==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-MAR-01 1I78 . COMPND 2 MOLECULE: PROTEASE VII; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR L.VANDEPUTTE-RUTTEN,R.A.KRAMER,J.KROON,N.DEKKER,M.R.EGMOND,P . 584 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 514 88.0 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 . 416 71.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 . 63 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), 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 . 4 0.7 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 0 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 . 2 0 3 3 0 2 1 3 6 0 1 1 0 0 0 0 2 5 3 2 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 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 1 A S > 0 0 60 0, 0.0 3,-0.6 0, 0.0 122,-0.1 0.000 360.0 360.0 360.0-118.4 27.5 25.4 27.3 2 2 A T T 3 + 0 0 47 1,-0.3 121,-0.1 118,-0.2 119,-0.1 0.438 360.0 67.8 -72.5 1.6 30.0 28.2 27.8 3 3 A E T 3 S+ 0 0 88 59,-0.1 2,-0.5 2,-0.0 -1,-0.3 -0.282 71.8 111.4-116.1 44.8 32.1 25.6 29.7 4 4 A T < - 0 0 40 -3,-0.6 2,-0.9 2,-0.1 59,-0.2 -0.936 58.4-144.8-124.6 109.7 33.0 23.4 26.7 5 5 A L + 0 0 168 -2,-0.5 2,-0.3 56,-0.1 -2,-0.0 -0.610 52.4 109.2 -76.9 103.6 36.7 23.3 25.6 6 6 A S - 0 0 59 -2,-0.9 2,-0.4 2,-0.0 -2,-0.1 -0.947 54.9-128.0-160.6 174.7 36.7 22.9 21.8 7 7 A F + 0 0 53 -2,-0.3 54,-0.2 54,-0.1 53,-0.1 -0.997 19.3 175.3-136.4 136.2 37.4 24.8 18.5 8 8 A T > + 0 0 38 52,-3.3 3,-2.2 -2,-0.4 51,-0.2 -0.409 13.7 164.3-141.9 64.7 35.0 25.1 15.5 9 9 A P T 3 S+ 0 0 70 0, 0.0 51,-0.1 0, 0.0 -1,-0.1 0.613 79.2 73.9 -57.4 -3.8 36.4 27.4 12.8 10 10 A D T 3 S+ 0 0 124 50,-0.1 2,-0.7 49,-0.1 50,-0.1 0.835 70.7 93.3 -76.3 -37.3 33.6 25.6 10.9 11 11 A N < + 0 0 61 -3,-2.2 48,-2.4 48,-0.3 2,-0.3 -0.464 53.9 150.2 -65.4 105.3 30.8 27.5 12.6 12 12 A I E -A 58 0A 49 -2,-0.7 285,-1.1 46,-0.2 2,-0.3 -0.982 22.8-175.6-139.5 148.7 29.9 30.5 10.4 13 13 A N E -AB 57 296A 1 44,-2.0 44,-2.8 -2,-0.3 2,-0.3 -0.996 11.2-150.4-144.2 143.3 26.8 32.5 9.6 14 14 A A E -AB 56 295A 35 281,-2.4 281,-2.0 -2,-0.3 2,-0.4 -0.806 5.3-159.6-112.4 156.5 26.1 35.3 7.2 15 15 A D E +AB 55 294A 28 40,-2.3 40,-2.6 -2,-0.3 2,-0.4 -0.958 12.5 172.6-142.0 117.4 23.6 38.1 7.5 16 16 A I E +AB 54 293A 90 277,-1.9 277,-2.4 -2,-0.4 2,-0.3 -0.985 13.1 159.2-126.2 134.0 22.2 40.2 4.6 17 17 A S E -AB 53 292A 3 36,-2.8 36,-2.9 -2,-0.4 2,-0.3 -0.986 26.3-143.3-153.2 163.7 19.5 42.7 5.0 18 18 A L E +AB 52 291A 99 273,-2.6 273,-2.3 -2,-0.3 2,-0.3 -0.879 38.0 105.9-125.5 157.1 17.8 45.8 3.5 19 19 A G E -AB 51 290A 22 32,-1.8 32,-2.9 -2,-0.3 2,-0.3 -0.984 52.0 -62.1 170.6-156.8 16.2 48.8 5.0 20 20 A T E -AB 50 289A 41 269,-2.3 269,-2.3 -2,-0.3 2,-0.4 -0.879 21.4-152.2-129.4 158.3 16.3 52.5 5.8 21 21 A L E +AB 49 288A 0 28,-1.8 28,-2.1 -2,-0.3 2,-0.4 -0.998 15.1 178.5-129.7 127.0 18.4 54.9 7.8 22 22 A S E + B 0 287A 19 265,-3.0 265,-3.1 -2,-0.4 2,-0.3 -0.959 19.9 130.6-127.4 146.0 17.0 58.1 9.2 23 23 A G E -AB 46 286A 7 23,-2.2 23,-1.8 -2,-0.4 2,-0.3 -0.992 37.3-131.4-174.2-177.1 18.9 60.6 11.3 24 24 A K E -AB 45 285A 45 261,-2.0 261,-1.3 -2,-0.3 2,-0.4 -0.980 9.6-165.8-156.1 141.1 20.1 64.1 12.2 25 25 A T E -AB 44 284A 3 19,-2.3 19,-2.2 -2,-0.3 2,-0.6 -0.995 11.3-148.7-132.1 136.2 23.4 65.7 13.0 26 26 A K E -AB 43 283A 51 257,-1.9 257,-0.9 -2,-0.4 2,-0.7 -0.925 5.7-160.7-111.9 116.8 24.0 69.1 14.6 27 27 A E E -AB 42 282A 13 15,-2.7 15,-2.6 -2,-0.6 2,-0.3 -0.839 18.9-172.3 -96.5 113.4 27.1 71.1 13.7 28 28 A R E -AB 41 281A 28 253,-2.0 253,-1.8 -2,-0.7 2,-0.4 -0.838 16.9-160.3-116.6 148.8 27.9 73.8 16.3 29 29 A V E -AB 40 280A 55 11,-1.9 10,-2.3 -2,-0.3 11,-1.3 -0.969 12.2-166.3-122.9 136.8 30.3 76.7 16.6 30 30 A Y E -A 38 0A 27 249,-3.0 2,-0.7 -2,-0.4 8,-0.2 -0.907 18.6-136.3-124.7 153.3 31.3 78.4 19.9 31 31 A L E > -A 37 0A 48 6,-1.9 5,-2.3 -2,-0.3 6,-0.8 -0.920 14.0-172.7-108.8 107.7 33.1 81.7 20.8 32 32 A A T > 5S+ 0 0 54 -2,-0.7 2,-2.7 1,-0.3 3,-0.9 0.962 84.2 59.2 -63.2 -51.5 35.7 81.0 23.6 33 33 A E T 3 5S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.1 0, 0.0 -0.391 107.1 48.8 -76.5 63.2 36.4 84.7 24.0 34 34 A E T > 5S- 0 0 85 -2,-2.7 3,-1.0 -3,-0.3 -1,-0.3 0.166 135.6 -71.1 168.4 38.2 32.7 85.4 24.8 35 35 A G T < 5S- 0 0 82 -3,-0.9 -3,-0.2 1,-0.2 -2,-0.1 0.290 77.1 -83.0 78.0 -8.5 31.8 82.8 27.5 36 36 A G T 3 - 0 0 52 6,-0.3 3,-1.9 3,-0.2 6,-0.2 -0.750 53.5-176.3 -94.9 95.9 23.4 89.2 19.7 89 89 A S T 3 S+ 0 0 71 -2,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.586 84.3 60.4 -65.0 -10.2 25.7 88.5 22.7 90 90 A S T 3 S+ 0 0 82 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.563 118.1 28.3 -91.8 -12.2 23.2 90.6 24.8 91 91 A N S X S+ 0 0 86 -3,-1.9 3,-1.6 3,-0.1 2,-0.4 -0.228 76.0 166.2-141.2 45.8 20.4 88.1 24.0 92 92 A P T 3 + 0 0 64 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.536 64.1 59.6 -66.9 119.3 22.1 84.8 23.4 93 93 A G T 3 S+ 0 0 66 -2,-0.4 2,-0.5 1,-0.2 -4,-0.1 0.092 92.2 69.9 146.6 -20.9 19.2 82.4 23.4 94 94 A T S < S- 0 0 63 -3,-1.6 -6,-0.3 -6,-0.2 -1,-0.2 -0.995 85.2-122.5-125.9 122.0 17.2 83.8 20.6 95 95 A W - 0 0 40 -2,-0.5 -9,-0.3 1,-0.1 3,-0.1 -0.310 16.7-164.9 -67.2 147.3 18.6 83.4 17.1 96 96 A T S S+ 0 0 9 -11,-3.3 61,-0.5 1,-0.3 2,-0.4 0.674 73.5 32.0-103.6 -24.2 19.2 86.4 14.9 97 97 A D E -F 85 0A 23 -12,-1.3 -12,-1.7 53,-0.2 2,-0.4 -0.992 58.8-176.8-142.2 132.3 19.6 84.7 11.5 98 98 A E E -FG 84 149A 13 51,-0.8 51,-0.8 -2,-0.4 2,-0.5 -0.965 3.1-171.7-133.4 120.0 18.0 81.6 10.0 99 99 A A E -FG 83 148A 2 -16,-2.2 -16,-2.4 -2,-0.4 2,-0.4 -0.929 10.9-157.9-111.0 122.7 18.8 80.1 6.6 100 100 A R E -FG 82 147A 132 47,-2.8 47,-0.7 -2,-0.5 -18,-0.2 -0.818 8.9-174.2-103.4 140.2 16.6 77.2 5.3 101 101 A H E +F 81 0A 10 -20,-2.1 -20,-0.8 -2,-0.4 3,-0.1 -0.741 16.2 166.0-133.9 87.6 17.7 74.7 2.7 102 102 A P E S+ 0 0 86 0, 0.0 2,-2.2 0, 0.0 -23,-0.1 0.843 71.8 77.3 -69.2 -27.3 15.2 72.3 1.5 103 103 A D E S+ H 0 144A 85 41,-0.5 41,-1.8 -3,-0.1 2,-0.3 -0.437 72.1 120.7 -82.8 68.0 17.5 71.4 -1.5 104 104 A T E -FH 79 143A 5 -2,-2.2 -25,-3.1 -25,-0.7 2,-0.3 -0.908 38.8-171.4-127.7 153.5 19.8 69.3 0.6 105 105 A Q E -FH 78 142A 75 37,-1.8 37,-1.3 -27,-0.3 2,-1.0 -0.999 31.0-123.3-149.9 149.9 20.8 65.7 0.2 106 106 A L E -FH 77 141A 2 -29,-4.2 -29,-1.4 -2,-0.3 35,-0.2 -0.835 26.8-166.0 -88.1 105.3 22.7 62.9 2.0 107 107 A N E - 0 0 40 33,-2.4 2,-0.3 -2,-1.0 -1,-0.2 0.948 62.0 -37.1 -58.9 -49.5 25.2 62.0 -0.7 108 108 A Y E - H 0 140A 91 32,-1.0 32,-1.6 -3,-0.1 2,-0.3 -0.975 51.8-165.7-166.0 170.3 26.1 58.9 1.1 109 109 A A E + H 0 139A 0 -2,-0.3 -36,-2.1 30,-0.2 2,-0.3 -0.944 15.1 165.9-162.9 144.7 26.7 57.2 4.5 110 110 A N E -EH 72 138A 46 28,-1.5 28,-1.9 -2,-0.3 2,-0.3 -0.960 12.5-165.6-155.8 175.7 28.3 54.0 5.6 111 111 A E E -EH 71 137A 26 -40,-2.3 -40,-2.2 -2,-0.3 2,-0.3 -0.947 3.8-167.7-168.2 141.1 29.7 52.0 8.5 112 112 A F E -EH 70 136A 74 24,-1.7 24,-1.9 -2,-0.3 2,-0.3 -0.927 10.6-167.6-129.7 157.8 31.8 49.0 9.3 113 113 A D E -EH 69 135A 6 -44,-2.4 -44,-2.9 -2,-0.3 2,-0.4 -0.964 8.9-169.7-152.9 128.5 32.3 47.2 12.6 114 114 A L E +EH 68 134A 99 20,-2.2 20,-2.4 -2,-0.3 2,-0.3 -0.982 26.0 157.4-119.2 129.6 34.7 44.6 13.9 115 115 A N E -EH 67 133A 12 -48,-2.5 -48,-2.1 -2,-0.4 2,-0.4 -0.920 33.9-137.1-148.1 171.7 34.0 43.0 17.2 116 116 A I E -EH 66 132A 18 16,-2.3 16,-1.5 -2,-0.3 2,-0.5 -0.975 17.2-150.0-130.9 145.8 34.5 40.0 19.6 117 117 A K E -EH 65 131A 26 -52,-2.4 -52,-1.5 -2,-0.4 2,-0.8 -0.975 3.9-161.1-122.4 127.3 31.9 38.4 21.8 118 118 A G E -EH 64 130A 5 12,-2.3 12,-3.0 -2,-0.5 2,-0.3 -0.907 23.2-140.2-107.5 105.8 32.6 36.7 25.1 119 119 A W E + H 0 129A 10 -56,-2.3 10,-0.3 -2,-0.8 3,-0.2 -0.475 28.0 174.9 -71.1 127.0 29.7 34.4 25.8 120 120 A L E S+ 0 0 50 8,-3.1 2,-0.4 1,-0.4 -118,-0.2 0.719 84.2 21.5 -95.8 -32.9 28.4 34.2 29.4 121 121 A L E + H 0 128A 74 7,-2.1 7,-2.5 -120,-0.1 -1,-0.4 -0.999 66.8 169.8-135.9 130.9 25.5 32.0 28.3 122 122 A N E + H 0 127A 42 -2,-0.4 5,-0.2 5,-0.2 -3,-0.0 -0.668 20.1 140.6-146.9 87.7 25.6 29.9 25.1 123 123 A E - 0 0 67 3,-2.9 -2,-0.1 -2,-0.2 3,-0.0 -0.608 63.3 -98.8-118.4 178.6 22.8 27.4 24.8 124 124 A P S S+ 0 0 106 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.817 122.7 30.8 -69.2 -30.3 20.5 26.1 21.9 125 125 A N S S+ 0 0 77 1,-0.2 63,-3.6 62,-0.0 2,-0.3 0.420 125.0 31.7-108.8 -1.7 17.6 28.4 22.9 126 126 A Y E - I 0 187A 91 61,-0.3 -3,-2.9 -3,-0.0 2,-0.3 -0.961 53.1-173.3-160.8 142.5 19.4 31.4 24.5 127 127 A R E +HI 122 186A 52 59,-2.0 59,-1.9 -2,-0.3 2,-0.4 -0.994 3.2 178.1-137.1 139.1 22.6 33.4 24.2 128 128 A L E +HI 121 185A 62 -7,-2.5 -8,-3.1 -2,-0.3 -7,-2.1 -0.966 17.1 168.1-141.7 121.2 24.1 36.2 26.3 129 129 A G E -HI 119 184A 0 55,-2.5 55,-2.3 -2,-0.4 -10,-0.3 -0.989 33.2-127.5-144.6 149.3 27.5 37.8 25.5 130 130 A L E -HI 118 183A 11 -12,-3.0 -12,-2.3 -2,-0.3 2,-0.3 -0.534 32.1-152.5 -81.4 153.8 29.8 40.6 26.3 131 131 A M E +HI 117 182A 6 51,-2.0 51,-1.8 -14,-0.2 2,-0.3 -0.936 20.3 178.7-130.6 155.6 31.1 42.6 23.4 132 132 A A E +HI 116 181A 7 -16,-1.5 -16,-2.3 -2,-0.3 2,-0.3 -0.937 29.8 129.8-151.9 126.6 34.2 44.7 22.6 133 133 A G E -HI 115 180A 18 47,-2.7 47,-3.3 -2,-0.3 2,-0.4 -0.945 45.8-111.8-163.9-173.8 34.7 46.3 19.2 134 134 A Y E -HI 114 179A 73 -20,-2.4 -20,-2.2 -2,-0.3 2,-0.3 -0.999 25.6-174.9-137.4 136.1 35.5 49.2 16.9 135 135 A Q E -HI 113 178A 5 43,-1.6 43,-3.7 -2,-0.4 2,-0.4 -0.964 7.9-168.3-133.6 151.2 33.2 51.0 14.5 136 136 A E E +HI 112 177A 21 -24,-1.9 -24,-1.7 -2,-0.3 2,-0.3 -0.991 9.2 180.0-138.8 127.1 33.7 53.8 11.9 137 137 A S E -HI 111 176A 4 39,-1.7 39,-2.4 -2,-0.4 2,-0.4 -0.952 7.3-161.2-128.0 150.4 30.9 55.7 10.2 138 138 A R E -HI 110 175A 79 -28,-1.9 -28,-1.5 -2,-0.3 2,-0.3 -0.981 4.2-171.5-132.1 143.4 30.9 58.4 7.5 139 139 A Y E -HI 109 174A 9 35,-1.5 35,-2.4 -2,-0.4 2,-0.3 -0.981 1.1-172.6-133.1 147.4 28.4 61.0 6.4 140 140 A S E +HI 108 173A 8 -32,-1.6 -33,-2.4 -2,-0.3 -32,-1.0 -0.972 11.0 174.1-143.0 120.3 28.4 63.4 3.4 141 141 A F E -HI 106 172A 3 31,-2.4 31,-2.1 -2,-0.3 2,-0.3 -0.805 14.3-163.6-124.2 167.9 25.9 66.2 2.7 142 142 A T E -HI 105 171A 27 -37,-1.3 -37,-1.8 -2,-0.3 2,-0.4 -0.958 4.7-165.7-153.1 129.9 25.3 69.1 0.4 143 143 A A E -HI 104 170A 0 27,-1.9 27,-1.8 -2,-0.3 2,-0.3 -0.939 8.5-173.8-119.6 141.5 22.9 72.1 0.6 144 144 A R E -HI 103 169A 108 -41,-1.8 -41,-0.5 -2,-0.4 25,-0.2 -0.961 46.5 -30.3-135.4 152.4 21.9 74.5 -2.2 145 145 A G + 0 0 3 22,-0.7 20,-0.1 23,-0.7 -2,-0.0 -0.101 67.2 148.8 47.0-126.5 19.9 77.7 -2.5 146 146 A G - 0 0 20 17,-0.3 17,-2.1 -45,-0.1 -45,-0.2 -0.048 44.7 -80.6 86.4 169.6 17.1 78.1 0.0 147 147 A S E -GJ 100 162A 56 -47,-0.7 -47,-2.8 15,-0.2 2,-0.3 -0.598 38.5-159.2-107.0 167.9 15.5 81.1 1.7 148 148 A Y E -G 99 0A 47 13,-1.3 -49,-0.2 -49,-0.2 -2,-0.0 -0.840 23.9-157.4-141.6 178.0 16.5 83.2 4.7 149 149 A I E +G 98 0A 53 -51,-0.8 -51,-0.8 -2,-0.3 11,-0.3 -0.496 33.6 174.8-156.2 71.4 15.4 85.6 7.5 150 150 A Y B -Q 159 0B 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