==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-MAY-02 1LO6 . COMPND 2 MOLECULE: KALLIKREIN 6; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.J.BERNETT,S.I.BLABER,I.A.SCARISBRICK,P.DHANARAJAN, . 221 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 62.0 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 . 76 34.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 4 1.8 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 . 16 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 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 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 . 3 1 3 6 1 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 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 L 0 0 1 0, 0.0 3,-0.4 0, 0.0 125,-0.4 0.000 360.0 360.0 360.0 129.2 39.1 79.3 78.6 2 17 A V B +A 170 0A 7 168,-2.5 168,-1.5 123,-0.2 123,-0.1 -0.763 360.0 6.1-101.1 140.6 41.1 79.9 81.8 3 18 A H S S+ 0 0 86 -2,-0.4 -1,-0.2 166,-0.2 166,-0.2 0.656 100.2 106.7 71.8 22.0 40.4 78.7 85.3 4 19 A G - 0 0 34 -3,-0.4 133,-0.2 166,-0.1 -1,-0.2 -0.042 58.9-128.3-104.9-151.0 37.5 76.5 84.4 5 20 A G E -B 136 0B 25 131,-2.0 131,-2.9 -3,-0.1 2,-0.1 -0.946 39.4 -59.7-154.7 172.7 37.2 72.7 84.2 6 21 A P E -B 135 0B 94 0, 0.0 129,-0.2 0, 0.0 128,-0.1 -0.354 55.7-123.0 -63.6 136.7 36.0 70.0 81.8 7 22 A a - 0 0 11 127,-2.1 2,-0.2 47,-0.1 127,-0.0 -0.312 29.9 -97.0 -70.8 161.0 32.4 70.3 80.8 8 23 A D > - 0 0 123 1,-0.1 3,-1.5 -2,-0.0 4,-0.2 -0.575 39.5-116.3 -74.3 146.4 29.9 67.5 81.4 9 24 A K T 3 S+ 0 0 55 1,-0.3 3,-0.3 -2,-0.2 -1,-0.1 0.760 111.1 41.0 -58.5 -28.8 29.7 65.5 78.2 10 25 A T T 3 S+ 0 0 75 1,-0.2 -1,-0.3 2,-0.0 -2,-0.0 0.322 93.2 86.8-104.4 11.5 26.0 66.3 77.6 11 26 A S S < S+ 0 0 41 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.450 87.0 45.8 -91.1 0.0 26.0 70.0 78.6 12 27 A H > + 0 0 10 -3,-0.3 3,-1.7 -4,-0.2 -1,-0.2 -0.257 53.8 145.1-140.0 53.1 27.0 71.6 75.3 13 28 A P T 3 S+ 0 0 23 0, 0.0 89,-1.5 0, 0.0 39,-0.3 0.715 77.6 55.7 -64.1 -17.5 25.0 70.2 72.4 14 29 A Y T 3 S+ 0 0 16 87,-0.2 16,-2.8 -3,-0.1 2,-0.3 0.483 81.6 113.9 -91.4 -5.6 25.0 73.6 70.7 15 30 A Q E < -J 29 0C 2 -3,-1.7 37,-0.5 14,-0.2 38,-0.4 -0.518 45.7-168.5 -76.8 129.4 28.8 74.0 70.7 16 31 A A E -JK 28 51C 0 12,-2.4 12,-1.2 -2,-0.3 2,-0.5 -0.845 13.0-145.0-111.4 151.1 30.5 74.0 67.3 17 32 A A E -JK 27 50C 0 33,-2.3 33,-2.6 -2,-0.3 2,-0.5 -0.974 13.2-153.4-113.8 130.4 34.3 73.7 66.6 18 33 A L E -JK 26 49C 0 8,-3.0 7,-3.4 -2,-0.5 8,-1.7 -0.934 16.3-172.8-108.7 126.1 35.5 75.7 63.7 19 34 A Y E +JK 24 48C 43 29,-2.8 29,-2.5 -2,-0.5 2,-0.3 -0.842 14.4 177.2-118.5 152.9 38.7 74.4 62.0 20 35 A T E > S+J 23 0C 26 3,-2.1 3,-2.1 -2,-0.3 27,-0.1 -0.975 74.9 3.1-149.9 140.0 41.0 75.7 59.3 21 36 A S T 3 S- 0 0 116 -2,-0.3 3,-0.1 25,-0.3 26,-0.1 0.797 130.6 -58.4 53.3 30.5 44.2 74.0 58.0 22 38 A G T 3 S+ 0 0 67 1,-0.2 2,-0.3 26,-0.0 -1,-0.3 0.503 117.5 96.5 81.5 4.7 43.6 71.1 60.3 23 39 A H E < S-J 20 0C 141 -3,-2.1 -3,-2.1 0, 0.0 -1,-0.2 -0.948 80.7-101.3-129.4 148.6 43.6 73.0 63.5 24 40 A L E +J 19 0C 40 -2,-0.3 -5,-0.3 -5,-0.2 3,-0.1 -0.436 38.5 170.4 -66.7 137.7 40.9 74.5 65.7 25 41 A L E - 0 0 48 -7,-3.4 2,-0.3 1,-0.4 149,-0.3 0.671 57.1 -15.2-114.6 -37.4 40.5 78.2 65.2 26 42 A b E -J 18 0C 4 -8,-1.7 -8,-3.0 149,-0.1 -1,-0.4 -0.958 57.3-109.5-160.0 171.6 37.3 79.1 67.0 27 43 A G E -J 17 0C 1 149,-2.9 12,-0.4 -2,-0.3 2,-0.3 -0.472 32.8-176.5-100.8 178.6 34.1 78.0 68.7 28 44 A G E -J 16 0C 0 -12,-1.2 -12,-2.4 -2,-0.2 2,-0.4 -0.965 21.4-119.1-165.3 171.3 30.6 78.6 67.3 29 45 A V E -JL 15 37C 0 8,-2.9 8,-3.1 -2,-0.3 2,-0.5 -0.981 15.3-135.7-130.4 124.3 27.0 78.1 68.2 30 46 A L E + L 0 36C 0 -16,-2.8 74,-2.2 -2,-0.4 6,-0.2 -0.637 33.5 163.2 -73.8 122.5 24.4 76.0 66.4 31 47 A I E + 0 0 24 4,-2.3 -1,-0.2 -2,-0.5 5,-0.2 0.407 67.5 9.0-120.6 -1.4 21.3 78.2 66.3 32 48 A H E > S- L 0 35C 69 3,-1.1 3,-1.7 73,-0.1 -1,-0.5 -0.920 86.2 -98.7-170.4 149.9 19.4 76.5 63.5 33 49 A P T 3 S+ 0 0 39 0, 0.0 62,-2.9 0, 0.0 60,-0.1 0.782 125.3 35.2 -49.6 -28.6 20.0 73.2 61.7 34 50 A L T 3 S+ 0 0 34 60,-0.2 57,-2.7 1,-0.1 2,-0.4 0.433 112.7 68.5-106.1 -0.2 21.5 75.1 58.8 35 51 A W E < -LM 32 90C 3 -3,-1.7 -4,-2.3 55,-0.2 -3,-1.1 -0.968 48.0-172.3-135.9 135.1 23.3 77.9 60.7 36 52 A V E -LM 30 89C 0 53,-2.3 53,-2.8 -2,-0.4 2,-0.4 -0.958 18.6-148.7-116.7 129.5 26.2 78.3 63.0 37 53 A L E +LM 29 88C 0 -8,-3.1 -8,-2.9 -2,-0.4 2,-0.3 -0.806 32.5 143.4 -98.0 140.6 26.7 81.7 64.7 38 54 A T E - M 0 87C 0 49,-2.2 49,-2.4 -2,-0.4 2,-0.3 -0.875 50.6 -62.3-157.7-174.2 30.3 82.8 65.5 39 55 A A > - 0 0 0 -12,-0.4 3,-1.8 -2,-0.3 47,-0.3 -0.617 36.3-129.7 -85.0 145.9 32.6 85.9 65.6 40 56 A A G > S+ 0 0 2 1,-0.3 3,-1.6 -2,-0.3 -1,-0.1 0.801 106.4 65.9 -62.8 -28.3 33.4 87.8 62.5 41 57 A H G 3 S+ 0 0 66 1,-0.3 -1,-0.3 41,-0.1 135,-0.0 0.548 87.2 71.4 -74.2 0.2 37.1 87.6 63.3 42 58 A b G < + 0 0 0 -3,-1.8 -1,-0.3 2,-0.0 2,-0.2 0.385 69.3 127.6 -91.4 2.3 36.9 83.8 62.8 43 59 A K < + 0 0 95 -3,-1.6 -3,-0.0 -4,-0.1 28,-0.0 -0.441 26.7 147.6 -65.7 126.6 36.5 84.2 59.0 44 60 A K > - 0 0 99 -2,-0.2 3,-0.6 0, 0.0 2,-0.2 -0.959 51.8 -93.6-150.6 159.4 39.0 82.1 57.1 45 61 A P T 3 S+ 0 0 93 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.543 105.4 15.6 -79.0 151.1 38.8 80.4 53.7 46 62 A N T 3 S- 0 0 137 -2,-0.2 -25,-0.3 1,-0.2 2,-0.1 0.871 81.0-172.3 60.5 43.1 37.8 76.8 53.8 47 63 A L < - 0 0 10 -3,-0.6 21,-0.7 -27,-0.1 2,-0.4 -0.433 9.3-152.3 -67.3 142.0 36.3 76.7 57.3 48 64 A Q E -KN 19 67C 59 -29,-2.5 -29,-2.8 19,-0.1 2,-0.5 -0.962 6.4-151.4-115.4 132.4 35.3 73.2 58.5 49 65 A V E -KN 18 66C 0 17,-2.6 17,-2.2 -2,-0.4 2,-0.5 -0.911 8.8-168.3-110.9 129.8 32.5 72.9 61.1 50 66 A F E -KN 17 65C 34 -33,-2.6 -33,-2.3 -2,-0.5 2,-0.3 -0.968 4.7-175.0-119.6 125.7 32.3 70.1 63.7 51 67 A L E +KN 16 64C 5 13,-3.0 13,-2.3 -2,-0.5 -35,-0.1 -0.767 64.8 32.5-112.7 159.8 29.3 69.4 65.8 52 69 A G S S+ 0 0 7 -37,-0.5 2,-0.3 48,-0.4 10,-0.2 0.688 82.8 142.2 70.0 17.9 28.8 66.9 68.6 53 70 A K + 0 0 14 -38,-0.4 -1,-0.2 -3,-0.2 3,-0.1 -0.650 16.3 153.3 -92.9 150.4 32.5 67.1 69.7 54 71 A H S S+ 0 0 36 1,-0.3 80,-2.2 -2,-0.3 2,-0.6 0.471 72.4 33.7-135.6 -57.5 33.7 67.0 73.3 55 72 A N B > -P 133 0D 31 78,-0.2 3,-1.5 3,-0.2 -1,-0.3 -0.935 65.6-156.9-110.2 115.7 37.2 65.7 73.4 56 73 A L T 3 S+ 0 0 42 76,-3.1 -1,-0.1 -2,-0.6 77,-0.1 0.651 90.8 56.8 -66.7 -14.3 39.3 66.7 70.3 57 74 A R T 3 S+ 0 0 202 75,-0.1 2,-0.4 2,-0.0 -1,-0.3 0.199 99.8 67.3-103.3 16.6 41.7 63.8 70.7 58 75 A Q S < S- 0 0 114 -3,-1.5 2,-0.4 74,-0.1 -4,-0.2 -0.997 80.9-123.6-138.8 131.5 39.0 61.1 70.6 59 76 A R - 0 0 223 -2,-0.4 2,-0.4 -6,-0.1 -3,-0.1 -0.627 37.0-156.3 -72.4 125.2 36.8 60.0 67.7 60 77 A E > - 0 0 26 -2,-0.4 3,-1.2 1,-0.1 -1,-0.0 -0.875 23.1-136.2-112.2 139.2 33.3 60.3 69.1 61 78 A S T 3 S+ 0 0 132 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.759 105.9 52.8 -59.9 -25.5 30.2 58.4 67.9 62 79 A S T 3 S+ 0 0 24 -10,-0.2 -1,-0.3 2,-0.0 -9,-0.1 0.606 81.7 114.0 -87.9 -14.6 28.3 61.7 68.1 63 80 A Q < - 0 0 56 -3,-1.2 2,-0.4 -11,-0.1 -11,-0.2 -0.307 39.8-176.4 -67.4 143.4 30.5 63.9 66.0 64 81 A E E -N 51 0C 82 -13,-2.3 -13,-3.0 2,-0.0 2,-0.3 -0.996 10.2-150.7-137.8 138.6 29.3 65.3 62.6 65 82 A Q E +N 50 0C 123 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.811 14.5 178.4-111.3 150.8 31.2 67.4 60.1 66 83 A S E -N 49 0C 20 -17,-2.2 -17,-2.6 -2,-0.3 2,-0.2 -0.996 22.2-133.4-151.1 147.5 30.0 70.0 57.7 67 84 A S E -N 48 0C 57 -2,-0.3 25,-2.0 -19,-0.2 2,-0.5 -0.542 29.3-117.3 -91.7 164.7 31.4 72.3 55.1 68 85 A V E -O 91 0C 37 -21,-0.7 23,-0.2 23,-0.2 3,-0.1 -0.900 25.3-177.7-104.8 130.4 30.3 75.9 54.9 69 86 A V E S+ 0 0 88 21,-2.6 2,-0.3 -2,-0.5 22,-0.1 0.651 73.0 14.1-100.8 -18.5 28.5 77.0 51.7 70 87 A R E -O 90 0C 114 20,-1.0 20,-3.1 2,-0.0 2,-0.5 -0.965 58.2-160.2-157.6 137.5 28.1 80.7 52.7 71 88 A A E -O 89 0C 38 -2,-0.3 2,-0.7 18,-0.2 18,-0.2 -0.983 8.0-164.2-122.9 120.2 29.6 83.0 55.3 72 89 A V E -O 88 0C 33 16,-3.2 16,-2.5 -2,-0.5 2,-0.3 -0.873 6.9-167.1-108.5 100.2 27.7 86.2 56.1 73 90 A I E -O 87 0C 54 -2,-0.7 14,-0.2 14,-0.2 12,-0.1 -0.642 38.7 -95.2 -83.5 140.2 29.9 88.7 58.0 74 91 A H > - 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0 0 11 0, 0.0 -40,-0.2 0, 0.0 -9,-0.1 -0.278 26.8 -97.7 -71.6 159.5 36.1 91.6 82.1 204 226 A G E -G 162 0B 0 -42,-2.2 -42,-2.2 -11,-0.2 2,-0.5 -0.477 37.0-133.1 -71.2 150.0 35.8 89.6 78.9 205 227 A V E -GI 161 192B 0 -13,-3.1 -13,-2.2 -44,-0.2 -14,-1.5 -0.930 24.8-173.1-112.2 129.2 34.0 91.4 76.1 206 228 A Y E -GI 160 190B 0 -46,-3.4 -46,-2.6 -2,-0.5 2,-0.2 -0.883 34.6-100.2-121.9 148.5 31.3 89.6 74.2 207 229 A T E -GI 159 189B 1 -18,-2.3 2,-1.6 -2,-0.3 -18,-0.8 -0.532 42.2-121.6 -65.2 130.3 29.3 90.4 71.1 208 230 A N E > - I 0 188B 7 -50,-2.6 3,-1.6 -2,-0.2 4,-0.3 -0.596 32.3-173.9 -78.6 86.4 25.9 91.6 72.5 209 231 A V G > S+ 0 0 0 -2,-1.6 3,-2.4 -22,-1.1 4,-0.2 0.814 73.7 68.9 -54.5 -38.8 23.7 89.0 70.7 210 232 A c G > S+ 0 0 5 -23,-0.6 3,-0.9 1,-0.3 -1,-0.3 0.807 93.7 62.1 -53.0 -27.9 20.3 90.5 71.8 211 233 A R G < S+ 0 0 126 -3,-1.6 -1,-0.3 1,-0.2 3,-0.2 0.694 101.7 52.1 -71.2 -18.4 21.2 93.4 69.5 212 234 A Y G <> + 0 0 5 -3,-2.4 4,-3.0 -4,-0.3 5,-0.3 0.246 68.3 109.3-105.6 11.3 21.2 91.2 66.4 213 235 A T H <> S+ 0 0 29 -3,-0.9 4,-2.4 -4,-0.2 5,-0.2 0.904 85.7 45.3 -54.4 -44.6 17.9 89.3 66.5 214 236 A N H > S+ 0 0 131 -3,-0.2 4,-2.4 2,-0.2 5,-0.2 0.921 114.2 47.2 -66.4 -45.9 16.6 91.2 63.5 215 237 A W H > S+ 0 0 46 -4,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.914 115.0 46.1 -62.5 -44.3 19.7 90.9 61.4 216 238 A I H X S+ 0 0 4 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.942 112.3 50.7 -64.3 -46.5 20.0 87.1 62.2 217 239 A Q H X S+ 0 0 55 -4,-2.4 4,-2.9 -5,-0.3 -2,-0.2 0.942 112.4 46.2 -56.7 -50.3 16.3 86.5 61.5 218 240 A K H < S+ 0 0 174 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.875 113.1 49.9 -61.8 -39.4 16.4 88.3 58.1 219 241 A T H < S+ 0 0 26 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.925 117.1 39.5 -67.1 -43.6 19.6 86.5 57.1 220 242 A I H < 0 0 42 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.927 360.0 360.0 -72.2 -48.4 18.2 83.1 57.9 221 243 A Q < 0 0 118 -4,-2.9 -3,-0.1 -5,-0.3 -4,-0.0 0.463 360.0 360.0 -75.6 360.0 14.7 83.5 56.7