==== 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 4PTD . 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) . 12099.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 12.2 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 . 2 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 . 24 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 22.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 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 1 1 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 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 0 119 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -12.3 0.6 43.7 59.0 2 2 A S + 0 0 87 1,-0.2 2,-0.3 2,-0.1 13,-0.0 0.821 360.0 155.3 51.6 37.6 -0.7 41.1 56.5 3 3 A S > - 0 0 36 1,-0.1 3,-0.8 293,-0.1 -1,-0.2 -0.699 53.4-133.3 -95.2 148.0 2.4 41.4 54.4 4 4 A V G > S+ 0 0 65 -2,-0.3 3,-1.3 1,-0.2 4,-0.3 0.692 104.2 71.7 -69.3 -19.2 3.7 38.7 52.1 5 5 A N G > S+ 0 0 121 1,-0.3 3,-2.5 2,-0.2 4,-0.3 0.875 83.7 68.5 -63.0 -37.5 7.2 39.4 53.5 6 6 A E G X S+ 0 0 36 -3,-0.8 3,-0.7 1,-0.3 -1,-0.3 0.636 86.5 67.2 -58.0 -17.4 6.1 37.8 56.8 7 7 A L G < S+ 0 0 2 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.708 85.7 72.4 -75.8 -20.0 6.0 34.4 55.0 8 8 A E G < S+ 0 0 82 -3,-2.5 2,-1.1 -4,-0.3 -1,-0.2 0.724 74.5 89.2 -66.9 -23.5 9.8 34.7 54.7 9 9 A N X> - 0 0 76 -3,-0.7 3,-1.4 -4,-0.3 4,-0.6 -0.677 63.9-164.8 -79.6 101.5 10.1 34.1 58.4 10 10 A W T 34 S+ 0 0 46 -2,-1.1 52,-0.7 1,-0.3 -1,-0.2 0.688 88.7 51.0 -60.8 -17.9 10.4 30.3 58.5 11 11 A S T 34 S+ 0 0 24 49,-0.1 -1,-0.3 1,-0.1 97,-0.2 0.572 124.3 24.4 -96.3 -11.4 9.7 30.4 62.2 12 12 A K T X4 S+ 0 0 65 -3,-1.4 3,-1.2 -6,-0.2 -2,-0.2 0.045 77.3 127.1-142.5 30.6 6.6 32.6 62.0 13 13 A W T 3< S+ 0 0 0 -4,-0.6 4,-0.3 1,-0.2 -3,-0.1 0.676 70.3 57.7 -67.5 -22.2 5.1 32.1 58.5 14 14 A M T 3 S+ 0 0 0 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.585 84.9 87.7 -82.9 -10.1 1.5 31.2 59.5 15 15 A Q S < S+ 0 0 87 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.907 87.9 44.9 -53.2 -51.6 1.2 34.5 61.4 16 16 A P S S+ 0 0 14 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.733 91.5 99.3 -68.6 -23.7 0.0 36.6 58.4 17 17 A I S S- 0 0 1 -3,-0.4 279,-0.1 -4,-0.3 276,-0.0 -0.480 84.5-105.5 -68.8 130.0 -2.5 33.9 57.3 18 18 A P > - 0 0 47 0, 0.0 3,-1.3 0, 0.0 133,-0.3 -0.198 17.2-124.9 -58.0 144.8 -6.1 34.7 58.4 19 19 A D T 3 S+ 0 0 92 1,-0.2 133,-2.3 132,-0.2 134,-0.3 0.776 105.2 60.7 -59.0 -34.8 -7.8 32.8 61.3 20 20 A S T 3 S+ 0 0 76 131,-0.2 -1,-0.2 130,-0.1 -3,-0.0 0.568 77.8 105.8 -74.7 -11.2 -10.8 31.8 59.2 21 21 A I S < S- 0 0 28 -3,-1.3 130,-2.1 129,-0.1 131,-0.2 -0.570 75.0-121.9 -75.4 126.4 -8.8 29.8 56.6 22 22 A P B >> -A 150 0A 10 0, 0.0 4,-1.1 0, 0.0 3,-1.1 -0.409 17.9-123.3 -64.4 143.3 -9.1 26.0 57.1 23 23 A L G >4 S+ 0 0 0 126,-2.4 3,-0.5 1,-0.3 127,-0.1 0.882 111.5 64.5 -54.4 -38.4 -5.8 24.2 57.6 24 24 A A G 34 S+ 0 0 1 125,-0.4 205,-0.3 1,-0.3 -1,-0.3 0.829 100.5 50.9 -53.3 -37.6 -6.6 22.1 54.6 25 25 A R G <4 S+ 0 0 4 -3,-1.1 -1,-0.3 200,-0.3 244,-0.2 0.823 93.3 89.2 -71.9 -34.8 -6.5 25.2 52.4 26 26 A I S << S- 0 0 0 -4,-1.1 2,-0.7 -3,-0.5 266,-0.1 -0.391 81.3-127.2 -67.6 138.8 -3.1 26.3 53.7 27 27 A S - 0 0 0 262,-0.2 243,-0.2 261,-0.1 265,-0.1 -0.843 36.8-169.4 -88.7 116.2 -0.0 24.9 51.8 28 28 A I E -b 270 0B 0 241,-1.0 243,-1.6 -2,-0.7 2,-0.2 -0.926 22.7-136.9-121.7 133.5 2.1 23.3 54.5 29 29 A P E +b 271 0B 2 0, 0.0 35,-2.7 0, 0.0 36,-1.2 -0.593 34.1 172.6 -78.8 140.0 5.7 21.9 54.6 30 30 A G E -bc 272 65B 0 241,-2.1 243,-2.7 -2,-0.2 2,-0.4 -0.975 24.6-127.6-147.9 157.8 6.0 18.6 56.5 31 31 A T E -bc 273 66B 0 34,-2.1 36,-1.3 -2,-0.3 3,-0.5 -0.874 14.9-132.6-115.7 146.0 8.6 16.0 57.1 32 32 A H S S- 0 0 26 241,-2.1 243,-0.2 -2,-0.4 18,-0.1 -0.811 88.1 -3.0 -96.3 132.8 8.5 12.2 56.6 33 33 A D S > S- 0 0 7 -2,-0.4 3,-1.7 1,-0.1 17,-0.4 0.942 80.8-174.9 49.6 51.4 9.7 9.8 59.4 34 34 A S G > + 0 0 0 33,-0.7 3,-0.6 -3,-0.5 34,-0.1 0.734 68.0 60.6 -47.4 -35.6 10.7 13.0 61.3 35 35 A G G > S+ 0 0 3 32,-0.5 3,-0.6 1,-0.2 -1,-0.3 0.365 74.7 92.8 -82.9 8.4 12.3 11.1 64.3 36 36 A T G X + 0 0 0 -3,-1.7 3,-1.0 1,-0.2 -1,-0.2 0.355 54.3 101.7 -83.1 8.6 15.1 9.3 62.3 37 37 A F G < + 0 0 28 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.494 69.7 61.2 -72.8 -8.9 17.7 12.1 62.8 38 38 A K G < S+ 0 0 76 -3,-0.6 -1,-0.2 15,-0.1 2,-0.1 0.578 73.1 117.3 -93.1 -11.6 19.8 10.4 65.6 39 39 A L < + 0 0 7 -3,-1.0 48,-0.0 1,-0.2 -3,-0.0 -0.364 26.2 159.0 -59.3 126.3 20.8 7.4 63.5 40 40 A Q + 0 0 161 -2,-0.1 -1,-0.2 9,-0.0 5,-0.1 0.654 39.7 100.8-119.3 -35.1 24.6 7.3 63.1 41 41 A N S > S- 0 0 87 1,-0.2 4,-1.7 3,-0.1 3,-0.4 -0.406 72.4-135.8 -59.1 119.2 25.3 3.6 62.2 42 42 A P H > S+ 0 0 91 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.789 100.9 54.6 -46.8 -39.4 25.8 3.6 58.4 43 43 A I H > S+ 0 0 123 1,-0.2 4,-0.6 2,-0.2 197,-0.1 0.939 112.5 40.9 -64.2 -49.5 23.7 0.4 58.0 44 44 A K H >>S+ 0 0 50 -3,-0.4 4,-3.4 1,-0.2 5,-1.1 0.709 114.1 57.1 -71.3 -20.3 20.7 1.8 59.8 45 45 A Q H <5S+ 0 0 67 -4,-1.7 -2,-0.2 3,-0.2 -1,-0.2 0.848 107.5 44.3 -76.9 -40.4 21.3 5.2 58.0 46 46 A V H <5S+ 0 0 56 -4,-2.1 194,-0.4 -5,-0.2 -2,-0.2 0.580 125.7 37.8 -79.3 -9.4 21.2 3.7 54.5 47 47 A W H <5S+ 0 0 145 -4,-0.6 -2,-0.2 -5,-0.2 -3,-0.2 0.797 134.1 6.1-107.5 -41.7 18.1 1.8 55.7 48 48 A G T <5S+ 0 0 2 -4,-3.4 -3,-0.2 -5,-0.1 -12,-0.1 0.756 87.4 105.5-119.1 -31.4 16.1 4.1 58.0 49 49 A M < + 0 0 18 -5,-1.1 197,-0.1 1,-0.2 -12,-0.1 -0.315 24.9 158.3 -58.9 131.3 17.4 7.7 58.3 50 50 A T + 0 0 3 -17,-0.4 225,-4.2 1,-0.3 2,-0.3 0.328 66.2 40.4-131.1 -6.0 15.1 10.1 56.3 51 51 A Q - 0 0 0 223,-0.2 -1,-0.3 224,-0.2 226,-0.1 -0.977 55.6-164.2-143.0 150.8 16.1 13.3 58.1 52 52 A E S S+ 0 0 44 224,-0.3 2,-0.3 -2,-0.3 225,-0.1 0.449 70.4 57.2-118.0 -4.0 19.4 14.6 59.3 53 53 A Y S S- 0 0 82 223,-0.2 -16,-0.2 1,-0.1 223,-0.1 -0.780 83.9 -95.5-123.6 168.0 18.4 17.4 61.7 54 54 A D > - 0 0 70 -2,-0.3 4,-2.5 -17,-0.1 3,-0.2 -0.204 37.4 -97.1 -80.1 174.2 16.2 17.6 64.9 55 55 A F H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.899 123.1 49.8 -54.7 -49.1 12.6 18.6 65.4 56 56 A R H > S+ 0 0 59 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.838 110.8 50.3 -61.9 -35.5 13.4 22.1 66.4 57 57 A Y H 4 S+ 0 0 45 -3,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.945 110.0 50.5 -65.5 -49.5 15.6 22.6 63.3 58 58 A Q H ><>S+ 0 0 0 -4,-2.5 5,-1.8 1,-0.2 3,-1.2 0.908 111.3 47.9 -54.9 -46.3 12.8 21.2 61.1 59 59 A M H ><5S+ 0 0 0 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.852 107.4 55.1 -65.1 -39.1 10.3 23.6 62.6 60 60 A D T 3<5S+ 0 0 47 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.487 104.0 57.4 -73.3 -4.4 12.6 26.6 62.2 61 61 A H T < 5S- 0 0 17 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 -0.032 131.2 -92.0-110.0 21.2 12.8 25.7 58.5 62 62 A G T < 5S+ 0 0 0 -3,-1.5 -3,-0.2 -52,-0.7 -2,-0.1 0.126 76.6 145.0 93.7 -21.6 9.1 26.0 58.1 63 63 A A < + 0 0 0 -5,-1.8 -1,-0.2 -6,-0.2 -33,-0.2 -0.306 10.2 161.3 -56.9 126.3 8.0 22.4 58.8 64 64 A R + 0 0 0 -35,-2.7 47,-3.6 1,-0.1 2,-0.4 0.483 55.4 70.6-122.9 -11.7 4.6 22.2 60.6 65 65 A I E -cd 30 111B 9 -36,-1.2 -34,-2.1 45,-0.2 2,-0.4 -0.922 63.4-164.6-111.3 134.7 3.5 18.6 59.8 66 66 A F E -cd 31 112B 0 45,-2.4 47,-2.6 -2,-0.4 2,-1.2 -0.974 18.1-147.4-128.6 127.6 5.3 15.7 61.5 67 67 A D E - d 0 113B 6 -36,-1.3 -33,-0.7 -2,-0.4 2,-0.5 -0.737 28.2-176.4 -90.5 87.5 5.2 12.0 60.6 68 68 A I E - d 0 114B 1 45,-2.0 47,-2.0 -2,-1.2 2,-0.5 -0.776 9.1-165.2 -91.6 124.7 5.6 10.4 64.1 69 69 A R E - d 0 115B 30 -2,-0.5 12,-1.9 45,-0.2 2,-0.2 -0.952 15.9-162.1-112.9 120.3 5.8 6.6 64.2 70 70 A G E -Ed 80 116B 0 45,-3.5 47,-2.4 -2,-0.5 48,-1.0 -0.591 19.3-166.2-110.1 165.9 5.4 5.0 67.6 71 71 A R E -E 79 0B 33 8,-1.2 8,-2.4 -2,-0.2 2,-0.4 -0.985 24.0-127.6-146.1 129.3 6.0 1.9 69.6 72 72 A L E -E 78 0B 0 46,-0.4 49,-2.7 -2,-0.3 6,-0.2 -0.665 28.6-156.9 -81.1 126.5 4.5 0.9 73.0 73 73 A T > - 0 0 9 4,-2.8 3,-1.2 -2,-0.4 50,-0.1 -0.422 30.8-110.0 -97.4 171.6 7.1 -0.2 75.6 74 74 A D T 3 S+ 0 0 59 1,-0.3 51,-0.3 2,-0.1 -1,-0.1 0.896 120.3 62.8 -63.8 -40.5 6.9 -2.3 78.7 75 75 A D T 3 S- 0 0 121 49,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.390 120.5-114.8 -65.6 1.6 7.3 0.9 80.7 76 76 A N S < S+ 0 0 35 -3,-1.2 2,-0.3 1,-0.2 -2,-0.1 0.916 76.8 121.7 61.6 45.8 4.0 1.9 79.1 77 77 A T - 0 0 44 -6,-0.1 -4,-2.8 58,-0.0 2,-0.6 -0.885 62.3-119.1-130.0 161.2 5.6 4.8 77.1 78 78 A I E -E 72 0B 1 -2,-0.3 13,-2.2 -6,-0.2 14,-0.4 -0.928 30.3-177.3-109.7 121.6 5.7 5.4 73.4 79 79 A V E -EF 71 90B 15 -8,-2.4 -8,-1.2 -2,-0.6 2,-0.3 -0.858 31.9-100.2-114.9 152.3 9.0 5.6 71.7 80 80 A L E +E 70 0B 1 9,-2.3 7,-2.5 -2,-0.3 9,-0.4 -0.529 43.5 178.0 -76.6 132.9 9.8 6.4 68.0 81 81 A H E - F 0 86B 6 -12,-1.9 2,-0.3 -2,-0.3 5,-0.2 -0.835 29.0-156.6-128.6 165.1 10.5 3.5 65.6 82 82 A H E > S- F 0 85B 36 3,-1.8 3,-1.6 -2,-0.3 -33,-0.0 -0.815 78.0 -52.2-141.2 90.8 11.3 2.9 61.9 83 83 A G T 3 S- 0 0 20 -2,-0.3 -1,-0.2 1,-0.3 34,-0.0 -0.540 121.2 -21.9 71.0-138.2 10.3 -0.6 61.3 84 84 A P T 3 S+ 0 0 85 0, 0.0 2,-0.5 0, 0.0 -1,-0.3 0.546 116.0 107.7 -80.6 -5.1 12.0 -2.9 63.9 85 85 A L E < -F 82 0B 49 -3,-1.6 -3,-1.8 1,-0.0 2,-0.5 -0.614 68.2-137.3 -81.4 120.7 14.6 -0.2 64.5 86 86 A Y E -F 81 0B 92 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.618 14.2-148.8 -76.5 119.5 14.4 1.8 67.7 87 87 A L E - 0 0 5 -7,-2.5 2,-2.3 -2,-0.5 -7,-0.2 -0.796 22.9-121.4 -86.3 135.0 15.0 5.4 67.0 88 88 A Y E S+ 0 0 143 -2,-0.4 2,-0.3 -9,-0.1 -7,-0.1 -0.165 83.7 96.4 -74.1 48.2 16.7 6.9 70.1 89 89 A V E - 0 0 0 -2,-2.3 -9,-2.3 -9,-0.4 2,-0.3 -0.958 58.1-151.5-136.1 150.8 13.8 9.4 70.4 90 90 A T E > -F 79 0B 46 -2,-0.3 4,-2.0 -11,-0.3 -11,-0.2 -0.828 28.5-117.1-122.7 165.0 10.6 9.4 72.4 91 91 A L H > S+ 0 0 0 -13,-2.2 4,-2.6 -2,-0.3 5,-0.2 0.861 117.6 54.6 -65.9 -38.0 7.1 10.9 72.1 92 92 A H H > S+ 0 0 105 -14,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.907 105.2 54.0 -61.7 -40.0 7.7 13.0 75.2 93 93 A E H > S+ 0 0 54 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.943 111.2 45.3 -58.6 -48.7 10.8 14.4 73.5 94 94 A F H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.960 115.7 44.4 -60.3 -55.0 8.8 15.4 70.4 95 95 A I H X S+ 0 0 6 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.877 112.6 53.2 -57.3 -40.8 5.9 17.0 72.4 96 96 A N H X S+ 0 0 77 -4,-2.8 4,-1.7 -5,-0.2 -1,-0.2 0.950 112.2 45.5 -58.3 -48.9 8.4 18.7 74.6 97 97 A E H X S+ 0 0 43 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.846 111.0 52.3 -62.8 -38.9 10.1 20.1 71.5 98 98 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.915 108.3 51.6 -65.5 -42.8 6.7 21.1 69.9 99 99 A K H X S+ 0 0 59 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.873 107.5 51.0 -62.5 -42.3 5.7 23.1 73.1 100 100 A Q H X S+ 0 0 85 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.868 112.2 47.7 -65.4 -34.9 8.9 25.1 73.3 101 101 A F H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.913 112.8 47.5 -70.6 -43.5 8.5 26.1 69.6 102 102 A L H < S+ 0 0 9 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.746 108.9 56.5 -67.5 -25.2 4.8 27.0 70.1 103 103 A K H < S+ 0 0 151 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.888 113.1 39.7 -70.9 -42.1 5.9 29.0 73.2 104 104 A D H < S+ 0 0 88 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.849 131.4 27.5 -74.7 -38.3 8.4 31.0 71.1 105 105 A N >< + 0 0 8 -4,-2.6 3,-1.8 -5,-0.1 51,-0.3 -0.651 65.9 168.7-130.5 74.8 6.0 31.3 68.1 106 106 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.558 73.9 70.0 -62.1 -13.6 2.4 31.1 69.4 107 107 A S T 3 S+ 0 0 20 48,-0.2 2,-0.1 49,-0.1 -95,-0.1 0.725 92.2 78.4 -76.1 -23.0 1.1 32.3 66.0 108 108 A E < - 0 0 0 -3,-1.8 48,-3.1 -97,-0.2 2,-0.3 -0.355 62.9-161.0 -86.5 163.0 2.2 28.9 64.6 109 109 A T - 0 0 0 46,-0.2 2,-0.4 47,-0.2 49,-0.2 -0.977 7.1-147.5-140.6 147.0 0.5 25.5 64.9 110 110 A I E - g 0 158B 0 47,-1.5 49,-2.4 -2,-0.3 2,-0.6 -0.976 7.4-145.3-122.9 136.6 2.0 22.0 64.4 111 111 A I E -dg 65 159B 0 -47,-3.6 -45,-2.4 -2,-0.4 2,-0.5 -0.891 14.1-158.0-101.2 120.5 0.2 19.1 63.1 112 112 A M E -dg 66 160B 0 47,-3.0 49,-2.4 -2,-0.6 2,-0.5 -0.886 4.0-164.4-105.3 124.5 1.1 15.7 64.6 113 113 A S E -dg 67 161B 8 -47,-2.6 -45,-2.0 -2,-0.5 2,-0.5 -0.903 10.3-164.1-104.4 130.4 0.5 12.5 62.7 114 114 A L E +dg 68 162B 0 47,-1.6 49,-2.0 -2,-0.5 2,-0.3 -0.962 14.2 166.1-125.8 124.5 0.7 9.4 64.8 115 115 A K E -dg 69 163B 54 -47,-2.0 -45,-3.5 -2,-0.5 2,-0.8 -0.901 39.4-115.7-130.0 150.6 1.0 5.8 63.5 116 116 A K E +d 70 0B 68 47,-0.6 -45,-0.2 -2,-0.3 -47,-0.1 -0.837 32.7 179.3 -89.2 111.6 1.9 2.5 65.2 117 117 A E + 0 0 42 -47,-2.4 2,-0.3 -2,-0.8 -46,-0.2 0.816 60.0 17.4 -82.9 -36.8 5.2 1.4 63.6 118 118 A Y S S- 0 0 105 -48,-1.0 -46,-0.4 -34,-0.1 -1,-0.1 -0.930 90.6 -79.9-137.1 162.6 5.9 -1.8 65.5 119 119 A E - 0 0 139 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.229 58.7 -87.3 -63.7 146.2 4.1 -4.3 67.7 120 120 A D - 0 0 53 1,-0.1 2,-0.2 -49,-0.1 -47,-0.2 -0.207 48.0-105.1 -51.8 138.7 3.5 -3.6 71.4 121 121 A M > - 0 0 39 -49,-2.7 3,-1.7 1,-0.1 2,-0.5 -0.534 40.4-108.0 -68.9 128.1 6.4 -4.6 73.6 122 122 A K T 3 S+ 0 0 152 1,-0.2 -48,-0.1 -2,-0.2 -1,-0.1 -0.512 108.1 44.7 -60.9 111.6 5.3 -7.8 75.4 123 123 A G T 3 S+ 0 0 61 -2,-0.5 -1,-0.2 1,-0.4 2,-0.2 0.306 76.8 130.8 133.4 -6.6 4.7 -6.6 78.9 124 124 A A < - 0 0 25 -3,-1.7 -1,-0.4 -52,-0.1 -50,-0.1 -0.512 49.2-144.9 -77.1 146.4 2.8 -3.4 78.4 125 125 A E S S+ 0 0 177 -51,-0.3 -1,-0.1 -2,-0.2 2,-0.1 0.972 75.4 29.7 -73.5 -62.5 -0.4 -2.8 80.4 126 126 A D S S- 0 0 60 1,-0.2 2,-0.1 2,-0.1 -50,-0.1 -0.239 88.4 -94.3 -90.9-177.3 -2.7 -1.0 77.9 127 127 A S > - 0 0 52 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.437 43.1 -98.6 -91.0 171.6 -3.0 -0.9 74.2 128 128 A F H > S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.929 118.6 44.1 -58.6 -50.9 -1.3 1.6 71.9 129 129 A S H > S+ 0 0 14 36,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.927 114.9 45.6 -62.9 -50.2 -4.2 4.0 71.5 130 130 A S H > S+ 0 0 17 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.895 112.6 51.9 -63.1 -39.7 -5.4 4.1 75.1 131 131 A T H X S+ 0 0 1 -4,-2.1 4,-2.0 1,-0.2 5,-0.5 0.928 112.2 45.9 -62.6 -43.9 -1.9 4.6 76.3 132 132 A F H X>S+ 0 0 0 -4,-2.1 5,-2.7 -5,-0.2 4,-1.5 0.906 117.3 45.3 -63.9 -41.0 -1.4 7.5 73.9 133 133 A E H <>S+ 0 0 11 -4,-2.6 5,-0.9 3,-0.2 -2,-0.2 0.907 118.1 39.4 -71.9 -40.7 -4.8 8.9 75.0 134 134 A K H <5S+ 0 0 118 -4,-3.4 -3,-0.2 -5,-0.1 -2,-0.2 0.960 126.1 33.3 -72.4 -53.0 -4.5 8.5 78.8 135 135 A K H <5S+ 0 0 111 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.767 136.3 6.2 -76.0 -32.0 -0.8 9.5 79.1 136 136 A Y T ><5S+ 0 0 4 -4,-1.5 3,-2.7 -5,-0.5 -3,-0.2 0.799 116.2 57.9-119.7 -58.9 -0.3 12.1 76.4 137 137 A F T 3 -A 22 0A 84 -128,-0.3 4,-1.5 -127,-0.1 3,-0.3 -0.585 20.0-114.7 -98.6 162.2 -9.3 26.3 61.1 151 151 A L H > S+ 0 0 0 -130,-2.1 4,-1.4 -133,-0.3 3,-0.3 0.928 110.6 59.5 -57.7 -51.1 -6.1 28.1 61.7 152 152 A G H 4 S+ 0 0 23 -133,-2.3 -1,-0.2 1,-0.2 3,-0.2 0.827 108.3 43.7 -48.5 -42.1 -7.5 30.4 64.5 153 153 A D H 4 S+ 0 0 76 -134,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.841 113.6 50.4 -73.7 -37.7 -8.4 27.4 66.7 154 154 A A H >< S+ 0 0 0 -4,-1.5 3,-2.2 -3,-0.3 -44,-0.3 0.605 78.8 123.7 -78.6 -14.8 -5.2 25.5 66.2 155 155 A R T 3< S+ 0 0 45 -4,-1.4 -46,-0.2 1,-0.3 -48,-0.2 -0.219 85.4 4.5 -54.3 129.5 -2.8 28.4 66.9 156 156 A G T 3 S+ 0 0 25 -48,-3.1 -1,-0.3 -51,-0.3 2,-0.3 0.654 119.6 93.4 69.2 16.5 -0.3 27.6 69.7 157 157 A K S < S- 0 0 55 -3,-2.2 -47,-1.5 -49,-0.3 2,-0.5 -0.802 76.8-115.1-131.7 170.5 -1.7 24.1 69.8 158 158 A I E -gh 110 142B 0 -17,-2.2 -15,-2.3 -2,-0.3 2,-0.5 -0.954 25.0-149.4-111.2 126.2 -0.9 20.7 68.3 159 159 A V E -g 111 0B 0 -49,-2.4 -47,-3.0 -2,-0.5 2,-0.2 -0.858 14.3-136.1 -98.5 129.8 -3.4 19.2 65.9 160 160 A L E -g 112 0B 0 -2,-0.5 13,-2.9 -17,-0.4 2,-0.5 -0.579 14.7-167.3 -86.8 142.5 -3.6 15.4 65.7 161 161 A L E -gi 113 173B 7 -49,-2.4 -47,-1.6 -2,-0.2 2,-0.2 -0.894 26.8-142.8-126.0 89.8 -3.9 13.5 62.5 162 162 A K E +g 114 0B 4 11,-1.8 14,-0.4 -2,-0.5 -47,-0.1 -0.431 31.2 169.3 -62.3 123.5 -4.8 10.0 63.8 163 163 A R E +g 115 0B 23 -49,-2.0 -47,-0.6 -2,-0.2 2,-0.3 -0.259 58.1 76.8-126.3 39.7 -3.2 7.2 61.9 164 164 A Y S S- 0 0 2 -49,-0.2 3,-0.3 -35,-0.0 2,-0.3 -0.967 74.4-123.5-145.6 154.0 -4.2 4.5 64.4 165 165 A S S S+ 0 0 93 -2,-0.3 -36,-0.3 1,-0.2 -2,-0.1 -0.741 80.4 52.9-102.8 153.3 -7.4 2.7 65.1 166 166 A G + 0 0 45 -2,-0.3 -1,-0.2 1,-0.2 -36,-0.0 0.545 64.2 163.3 104.6 9.3 -9.2 2.4 68.5 167 167 A S + 0 0 40 -3,-0.3 -1,-0.2 1,-0.1 -37,-0.1 -0.231 16.6 172.8 -59.9 147.8 -9.5 6.1 69.3 168 168 A N + 0 0 120 -39,-0.1 -1,-0.1 1,-0.1 -38,-0.0 0.151 56.5 82.4-138.9 8.4 -12.0 7.1 72.1 169 169 A E S S- 0 0 92 2,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.979 74.8-129.1-124.5 123.9 -11.1 10.8 72.4 170 170 A P + 0 0 71 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.306 55.9 105.4 -65.5 149.0 -12.4 13.5 70.1 171 171 A G - 0 0 0 1,-0.3 -25,-0.2 -11,-0.0 -27,-0.2 -0.277 63.0 -1.7 143.3 132.8 -9.8 15.9 68.6 172 172 A G S S- 0 0 0 -27,-2.3 2,-0.6 -2,-0.1 -25,-0.3 -0.330 105.8 -16.2 72.2-148.9 -8.0 16.6 65.4 173 173 A Y B S-i 161 0B 4 -13,-2.9 -11,-1.8 -27,-0.1 3,-0.1 -0.859 71.7-122.2-100.2 119.1 -8.5 14.6 62.2 174 174 A N - 0 0 54 -2,-0.6 2,-0.1 -13,-0.1 -1,-0.1 -0.029 34.8 -93.3 -52.5 159.3 -10.2 11.2 62.5 175 175 A N - 0 0 69 -11,-0.1 2,-0.3 -14,-0.1 -12,-0.2 -0.454 48.2-172.2 -76.1 148.8 -8.5 8.1 61.3 176 176 A F - 0 0 17 -14,-0.4 12,-0.1 -2,-0.1 13,-0.0 -0.971 36.2 -83.7-144.5 159.2 -9.3 6.9 57.7 177 177 A Y + 0 0 178 -2,-0.3 -1,-0.1 10,-0.2 9,-0.0 0.707 47.1 175.4 -21.7 -74.7 -8.7 4.0 55.3 178 178 A W - 0 0 30 1,-0.1 -1,-0.1 -3,-0.0 2,-0.0 0.977 20.2-148.8 54.9 76.2 -5.2 4.8 53.9 179 179 A P - 0 0 20 0, 0.0 3,-0.4 0, 0.0 2,-0.2 -0.308 26.6 -84.3 -72.5 160.4 -4.3 1.9 51.6 180 180 A D S S- 0 0 119 1,-0.2 3,-0.1 19,-0.1 19,-0.1 -0.444 95.8 -13.3 -71.9 128.7 -0.7 0.7 51.0 181 181 A N S S+ 0 0 40 -2,-0.2 2,-0.3 17,-0.2 18,-0.3 0.952 107.4 103.4 48.1 70.9 1.6 2.3 48.4 182 182 A E E S-J 198 0B 85 16,-1.1 16,-2.1 -3,-0.4 2,-0.5 -0.977 70.7-113.3-166.8 167.8 -1.1 4.2 46.5 183 183 A T E +J 197 0B 49 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.976 51.4 154.0-112.6 128.7 -2.8 7.5 45.7 184 184 A F E -J 196 0B 24 12,-2.2 12,-2.5 -2,-0.5 2,-0.3 -0.905 34.2-134.4-147.2 177.3 -6.4 7.6 47.0 185 185 A T E +J 195 0B 88 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.998 30.7 141.5-144.2 140.0 -9.3 9.7 48.1 186 186 A T E -J 194 0B 42 8,-2.1 8,-3.5 -2,-0.3 2,-0.4 -0.875 47.8 -85.5-155.3-171.7 -11.7 9.4 51.1 187 187 A T E -J 193 0B 87 6,-0.3 6,-0.3 -2,-0.3 -10,-0.2 -0.911 22.0-170.2-112.5 133.2 -13.6 11.3 53.7 188 188 A V S S- 0 0 12 4,-2.3 2,-0.2 -2,-0.4 -1,-0.2 0.927 73.0 -31.6 -81.6 -59.6 -12.0 12.2 57.0 189 189 A N S S- 0 0 29 3,-0.9 3,-0.4 -15,-0.0 -1,-0.2 -0.501 83.5 -70.4-137.3-156.5 -15.2 13.5 58.7 190 190 A Q S S+ 0 0 184 1,-0.2 3,-0.1 -2,-0.2 -42,-0.0 0.610 130.0 44.9 -84.2 -12.8 -18.4 15.2 57.6 191 191 A N S S+ 0 0 84 1,-0.1 2,-0.3 36,-0.0 -1,-0.2 0.360 111.7 50.1-112.2 7.4 -16.6 18.4 56.8 192 192 A A - 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