7 9.4 73 88 A K E -O 92 0C 65 -2,-0.3 2,-0.4 19,-0.2 19,-0.2 -0.996 13.6-164.3-136.6 129.4 -8.0 -14.3 9.4 74 89 A Y E +O 91 0C 48 17,-2.9 17,-2.3 -2,-0.4 2,-0.2 -0.950 8.6 176.5-125.0 137.8 -11.4 -15.6 8.3 75 90 A F E -O 90 0C 72 -2,-0.4 2,-0.4 15,-0.2 15,-0.1 -0.766 39.1 -94.2-128.1 170.9 -13.3 -18.9 8.8 76 91 A c - 0 0 10 13,-0.5 3,-0.2 11,-0.4 11,-0.1 -0.711 32.7-171.4 -81.8 134.9 -16.6 -20.6 8.1 77 92 A L S S+ 0 0 162 -2,-0.4 2,-0.5 1,-0.2 -1,-0.1 0.446 70.7 70.9-110.2 -0.5 -18.8 -20.1 11.2 78 93 A N S S+ 0 0 59 155,-0.1 2,-0.2 6,-0.1 -1,-0.2 -0.605 70.2 148.4-113.3 67.3 -21.6 -22.4 10.2 79 94 A T - 0 0 39 -2,-0.5 6,-0.1 -3,-0.2 5,-0.0 -0.632 53.2-133.6-102.7 160.9 -19.9 -25.8 10.6 80 95 A K S S+ 0 0 153 -2,-0.2 -1,-0.1 4,-0.1 3,-0.0 0.806 96.5 52.4 -80.0 -31.5 -21.2 -29.2 11.6 81 95AA F S > S- 0 0 64 1,-0.1 3,-1.8 75,-0.1 5,-0.2 -0.869 83.1-133.7-105.1 139.8 -18.4 -29.8 14.0 82 96 A P T 3 S+ 0 0 141 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.819 109.0 57.1 -61.6 -29.4 -17.6 -27.2 16.7 83 97 A N T 3 S- 0 0 103 1,-0.1 -3,-0.0 -3,-0.0 0, 0.0 0.521 109.1-130.4 -78.5 -2.9 -13.9 -27.5 15.9 84 98 A G X + 0 0 13 -3,-1.8 3,-1.4 1,-0.1 5,-0.2 0.572 64.1 135.9 67.5 14.0 -14.9 -26.6 12.3 85 99 A L G > + 0 0 72 1,-0.3 3,-0.6 3,-0.1 -1,-0.1 0.605 59.6 69.2 -70.6 -10.7 -13.0 -29.4 10.7 86 100 A D G 3 S+ 0 0 22 1,-0.3 76,-0.4 -5,-0.2 -1,-0.3 0.679 108.9 37.5 -78.4 -18.1 -15.8 -30.3 8.3 87 101 A K G < S- 0 0 13 -3,-1.4 2,-1.9 -6,-0.1 -11,-0.4 -0.616 82.7-177.8-129.4 69.6 -15.2 -27.1 6.5 88 102 A D < + 0 0 10 -3,-0.6 2,-0.3 -2,-0.2 123,-0.2 -0.500 36.8 110.4 -76.0 81.5 -11.4 -27.0 6.7 89 103 A I + 0 0 0 -2,-1.9 -13,-0.5 -48,-0.3 2,-0.3 -0.992 36.0 177.3-155.0 143.7 -10.6 -23.7 5.1 90 104 A M E -MO 40 75C 0 -50,-2.5 -50,-2.3 -2,-0.3 2,-0.4 -0.997 19.1-142.3-150.0 146.6 -9.3 -20.3 6.1 91 105 A L E -MO 39 74C 0 -17,-2.3 -17,-2.9 -2,-0.3 2,-0.5 -0.923 14.6-163.7-110.1 136.1 -8.5 -17.0 4.5 92 106 A I E -MO 38 73C 0 -54,-2.6 -54,-2.5 -2,-0.4 2,-0.6 -0.982 7.5-151.5-120.1 124.4 -5.5 -15.0 5.7 93 107 A R E -MO 37 72C 58 -21,-3.1 -22,-3.2 -2,-0.5 -21,-1.1 -0.872 23.3-125.6 -96.8 126.5 -5.1 -11.3 4.8 94 108 A L E - 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