==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-JUN-12 4FON . COMPND 2 MOLECULE: PROTEINASE K; . SOURCE 2 ORGANISM_SCIENTIFIC: ENGYODONTIUM ALBUM; . AUTHOR J.JAKONCIC . 279 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10438.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 3 1.1 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-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 . 19 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 21.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 0 1 0 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 1 3 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 PARALLEL BRIDGES PER LADDER . 1 3 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 A 0 0 49 0, 0.0 24,-2.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 149.4 21.4 24.6 8.1 2 2 A A E -A 24 0A 66 22,-0.2 2,-0.6 20,-0.0 22,-0.2 -0.997 360.0-165.4-128.4 126.7 23.6 26.4 10.5 3 3 A Q E > -A 23 0A 30 20,-2.7 20,-2.0 -2,-0.4 3,-0.6 -0.943 21.4-146.9-106.5 109.9 22.6 27.9 13.8 4 4 A T T 3 S+ 0 0 98 -2,-0.6 18,-0.2 1,-0.2 -2,-0.0 -0.400 75.8 16.1 -79.3 156.0 25.3 30.3 15.1 5 5 A N T 3 S+ 0 0 138 16,-0.2 -1,-0.2 1,-0.1 17,-0.2 0.880 88.6 171.0 49.3 46.3 26.1 30.7 18.7 6 6 A A < - 0 0 10 15,-2.3 -1,-0.1 -3,-0.6 76,-0.1 -0.407 45.4 -81.9 -76.7 156.8 24.2 27.5 19.6 7 7 A P >> - 0 0 19 0, 0.0 4,-2.0 0, 0.0 3,-0.8 -0.298 47.9-111.9 -52.6 146.4 24.2 25.9 23.0 8 8 A W H 3> S+ 0 0 21 1,-0.3 4,-2.4 199,-0.2 12,-0.2 0.822 114.5 57.5 -56.9 -36.1 27.4 23.9 23.3 9 9 A G H 3> S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.873 106.1 48.1 -65.4 -38.6 25.5 20.6 23.3 10 10 A L H <> S+ 0 0 1 -3,-0.8 4,-0.9 2,-0.2 14,-0.3 0.943 113.0 48.3 -65.1 -48.6 23.8 21.2 20.0 11 11 A A H >< S+ 0 0 0 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.904 110.4 54.2 -55.9 -38.6 27.2 22.2 18.5 12 12 A R H >< S+ 0 0 6 -4,-2.4 3,-1.6 -5,-0.2 -1,-0.2 0.895 101.1 56.6 -65.2 -41.1 28.7 19.1 20.0 13 13 A I H 3< S+ 0 0 0 -4,-1.9 262,-2.9 1,-0.3 263,-0.3 0.687 111.7 43.1 -71.0 -13.8 26.2 16.7 18.4 14 14 A S T << S+ 0 0 9 -4,-0.9 2,-0.4 -3,-0.7 -1,-0.3 0.154 105.8 82.6-110.4 22.0 27.0 17.9 14.9 15 15 A S < - 0 0 17 -3,-1.6 242,-0.1 -5,-0.1 261,-0.1 -0.944 61.9-151.6-129.6 145.9 30.8 18.0 15.4 16 16 A T S S+ 0 0 86 -2,-0.4 -1,-0.1 2,-0.1 -4,-0.1 0.434 91.3 46.1 -83.3 -0.7 33.8 15.6 15.2 17 17 A S S S- 0 0 62 -5,-0.1 3,-0.4 240,-0.0 -3,-0.1 -0.995 79.8-122.5-140.0 147.6 35.5 17.9 17.8 18 18 A P S S+ 0 0 59 0, 0.0 168,-0.1 0, 0.0 167,-0.1 -0.321 84.0 57.5 -71.7 166.7 34.7 19.7 21.0 19 19 A G S S+ 0 0 77 166,-0.4 2,-0.2 1,-0.3 167,-0.1 0.643 74.3 115.2 90.2 17.2 35.1 23.5 21.3 20 20 A T - 0 0 62 -3,-0.4 -1,-0.3 -12,-0.2 -9,-0.1 -0.734 47.3-157.2-115.9 169.1 32.8 24.8 18.5 21 21 A S + 0 0 59 -2,-0.2 -15,-2.3 -10,-0.1 2,-0.4 0.200 60.0 90.0-134.5 13.6 29.6 26.9 18.8 22 22 A T - 0 0 23 -17,-0.2 2,-0.5 -18,-0.2 -18,-0.2 -0.969 60.2-145.3-118.3 132.8 27.6 26.4 15.6 23 23 A Y E -A 3 0A 0 -20,-2.0 -20,-2.7 -2,-0.4 2,-0.4 -0.871 15.2-164.9 -97.5 125.8 24.9 23.6 15.2 24 24 A Y E +A 2 0A 105 -2,-0.5 2,-0.3 -14,-0.3 253,-0.2 -0.951 21.4 147.3-113.5 131.1 24.7 22.1 11.7 25 25 A Y - 0 0 35 -24,-2.0 2,-0.2 -2,-0.4 -11,-0.0 -0.995 51.5 -87.3-159.6 156.6 21.7 20.0 10.7 26 26 A D > - 0 0 49 -2,-0.3 3,-2.0 1,-0.1 4,-0.1 -0.498 39.9-125.0 -69.0 135.2 19.5 19.0 7.8 27 27 A E T 3 S+ 0 0 167 1,-0.3 -1,-0.1 -2,-0.2 4,-0.1 0.640 101.9 82.1 -62.2 -16.6 16.6 21.5 7.4 28 28 A S T > S- 0 0 30 1,-0.1 3,-2.5 2,-0.1 -1,-0.3 0.873 74.5-174.7 -54.8 -37.1 14.0 18.7 7.6 29 29 A A T < - 0 0 3 -3,-2.0 58,-2.9 1,-0.3 59,-0.4 0.729 64.8 -54.6 56.8 34.4 14.6 19.1 11.4 30 30 A G T > S+ 0 0 0 206,-0.4 3,-2.1 1,-0.2 59,-0.3 0.611 84.2 167.4 75.1 12.2 12.4 16.2 12.5 31 31 A Q T < + 0 0 133 -3,-2.5 -1,-0.2 1,-0.3 57,-0.2 -0.318 67.0 24.1 -61.5 137.5 9.3 17.4 10.7 32 32 A G T 3 S+ 0 0 23 55,-0.5 93,-2.6 1,-0.4 94,-0.6 0.387 103.9 102.9 86.1 -4.1 6.7 14.7 10.6 33 33 A S E < -b 126 0B 1 -3,-2.1 56,-1.7 92,-0.2 -1,-0.4 -0.583 58.8-144.5 -98.4 169.2 8.1 13.0 13.7 34 34 A a E -bc 127 89B 0 92,-1.8 94,-2.4 -2,-0.2 2,-0.4 -1.000 7.8-165.0-136.4 139.2 6.7 13.1 17.3 35 35 A V E -bc 128 90B 0 54,-2.8 56,-2.4 -2,-0.4 2,-0.5 -0.984 8.5-153.6-126.7 121.7 8.5 13.1 20.6 36 36 A Y E -bc 129 91B 0 92,-2.8 94,-3.1 -2,-0.4 2,-0.6 -0.791 5.8-156.5 -87.0 131.0 6.7 12.4 23.9 37 37 A V E -bc 130 92B 1 54,-2.6 56,-2.2 -2,-0.5 2,-0.8 -0.944 5.6-163.5-111.5 107.4 8.3 14.0 26.9 38 38 A I E + c 0 93B 0 92,-2.2 94,-0.5 -2,-0.6 2,-0.2 -0.844 51.6 84.5 -99.1 104.1 7.3 11.9 30.0 39 39 A D E S- c 0 94B 0 54,-2.2 57,-2.2 -2,-0.8 56,-1.4 -0.627 96.7 -32.4-169.0-147.1 8.1 14.2 32.9 40 40 A T S S- 0 0 0 1,-0.4 26,-0.4 54,-0.2 27,-0.2 0.351 97.8 -92.3 -84.6 4.6 6.7 17.2 34.9 41 41 A G - 0 0 0 52,-0.3 -1,-0.4 -4,-0.2 2,-0.3 -0.624 38.1 -94.1 111.0-177.5 4.8 18.6 31.9 42 42 A I - 0 0 3 21,-0.5 2,-1.8 -2,-0.2 3,-0.1 -0.982 18.0-130.8-141.7 130.5 5.7 21.1 29.2 43 43 A E > - 0 0 35 -2,-0.3 3,-2.0 1,-0.2 6,-0.2 -0.624 31.9-177.8 -78.0 85.2 4.9 24.9 29.2 44 44 A A T 3 S+ 0 0 31 -2,-1.8 7,-0.5 1,-0.3 9,-0.3 0.751 71.6 66.8 -62.6 -26.2 3.5 24.6 25.7 45 45 A S T 3 S+ 0 0 104 -3,-0.1 -1,-0.3 5,-0.1 5,-0.1 0.555 70.2 121.2 -72.3 -7.7 2.8 28.4 25.5 46 46 A H S X> S- 0 0 10 -3,-2.0 3,-2.4 1,-0.2 4,-0.6 -0.375 70.4-131.4 -58.0 130.1 6.5 29.1 25.6 47 47 A P G >4 S+ 0 0 76 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.810 103.5 70.6 -53.9 -28.4 7.4 31.1 22.4 48 48 A E G 34 S+ 0 0 13 1,-0.2 32,-2.5 2,-0.1 33,-0.1 0.688 93.5 55.0 -61.5 -20.8 10.3 28.7 21.8 49 49 A F G X4 S- 0 0 0 -3,-2.4 3,-2.6 30,-0.2 -1,-0.2 0.630 89.1-152.1 -91.7 -14.9 7.8 25.9 21.0 50 50 A E T << - 0 0 92 -3,-1.1 -2,-0.1 -4,-0.6 -5,-0.1 0.737 67.9 -55.7 59.3 26.9 6.0 27.8 18.2 51 51 A G T 3 S+ 0 0 69 -7,-0.5 -1,-0.3 -5,-0.3 -6,-0.1 0.487 117.4 109.1 83.1 2.0 2.7 26.0 18.7 52 52 A R < + 0 0 19 -3,-2.6 38,-2.8 -8,-0.1 2,-0.4 0.437 62.9 75.1 -90.6 -3.7 4.4 22.6 18.1 53 53 A A E +d 90 0B 10 -9,-0.3 2,-0.3 36,-0.2 38,-0.2 -0.865 53.7 163.6-108.7 147.4 4.1 21.5 21.8 54 54 A Q E -d 91 0B 77 36,-1.7 38,-2.8 -2,-0.4 2,-0.4 -0.981 37.1-117.2-154.4 149.4 0.9 20.3 23.6 55 55 A M E +d 92 0B 41 -2,-0.3 38,-0.2 36,-0.2 3,-0.1 -0.780 30.0 172.0 -81.5 131.7 -0.0 18.5 26.8 56 56 A V E + 0 0 28 36,-2.7 2,-0.3 -2,-0.4 37,-0.2 0.547 61.6 15.2-115.2 -15.4 -1.8 15.2 26.1 57 57 A K E +d 93 0B 76 35,-1.4 37,-2.9 6,-0.1 -1,-0.3 -0.958 51.2 176.2-160.9 141.3 -2.0 13.6 29.6 58 58 A T E -d 94 0B 39 -2,-0.3 37,-0.1 35,-0.2 5,-0.1 -0.981 19.0-162.4-140.0 154.0 -1.7 14.4 33.3 59 59 A Y S S+ 0 0 71 35,-1.5 2,-0.2 -2,-0.3 36,-0.1 0.246 76.7 64.3-111.1 9.5 -2.2 12.3 36.4 60 60 A Y S S- 0 0 64 2,-0.4 -2,-0.1 34,-0.2 34,-0.1 -0.586 104.5 -79.4-126.9-177.6 -2.5 15.4 38.7 61 61 A Y S S+ 0 0 213 -2,-0.2 2,-0.3 2,-0.1 -3,-0.0 0.652 111.9 24.0 -65.8 -16.3 -4.7 18.4 39.2 62 62 A S - 0 0 43 2,-0.1 -2,-0.4 1,-0.1 -3,-0.2 -0.979 58.9-143.1-142.6 157.2 -3.2 20.3 36.3 63 63 A S S S+ 0 0 51 -2,-0.3 -21,-0.5 -5,-0.1 -6,-0.1 0.448 70.7 116.1 -91.2 -5.1 -1.3 19.5 33.1 64 64 A R S S- 0 0 145 -23,-0.1 2,-1.1 1,-0.1 -2,-0.1 -0.360 73.8-122.0 -60.6 140.1 0.8 22.6 33.7 65 65 A D + 0 0 1 1,-0.2 -24,-0.1 -23,-0.1 -1,-0.1 -0.759 36.2 171.6 -81.2 99.9 4.6 22.2 34.4 66 66 A G S S+ 0 0 22 -2,-1.1 -1,-0.2 -26,-0.4 -25,-0.1 0.312 73.4 48.5 -89.0 7.8 4.9 23.8 37.8 67 67 A N S S- 0 0 46 -27,-0.2 146,-0.1 30,-0.0 -1,-0.1 0.802 89.8-135.6-109.6 -55.7 8.5 22.6 38.1 68 68 A G S > S+ 0 0 0 144,-0.1 4,-2.4 -28,-0.1 5,-0.2 -0.071 77.3 100.1 117.9 -30.6 10.4 23.5 34.9 69 69 A H H > S+ 0 0 39 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.920 85.0 45.4 -57.2 -48.4 12.3 20.2 34.4 70 70 A G H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.879 112.5 51.8 -64.1 -37.3 9.9 18.8 31.8 71 71 A T H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 140,-0.3 0.892 109.8 50.1 -64.3 -40.4 9.9 22.1 29.9 72 72 A H H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 139,-0.3 0.958 112.4 46.0 -63.6 -49.4 13.7 22.2 29.9 73 73 A C H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 3,-0.2 0.926 112.1 51.2 -60.4 -45.9 13.9 18.6 28.5 74 74 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.875 106.6 55.6 -58.9 -38.6 11.3 19.4 25.9 75 75 A G H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.878 105.8 50.4 -62.1 -37.6 13.3 22.4 24.9 76 76 A T H < S+ 0 0 0 -4,-1.8 8,-2.3 -3,-0.2 9,-0.2 0.861 113.1 47.9 -70.6 -33.7 16.4 20.3 24.3 77 77 A V H < S- 0 0 0 -4,-2.0 8,-2.8 6,-0.2 -2,-0.2 0.953 137.7 -12.3 -62.6 -53.6 14.3 17.9 22.1 78 78 A G H < S+ 0 0 0 -4,-2.5 -3,-0.2 5,-0.2 -2,-0.2 0.334 81.6 130.2-149.1 11.5 12.5 20.4 20.0 79 79 A S X - 0 0 0 -4,-2.0 4,-1.6 -5,-0.3 -30,-0.2 -0.380 62.3-116.0 -71.7 157.3 12.6 24.2 20.8 80 80 A R T 4 S+ 0 0 111 -32,-2.5 -1,-0.1 1,-0.2 6,-0.1 0.889 109.8 21.0 -60.1 -43.0 13.5 26.6 18.0 81 81 A T T 4 S+ 0 0 49 -33,-0.1 -1,-0.2 1,-0.1 5,-0.0 0.842 135.2 32.9 -92.9 -41.8 16.7 27.8 19.7 82 82 A Y T 4 S+ 0 0 38 -34,-0.1 2,-0.2 -76,-0.1 -2,-0.2 0.457 98.4 100.5-101.1 -0.8 17.6 25.1 22.2 83 83 A G < - 0 0 0 -4,-1.6 3,-0.3 1,-0.1 -6,-0.2 -0.586 57.5-151.4-101.0 151.0 16.4 22.0 20.4 84 84 A V S S+ 0 0 0 -8,-2.3 2,-0.7 1,-0.2 -6,-0.2 0.895 100.1 37.8 -72.2 -45.4 17.9 19.2 18.3 85 85 A A S > S- 0 0 0 -8,-2.8 3,-1.5 -9,-0.2 -1,-0.2 -0.825 73.5-177.1-116.3 85.1 14.8 18.5 16.2 86 86 A K T 3 S+ 0 0 11 -2,-0.7 -56,-0.2 -3,-0.3 -1,-0.1 0.503 77.3 41.2 -74.7 -5.1 13.5 22.0 15.6 87 87 A K T 3 S+ 0 0 98 -58,-2.9 -55,-0.5 2,-0.1 -1,-0.3 0.249 85.7 118.0-123.6 10.3 10.3 21.0 13.7 88 88 A T < - 0 0 0 -3,-1.5 2,-0.5 -59,-0.4 -54,-0.2 -0.279 68.2-112.2 -70.5 162.3 9.2 17.9 15.6 89 89 A Q E -c 34 0B 70 -56,-1.7 -54,-2.8 -59,-0.3 2,-0.5 -0.862 30.7-149.8 -94.4 132.0 5.8 17.7 17.3 90 90 A L E -cd 35 53B 0 -38,-2.8 -36,-1.7 -2,-0.5 2,-0.5 -0.892 11.5-170.6-109.2 130.0 6.2 17.6 21.2 91 91 A F E -cd 36 54B 7 -56,-2.4 -54,-2.6 -2,-0.5 2,-0.4 -0.977 12.5-146.6-122.6 122.5 3.6 15.8 23.4 92 92 A G E -cd 37 55B 0 -38,-2.8 -36,-2.7 -2,-0.5 -35,-1.4 -0.743 13.3-175.0 -94.1 134.3 3.7 16.2 27.1 93 93 A V E -cd 38 57B 0 -56,-2.2 -54,-2.2 -2,-0.4 2,-1.3 -0.968 17.1-149.4-125.0 108.9 2.8 13.4 29.6 94 94 A K E +cd 39 58B 3 -37,-2.9 -35,-1.5 -2,-0.5 -54,-0.2 -0.676 41.0 144.0 -89.6 91.7 2.8 14.6 33.2 95 95 A V + 0 0 0 -56,-1.4 2,-0.4 -2,-1.3 -55,-0.2 0.533 60.7 69.3 -96.1 -13.1 3.8 11.6 35.3 96 96 A L S S- 0 0 10 -57,-2.2 6,-0.2 -3,-0.2 -57,-0.1 -0.893 80.6-129.7-110.2 138.0 5.8 13.7 37.8 97 97 A D > - 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0 0 56 -2,-0.3 2,-0.2 37,-0.1 3,-0.1 -0.921 12.4-177.3 175.9 166.1 14.4 7.0 37.3 135 135 A G E -K 170 0C 23 35,-2.2 35,-2.3 -2,-0.3 37,-0.2 -0.753 52.2 -31.1-152.2-157.6 14.6 5.3 40.6 136 136 A G E S-K 169 0C 42 33,-0.3 33,-0.3 -2,-0.2 -1,-0.2 -0.156 85.5 -64.8 -65.3 163.1 15.7 2.0 42.1 137 137 A Y + 0 0 134 31,-1.5 2,-0.3 32,-0.1 -1,-0.2 -0.198 59.0 169.9 -53.5 130.8 15.6 -1.2 40.1 138 138 A S > - 0 0 19 -3,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.936 29.2-157.4-145.3 119.7 12.1 -2.4 39.3 139 139 A S H > S+ 0 0 79 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.851 98.5 53.8 -63.9 -32.7 11.2 -5.2 36.9 140 140 A S H > S+ 0 0 61 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.896 109.1 46.9 -72.0 -37.7 7.8 -3.7 36.4 141 141 A V H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.937 114.2 48.2 -65.6 -44.8 9.2 -0.3 35.4 142 142 A N H X S+ 0 0 6 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.911 110.2 51.9 -60.3 -43.1 11.7 -2.0 33.1 143 143 A S H X S+ 0 0 54 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.884 107.4 52.2 -61.9 -40.2 8.9 -4.1 31.6 144 144 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.913 111.1 47.4 -61.3 -41.9 6.8 -1.0 30.9 145 145 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.906 111.2 51.7 -65.6 -40.1 9.7 0.6 29.1 146 146 A A H X S+ 0 0 23 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.902 109.8 49.5 -62.6 -42.3 10.3 -2.6 27.1 147 147 A R H X S+ 0 0 98 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.932 109.2 51.5 -61.5 -46.1 6.6 -2.7 26.1 148 148 A L H <>S+ 0 0 0 -4,-2.3 5,-1.1 1,-0.2 4,-0.2 0.940 113.5 44.7 -58.2 -46.6 6.7 0.9 24.9 149 149 A Q H >X5S+ 0 0 27 -4,-2.3 3,-2.0 1,-0.2 4,-0.6 0.941 111.7 52.5 -60.6 -49.5 9.8 0.2 22.8 150 150 A S H 3<5S+ 0 0 107 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.843 99.7 64.7 -55.3 -34.6 8.3 -3.0 21.5 151 151 A S T 3<5S- 0 0 45 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.521 129.9 -88.6 -70.2 -7.4 5.2 -1.1 20.4 152 152 A G T <45S+ 0 0 36 -3,-2.0 -25,-0.5 1,-0.3 2,-0.4 0.708 86.5 126.6 105.0 28.0 7.3 0.9 17.9 153 153 A V E << -e 127 0B 0 -5,-1.1 2,-0.9 -4,-0.6 -1,-0.3 -0.959 60.9-127.0-115.6 131.9 8.5 3.9 19.9 154 154 A M E -e 128 0B 1 -27,-2.6 -25,-2.9 -2,-0.4 2,-0.6 -0.704 32.8-158.1 -74.5 107.5 12.2 4.9 20.2 155 155 A V E -e 129 0B 0 -2,-0.9 23,-2.6 -27,-0.2 2,-0.4 -0.820 13.4-176.3 -97.1 121.0 12.6 5.0 24.0 156 156 A A E -ef 130 178B 0 -27,-2.8 -25,-2.7 -2,-0.6 2,-0.3 -0.972 8.9-176.7-114.1 129.8 15.5 7.0 25.4 157 157 A V E -ef 131 179B 0 21,-2.8 23,-2.7 -2,-0.4 -25,-0.2 -0.954 28.9-106.5-130.8 148.5 16.0 7.0 29.2 158 158 A A E - f 0 180B 6 -27,-2.2 14,-0.2 -2,-0.3 23,-0.2 -0.438 17.1-143.4 -71.0 138.9 18.4 8.7 31.6 159 159 A A - 0 0 1 21,-2.5 22,-0.1 -2,-0.2 -1,-0.1 0.813 51.5-111.0 -68.8 -29.6 21.2 6.6 33.0 160 160 A G - 0 0 18 20,-0.3 34,-2.6 34,-0.1 3,-0.3 -0.178 11.2-102.7 107.6 160.3 20.9 8.4 36.3 161 161 A N S S+ 0 0 70 32,-0.2 32,-0.2 1,-0.2 -1,-0.1 -0.206 83.6 103.4-114.1 38.9 23.0 10.9 38.3 162 162 A N S S- 0 0 82 2,-0.2 31,-0.2 -3,-0.1 -1,-0.2 0.352 82.3-125.3-102.3 2.9 24.5 8.6 41.0 163 163 A N S S+ 0 0 79 29,-2.1 2,-0.3 -3,-0.3 31,-0.2 0.923 79.3 107.1 43.9 49.1 28.1 8.2 39.6 164 164 A A S S- 0 0 25 28,-0.2 31,-2.1 -4,-0.1 2,-0.4 -0.850 84.4 -65.4-143.7 172.4 27.3 4.5 39.9 165 165 A D B > -l 195 0D 36 -2,-0.3 3,-1.4 29,-0.2 31,-0.2 -0.554 38.2-142.3 -68.8 125.3 26.5 1.4 37.7 166 166 A A G > S+ 0 0 0 29,-3.0 3,-1.9 -2,-0.4 7,-0.2 0.562 85.9 91.1 -65.3 -10.0 23.1 2.0 36.0 167 167 A R G 3 S+ 0 0 145 28,-0.3 -1,-0.3 1,-0.3 6,-0.1 0.737 84.3 54.7 -54.1 -27.1 22.3 -1.7 36.5 168 168 A N G < S+ 0 0 99 -3,-1.4 -31,-1.5 -31,-0.1 2,-0.3 0.239 100.2 71.8 -97.8 15.1 20.7 -0.8 39.8 169 169 A Y E <> S-K 136 0C 60 -3,-1.9 4,-2.0 -33,-0.3 -33,-0.3 -0.918 76.5-101.7-132.2 154.6 18.3 1.8 38.5 170 170 A S E 4 S+K 135 0C 0 -35,-2.3 -35,-2.2 -2,-0.3 -31,-0.1 -0.984 93.4 3.6-133.1 143.1 15.1 1.8 36.4 171 171 A P T >4 S+ 0 0 0 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 -0.983 122.3 70.9 -81.1 8.7 14.2 2.3 33.6 172 172 A A T 34 S+ 0 0 3 1,-0.3 -2,-0.2 -14,-0.2 -15,-0.1 0.835 96.6 54.0 -49.0 -40.2 18.0 2.8 33.0 173 173 A S T 3< S+ 0 0 14 -4,-2.0 -1,-0.3 -7,-0.2 -3,-0.1 0.485 76.0 111.6 -81.2 -2.7 18.7 -0.9 33.4 174 174 A E X - 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