==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (PHOSPHORIC DIESTER) 24-MAY-95 1PTG . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR D.W.HEINZ,M.RYAN,T.L.BULLOCK,O.H.GRIFFITH . 296 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11904.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 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 . 2 0.7 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 . 34 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 21.6 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 2 1 0 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 . 4 0 0 2 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 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 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 72 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-171.1 29.4 63.0 99.2 2 2 A S + 0 0 111 294,-0.1 2,-0.3 15,-0.1 3,-0.0 0.538 360.0 87.6-126.5 -17.0 29.3 64.8 102.6 3 3 A S > - 0 0 43 1,-0.1 3,-0.6 2,-0.0 4,-0.1 -0.707 58.3-151.2 -92.0 145.1 25.6 64.8 103.7 4 4 A V G > S+ 0 0 72 -2,-0.3 3,-2.4 1,-0.2 4,-0.3 0.757 88.9 80.2 -81.2 -23.7 24.1 62.0 105.8 5 5 A N G > S+ 0 0 108 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.756 79.2 73.5 -56.6 -19.1 20.7 62.8 104.3 6 6 A E G X S+ 0 0 44 -3,-0.6 3,-1.1 1,-0.3 -1,-0.3 0.720 84.2 63.1 -68.2 -23.9 21.9 60.8 101.3 7 7 A L G < S+ 0 0 1 -3,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.601 90.9 66.5 -77.7 -12.0 21.6 57.4 103.1 8 8 A E G < S+ 0 0 78 -3,-1.3 2,-0.9 -4,-0.3 -1,-0.2 0.511 82.2 88.2 -83.2 -6.5 17.9 57.9 103.5 9 9 A N X> - 0 0 76 -3,-1.1 4,-1.0 1,-0.2 3,-0.5 -0.840 61.9-170.5 -93.8 103.9 17.6 57.6 99.7 10 10 A W T 34 S+ 0 0 49 -2,-0.9 3,-0.4 1,-0.2 52,-0.3 0.868 80.3 56.2 -64.7 -39.7 17.2 53.9 99.0 11 11 A S T 34 S+ 0 0 32 49,-0.3 -1,-0.2 1,-0.2 97,-0.1 0.776 128.1 17.2 -66.5 -22.3 17.6 54.0 95.3 12 12 A K T X4 S+ 0 0 43 -3,-0.5 3,-2.9 -6,-0.2 -2,-0.2 0.212 76.1 134.1-138.0 22.6 21.0 55.7 95.6 13 13 A W T 3< S+ 0 0 0 -4,-1.0 4,-0.3 -3,-0.4 -3,-0.1 0.647 71.1 63.2 -49.6 -22.7 22.3 55.3 99.2 14 14 A M T 3 S+ 0 0 0 1,-0.2 -1,-0.3 -4,-0.2 3,-0.2 0.493 82.5 85.3 -83.5 0.1 25.8 54.3 98.1 15 15 A Q S < S+ 0 0 91 -3,-2.9 -1,-0.2 -9,-0.2 -2,-0.2 0.917 85.8 48.3 -68.8 -46.7 26.2 57.8 96.5 16 16 A P S S+ 0 0 0 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.705 92.0 99.0 -69.7 -14.4 27.4 59.7 99.6 17 17 A I S S- 0 0 1 -4,-0.3 279,-0.1 -3,-0.2 -15,-0.1 -0.473 84.1-100.1 -78.2 137.2 30.0 57.0 100.5 18 18 A P > - 0 0 41 0, 0.0 3,-1.7 0, 0.0 133,-0.3 -0.267 19.8-126.9 -57.5 139.9 33.7 57.6 99.5 19 19 A D T 3 S+ 0 0 102 1,-0.3 133,-3.0 132,-0.2 134,-0.3 0.669 105.9 57.7 -58.7 -23.6 35.2 55.9 96.3 20 20 A S T 3 S+ 0 0 67 131,-0.2 -1,-0.3 130,-0.1 -3,-0.0 0.502 75.0 110.5 -89.9 -6.0 38.0 54.5 98.3 21 21 A I S < S- 0 0 26 -3,-1.7 130,-2.3 129,-0.1 131,-0.1 -0.564 71.6-124.1 -74.0 125.6 36.1 52.5 100.9 22 22 A P B >> -A 150 0A 9 0, 0.0 3,-0.9 0, 0.0 4,-0.8 -0.431 20.9-118.2 -65.2 146.7 36.5 48.7 100.3 23 23 A L T 34 S+ 0 0 0 126,-3.1 3,-0.3 1,-0.2 127,-0.1 0.764 110.3 68.9 -58.9 -23.8 33.1 47.0 99.9 24 24 A A T 34 S+ 0 0 0 125,-0.3 205,-0.3 201,-0.3 -1,-0.2 0.901 96.4 49.7 -60.1 -46.7 34.0 44.9 103.0 25 25 A R T <4 S+ 0 0 4 -3,-0.9 244,-0.3 200,-0.3 -1,-0.2 0.735 92.2 95.3 -66.1 -27.1 33.7 47.9 105.4 26 26 A I S < S- 0 0 0 -4,-0.8 2,-0.8 -3,-0.3 263,-0.1 -0.324 77.7-128.0 -70.1 147.2 30.3 49.0 104.0 27 27 A S - 0 0 0 262,-0.2 243,-0.2 261,-0.1 265,-0.1 -0.899 37.6-179.1 -96.2 107.5 27.2 47.8 105.7 28 28 A I E -b 270 0B 0 -2,-0.8 243,-1.3 241,-0.6 2,-0.2 -0.943 21.1-142.7-115.0 126.5 25.2 46.4 102.9 29 29 A P E +b 271 0B 1 0, 0.0 35,-2.3 0, 0.0 36,-0.5 -0.560 27.9 175.4 -80.0 158.1 21.7 44.8 103.1 30 30 A G E -b 272 0B 1 241,-1.9 243,-1.5 33,-0.2 2,-0.4 -0.863 25.7-112.7-149.2 178.6 21.1 41.8 101.0 31 31 A T E > -bc 273 66B 0 34,-1.8 36,-1.2 -2,-0.3 3,-0.6 -0.989 17.2-134.1-129.2 135.7 18.4 39.2 100.3 32 32 A H T 3 S- 0 0 15 241,-2.8 243,-0.1 -2,-0.4 18,-0.0 -0.715 91.6 -4.3 -83.5 134.7 18.4 35.5 101.0 33 33 A D T > S- 0 0 9 -2,-0.4 3,-1.5 1,-0.1 17,-0.4 0.941 82.2-170.0 43.5 59.9 17.1 33.4 98.1 34 34 A S G X S+ 0 0 0 33,-1.1 3,-0.6 -3,-0.6 34,-0.1 0.781 70.0 57.0 -49.7 -38.1 16.2 36.5 96.1 35 35 A G G > S+ 0 0 3 32,-0.5 3,-0.5 1,-0.2 -1,-0.3 0.217 74.5 93.8 -89.0 22.4 14.3 34.9 93.3 36 36 A T G X + 0 0 1 -3,-1.5 3,-1.6 1,-0.2 -1,-0.2 0.426 52.4 102.2 -93.9 8.1 11.6 33.1 95.2 37 37 A F G < S+ 0 0 30 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.518 73.4 60.1 -66.5 -12.3 9.0 36.0 94.9 38 38 A K G < S+ 0 0 87 -3,-0.5 2,-1.0 15,-0.1 -1,-0.3 0.419 72.5 109.9 -95.7 -2.9 7.0 34.3 92.1 39 39 A L < + 0 0 4 -3,-1.6 48,-0.1 1,-0.2 10,-0.0 -0.673 31.2 154.0 -73.5 103.9 6.2 31.2 94.1 40 40 A Q + 0 0 149 -2,-1.0 -1,-0.2 4,-0.0 3,-0.1 0.207 34.4 107.2-118.2 14.2 2.4 31.7 94.6 41 41 A N S >> S- 0 0 75 1,-0.1 3,-2.2 -3,-0.0 4,-1.6 -0.844 73.0-131.3 -98.5 103.0 1.4 28.1 95.1 42 42 A P H 3> S+ 0 0 92 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.575 100.3 42.1 -17.3 -62.3 0.6 27.7 98.9 43 43 A I H 34 S+ 0 0 134 1,-0.2 4,-0.2 2,-0.2 5,-0.2 0.837 115.2 51.3 -69.2 -29.0 2.5 24.5 99.8 44 44 A K H X>>S+ 0 0 62 -3,-2.2 4,-3.4 1,-0.2 3,-1.0 0.918 109.0 55.0 -70.5 -39.0 5.5 25.7 97.7 45 45 A Q H 3<5S+ 0 0 61 -4,-1.6 4,-0.3 1,-0.2 -2,-0.2 0.918 98.9 55.1 -58.1 -57.2 5.4 29.0 99.6 46 46 A V T 3<5S+ 0 0 38 -4,-1.8 194,-0.6 1,-0.2 -1,-0.2 0.487 124.0 29.0 -59.3 -4.9 5.6 27.8 103.2 47 47 A W T <45S+ 0 0 131 -3,-1.0 -2,-0.2 -4,-0.2 -1,-0.2 0.677 133.8 22.0-118.7 -56.7 8.8 26.0 102.3 48 48 A G T <5S+ 0 0 1 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.1 0.920 89.7 101.6 -84.3 -49.5 10.5 27.9 99.5 49 49 A M < + 0 0 18 -5,-0.6 -12,-0.1 -4,-0.3 197,-0.1 -0.130 26.5 153.2 -47.8 117.5 9.2 31.5 99.5 50 50 A T + 0 0 2 -17,-0.4 225,-1.9 1,-0.2 2,-0.3 0.324 65.2 38.9-126.6 4.0 11.7 33.9 101.1 51 51 A Q - 0 0 0 223,-0.2 -1,-0.2 224,-0.2 226,-0.1 -0.976 51.0-167.3-150.9 150.7 10.7 37.1 99.3 52 52 A E S S+ 0 0 45 224,-0.4 2,-0.3 -2,-0.3 225,-0.1 0.487 72.7 52.5-120.1 -7.3 7.4 38.6 98.2 53 53 A Y S S- 0 0 89 223,-0.2 -16,-0.2 1,-0.1 223,-0.1 -0.825 87.0 -93.4-125.1 165.0 8.4 41.4 95.9 54 54 A D > - 0 0 70 -2,-0.3 4,-3.0 -17,-0.1 3,-0.3 -0.128 38.6 -94.1 -78.1 174.0 10.7 41.5 92.8 55 55 A F H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.783 123.8 50.4 -53.0 -37.5 14.4 42.3 92.3 56 56 A R H > S+ 0 0 61 2,-0.2 4,-3.0 3,-0.2 -1,-0.2 0.882 110.0 47.7 -73.4 -39.4 13.7 45.9 91.5 57 57 A Y H 4 S+ 0 0 45 -3,-0.3 4,-0.2 2,-0.2 -2,-0.2 0.983 112.8 52.2 -60.8 -52.9 11.5 46.5 94.6 58 58 A Q H ><>S+ 0 0 0 -4,-3.0 5,-1.8 1,-0.2 3,-0.9 0.869 113.1 43.1 -48.5 -46.0 14.3 44.8 96.5 59 59 A M H ><5S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.3 -1,-0.2 0.878 107.9 56.6 -71.4 -40.5 16.9 47.2 94.9 60 60 A D T 3<5S+ 0 0 40 -4,-3.0 -49,-0.3 1,-0.3 -1,-0.3 0.383 104.2 60.1 -71.7 5.3 14.8 50.3 95.4 61 61 A H T < 5S- 0 0 15 -3,-0.9 -1,-0.3 -4,-0.2 -2,-0.2 0.125 128.0 -93.7-116.9 16.7 14.8 49.2 99.0 62 62 A G T < 5S+ 0 0 0 -3,-1.8 2,-0.2 -52,-0.3 -3,-0.2 0.256 75.1 146.0 92.0 -12.7 18.6 49.4 99.5 63 63 A A < + 0 0 0 -5,-1.8 -1,-0.3 -6,-0.2 -33,-0.2 -0.425 10.9 163.2 -62.5 121.5 19.3 45.7 98.8 64 64 A R + 0 0 0 -35,-2.3 47,-3.0 -2,-0.2 2,-0.4 0.238 56.2 63.2-123.9 10.6 22.7 45.5 97.1 65 65 A I E - d 0 111B 7 -36,-0.5 -34,-1.8 45,-0.2 2,-0.4 -0.993 65.1-161.5-138.6 127.4 23.6 41.8 97.5 66 66 A F E -cd 31 112B 0 45,-2.6 47,-2.9 -2,-0.4 2,-1.1 -0.931 17.1-141.4-120.3 133.0 21.6 39.1 95.9 67 67 A D E - d 0 113B 6 -36,-1.2 -33,-1.1 -2,-0.4 2,-0.6 -0.835 30.6-175.1 -89.9 95.1 21.5 35.4 96.9 68 68 A I E - d 0 114B 0 45,-2.3 47,-2.2 -2,-1.1 2,-0.6 -0.882 9.7-175.3-102.2 115.1 21.3 33.8 93.4 69 69 A R E + d 0 115B 30 -2,-0.6 12,-1.9 45,-0.2 47,-0.2 -0.939 17.1 175.6-109.6 120.1 20.9 30.0 93.2 70 70 A G E -Ed 80 116B 0 45,-2.4 47,-1.9 -2,-0.6 48,-1.0 -0.539 20.6-157.3-119.6-176.0 20.9 28.6 89.7 71 71 A R E -E 79 0B 27 8,-1.1 8,-2.1 -2,-0.2 2,-0.3 -0.936 23.4-117.5-161.8 138.7 20.9 25.5 87.6 72 72 A L E -E 78 0B 0 46,-0.3 49,-1.9 -2,-0.3 6,-0.2 -0.569 34.8-166.0 -78.3 139.5 21.9 24.4 84.1 73 73 A T > - 0 0 11 4,-2.2 3,-1.3 -2,-0.3 47,-0.0 -0.567 37.0 -96.2-118.4 179.6 19.2 23.2 81.7 74 74 A D T 3 S+ 0 0 79 1,-0.3 51,-0.1 -2,-0.2 -1,-0.1 0.884 122.2 60.2 -60.8 -42.1 18.9 21.3 78.4 75 75 A D T 3 S- 0 0 132 1,-0.1 -1,-0.3 49,-0.1 3,-0.1 0.301 117.8-116.5 -71.2 10.4 18.6 24.6 76.5 76 76 A N S < S+ 0 0 18 -3,-1.3 2,-0.2 1,-0.2 -2,-0.1 0.739 76.1 122.3 57.3 30.6 22.0 25.4 78.0 77 77 A T - 0 0 45 -6,-0.1 -4,-2.2 14,-0.0 2,-0.5 -0.680 62.2-120.5-112.0 169.6 20.8 28.3 80.0 78 78 A I E +E 72 0B 0 -2,-0.2 13,-2.0 -6,-0.2 14,-0.5 -0.947 33.0 180.0-114.7 129.6 21.0 28.9 83.7 79 79 A V E -EF 71 90B 8 -8,-2.1 -8,-1.1 -2,-0.5 2,-0.4 -0.793 32.1 -93.6-122.6 170.2 17.7 29.4 85.7 80 80 A L E -E 70 0B 3 9,-2.5 7,-1.8 7,-0.3 9,-0.4 -0.715 43.5-179.7 -93.0 137.6 16.8 30.0 89.3 81 81 A H E - F 0 86B 5 -12,-1.9 2,-0.6 -2,-0.4 5,-0.2 -0.955 30.7-152.3-135.1 148.1 16.0 27.1 91.6 82 82 A H E > S- F 0 85B 39 3,-3.1 3,-1.4 -2,-0.3 -2,-0.0 -0.778 77.0 -61.5-116.6 82.8 15.0 26.5 95.2 83 83 A G T 3 S- 0 0 20 -2,-0.6 -35,-0.0 1,-0.3 34,-0.0 -0.657 119.5 -14.9 79.5-116.1 16.4 23.0 95.7 84 84 A P T 3 S+ 0 0 87 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.616 119.9 93.5 -97.4 -10.4 14.7 20.7 93.2 85 85 A L E < S-F 82 0B 52 -3,-1.4 -3,-3.1 -41,-0.0 2,-0.5 -0.674 73.2-129.4 -91.1 133.5 11.9 23.2 92.4 86 86 A Y E -F 81 0B 96 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.652 13.0-151.2 -79.8 116.7 12.0 25.6 89.5 87 87 A L E - 0 0 6 -7,-1.8 2,-2.5 -2,-0.5 -7,-0.3 -0.699 31.3-115.0 -82.0 142.3 11.3 29.2 90.5 88 88 A Y E S+ 0 0 146 -2,-0.3 2,-0.3 -9,-0.1 -1,-0.1 -0.312 87.0 93.0 -80.0 63.9 9.8 30.7 87.4 89 89 A V E - 0 0 0 -2,-2.5 -9,-2.5 -9,-0.4 2,-0.3 -0.983 58.8-151.4-150.1 150.4 12.7 33.1 87.0 90 90 A T E > -F 79 0B 42 -2,-0.3 4,-1.1 -11,-0.3 -11,-0.3 -0.778 29.8-109.0-124.8 169.1 16.0 32.9 85.0 91 91 A L H >> S+ 0 0 0 -13,-2.0 4,-2.3 -2,-0.3 3,-0.9 0.935 117.6 54.4 -62.6 -47.8 19.5 34.2 85.3 92 92 A H H 3> S+ 0 0 92 -14,-0.5 4,-2.0 1,-0.3 5,-0.2 0.906 103.1 58.4 -52.2 -43.9 19.1 36.6 82.4 93 93 A E H 3> S+ 0 0 59 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.857 108.6 45.2 -55.5 -36.8 16.0 38.0 84.1 94 94 A F H X S+ 0 0 91 -4,-2.5 4,-2.0 2,-0.2 3,-0.5 0.964 117.2 45.9 -64.6 -48.0 18.1 48.8 84.4 101 101 A F H 3X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 3,-0.4 0.961 113.1 50.1 -56.3 -53.7 18.5 49.5 88.0 102 102 A L H 3< S+ 0 0 7 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.706 110.9 48.1 -59.8 -24.7 22.2 50.2 87.6 103 103 A K H << S+ 0 0 132 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.786 112.0 48.9 -87.2 -26.3 21.7 52.6 84.6 104 104 A D H < S+ 0 0 78 -4,-2.0 -2,-0.2 -3,-0.4 -3,-0.1 0.775 128.0 26.8 -76.1 -27.2 19.0 54.5 86.5 105 105 A N >< + 0 0 13 -4,-1.9 3,-2.5 -5,-0.2 -1,-0.2 -0.510 68.9 169.6-137.6 67.3 21.3 54.8 89.5 106 106 A P T 3 S+ 0 0 78 0, 0.0 51,-0.1 0, 0.0 -4,-0.1 0.506 72.6 71.1 -55.0 -14.6 24.9 54.6 88.2 107 107 A S T 3 S+ 0 0 12 48,-0.1 -95,-0.1 49,-0.1 -5,-0.1 0.678 92.7 72.5 -77.3 -20.3 26.2 55.5 91.7 108 108 A E < - 0 0 0 -3,-2.5 48,-2.6 -6,-0.1 2,-0.3 -0.191 61.1-168.5 -87.0 179.9 25.2 52.1 93.0 109 109 A T - 0 0 0 46,-0.2 2,-0.4 47,-0.1 49,-0.2 -0.913 11.2-139.6-157.9 164.9 26.7 48.7 92.4 110 110 A I E - g 0 158B 0 47,-1.2 49,-2.4 44,-0.3 2,-0.5 -0.996 3.9-144.5-143.4 139.6 25.4 45.2 93.2 111 111 A I E -dg 65 159B 0 -47,-3.0 -45,-2.6 -2,-0.4 2,-0.6 -0.910 16.6-164.2-100.0 123.3 27.0 42.0 94.5 112 112 A M E -dg 66 160B 0 47,-3.2 49,-2.6 -2,-0.5 2,-0.5 -0.963 3.9-157.8-111.4 119.2 25.5 38.8 92.9 113 113 A S E -dg 67 161B 6 -47,-2.9 -45,-2.3 -2,-0.6 2,-0.5 -0.866 11.5-162.1 -94.5 128.2 26.3 35.6 94.8 114 114 A L E +dg 68 162B 0 47,-2.1 49,-2.4 -2,-0.5 2,-0.4 -0.960 12.5 174.7-118.6 127.6 26.0 32.6 92.5 115 115 A K E -dg 69 163B 58 -47,-2.2 -45,-2.4 -2,-0.5 2,-1.2 -0.980 38.1-119.2-130.2 139.5 25.6 29.1 93.8 116 116 A K E -d 70 0B 84 47,-0.8 -45,-0.2 -2,-0.4 -47,-0.1 -0.679 37.2-177.5 -77.7 98.0 25.0 26.0 91.8 117 117 A E + 0 0 30 -47,-1.9 2,-0.3 -2,-1.2 -1,-0.2 0.852 55.5 9.2 -68.7 -42.8 21.7 25.1 93.5 118 118 A Y S S- 0 0 105 -48,-1.0 -46,-0.3 -34,-0.1 2,-0.2 -0.813 90.6 -76.2-133.7 175.3 20.7 21.7 91.9 119 119 A E - 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0 0 15 4,-0.7 2,-0.2 1,-0.4 -1,-0.2 0.747 69.5 -4.7-105.2 -62.8 39.2 34.7 100.4 189 189 A N S S- 0 0 23 -16,-0.0 3,-0.4 -43,-0.0 -1,-0.4 -0.400 89.8 -84.3-115.4-166.4 42.1 36.4 98.6 190 190 A Q S S+ 0 0 193 1,-0.3 2,-0.7 -2,-0.2 -1,-0.0 0.908 131.0 37.1 -69.5 -41.0 45.6 37.2 99.9 191 191 A N S S+ 0 0 63 -4,-0.0 -1,-0.3 2,-0.0 2,-0.2 -0.851 107.9 69.6-114.1 86.4 44.2 40.3 101.4 192 192 A A - 0 0 7 -2,-0.7 -4,-0.7 -3,-0.4 2,-0.3 -0.782 49.6-164.8 172.2 154.3 40.7 39.4 102.7 193 193 A N E -J 187 0B 64 -6,-0.2 35,-3.2 -2,-0.2 2,-0.4 -0.973 11.0-150.2-150.3 149.4 39.1 37.4 105.4 194 194 A V E -Jk 186 228B 0 -8,-3.0 -8,-2.1 -2,-0.3 2,-0.5 -0.991 10.9-172.7-133.5 132.9 35.5 36.2 105.8 195 195 A T E -Jk 185 229B 8 33,-2.1 35,-2.4 -2,-0.4 2,-0.4 -0.988 18.8-172.2-119.6 118.0 33.3 35.5 108.8 196 196 A V E -Jk 184 230B 0 -12,-2.2 -12,-2.0 -2,-0.5 2,-0.6 -0.949 19.8-165.1-119.0 135.0 30.1 33.9 107.9 197 197 A Q E +Jk 183 231B 0 33,-1.8 35,-1.8 -2,-0.4 -14,-0.3 -0.953 28.5 152.0-114.3 101.0 27.1 33.2 110.1 198 198 A D E +J 182 0B 14 -16,-2.8 2,-1.3 -2,-0.6 -16,-0.5 -0.445 4.4 152.7-132.0 59.6 24.9 30.9 108.0 199 199 A K + 0 0 40 33,-0.3 2,-0.3 -18,-0.2 3,-0.1 -0.709 12.1 163.9 -91.2 82.9 23.0 28.8 110.6 200 200 A Y + 0 0 71 -2,-1.3 35,-0.1 1,-0.2 37,-0.1 -0.719 62.6 38.8 -90.7 158.2 19.9 27.8 108.7 201 201 A K S S+ 0 0 119 35,-0.9 2,-0.3 -2,-0.3 -1,-0.2 0.994 90.4 115.5 60.3 75.7 18.0 24.9 110.3 202 202 A V S S- 0 0 23 34,-0.2 -1,-0.2 -3,-0.1 2,-0.2 -0.927 71.6 -81.9-162.3 163.8 18.6 25.9 114.0 203 203 A S > - 0 0 63 -2,-0.3 4,-3.0 1,-0.1 5,-0.2 -0.548 38.8-112.9 -80.0 150.0 16.2 27.0 116.8 204 204 A Y H > S+ 0 0 59 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.892 116.6 53.1 -43.7 -50.8 15.0 30.5 117.0 205 205 A D H > S+ 0 0 130 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.925 112.6 41.8 -53.7 -54.4 16.9 31.0 120.2 206 206 A E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.890 114.9 53.7 -63.0 -36.7 20.2 29.9 118.8 207 207 A K H X S+ 0 0 0 -4,-3.0 4,-1.9 2,-0.2 -2,-0.2 0.960 108.3 46.6 -61.9 -55.1 19.5 31.8 115.6 208 208 A V H X S+ 0 0 12 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.888 114.3 49.8 -54.5 -43.2 18.8 35.2 117.3 209 209 A K H X S+ 0 0 123 -4,-2.0 4,-3.0 -5,-0.3 -1,-0.2 0.905 107.1 53.0 -64.2 -44.6 22.0 34.7 119.4 210 210 A S H X S+ 0 0 6 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.857 109.5 50.0 -60.4 -37.4 24.2 33.9 116.5 211 211 A I H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.987 115.1 41.0 -64.9 -59.3 23.2 37.0 114.6 212 212 A K H X S+ 0 0 49 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.895 115.5 52.2 -56.3 -45.3 23.8 39.4 117.5 213 213 A D H X S+ 0 0 80 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.919 114.1 41.0 -59.8 -45.5 27.0 37.6 118.5 214 214 A T H X S+ 0 0 10 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.885 114.3 54.8 -71.4 -32.2 28.4 37.8 115.0 215 215 A M H X S+ 0 0 0 -4,-3.0 4,-2.1 -5,-0.2 3,-0.3 0.919 105.2 52.7 -66.5 -37.0 27.1 41.4 114.8 216 216 A D H X S+ 0 0 47 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.907 104.6 55.7 -65.3 -38.4 28.9 42.2 118.0 217 217 A E H X S+ 0 0 85 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.850 110.5 45.0 -63.5 -33.7 32.2 41.0 116.6 218 218 A T H < S+ 0 0 0 -4,-1.4 4,-0.3 -3,-0.3 -1,-0.2 0.859 105.6 58.8 -79.1 -35.3 31.9 43.3 113.6 219 219 A M H < S+ 0 0 24 -4,-2.1 47,-0.3 2,-0.2 -2,-0.2 0.868 115.6 38.5 -57.5 -37.4 30.9 46.4 115.6 220 220 A N H >< S+ 0 0 127 -4,-1.6 3,-0.5 1,-0.2 -2,-0.2 0.920 116.1 47.2 -79.6 -49.9 34.1 46.0 117.4 221 221 A N G >< S+ 0 0 56 -4,-2.2 3,-2.3 1,-0.2 -1,-0.2 0.355 80.3 130.9 -77.9 13.9 36.4 44.9 114.5 222 222 A S G 3 + 0 0 16 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.683 62.1 52.8 -37.3 -42.9 34.8 47.9 112.7 223 223 A E G < S+ 0 0 123 -3,-0.5 2,-1.1 1,-0.1 -1,-0.3 0.223 78.2 104.5 -89.3 20.6 38.0 49.5 111.4 224 224 A D < - 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0 0 2 -2,-0.3 2,-0.4 10,-0.1 13,-0.2 -0.914 3.5-174.5-147.9 105.6 16.1 30.7 109.3 236 236 A S + 0 0 36 -2,-0.4 -35,-0.9 12,-0.1 2,-0.2 -0.862 17.5 154.6 -98.9 143.4 14.1 28.2 107.2 237 237 A S - 0 0 17 6,-0.4 2,-2.3 -2,-0.4 3,-0.2 -0.643 60.9 -46.4-146.9-160.3 12.7 25.2 108.9 238 238 A G S S+ 0 0 34 -2,-0.2 3,-0.4 1,-0.2 6,-0.1 -0.292 72.1 167.1 -77.1 56.0 9.8 22.6 108.6 239 239 A G + 0 0 3 -2,-2.3 2,-3.2 4,-0.3 -1,-0.2 0.848 24.9 129.9 -33.1 -94.6 7.4 25.5 108.0 240 240 A T S S+ 0 0 92 -194,-0.6 -1,-0.2 -3,-0.2 -194,-0.1 -0.370 85.9 22.2 64.9 -69.7 4.1 24.1 106.7 241 241 A A S > S- 0 0 65 -2,-3.2 2,-2.2 -3,-0.4 3,-0.8 -0.175 134.9 -34.2-104.7-161.3 2.2 26.1 109.4 242 242 A W T 3 S+ 0 0 188 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 -0.414 120.4 81.4 -61.9 83.9 3.4 29.3 111.2 243 243 A N T 3 + 0 0 47 -2,-2.2 -6,-0.4 -197,-0.1 -4,-0.3 0.041 63.6 120.2-170.0 5.2 7.0 28.0 111.2 244 244 A S S X> S- 0 0 13 -3,-0.8 4,-1.7 -5,-0.2 3,-0.7 -0.402 86.4 -96.2 -77.8 161.6 7.7 29.2 107.7 245 245 A P H 3> S+ 0 0 3 0, 0.0 4,-1.8 0, 0.0 -10,-0.1 0.669 125.0 62.5 -57.0 -10.8 10.5 31.7 107.1 246 246 A Y H 3> S+ 0 0 56 2,-0.2 4,-2.2 3,-0.2 5,-0.1 0.953 102.2 47.0 -77.3 -48.1 7.8 34.3 107.1 247 247 A Y H <4 S+ 0 0 80 -3,-0.7 4,-0.3 2,-0.2 3,-0.2 0.943 117.5 42.7 -56.0 -52.4 6.8 33.7 110.7 248 248 A Y H >X S+ 0 0 31 -4,-1.7 4,-3.2 1,-0.2 3,-1.8 0.922 113.1 53.4 -60.6 -45.2 10.5 33.7 111.8 249 249 A A H 3X S+ 0 0 6 -4,-1.8 4,-1.6 1,-0.3 -1,-0.2 0.796 98.6 63.4 -61.0 -32.2 11.2 36.7 109.7 250 250 A S H 3< S+ 0 0 26 -4,-2.2 -1,-0.3 -3,-0.2 -2,-0.2 0.565 118.3 27.5 -69.6 -9.2 8.3 38.6 111.3 251 251 A Y H <> S+ 0 0 109 -3,-1.8 4,-2.3 -4,-0.3 -2,-0.2 0.714 118.7 53.0-113.8 -52.3 10.3 38.4 114.6 252 252 A I H X S+ 0 0 1 -4,-3.2 4,-1.8 1,-0.2 -3,-0.2 0.764 108.4 52.4 -60.5 -28.8 13.9 38.2 113.6 253 253 A N H X S+ 0 0 2 -4,-1.6 4,-2.5 -5,-0.3 -1,-0.2 0.978 113.2 37.6 -75.0 -57.9 13.8 41.3 111.5 254 254 A P H > S+ 0 0 29 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.962 116.7 57.2 -57.0 -46.5 12.3 43.9 113.9 255 255 A E H X S+ 0 0 73 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.914 113.2 36.6 -45.8 -59.4 14.3 42.2 116.6 256 256 A I H X S+ 0 0 0 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.2 0.790 111.2 60.6 -71.2 -28.1 17.6 42.8 114.8 257 257 A A H >X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 3,-0.9 0.987 109.7 42.1 -61.9 -54.5 16.7 46.2 113.4 258 258 A N H 3X S+ 0 0 77 -4,-2.4 4,-2.8 1,-0.3 5,-0.4 0.878 106.2 62.7 -58.6 -43.2 16.2 47.7 116.8 259 259 A Y H 3X S+ 0 0 33 -4,-1.8 4,-1.5 -5,-0.3 -1,-0.3 0.857 109.7 41.4 -51.4 -37.7 19.3 45.9 118.1 260 260 A I H S- 0 0 42 1,-0.2 3,-1.8 2,-0.1 4,-0.1 -0.375 83.3-135.8 -59.3 98.3 7.9 44.9 110.1 281 281 A S T 3 S+ 0 0 116 -2,-1.0 -1,-0.2 1,-0.2 -2,-0.0 0.544 93.2 46.2 -23.4 -52.3 7.6 48.3 111.9 282 282 A P T 3 S- 0 0 40 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.755 94.9-138.9 -74.2 -28.2 11.4 48.9 112.6 283 283 A L <> - 0 0 22 -3,-1.8 4,-1.7 3,-0.1 3,-0.3 0.992 12.8-157.0 65.5 94.2 13.0 48.1 109.2 284 284 A L H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.881 90.0 55.4 -63.1 -47.2 16.2 46.1 109.2 285 285 A Y H > S+ 0 0 2 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.835 108.8 49.0 -59.4 -33.4 17.5 47.2 105.7 286 286 A Q H > S+ 0 0 33 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.903 110.5 49.1 -73.6 -42.5 17.2 50.9 106.7 287 287 A E H X S+ 0 0 13 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.902 110.4 51.4 -63.6 -41.9 19.1 50.5 110.0 288 288 A V H < S+ 0 0 0 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.910 111.6 47.4 -61.2 -41.2 21.9 48.5 108.3 289 289 A I H >< S+ 0 0 1 -4,-1.5 3,-1.6 -5,-0.2 -2,-0.2 0.953 109.6 53.7 -64.2 -49.1 22.2 51.3 105.6 290 290 A R H >< S+ 0 0 70 -4,-2.6 3,-2.6 1,-0.3 -1,-0.2 0.796 91.0 72.8 -55.6 -35.5 22.2 54.1 108.3 291 291 A A T 3< S+ 0 0 2 -4,-1.8 3,-0.4 1,-0.3 -1,-0.3 0.483 83.6 73.2 -62.0 0.7 25.1 52.4 110.3 292 292 A N T X> + 0 0 0 -3,-1.6 3,-2.6 1,-0.2 4,-0.6 0.416 63.0 101.6 -91.7 -2.2 27.2 53.7 107.4 293 293 A K G X4 S+ 0 0 69 -3,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.847 71.7 66.5 -49.3 -33.8 26.9 57.2 108.7 294 294 A S G 34 S+ 0 0 58 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.430 94.8 55.9 -68.8 -4.6 30.4 56.7 110.1 295 295 A L G <4 0 0 24 -3,-2.6 -1,-0.2 -274,-0.0 -2,-0.2 0.626 360.0 360.0-101.4 -21.3 31.9 56.6 106.6 296 296 A I << 0 0 56 -3,-1.0 -294,-0.1 -4,-0.6 -279,-0.1 -0.665 360.0 360.0 -78.9 360.0 30.6 59.9 105.3