==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-JUL-97 6PTD . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR D.W.HEINZ . 296 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12058.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 5.7 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 29 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 1 1 1 0 0 0 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 2 1 0 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 PARALLEL BRIDGES PER LADDER . 1 0 2 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 . 0 0 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 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 87 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-106.9 28.5 63.8 98.2 2 2 A S + 0 0 110 15,-0.1 2,-0.3 3,-0.0 15,-0.0 -0.593 360.0 89.1-135.0 73.0 29.1 64.7 101.9 3 3 A S > - 0 0 45 -2,-0.2 3,-1.0 13,-0.1 0, 0.0 -0.949 65.1-135.1-164.2 142.5 25.8 64.4 103.8 4 4 A V T 3 S+ 0 0 78 -2,-0.3 3,-0.4 1,-0.2 289,-0.1 0.253 96.8 78.4 -85.8 12.6 24.0 61.6 105.8 5 5 A N T > S+ 0 0 100 1,-0.2 3,-0.7 2,-0.1 -1,-0.2 0.491 78.9 70.5 -93.9 -6.6 20.7 62.5 104.1 6 6 A E T < S+ 0 0 49 -3,-1.0 9,-0.3 1,-0.2 -1,-0.2 0.403 87.7 65.8 -86.2 -3.2 21.8 60.6 101.0 7 7 A L T 3 S+ 0 0 3 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.471 90.9 63.7 -92.4 -8.9 21.5 57.4 103.0 8 8 A E S < S+ 0 0 85 -3,-0.7 2,-0.8 4,-0.1 -2,-0.2 0.459 83.6 82.3 -92.7 -6.1 17.7 58.0 103.2 9 9 A N - 0 0 73 1,-0.2 3,-0.4 -3,-0.1 4,-0.2 -0.908 66.5-167.1 -99.4 105.6 17.4 57.6 99.4 10 10 A W S > S+ 0 0 52 -2,-0.8 3,-1.2 1,-0.2 4,-0.2 0.921 79.9 57.2 -61.4 -47.4 17.2 53.9 99.0 11 11 A S T 3 S+ 0 0 27 49,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.773 124.7 22.1 -56.8 -31.8 17.8 53.7 95.3 12 12 A K T > S+ 0 0 45 -3,-0.4 3,-2.6 48,-0.1 -1,-0.3 0.068 76.0 130.7-129.5 31.5 21.1 55.6 95.5 13 13 A W T < S+ 0 0 0 -3,-1.2 4,-0.2 1,-0.3 -2,-0.1 0.696 72.0 63.2 -58.3 -19.9 22.2 55.1 99.1 14 14 A M T 3 S+ 0 0 0 -4,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.409 80.5 88.3 -85.8 3.0 25.7 54.1 97.8 15 15 A Q S < S+ 0 0 91 -3,-2.6 -1,-0.2 -9,-0.3 -2,-0.1 0.965 87.4 42.4 -65.9 -54.3 26.2 57.5 96.3 16 16 A P S S+ 0 0 5 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.535 87.4 104.5 -72.5 -8.2 27.8 59.4 99.3 17 17 A I S S- 0 0 1 -3,-0.2 279,-0.1 -4,-0.2 -15,-0.1 -0.673 83.0-107.4 -79.9 117.8 30.1 56.5 100.3 18 18 A P > - 0 0 49 0, 0.0 3,-0.8 0, 0.0 133,-0.3 -0.002 15.4-123.7 -44.7 143.1 33.7 57.3 99.2 19 19 A D T 3 S+ 0 0 98 1,-0.2 133,-1.0 132,-0.1 134,-0.2 0.417 106.0 69.4 -69.3 -0.8 35.2 55.5 96.3 20 20 A S T 3 S+ 0 0 92 131,-0.1 -1,-0.2 130,-0.1 -3,-0.0 0.845 74.1 99.9 -85.6 -38.7 38.0 54.5 98.6 21 21 A I S < S- 0 0 19 -3,-0.8 130,-2.6 129,-0.1 2,-0.2 -0.239 74.0-124.7 -58.4 127.1 36.1 52.1 100.8 22 22 A P B >> -A 150 0A 5 0, 0.0 3,-1.9 0, 0.0 4,-1.1 -0.551 24.3-118.6 -72.2 133.1 36.4 48.3 100.2 23 23 A L T 34 S+ 0 0 0 126,-3.4 127,-0.1 1,-0.3 5,-0.1 0.756 112.4 63.1 -42.5 -33.0 33.0 46.7 99.6 24 24 A A T 34 S+ 0 0 0 125,-0.3 205,-0.3 201,-0.2 -1,-0.3 0.858 99.7 51.6 -62.6 -41.0 33.6 44.5 102.7 25 25 A R T <4 S+ 0 0 4 -3,-1.9 244,-0.3 200,-0.2 -1,-0.2 0.895 94.7 84.0 -63.9 -42.5 33.7 47.5 105.0 26 26 A I S < S- 0 0 0 -4,-1.1 2,-0.6 1,-0.1 263,-0.1 -0.198 82.4-127.5 -60.8 149.8 30.4 48.9 103.8 27 27 A S - 0 0 0 261,-0.2 243,-0.2 262,-0.2 265,-0.1 -0.935 32.4-174.0-104.9 118.7 27.3 47.4 105.4 28 28 A I - 0 0 0 -2,-0.6 243,-1.3 -4,-0.1 2,-0.1 -0.928 22.4-135.5-123.4 132.8 24.8 46.1 102.9 29 29 A P E -b 271 0B 0 0, 0.0 35,-2.3 0, 0.0 36,-1.0 -0.505 32.3-179.9 -75.9 147.6 21.3 44.7 103.1 30 30 A G E -bc 272 65B 0 241,-2.2 243,-2.0 33,-0.2 2,-0.4 -0.868 23.2-120.2-139.6 173.5 20.7 41.6 100.9 31 31 A T E > -bc 273 66B 0 34,-2.3 36,-2.1 -2,-0.3 3,-0.6 -0.981 16.1-138.1-125.2 131.2 17.9 39.1 100.1 32 32 A L T 3 S+ 0 0 16 241,-2.4 243,-0.2 -2,-0.4 18,-0.1 -0.658 89.6 0.0 -83.7 140.5 17.9 35.3 100.6 33 33 A D T > S- 0 0 3 -2,-0.3 3,-1.3 1,-0.1 17,-0.4 0.888 80.0-172.8 44.0 52.1 16.5 33.3 97.7 34 34 A S T < S+ 0 0 0 33,-1.3 3,-0.5 -3,-0.6 34,-0.1 0.697 71.9 60.2 -45.7 -32.1 15.8 36.5 95.8 35 35 A G T 3 S+ 0 0 4 32,-0.5 3,-0.3 1,-0.2 -1,-0.3 -0.011 75.7 92.2 -94.0 34.1 13.9 34.7 93.0 36 36 A T X + 0 0 0 -3,-1.3 3,-1.0 1,-0.2 -1,-0.2 0.248 51.9 100.2-108.0 14.1 11.1 33.2 95.1 37 37 A F T 3 S+ 0 0 31 -3,-0.5 -1,-0.2 1,-0.2 17,-0.1 0.516 73.5 64.0 -75.8 -6.8 8.6 36.1 94.7 38 38 A K T 3 S+ 0 0 78 -3,-0.3 2,-0.6 15,-0.1 -1,-0.2 0.563 70.7 109.8 -93.4 -10.1 6.7 34.3 91.9 39 39 A L < + 0 0 8 -3,-1.0 48,-0.0 1,-0.2 -3,-0.0 -0.558 29.5 157.7 -70.0 113.5 5.5 31.4 94.1 40 40 A Q + 0 0 157 -2,-0.6 -1,-0.2 4,-0.0 -3,-0.0 0.507 39.0 103.2-113.9 -10.7 1.7 31.9 94.5 41 41 A N S >> S- 0 0 70 1,-0.1 4,-2.2 2,-0.0 3,-1.1 -0.624 70.5-134.8 -78.8 128.7 0.7 28.3 95.4 42 42 A P H 3> S+ 0 0 98 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.880 103.8 44.7 -47.2 -56.3 0.0 27.8 99.2 43 43 A I H 34 S+ 0 0 119 1,-0.2 5,-0.1 2,-0.2 -2,-0.0 0.605 115.6 51.8 -70.0 -11.1 1.9 24.5 99.7 44 44 A K H X>>S+ 0 0 52 -3,-1.1 4,-2.3 3,-0.1 3,-0.7 0.819 107.8 50.4 -89.3 -39.9 4.8 26.1 97.7 45 45 A Q H 3<5S+ 0 0 64 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.881 101.7 58.6 -66.0 -45.4 5.0 29.3 99.7 46 46 A V T 3<5S+ 0 0 37 -4,-1.8 194,-0.4 -5,-0.2 -1,-0.2 0.530 123.1 25.6 -65.7 -5.5 5.2 27.7 103.2 47 47 A W T <45S+ 0 0 129 -3,-0.7 -2,-0.2 -5,-0.1 -3,-0.1 0.678 133.3 19.8-119.5 -67.6 8.3 25.9 102.0 48 48 A G T <5S+ 0 0 0 -4,-2.3 -3,-0.2 -5,-0.1 -12,-0.1 0.982 92.9 91.8 -70.7 -82.0 10.1 27.7 99.2 49 49 A M < + 0 0 18 -5,-0.5 197,-0.2 1,-0.1 -12,-0.1 0.311 30.7 158.8 -22.8 124.7 9.1 31.4 99.1 50 50 A T + 0 0 4 -17,-0.4 225,-4.1 1,-0.2 2,-0.3 0.338 64.6 44.4-131.3 -6.0 11.3 33.8 101.1 51 51 A Q - 0 0 0 223,-0.2 -1,-0.2 -15,-0.2 226,-0.1 -0.982 53.3-165.9-141.1 151.2 10.5 37.1 99.3 52 52 A E + 0 0 44 224,-0.5 2,-0.2 -2,-0.3 -1,-0.1 0.785 68.8 57.5-107.3 -37.6 7.2 38.6 98.1 53 53 A Y S S- 0 0 91 223,-0.5 -16,-0.1 1,-0.1 223,-0.1 -0.620 85.3 -98.3-100.2 157.1 8.2 41.5 95.8 54 54 A D > - 0 0 74 -2,-0.2 4,-2.4 -17,-0.1 -1,-0.1 0.066 40.5 -92.2 -62.7 175.7 10.3 41.5 92.6 55 55 A F H > S+ 0 0 1 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.888 123.0 53.0 -58.2 -47.3 14.0 42.4 92.1 56 56 A R H > S+ 0 0 67 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.890 109.8 48.6 -58.6 -40.9 13.4 46.0 91.3 57 57 A Y H > S+ 0 0 40 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.972 111.6 51.3 -62.0 -48.8 11.3 46.5 94.5 58 58 A Q H <>S+ 0 0 0 -4,-2.4 5,-2.0 1,-0.2 3,-0.4 0.891 114.3 42.3 -54.4 -45.3 14.2 44.7 96.3 59 59 A M H ><5S+ 0 0 0 -4,-2.9 3,-1.4 1,-0.2 -1,-0.2 0.844 111.2 55.0 -71.4 -37.1 16.8 47.1 94.8 60 60 A D H 3<5S+ 0 0 48 -4,-2.8 -49,-0.3 1,-0.3 -1,-0.2 0.659 103.3 58.0 -70.2 -17.2 14.6 50.2 95.3 61 61 A H T 3<5S- 0 0 15 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.310 130.7 -92.1 -93.7 6.4 14.3 49.3 99.0 62 62 A G T < 5S+ 0 0 0 -3,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.298 76.1 145.3 104.3 -9.2 18.1 49.4 99.3 63 63 A A < + 0 0 0 -5,-2.0 -1,-0.3 -6,-0.2 -33,-0.2 -0.422 12.0 163.1 -66.6 132.2 19.1 45.8 98.7 64 64 A R + 0 0 0 -35,-2.3 47,-3.3 -2,-0.2 2,-0.5 0.382 56.6 70.9-127.7 -5.0 22.4 45.3 96.9 65 65 A I E -cd 30 111B 7 -36,-1.0 -34,-2.3 45,-0.2 2,-0.5 -0.978 61.9-168.8-120.5 123.1 23.2 41.6 97.6 66 66 A F E -cd 31 112B 0 45,-2.0 47,-1.7 -2,-0.5 2,-0.8 -0.951 17.8-144.7-120.4 123.9 21.2 39.0 95.9 67 67 A D E - d 0 113B 6 -36,-2.1 -33,-1.3 -2,-0.5 2,-0.5 -0.745 27.0-176.0 -84.1 107.9 21.2 35.3 96.6 68 68 A I E - d 0 114B 1 45,-1.8 47,-1.9 -2,-0.8 2,-0.4 -0.953 6.9-172.5-113.0 120.4 20.7 33.6 93.3 69 69 A R E - d 0 115B 37 -2,-0.5 12,-1.7 45,-0.2 2,-0.3 -0.930 14.1-176.5-112.5 136.8 20.4 29.8 93.0 70 70 A G E -Ed 80 116B 0 45,-2.5 47,-2.7 -2,-0.4 48,-1.4 -0.801 23.7-156.5-135.3 172.7 20.3 28.1 89.7 71 71 A R E -E 79 0B 47 8,-2.0 8,-2.0 -2,-0.3 2,-0.5 -0.995 29.5-116.8-143.6 142.4 19.9 24.9 87.6 72 72 A L E -E 78 0B 0 46,-0.4 49,-2.0 -2,-0.3 2,-0.2 -0.730 29.6-155.3 -84.4 124.4 21.2 24.0 84.1 73 73 A T > - 0 0 15 4,-2.0 3,-1.6 -2,-0.5 4,-0.3 -0.645 28.0-115.4 -94.6 155.5 18.4 23.3 81.7 74 74 A D T 3 S+ 0 0 76 1,-0.3 51,-0.2 -2,-0.2 -1,-0.1 0.693 115.0 71.1 -63.7 -15.8 18.8 21.2 78.6 75 75 A D T 3 S- 0 0 121 2,-0.2 -1,-0.3 49,-0.1 3,-0.1 0.251 119.0-113.5 -80.9 11.8 18.1 24.3 76.6 76 76 A N S < S+ 0 0 48 -3,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.761 76.6 125.9 60.3 31.7 21.6 25.3 77.8 77 77 A T - 0 0 43 -4,-0.3 -4,-2.0 -6,-0.0 2,-0.5 -0.918 60.9-122.9-121.9 145.6 20.2 28.2 80.0 78 78 A I E -E 72 0B 1 -2,-0.3 13,-2.2 -6,-0.2 14,-0.4 -0.767 34.5-178.6 -90.0 123.5 20.6 29.0 83.7 79 79 A V E -EF 71 90B 9 -8,-2.0 -8,-2.0 -2,-0.5 2,-0.3 -0.874 30.1-101.6-121.1 156.5 17.4 29.3 85.6 80 80 A L E +E 70 0B 2 9,-1.6 7,-1.3 -2,-0.3 9,-0.4 -0.581 43.0 175.5 -81.7 135.4 16.5 30.1 89.2 81 81 A H E - F 0 86B 9 -12,-1.7 2,-0.6 -2,-0.3 5,-0.2 -0.982 31.6-151.3-140.0 148.4 15.6 27.2 91.5 82 82 A H E > S- F 0 85B 47 3,-2.4 3,-1.5 -2,-0.3 -33,-0.1 -0.880 77.3 -59.4-118.3 92.5 14.8 26.6 95.2 83 83 A G T 3 S- 0 0 19 -2,-0.6 34,-0.0 1,-0.3 -35,-0.0 -0.559 120.5 -17.4 70.2-117.6 16.0 23.0 95.7 84 84 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.747 116.0 102.4 -91.1 -25.4 14.0 20.9 93.2 85 85 A L E < S-F 82 0B 62 -3,-1.5 -3,-2.4 1,-0.1 2,-0.8 -0.386 71.0-133.7 -64.9 127.2 11.3 23.6 92.7 86 86 A Y E -F 81 0B 95 -5,-0.2 -5,-0.2 -2,-0.2 2,-0.2 -0.717 16.5-150.4 -83.0 107.3 11.5 25.6 89.5 87 87 A L E - 0 0 4 -7,-1.3 2,-1.3 -2,-0.8 -7,-0.1 -0.580 27.1-116.6 -70.6 143.7 11.0 29.2 90.5 88 88 A Y E S+ 0 0 137 -2,-0.2 2,-0.3 -53,-0.1 -1,-0.1 -0.100 85.9 96.3 -81.6 47.7 9.4 30.9 87.5 89 89 A V E - 0 0 0 -2,-1.3 -9,-1.6 -9,-0.4 2,-0.3 -0.892 56.2-155.9-131.6 156.2 12.4 33.1 87.1 90 90 A T E > -F 79 0B 41 -2,-0.3 4,-1.1 -11,-0.3 -11,-0.2 -0.801 29.9-111.3-127.5 170.9 15.6 32.9 84.9 91 91 A L H >> S+ 0 0 0 -13,-2.2 4,-2.8 -2,-0.3 3,-1.0 0.953 116.7 53.1 -68.5 -50.1 19.1 34.3 85.1 92 92 A H H 3> S+ 0 0 83 -14,-0.4 4,-2.1 1,-0.3 -1,-0.2 0.857 105.0 59.1 -51.9 -35.3 18.7 36.7 82.1 93 93 A E H 3> S+ 0 0 60 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.882 111.4 39.4 -61.7 -38.9 15.7 38.0 84.0 94 94 A F H < + 0 0 13 -4,-2.3 3,-2.4 -5,-0.2 -1,-0.2 -0.460 69.1 165.7-131.4 61.6 21.0 54.6 89.4 106 106 A P T 3 + 0 0 75 0, 0.0 -4,-0.1 0, 0.0 51,-0.1 0.512 68.0 77.5 -56.1 -8.7 24.6 54.3 88.1 107 107 A S T 3 S+ 0 0 8 48,-0.1 -5,-0.1 49,-0.1 48,-0.1 0.642 92.6 67.8 -76.1 -13.6 25.9 55.4 91.5 108 108 A E < - 0 0 0 -3,-2.4 48,-2.5 -7,-0.1 2,-0.3 -0.189 61.9-161.4 -97.7-175.1 25.2 51.9 92.8 109 109 A T - 0 0 0 46,-0.2 2,-0.4 47,-0.1 49,-0.2 -0.937 11.5-141.5-163.3 147.7 26.4 48.4 92.3 110 110 A I E - g 0 158B 0 47,-1.1 49,-1.7 -2,-0.3 2,-0.5 -0.970 6.5-145.1-123.3 137.5 25.0 45.0 93.0 111 111 A I E -dg 65 159B 0 -47,-3.3 -45,-2.0 -2,-0.4 2,-0.6 -0.885 17.1-156.5 -96.6 130.5 26.8 42.0 94.3 112 112 A M E -dg 66 160B 0 47,-1.7 49,-2.2 -2,-0.5 2,-0.3 -0.891 4.5-158.9-116.9 105.4 25.4 38.7 92.9 113 113 A S E -dg 67 161B 6 -47,-1.7 -45,-1.8 -2,-0.6 2,-0.4 -0.613 14.7-166.6 -76.8 132.0 25.9 35.5 94.8 114 114 A L E +dg 68 162B 0 47,-1.8 49,-1.2 -2,-0.3 2,-0.4 -0.994 11.7 169.9-125.8 127.5 25.6 32.6 92.4 115 115 A K E -dg 69 163B 63 -47,-1.9 -45,-2.5 -2,-0.4 2,-0.7 -0.994 39.3-116.6-138.7 142.1 25.2 29.0 93.6 116 116 A K E +d 70 0B 76 47,-0.5 -45,-0.2 -2,-0.4 3,-0.1 -0.705 35.6 177.1 -74.7 116.5 24.3 25.8 91.8 117 117 A E + 0 0 37 -47,-2.7 2,-0.3 -2,-0.7 -46,-0.2 0.752 57.8 20.4 -94.8 -28.7 21.0 24.8 93.5 118 118 A Y S S- 0 0 98 -48,-1.4 -46,-0.4 -34,-0.1 -1,-0.2 -0.950 89.3 -83.4-140.6 160.2 20.1 21.6 91.7 119 119 A E - 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0 0 16 7,-0.1 11,-0.1 -35,-0.1 -2,-0.1 0.470 39.8-151.0 -3.8 106.1 13.3 25.6 109.1 238 238 A G + 0 0 18 1,-0.1 -37,-0.0 6,-0.1 -3,-0.0 0.859 49.3 132.7 -57.6-113.4 10.3 24.0 107.4 239 239 A G - 0 0 52 3,-0.0 2,-0.3 4,-0.0 -1,-0.1 0.356 62.2-135.8 76.1 -10.0 7.6 22.7 109.6 240 240 A T S >> S+ 0 0 46 -194,-0.4 3,-1.2 3,-0.1 4,-1.1 -0.425 75.0 66.6 65.2-120.1 5.1 24.4 107.3 241 241 A A T 34 S- 0 0 76 -2,-0.3 -195,-0.0 1,-0.3 0, 0.0 -0.022 126.2 -18.9 -40.6 120.5 2.3 26.3 109.3 242 242 A W T 34 S+ 0 0 178 1,-0.2 -1,-0.3 5,-0.0 -3,-0.0 0.870 125.1 80.3 38.6 57.1 3.8 29.2 111.2 243 243 A N T <4 + 0 0 53 -3,-1.2 -2,-0.2 -197,-0.1 -1,-0.2 0.120 67.0 118.0-155.8 -16.2 7.3 27.9 111.0 244 244 A S S X S- 0 0 6 -4,-1.1 4,-1.9 1,-0.1 3,-0.5 -0.042 88.1 -97.7 -56.7 160.6 7.8 29.2 107.5 245 245 A P H > S+ 0 0 2 0, 0.0 4,-1.9 0, 0.0 -10,-0.1 0.767 126.5 57.4 -54.7 -23.3 10.4 31.8 106.7 246 246 A Y H > S+ 0 0 57 2,-0.2 4,-1.2 -197,-0.2 -200,-0.0 0.898 103.5 48.6 -75.3 -43.9 7.6 34.3 107.0 247 247 A Y H >4 S+ 0 0 81 -3,-0.5 3,-0.5 1,-0.2 4,-0.4 0.962 117.3 42.0 -60.2 -51.4 6.6 33.4 110.5 248 248 A Y H >X S+ 0 0 30 -4,-1.9 4,-2.3 1,-0.2 3,-1.6 0.890 108.6 59.0 -61.2 -44.7 10.2 33.6 111.8 249 249 A A H 3X S+ 0 0 5 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.773 92.1 70.2 -57.5 -29.4 11.0 36.8 109.8 250 250 A S H << S+ 0 0 33 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.752 113.6 26.4 -60.4 -27.4 8.1 38.6 111.6 251 251 A Y H <> S+ 0 0 116 -3,-1.6 4,-2.6 -4,-0.4 -2,-0.2 0.838 121.0 50.7-102.7 -48.2 10.2 38.6 114.8 252 252 A I H X S+ 0 0 1 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.879 107.4 52.7 -61.4 -43.3 13.8 38.4 113.6 253 253 A N H X S+ 0 0 1 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.970 118.3 34.3 -60.4 -55.0 13.7 41.3 111.2 254 254 A P H > S+ 0 0 16 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.929 116.9 58.7 -64.4 -41.9 12.3 43.9 113.6 255 255 A E H X S+ 0 0 73 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.889 112.6 37.0 -49.8 -52.3 14.3 42.2 116.4 256 256 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.816 108.9 65.1 -73.2 -32.6 17.6 42.8 114.7 257 257 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.878 107.2 42.4 -57.4 -38.8 16.4 46.2 113.4 258 258 A N H X S+ 0 0 64 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.879 107.6 60.0 -73.2 -43.6 16.3 47.4 117.0 259 259 A Y H X S+ 0 0 28 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.912 110.1 42.3 -49.4 -48.1 19.5 45.7 117.9 260 260 A I H X S+ 0 0 4 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.901 115.1 50.7 -68.3 -42.4 21.3 47.9 115.3 261 261 A K H >< S+ 0 0 103 -4,-1.6 3,-1.0 -5,-0.2 -2,-0.2 0.990 113.5 42.5 -58.8 -66.1 19.4 51.0 116.2 262 262 A Q H 3< S+ 0 0 155 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.876 115.6 47.7 -46.3 -56.1 20.0 50.9 120.0 263 263 A K H 3< S- 0 0 104 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.744 91.0-151.3 -62.3 -25.6 23.7 49.9 119.7 264 264 A N << - 0 0 109 -4,-1.4 -3,-0.1 -3,-1.0 -2,-0.1 0.958 25.2-165.3 48.5 62.8 24.4 52.6 117.1 265 265 A P - 0 0 11 0, 0.0 29,-0.2 0, 0.0 3,-0.1 -0.141 32.2-144.4 -73.9 169.3 27.2 50.7 115.5 266 266 A A S S+ 0 0 35 1,-0.3 2,-0.3 -47,-0.2 28,-0.1 0.501 92.3 27.3-106.1 -15.1 29.8 51.9 113.0 267 267 A R + 0 0 0 -52,-0.1 -1,-0.3 1,-0.1 -241,-0.1 -0.986 50.0 162.6-149.0 138.6 29.8 48.6 111.2 268 268 A V - 0 0 0 -2,-0.3 -50,-0.1 20,-0.1 -49,-0.1 0.434 42.0-142.2-132.5 -14.1 27.0 46.0 110.8 269 269 A G - 0 0 0 -244,-0.3 2,-0.9 -51,-0.1 -39,-0.2 -0.138 46.0 -31.5 76.6-177.0 28.3 44.0 107.8 270 270 A W E - l 0 230B 2 -41,-2.8 -39,-3.6 -243,-0.2 2,-0.6 -0.710 65.5-166.0 -81.1 105.9 26.5 42.4 104.9 271 271 A V E -bl 29 231B 0 -243,-1.3 -241,-2.2 -2,-0.9 2,-0.5 -0.868 4.4-165.9-101.1 115.7 23.1 41.4 106.3 272 272 A I E +bl 30 232B 4 -41,-2.0 -39,-2.9 -2,-0.6 -38,-0.5 -0.880 17.2 172.0-102.9 128.2 21.0 39.0 104.2 273 273 A Q E -b 31 0B 1 -243,-2.0 -241,-2.4 -2,-0.5 3,-0.2 -0.776 29.2-115.6-132.1 172.7 17.3 38.6 105.1 274 274 A D S S+ 0 0 3 -2,-0.2 -223,-0.2 1,-0.2 -241,-0.1 -0.523 85.4 19.4-100.8 167.5 14.0 37.1 104.1 275 275 A Y - 0 0 10 -225,-4.1 2,-0.5 -2,-0.2 -1,-0.2 0.850 67.0-160.8 34.0 76.4 10.8 39.0 103.2 276 276 A I + 0 0 0 -3,-0.2 -223,-0.5 -223,-0.1 -224,-0.5 -0.741 42.7 115.5 -80.9 123.8 12.0 42.4 102.3 277 277 A N S S- 0 0 0 -2,-0.5 -226,-0.0 -225,-0.1 0, 0.0 -0.875 74.1 -98.6-163.2-159.5 8.9 44.6 102.6 278 278 A E S S+ 0 0 118 -2,-0.2 -2,-0.1 5,-0.0 0, 0.0 0.206 93.5 89.1-126.9 12.3 7.3 47.4 104.6 279 279 A K + 0 0 107 0, 0.0 -3,-0.0 0, 0.0 -29,-0.0 0.982 65.3 88.8 -71.2 -59.7 5.2 45.5 107.1 280 280 A W S S- 0 0 26 1,-0.1 -29,-0.1 2,-0.1 -3,-0.1 -0.075 78.5-134.8 -44.0 126.8 7.8 45.0 109.8 281 281 A S S S+ 0 0 113 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 0.887 94.1 31.1 -55.7 -53.6 7.7 48.0 112.1 282 282 A P S S- 0 0 21 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.857 95.9-135.7 -78.0 -37.9 11.5 48.9 112.5 283 283 A L > - 0 0 22 3,-0.1 4,-1.5 2,-0.1 3,-0.1 0.929 9.8-152.8 75.9 97.1 12.8 47.9 109.1 284 284 A L H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 3,-0.3 0.932 90.8 53.2 -60.2 -58.0 16.1 46.0 109.1 285 285 A Y H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.810 108.2 52.4 -51.0 -36.0 17.5 47.0 105.7 286 286 A Q H > S+ 0 0 33 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.898 109.5 48.4 -68.6 -42.1 17.0 50.7 106.5 287 287 A E H X S+ 0 0 17 -4,-1.5 4,-1.8 -3,-0.3 -2,-0.2 0.853 109.8 52.5 -67.0 -35.3 19.0 50.3 109.8 288 288 A V H < S+ 0 0 0 -4,-2.2 4,-0.2 2,-0.2 -1,-0.2 0.879 112.0 46.0 -66.7 -39.6 21.8 48.4 108.0 289 289 A I H >< S+ 0 0 0 -4,-1.7 3,-1.7 -5,-0.2 -2,-0.2 0.945 111.1 53.3 -66.9 -47.8 22.0 51.2 105.4 290 290 A R H >< S+ 0 0 79 -4,-2.6 3,-2.4 1,-0.3 -2,-0.2 0.811 94.1 67.8 -58.2 -34.8 22.0 53.9 108.2 291 291 A A G >< S+ 0 0 3 -4,-1.8 3,-0.8 1,-0.3 -1,-0.3 0.630 86.8 72.0 -62.8 -12.8 24.9 52.3 110.2 292 292 A N G X + 0 0 0 -3,-1.7 3,-3.1 -4,-0.2 -1,-0.3 0.523 66.0 98.5 -78.3 -6.9 27.1 53.4 107.2 293 293 A K G X S+ 0 0 83 -3,-2.4 3,-1.7 1,-0.3 -1,-0.2 0.794 70.7 68.8 -51.1 -29.5 26.6 57.0 108.4 294 294 A S G < S+ 0 0 59 -3,-0.8 -1,-0.3 1,-0.3 -2,-0.1 0.688 90.1 63.6 -63.9 -19.2 30.0 56.5 110.0 295 295 A L G < 0 0 29 -3,-3.1 -1,-0.3 1,-0.1 -2,-0.2 0.389 360.0 360.0 -86.9 0.7 31.6 56.4 106.5 296 296 A I < 0 0 74 -3,-1.7 -2,-0.2 -4,-0.2 -3,-0.1 0.732 360.0 360.0-121.4 360.0 30.6 60.0 105.5