==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 07-MAY-12 4F2B . COMPND 2 MOLECULE: 1-PHOSPHATIDYLINOSITOL PHOSPHODIESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR J.CHENG,R.GOLDSTEIN,B.STEC,A.GERSHENSON,M.F.ROBERTS . 606 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23659.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 421 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 6.4 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 . 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-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 . 65 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 20.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.5 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 0 3 2 2 0 0 1 0 0 1 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 3 1 4 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 . 2 0 3 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 2 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 2 A D 0 0 186 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -3.3 -2.2 -6.7 35.5 2 3 A S > - 0 0 43 1,-0.1 3,-0.9 2,-0.0 4,-0.2 -0.512 360.0-153.9 -71.3 125.1 0.9 -6.6 33.4 3 4 A L G > S+ 0 0 13 -2,-0.4 3,-0.6 1,-0.2 6,-0.1 0.587 84.0 63.0 -75.0 -16.0 0.6 -4.2 30.4 4 5 A S G 3 S+ 0 0 16 1,-0.2 -1,-0.2 290,-0.1 4,-0.1 0.507 72.8 89.9 -98.3 -0.7 3.1 -5.8 28.1 5 6 A K G < S+ 0 0 165 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.767 102.5 35.2 -60.1 -28.3 1.4 -9.1 27.7 6 7 A S S X S+ 0 0 26 -3,-0.6 3,-1.5 -4,-0.2 -1,-0.3 -0.595 73.2 170.8-128.3 76.8 -0.3 -7.3 24.9 7 8 A P G > + 0 0 28 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.702 68.4 73.1 -61.8 -25.1 2.4 -5.0 23.3 8 9 A E G 3 S+ 0 0 62 1,-0.2 3,-0.1 49,-0.1 50,-0.1 0.854 113.3 22.6 -59.7 -38.5 0.2 -4.1 20.3 9 10 A N G X> S+ 0 0 44 -3,-1.5 3,-0.7 -6,-0.1 4,-0.5 0.142 77.9 128.9-114.2 18.8 -2.1 -1.9 22.5 10 11 A W G X4 S+ 0 0 0 -3,-0.8 3,-1.3 1,-0.2 -1,-0.1 0.865 77.2 46.7 -51.7 -43.7 -0.1 -0.9 25.5 11 12 A M G >4 S+ 0 0 1 1,-0.3 3,-3.3 -4,-0.2 -1,-0.2 0.876 94.9 72.0 -62.3 -35.9 -0.8 2.9 25.3 12 13 A S G <4 S+ 0 0 56 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.668 98.6 55.2 -59.2 -14.7 -4.5 2.6 24.6 13 14 A K G << S+ 0 0 95 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.453 91.1 88.6 -99.6 -2.0 -4.5 1.6 28.3 14 15 A L S < S- 0 0 24 -3,-3.3 2,-0.9 -4,-0.1 9,-0.0 -0.135 93.6 -82.1 -81.8-174.6 -2.7 4.6 29.8 15 16 A D > - 0 0 99 1,-0.1 3,-3.2 287,-0.1 138,-0.2 -0.850 31.4-152.5 -92.4 104.5 -4.3 7.9 31.0 16 17 A D T 3 S+ 0 0 51 -2,-0.9 138,-2.5 1,-0.3 139,-0.3 0.503 91.9 72.5 -56.7 -6.1 -4.8 10.0 27.8 17 18 A G T 3 S+ 0 0 42 136,-0.2 -1,-0.3 135,-0.1 138,-0.0 0.704 78.3 101.7 -75.7 -23.2 -4.4 13.0 30.2 18 19 A K S < S- 0 0 71 -3,-3.2 135,-1.9 134,-0.1 136,-0.3 -0.295 78.5-119.6 -63.5 142.9 -0.7 12.3 30.5 19 20 A H B -A 152 0A 36 133,-0.2 3,-0.3 1,-0.1 133,-0.2 -0.418 24.3-120.5 -67.3 155.6 1.8 14.3 28.6 20 21 A L S > S+ 0 0 0 131,-1.8 3,-1.3 1,-0.2 -1,-0.1 0.770 113.8 63.0 -76.0 -21.3 3.9 12.1 26.2 21 22 A T T 3 S+ 0 0 0 130,-0.3 214,-0.3 1,-0.2 -1,-0.2 0.874 98.5 56.5 -63.5 -33.4 7.0 13.2 28.0 22 23 A E T 3 S+ 0 0 42 -3,-0.3 2,-0.5 2,-0.1 -1,-0.2 0.303 91.0 97.7 -81.6 9.6 5.6 11.5 31.1 23 24 A I S < S- 0 0 0 -3,-1.3 2,-0.7 250,-0.1 250,-0.0 -0.916 73.0-136.7-110.8 124.6 5.3 8.3 29.2 24 25 A N - 0 0 6 -2,-0.5 252,-0.2 272,-0.1 276,-0.1 -0.702 37.2-179.2 -74.5 111.3 8.0 5.6 29.5 25 26 A I E -b 276 0B 0 250,-0.8 252,-1.4 -2,-0.7 2,-0.2 -0.974 25.1-137.6-134.2 124.6 8.3 4.6 25.9 26 27 A P E -b 277 0B 0 0, 0.0 35,-1.5 0, 0.0 36,-0.5 -0.507 28.0-176.8 -81.0 146.7 10.5 2.0 24.3 27 28 A G E -b 278 0B 0 250,-2.4 252,-2.7 34,-0.2 2,-0.4 -0.919 22.0-127.2-139.0 162.8 12.2 3.0 21.1 28 29 A S E -bc 279 63B 0 34,-1.8 36,-1.6 -2,-0.3 3,-0.5 -0.971 19.5-135.7-113.6 138.6 14.4 1.4 18.5 29 30 A H S S+ 0 0 29 250,-1.9 252,-0.3 -2,-0.4 253,-0.1 -0.760 90.4 4.0 -87.3 138.4 17.7 2.9 17.4 30 31 A D S > S- 0 0 6 -2,-0.4 3,-2.0 34,-0.1 17,-0.4 0.972 86.9-168.8 50.1 58.9 18.4 3.0 13.7 31 32 A S G > S+ 0 0 0 33,-1.6 3,-0.5 -3,-0.5 34,-0.1 0.745 70.2 48.0 -58.7 -34.0 14.9 1.6 13.3 32 33 A G G > S+ 0 0 1 32,-0.4 3,-1.0 1,-0.2 -1,-0.3 0.307 77.1 96.3 -95.7 10.9 15.0 0.6 9.7 33 34 A S G X + 0 0 0 -3,-2.0 3,-2.3 1,-0.2 -1,-0.2 0.490 55.7 98.7 -72.1 -0.4 18.3 -1.3 9.5 34 35 A F G < + 0 0 19 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.719 69.4 71.7 -59.6 -17.8 16.2 -4.5 9.9 35 36 A T G < S+ 0 0 16 -3,-1.0 -1,-0.3 49,-0.2 2,-0.2 0.566 71.8 103.5 -73.7 -16.2 16.5 -4.8 6.1 36 37 A L < + 0 0 5 -3,-2.3 48,-0.0 1,-0.1 6,-0.0 -0.501 36.1 161.5 -64.7 137.8 20.3 -5.7 6.3 37 38 A K + 0 0 49 -2,-0.2 -1,-0.1 9,-0.0 5,-0.1 0.484 39.0 104.6-139.7 -10.6 20.8 -9.5 5.8 38 39 A D - 0 0 27 1,-0.2 4,-0.5 3,-0.1 310,-0.1 -0.640 62.3-151.6 -67.9 111.4 24.4 -9.8 4.9 39 40 A P S > S+ 0 0 7 0, 0.0 3,-0.6 0, 0.0 4,-0.3 0.880 92.9 49.8 -54.4 -39.6 25.7 -11.2 8.1 40 41 A V G > S+ 0 0 52 1,-0.2 3,-1.4 2,-0.2 -2,-0.1 0.968 111.8 43.5 -62.7 -51.9 29.1 -9.6 7.5 41 42 A K G 3 S+ 0 0 95 1,-0.3 4,-0.2 2,-0.1 -1,-0.2 0.395 110.5 66.0 -73.3 -1.8 27.9 -6.1 6.6 42 43 A S G <> + 0 0 3 -3,-0.6 4,-0.9 -4,-0.5 -1,-0.3 0.519 65.2 98.4 -97.0 -12.7 25.7 -6.6 9.6 43 44 A V T <4 S- 0 0 35 -3,-1.4 208,-2.9 -4,-0.3 209,-0.4 0.830 111.7 -1.6 -54.0 -44.2 28.1 -6.8 12.5 44 45 A W T 4 S+ 0 0 115 206,-0.2 -1,-0.2 207,-0.1 -2,-0.1 0.559 129.3 64.1-116.2 -29.8 27.7 -3.1 13.5 45 46 A A T 4 S+ 0 0 13 -4,-0.2 2,-0.3 2,-0.0 -3,-0.2 0.956 86.5 75.8 -65.5 -42.2 25.3 -1.8 10.9 46 47 A K < + 0 0 24 -4,-0.9 206,-0.2 1,-0.2 205,-0.1 -0.499 46.2 161.1 -75.7 124.4 22.3 -4.0 11.9 47 48 A T + 0 0 3 -17,-0.4 234,-6.0 -2,-0.3 2,-0.3 0.473 64.9 30.8-117.9 -12.4 20.6 -2.7 15.1 48 49 A Q - 0 0 1 232,-0.2 -1,-0.2 233,-0.2 235,-0.1 -0.954 49.2-166.8-142.5 158.6 17.2 -4.4 14.8 49 50 A D S S+ 0 0 33 -2,-0.3 2,-0.2 233,-0.3 -1,-0.1 0.487 70.1 74.9-126.2 -10.9 15.8 -7.6 13.2 50 51 A K S S- 0 0 49 232,-0.2 -16,-0.2 1,-0.1 2,-0.2 -0.466 80.7-114.9 -91.5 170.7 12.1 -7.0 13.2 51 52 A D > - 0 0 63 -2,-0.2 4,-3.5 1,-0.1 5,-0.2 -0.457 33.2 -97.4 -97.4 178.2 10.3 -4.7 10.8 52 53 A Y H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 8,-0.1 0.929 124.1 52.9 -57.6 -46.8 8.5 -1.5 11.7 53 54 A L H > S+ 0 0 29 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.850 115.5 39.1 -63.6 -37.8 5.2 -3.3 11.8 54 55 A T H > S+ 0 0 48 2,-0.2 4,-4.3 1,-0.2 5,-0.3 0.939 109.2 59.0 -77.4 -45.8 6.4 -6.0 14.2 55 56 A Q H <>S+ 0 0 1 -4,-3.5 5,-3.0 1,-0.2 4,-0.4 0.914 111.7 47.5 -41.8 -42.0 8.5 -3.5 16.2 56 57 A M H ><5S+ 0 0 1 -4,-2.6 3,-1.7 -5,-0.2 -2,-0.2 0.952 109.9 45.5 -68.0 -52.7 5.0 -2.0 16.6 57 58 A K H 3<5S+ 0 0 106 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.833 111.1 59.7 -53.5 -32.4 3.2 -5.2 17.5 58 59 A S T 3<5S- 0 0 27 -4,-4.3 -1,-0.3 -51,-0.1 -2,-0.2 0.580 127.0 -99.6 -73.9 -15.8 6.1 -5.7 19.8 59 60 A G T < 5 + 0 0 0 -3,-1.7 2,-0.6 -4,-0.4 -3,-0.2 0.476 69.0 150.2 108.8 6.9 5.4 -2.4 21.7 60 61 A V < + 0 0 0 -5,-3.0 -1,-0.2 -6,-0.3 -33,-0.2 -0.564 10.2 165.8 -75.0 114.9 7.9 0.0 20.1 61 62 A R + 0 0 1 -35,-1.5 47,-1.1 -2,-0.6 2,-0.4 0.173 59.0 62.1-115.5 23.0 6.6 3.7 20.0 62 63 A F E - d 0 108B 1 -36,-0.5 -34,-1.8 45,-0.2 2,-0.5 -0.957 65.5-167.2-142.3 121.7 9.6 5.7 19.3 63 64 A F E -cd 28 109B 0 45,-2.6 47,-3.1 -2,-0.4 2,-1.1 -0.969 15.5-147.6-115.8 134.9 11.3 5.2 16.0 64 65 A D E - d 0 110B 1 -36,-1.6 -33,-1.6 -2,-0.5 2,-0.5 -0.746 23.9-170.8-100.6 91.9 14.8 6.5 15.1 65 66 A I E - d 0 111B 0 45,-1.5 47,-1.9 -2,-1.1 2,-0.5 -0.702 6.8-162.5 -90.6 120.6 14.5 7.2 11.4 66 67 A R E - d 0 112B 24 -2,-0.5 12,-1.5 12,-0.2 2,-0.3 -0.909 18.1-178.4-108.2 129.8 17.7 8.0 9.6 67 68 A G E -Ed 77 113B 0 45,-2.1 47,-1.7 -2,-0.5 48,-0.9 -0.815 22.3-170.0-130.9 159.0 17.3 9.6 6.2 68 69 A R E -E 76 0B 43 8,-1.8 8,-2.9 -2,-0.3 2,-0.8 -0.972 31.6-117.9-145.2 137.3 19.1 10.9 3.3 69 70 A A E +E 75 0B 0 46,-0.5 49,-2.1 -2,-0.3 6,-0.2 -0.696 38.1 161.7 -84.1 117.0 17.8 12.9 0.4 70 71 A S E S+ 0 0 26 4,-1.1 2,-0.3 -2,-0.8 -1,-0.2 0.511 74.8 18.1-104.8 -8.7 18.3 11.0 -2.8 71 72 A A E > S-E 74 0B 16 3,-1.8 3,-0.5 -3,-0.1 -1,-0.2 -0.978 76.6-114.8-156.7 156.6 15.5 13.2 -4.6 72 73 A D T 3 S+ 0 0 42 -2,-0.3 60,-0.2 1,-0.3 -1,-0.1 0.886 126.4 33.8 -62.2 -35.1 13.8 16.5 -4.0 73 74 A N T 3 S+ 0 0 81 1,-0.1 2,-0.4 58,-0.1 -1,-0.3 0.385 116.3 71.3 -96.3 1.1 10.6 14.4 -3.6 74 75 A M E < -E 71 0B 67 -3,-0.5 -3,-1.8 14,-0.0 -4,-1.1 -0.967 51.0-170.3-128.6 129.6 12.3 11.5 -1.9 75 76 A I E -E 69 0B 0 -2,-0.4 13,-3.1 -6,-0.2 -6,-0.2 -0.937 20.5-150.9-109.7 113.4 14.0 10.7 1.5 76 77 A S E -EF 68 87B 6 -8,-2.9 -8,-1.8 -2,-0.6 2,-0.8 -0.566 18.5-120.7 -80.3 137.9 15.9 7.4 1.5 77 78 A V E +E 67 0B 1 9,-2.1 7,-2.2 -2,-0.2 9,-0.3 -0.728 48.6 172.0 -82.2 114.7 16.2 5.6 4.9 78 79 A H E - F 0 83B 9 -12,-1.5 -12,-0.2 -2,-0.8 5,-0.2 -0.628 45.1-147.0-117.8 166.6 19.9 5.3 5.5 79 80 A H E > S- F 0 82B 49 3,-2.3 3,-1.3 1,-0.4 2,-0.3 -0.656 78.4 -66.8-128.1 76.9 22.5 4.3 8.0 80 81 A G T 3 S- 0 0 20 1,-0.3 -1,-0.4 -2,-0.2 34,-0.1 -0.603 119.5 -11.3 70.1-142.5 25.2 6.8 7.1 81 82 A M T 3 S+ 0 0 144 -2,-0.3 2,-0.6 -3,-0.1 -1,-0.3 0.808 117.6 101.8 -42.5 -38.2 26.4 5.9 3.6 82 83 A V E < -F 79 0B 35 -3,-1.3 -3,-2.3 1,-0.1 2,-0.3 -0.390 69.0-143.8 -73.6 107.2 24.5 2.6 3.8 83 84 A Y E -F 78 0B 80 -2,-0.6 -5,-0.2 -5,-0.2 -1,-0.1 -0.531 6.6-153.2 -62.7 123.8 21.3 2.7 1.9 84 85 A L E - 0 0 2 -7,-2.2 -49,-0.2 -2,-0.3 -1,-0.1 0.169 37.9-109.3 -91.7 20.7 18.7 0.6 3.9 85 86 A H E S+ 0 0 106 1,-0.1 2,-0.3 -8,-0.0 -7,-0.1 0.835 83.8 68.2 58.0 41.6 16.5 -0.4 1.0 86 87 A H E S- 0 0 9 -9,-0.3 -9,-2.1 4,-0.0 2,-0.3 -0.955 72.7-108.6-165.9 176.2 13.3 1.6 1.5 87 88 A E E >> -F 76 0B 51 -2,-0.3 3,-3.3 -11,-0.2 4,-0.8 -0.732 34.8-107.3-108.2 158.4 11.9 5.1 1.4 88 89 A L H >> S+ 0 0 0 -13,-3.1 3,-1.3 1,-0.3 4,-1.3 0.846 121.1 64.3 -44.3 -35.9 10.8 7.2 4.2 89 90 A G H 3> S+ 0 0 12 1,-0.3 4,-1.8 -14,-0.2 -1,-0.3 0.660 88.4 66.8 -73.0 -16.0 7.4 6.5 2.9 90 91 A K H <> S+ 0 0 77 -3,-3.3 4,-1.6 1,-0.2 -1,-0.3 0.878 104.5 44.1 -64.6 -35.4 7.8 2.9 3.7 91 92 A F H < S+ 0 0 71 -4,-2.8 3,-1.5 1,-0.1 -1,-0.2 -0.735 75.6 179.0-127.1 73.9 -4.7 0.5 17.0 103 104 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.643 72.1 62.0 -63.3 -22.9 -6.0 4.0 16.7 104 105 A N T 3 S+ 0 0 85 53,-0.2 2,-0.3 -3,-0.1 53,-0.1 -0.033 87.2 91.1 -96.0 32.4 -5.4 4.8 20.4 105 106 A E < - 0 0 0 -3,-1.5 53,-2.3 -6,-0.2 2,-0.3 -0.867 60.3-157.2-116.3 155.0 -1.6 4.4 20.1 106 107 A T - 0 0 0 -2,-0.3 2,-0.3 51,-0.2 54,-0.2 -0.924 0.6-154.7-130.3 156.7 0.8 7.2 19.2 107 108 A I E - g 0 160B 1 52,-1.6 54,-3.4 -2,-0.3 2,-0.6 -0.926 8.5-146.8-134.7 153.0 4.3 7.1 17.7 108 109 A V E -dg 62 161B 0 -47,-1.1 -45,-2.6 -2,-0.3 2,-0.7 -0.996 17.6-159.5-122.7 118.6 7.1 9.6 17.9 109 110 A M E -dg 63 162B 0 52,-3.9 54,-2.0 -2,-0.6 2,-0.3 -0.900 1.1-156.8-106.3 116.8 9.0 9.6 14.8 110 111 A S E -dg 64 163B 1 -47,-3.1 -45,-1.5 -2,-0.7 2,-0.4 -0.650 9.9-168.1 -91.6 141.3 12.6 11.0 15.0 111 112 A M E +dg 65 164B 0 52,-0.8 54,-1.5 -2,-0.3 2,-0.4 -0.936 13.5 164.2-136.4 113.5 13.9 12.2 11.7 112 113 A K E -d 66 0B 63 -47,-1.9 -45,-2.1 -2,-0.4 2,-1.0 -0.995 41.6-119.6-134.8 129.7 17.6 13.0 11.3 113 114 A K E +d 67 0B 100 -2,-0.4 -45,-0.2 52,-0.4 -47,-0.1 -0.591 32.8 178.2 -69.1 104.1 19.5 13.5 8.1 114 115 A D + 0 0 34 -47,-1.7 2,-0.3 -2,-1.0 -46,-0.2 0.523 61.2 27.4 -83.0 -11.5 22.2 10.7 8.4 115 116 A Y S S- 0 0 71 -48,-0.9 -46,-0.5 -34,-0.1 -1,-0.1 -0.998 85.2 -94.6-151.9 154.9 23.9 11.4 5.1 116 117 A D - 0 0 100 -2,-0.3 2,-0.1 -48,-0.1 -2,-0.0 -0.357 52.3-103.5 -67.8 158.0 24.6 14.1 2.5 117 118 A S - 0 0 42 1,-0.1 -47,-0.2 -49,-0.1 2,-0.1 -0.356 34.7 -95.3 -83.2 158.5 22.1 14.3 -0.4 118 119 A D > - 0 0 50 -49,-2.1 3,-1.2 -2,-0.1 -1,-0.1 -0.400 39.3-103.4 -75.5 156.0 22.6 13.1 -3.9 119 120 A S T 3 S+ 0 0 114 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.796 117.4 53.5 -59.2 -38.3 23.7 15.4 -6.6 120 121 A K T 3 S+ 0 0 137 -50,-0.2 -1,-0.3 2,-0.0 -49,-0.1 0.942 87.0 103.3 -59.0 -40.7 20.4 15.9 -8.3 121 122 A V < + 0 0 19 -3,-1.2 3,-0.1 -51,-0.2 -4,-0.0 0.070 36.4 163.9 -52.4 136.6 18.9 16.9 -5.0 122 123 A T + 0 0 111 2,-0.1 2,-0.2 1,-0.1 -1,-0.1 0.702 49.9 76.9-118.9 -40.2 18.3 20.6 -4.6 123 124 A K S S- 0 0 49 1,-0.1 -1,-0.1 2,-0.1 -52,-0.0 -0.515 87.3-106.4 -71.6 142.6 15.9 21.2 -1.7 124 125 A T > - 0 0 68 -2,-0.2 4,-3.4 1,-0.1 5,-0.1 -0.103 31.4-106.7 -64.8 166.6 17.3 20.8 1.8 125 126 A F H > S+ 0 0 9 2,-0.2 4,-2.3 3,-0.2 5,-0.2 0.935 123.3 46.0 -67.3 -46.3 16.3 17.7 3.7 126 127 A E H > S+ 0 0 17 2,-0.2 4,-4.1 40,-0.2 5,-0.4 0.982 114.7 47.7 -55.9 -56.2 14.0 19.8 6.0 127 128 A E H > S+ 0 0 71 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.958 112.7 50.3 -45.4 -51.7 12.6 21.5 2.9 128 129 A I H X S+ 0 0 0 -4,-3.4 4,-2.0 1,-0.2 5,-0.3 0.856 116.2 41.1 -59.3 -37.1 12.3 18.1 1.3 129 130 A F H X>S+ 0 0 0 -4,-2.3 5,-3.2 -3,-0.3 4,-1.1 0.858 113.3 50.0 -84.6 -38.1 10.5 16.7 4.4 130 131 A R H <>S+ 0 0 45 -4,-4.1 5,-2.3 3,-0.2 -2,-0.2 0.944 119.8 39.6 -62.3 -44.3 8.3 19.6 5.2 131 132 A E H <5S+ 0 0 76 -4,-3.0 -2,-0.2 -5,-0.4 -3,-0.2 0.970 127.0 23.3 -71.0 -62.1 7.1 19.7 1.5 132 133 A Y H <5S+ 0 0 77 -4,-2.0 -3,-0.2 -5,-0.3 -1,-0.1 0.507 133.5 24.7 -91.1 -8.3 6.7 16.1 0.3 133 134 A Y T ><5S+ 0 0 10 -4,-1.1 3,-0.9 -5,-0.3 6,-0.2 0.718 123.2 33.1-119.7 -60.1 6.1 14.3 3.6 134 135 A Y T 3 S+ 0 0 101 0, 0.0 3,-1.2 0, 0.0 4,-0.2 0.838 102.0 57.4 -62.5 -39.0 -2.2 14.7 1.4 138 139 A Q T 3 S+ 0 0 109 1,-0.2 3,-0.2 2,-0.1 4,-0.1 0.847 114.2 37.6 -62.3 -38.0 -1.6 11.0 1.9 139 140 A Y T 3> S+ 0 0 13 -3,-0.4 4,-1.4 -6,-0.2 3,-0.4 0.179 84.6 126.2 -98.4 19.5 -0.4 11.4 5.4 140 141 A Q T <4 S+ 0 0 138 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.807 74.9 31.5 -58.2 -50.0 -2.8 14.1 6.3 141 142 A N T 4 S+ 0 0 90 -4,-0.2 -1,-0.3 -3,-0.2 4,-0.1 0.796 111.7 68.3 -72.4 -28.7 -4.6 12.9 9.4 142 143 A L T 4 S+ 0 0 6 -3,-0.4 18,-2.0 -4,-0.1 2,-0.4 0.893 81.4 75.6 -63.8 -52.0 -1.4 10.9 10.7 143 144 A F B < S-h 160 0B 4 -4,-1.4 18,-0.2 16,-0.2 2,-0.1 -0.546 85.6-122.7 -71.0 124.9 1.0 13.7 11.6 144 145 A Y + 0 0 10 16,-1.3 18,-0.2 -2,-0.4 29,-0.2 -0.440 32.9 174.9 -61.3 133.9 0.2 15.6 14.8 145 146 A T + 0 0 99 -4,-0.1 -1,-0.2 -2,-0.1 27,-0.1 0.156 26.1 151.9-124.5 10.5 -0.2 19.2 13.8 146 147 A G - 0 0 14 1,-0.1 28,-0.3 9,-0.1 -2,-0.0 0.015 50.1-137.6 -61.3 144.9 -1.2 20.2 17.2 147 148 A S S S+ 0 0 129 26,-0.1 -1,-0.1 2,-0.0 0, 0.0 0.789 74.5 96.4 -61.1 -39.0 -0.7 23.7 18.7 148 149 A N - 0 0 62 1,-0.1 26,-0.4 2,-0.1 0, 0.0 -0.045 57.9-156.4 -48.7 154.4 0.4 22.4 22.2 149 150 A A S S+ 0 0 28 1,-0.1 -1,-0.1 24,-0.1 27,-0.1 0.652 94.1 46.8-101.9 -45.3 4.0 22.0 23.2 150 151 A N S S- 0 0 9 25,-0.0 -1,-0.1 -131,-0.0 -2,-0.1 -0.590 94.8-158.4 -90.8 72.0 3.6 19.4 25.9 151 152 A P - 0 0 0 0, 0.0 -131,-1.8 0, 0.0 -130,-0.3 -0.168 4.8-133.8 -58.4 136.2 1.3 17.3 23.7 152 153 A T B > -A 19 0A 24 -133,-0.2 4,-1.5 -132,-0.1 -133,-0.2 -0.418 16.3-120.4 -82.0 163.7 -1.0 15.0 25.5 153 154 A L H > S+ 0 0 2 -135,-1.9 4,-2.1 -137,-0.3 3,-0.3 0.918 117.7 56.5 -66.5 -41.7 -1.6 11.4 24.6 154 155 A K H >4 S+ 0 0 133 -138,-2.5 3,-0.6 -136,-0.3 -1,-0.1 0.952 110.1 45.1 -57.1 -46.6 -5.2 12.4 24.1 155 156 A E H 34 S+ 0 0 87 -139,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.799 122.1 36.2 -61.5 -37.4 -4.1 15.0 21.6 156 157 A T H >< S+ 0 0 0 -4,-1.5 3,-3.6 -3,-0.3 -49,-0.3 0.428 78.6 131.7-106.1 -1.6 -1.7 12.7 19.8 157 158 A K T << S+ 0 0 48 -4,-2.1 -51,-0.2 -3,-0.6 -53,-0.2 -0.315 85.4 13.2 -51.2 124.6 -3.6 9.4 20.0 158 159 A G T 3 S+ 0 0 19 -53,-2.3 2,-0.4 -56,-0.2 -1,-0.3 0.410 110.3 110.9 84.3 -3.5 -3.5 8.1 16.5 159 160 A K < - 0 0 67 -3,-3.6 -52,-1.6 -60,-0.1 2,-1.0 -0.883 68.8-129.9-113.1 140.2 -0.8 10.6 15.4 160 161 A I E -gh 107 143B 0 -18,-2.0 -16,-1.3 -2,-0.4 2,-0.2 -0.775 34.3-155.8 -73.4 101.9 2.8 10.3 14.4 161 162 A V E -g 108 0B 0 -54,-3.4 -52,-3.9 -2,-1.0 2,-0.6 -0.566 14.2-118.7 -76.5 141.9 4.4 13.0 16.6 162 163 A L E -g 109 0B 5 -2,-0.2 13,-4.7 -54,-0.2 2,-0.7 -0.744 24.2-175.9 -90.1 123.0 7.8 14.5 15.4 163 164 A F E -gi 110 175B 0 -54,-2.0 -52,-0.8 -2,-0.6 2,-0.4 -0.737 33.2-154.6-103.0 85.2 10.9 14.3 17.4 164 165 A N E +g 111 0B 0 11,-1.3 18,-0.3 -2,-0.7 3,-0.3 -0.416 39.1 160.4 -79.7 115.8 12.9 16.5 15.0 165 166 A R + 0 0 27 -54,-1.5 -52,-0.4 -2,-0.4 -1,-0.1 0.039 54.9 101.0-108.2 20.6 16.7 16.2 14.6 166 167 A M S S- 0 0 29 1,-0.4 -40,-0.2 -54,-0.2 2,-0.2 0.559 86.4-125.3 -79.5 -7.9 16.6 17.9 11.2 167 168 A G S S+ 0 0 27 -3,-0.3 -1,-0.4 15,-0.1 14,-0.3 -0.611 71.6 12.2 87.8-159.6 17.7 21.2 12.7 168 169 A G S S+ 0 0 38 -2,-0.2 2,-0.3 12,-0.2 11,-0.2 -0.282 75.4 179.7 -57.2 131.0 15.6 24.4 12.1 169 170 A T - 0 0 0 9,-1.8 12,-0.2 2,-0.2 11,-0.1 -0.916 42.1-138.4-135.7 154.7 12.2 23.7 10.6 170 171 A Y S S+ 0 0 161 -2,-0.3 2,-0.3 9,-0.1 9,-0.1 0.263 77.9 106.9 -95.7 11.6 9.1 25.5 9.5 171 172 A I - 0 0 4 7,-0.2 -2,-0.2 1,-0.1 -26,-0.0 -0.740 48.8-173.5 -86.2 140.2 7.1 22.8 11.2 172 173 A K + 0 0 137 -2,-0.3 2,-0.3 -27,-0.1 5,-0.1 0.440 58.3 78.7-116.0 -8.6 5.4 23.9 14.5 173 174 A S S S+ 0 0 9 -29,-0.2 2,-0.2 3,-0.1 -26,-0.1 -0.838 81.5 26.3-107.8 143.3 3.9 20.7 15.9 174 175 A G S > S- 0 0 3 -26,-0.4 3,-0.7 -2,-0.3 2,-0.4 -0.536 101.6 -25.6 105.0-170.4 6.1 18.0 17.7 175 176 A Y B 3 S-i 163 0B 0 -13,-4.7 -11,-1.3 1,-0.2 3,-0.1 -0.650 125.9 -6.9 -91.1 128.3 9.3 18.0 19.7 176 177 A G T 3 S+ 0 0 0 -2,-0.4 2,-1.4 1,-0.2 -1,-0.2 0.795 85.3 159.1 56.9 33.9 11.8 20.8 19.0 177 178 A A < + 0 0 6 -3,-0.7 2,-0.3 -5,-0.1 -1,-0.2 -0.665 32.9 90.9 -87.4 88.1 9.7 22.0 16.1 178 179 A D S > S- 0 0 20 -2,-1.4 -9,-1.8 -11,-0.2 3,-1.6 -0.947 92.3 -72.7-170.9 178.9 10.8 25.5 15.7 179 180 A T T 3 S+ 0 0 86 -2,-0.3 -11,-0.2 1,-0.3 -9,-0.1 0.618 125.4 42.8 -67.6 -20.7 13.2 27.7 13.9 180 181 A S T 3 S- 0 0 82 1,-0.2 -1,-0.3 -13,-0.1 -12,-0.2 0.155 88.9-158.9-109.2 18.1 16.2 26.6 15.9 181 182 A G < - 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