==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 14-JUL-08 3DT2 . COMPND 2 MOLECULE: PHOSPHOENOLPYRUVATE CARBOXYKINASE, CYTOSOLIC [GTP . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR S.M.SULLIVAN,T.HOLYOAK . 621 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24986.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 399 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 85 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 30 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.8 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 4 1 1 1 0 2 3 1 0 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 3 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 PARALLEL BRIDGES PER LADDER . 3 5 5 2 3 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 . 1 0 2 1 0 0 0 1 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 2 A P 0 0 152 0, 0.0 2,-0.6 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 73.5 46.9 13.7 8.1 2 3 A P + 0 0 134 0, 0.0 2,-0.3 0, 0.0 4,-0.0 -0.460 360.0 109.6 -73.5 105.5 49.1 11.1 10.1 3 4 A Q - 0 0 79 -2,-0.6 0, 0.0 2,-0.1 0, 0.0 -0.961 62.2-136.9-171.7 151.3 49.2 7.8 8.1 4 5 A L S S- 0 0 166 -2,-0.3 -1,-0.1 0, 0.0 2,-0.1 0.604 101.7 -2.7 -91.7 -15.6 51.4 5.5 6.1 5 6 A H S S- 0 0 171 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.115 125.4 -46.3-135.6-106.6 48.7 4.8 3.5 6 7 A N > - 0 0 104 1,-0.4 3,-1.9 -2,-0.1 -3,-0.0 0.173 70.0-145.6-120.9 17.0 45.2 6.3 3.8 7 8 A G T 3 - 0 0 49 1,-0.2 -1,-0.4 3,-0.0 -4,-0.1 -0.207 61.4 -41.9 53.3-143.8 44.7 5.3 7.5 8 9 A L T 3 S+ 0 0 90 -3,-0.1 2,-0.6 2,-0.0 -1,-0.2 -0.066 92.8 145.3-102.8 31.2 41.1 4.4 8.2 9 10 A D < + 0 0 57 -3,-1.9 3,-0.3 1,-0.1 -3,-0.0 -0.601 23.7 177.2 -74.0 113.5 39.9 7.3 6.0 10 11 A F > + 0 0 31 -2,-0.6 3,-2.1 1,-0.2 4,-0.3 0.112 41.0 121.9-102.5 17.5 36.6 6.2 4.3 11 12 A S G > + 0 0 44 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 0.804 63.0 65.2 -50.6 -35.8 36.1 9.6 2.6 12 13 A A G 3 S+ 0 0 107 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.716 102.4 48.9 -64.0 -20.3 36.1 8.1 -0.9 13 14 A K G < S+ 0 0 83 -3,-2.1 29,-2.6 28,-0.1 2,-0.5 0.377 80.8 116.5-101.3 3.1 32.9 6.2 -0.2 14 15 A V E < +a 42 0A 32 -3,-1.7 29,-0.2 -4,-0.3 3,-0.1 -0.602 30.4 171.3 -80.8 123.6 30.9 9.1 1.3 15 16 A I E S+ 0 0 94 27,-2.8 2,-0.3 -2,-0.5 28,-0.2 0.385 70.1 29.8-114.4 -1.7 27.8 9.9 -0.8 16 17 A Q E S-a 43 0A 48 26,-0.8 28,-2.2 29,-0.0 -1,-0.3 -0.905 113.0 -8.2-156.2 137.1 26.2 12.4 1.6 17 18 A G S S- 0 0 55 -2,-0.3 2,-0.3 26,-0.1 3,-0.1 -0.375 81.0 -82.3 78.1-159.0 27.7 14.7 4.2 18 19 A S >> - 0 0 44 -2,-0.1 3,-1.2 1,-0.1 4,-0.6 -0.962 8.1-146.0-152.4 125.3 31.4 14.8 5.2 19 20 A L G >4 S+ 0 0 1 -2,-0.3 3,-0.9 1,-0.3 8,-0.1 0.824 105.1 63.2 -57.4 -31.3 33.5 12.7 7.6 20 21 A D G 34 S+ 0 0 122 1,-0.2 -1,-0.3 -3,-0.1 4,-0.1 0.758 96.7 58.1 -63.2 -28.7 35.4 16.0 8.2 21 22 A S G <4 S+ 0 0 95 -3,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.698 89.2 97.1 -73.9 -23.3 32.2 17.5 9.6 22 23 A L S << S- 0 0 14 -3,-0.9 -3,-0.0 -4,-0.6 158,-0.0 -0.356 85.8-100.7 -76.4 145.7 31.8 14.9 12.3 23 24 A P >> - 0 0 18 0, 0.0 4,-2.6 0, 0.0 3,-0.7 -0.352 44.4-107.7 -54.0 142.5 32.9 15.2 16.0 24 25 A Q H 3> S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.847 118.0 45.7 -43.2 -49.4 36.1 13.2 16.4 25 26 A E H 3> S+ 0 0 83 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.807 111.1 52.8 -72.9 -29.4 34.6 10.3 18.3 26 27 A V H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.946 108.6 50.7 -66.6 -47.9 31.7 10.0 15.9 27 28 A R H X S+ 0 0 54 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.917 110.2 50.2 -54.1 -45.7 34.1 9.8 13.0 28 29 A K H X S+ 0 0 128 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.903 110.1 49.6 -60.9 -43.0 36.1 7.1 14.8 29 30 A F H X S+ 0 0 21 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.921 114.5 45.1 -60.3 -46.1 33.0 5.1 15.5 30 31 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.946 116.8 43.6 -61.8 -51.7 31.9 5.4 11.8 31 32 A E H X S+ 0 0 19 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.896 111.4 53.2 -70.5 -37.5 35.3 4.6 10.3 32 33 A G H X S+ 0 0 29 -4,-2.7 4,-1.8 -5,-0.3 -1,-0.2 0.918 114.6 42.8 -60.1 -42.1 36.0 1.7 12.7 33 34 A N H X S+ 0 0 22 -4,-1.8 4,-2.9 -5,-0.3 5,-0.3 0.795 109.8 55.8 -78.6 -27.3 32.7 0.1 11.8 34 35 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.911 107.8 50.8 -62.2 -42.7 33.2 0.8 8.1 35 36 A Q H < S+ 0 0 107 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.927 116.9 40.7 -58.5 -46.3 36.5 -1.1 8.3 36 37 A L H < S+ 0 0 45 -4,-1.8 95,-2.8 -5,-0.2 -2,-0.2 0.940 123.9 33.9 -67.6 -51.1 34.7 -4.0 10.0 37 38 A C H < S- 0 0 0 -4,-2.9 96,-2.2 93,-0.2 97,-0.4 0.636 90.4-143.2 -89.5 -18.5 31.5 -4.2 7.9 38 39 A Q < - 0 0 85 -4,-2.2 97,-0.5 -5,-0.3 98,-0.2 0.882 22.9-171.2 60.5 49.4 32.9 -3.1 4.5 39 40 A P - 0 0 2 0, 0.0 95,-0.2 0, 0.0 98,-0.2 -0.330 26.5-135.7 -65.9 156.6 29.9 -1.0 3.2 40 41 A E S S+ 0 0 85 96,-2.4 2,-0.3 93,-0.7 97,-0.2 0.783 87.1 16.7 -78.1 -31.9 30.1 0.1 -0.5 41 42 A Y E - b 0 137A 92 95,-1.5 97,-3.0 2,-0.0 2,-0.4 -0.961 64.3-143.0-140.2 155.4 28.9 3.6 0.5 42 43 A I E -ab 14 138A 0 -29,-2.6 -27,-2.8 -2,-0.3 -26,-0.8 -0.992 14.3-170.4-119.3 127.4 28.6 5.8 3.6 43 44 A H E -ab 16 139A 23 95,-2.7 97,-3.0 -2,-0.4 2,-0.8 -0.959 9.5-156.4-119.2 109.8 25.6 8.1 3.9 44 45 A I E - b 0 140A 10 -28,-2.2 97,-0.1 -2,-0.5 2,-0.1 -0.791 26.0-131.2 -86.8 112.7 25.8 10.7 6.8 45 46 A C - 0 0 1 95,-2.5 131,-0.1 -2,-0.8 -29,-0.0 -0.392 26.4-176.4 -71.6 137.8 22.1 11.5 7.5 46 47 A D - 0 0 58 130,-0.2 131,-1.6 -2,-0.1 132,-0.4 0.546 35.2-130.7-106.0 -10.7 21.1 15.1 7.7 47 48 A G + 0 0 12 129,-0.3 128,-0.1 1,-0.2 -2,-0.1 0.487 54.8 148.3 77.3 5.3 17.4 14.5 8.6 48 49 A S > - 0 0 31 1,-0.1 4,-2.1 4,-0.0 -1,-0.2 -0.265 60.8-120.1 -74.3 159.2 16.2 17.0 6.0 49 50 A E H > S+ 0 0 151 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.866 115.4 56.3 -62.2 -37.0 13.0 16.7 4.1 50 51 A E H > S+ 0 0 139 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.932 108.0 46.7 -60.0 -48.9 15.0 16.5 0.8 51 52 A E H > S+ 0 0 6 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.921 111.8 51.6 -59.0 -44.9 17.0 13.5 2.1 52 53 A Y H X S+ 0 0 14 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.917 108.7 50.2 -62.4 -44.8 13.8 11.8 3.3 53 54 A G H X S+ 0 0 40 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.908 113.0 46.2 -57.7 -43.1 12.1 12.2 -0.1 54 55 A R H X S+ 0 0 184 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.859 111.5 52.1 -70.8 -35.9 15.1 10.8 -1.9 55 56 A L H X S+ 0 0 10 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.917 111.5 46.1 -64.3 -45.8 15.4 7.9 0.6 56 57 A L H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.920 113.4 50.1 -63.5 -43.4 11.7 7.0 0.1 57 58 A A H X S+ 0 0 26 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.897 109.4 51.2 -58.2 -46.7 12.2 7.3 -3.7 58 59 A H H X S+ 0 0 82 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.942 112.5 45.6 -58.1 -47.4 15.2 5.0 -3.5 59 60 A M H X>S+ 0 0 3 -4,-2.5 5,-2.1 1,-0.2 6,-1.1 0.886 112.5 50.8 -66.5 -37.2 13.3 2.4 -1.6 60 61 A Q H ><5S+ 0 0 83 -4,-2.5 3,-0.8 2,-0.2 -1,-0.2 0.925 111.7 47.4 -62.4 -44.1 10.3 2.6 -3.9 61 62 A E H 3<5S+ 0 0 150 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.810 112.0 50.3 -67.6 -33.8 12.6 2.2 -6.9 62 63 A E H 3<5S- 0 0 128 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.512 113.8-120.3 -79.9 -8.2 14.3 -0.8 -5.3 63 64 A G T <<5S+ 0 0 39 -3,-0.8 -3,-0.2 -4,-0.5 -2,-0.1 0.597 79.7 121.7 78.4 11.4 10.9 -2.3 -4.5 64 65 A V S -J 74 0B 0 6,-2.6 3,-1.6 -2,-0.3 6,-0.5 -0.824 17.8-165.3 -90.9 100.6 -0.0 4.1 -0.7 69 70 A K T 3 S+ 0 0 149 -2,-1.0 -1,-0.1 1,-0.3 296,-0.1 0.675 76.8 69.4 -68.7 -18.7 -1.6 6.3 -3.3 70 71 A K T 3 S+ 0 0 107 295,-1.7 -1,-0.3 -3,-0.1 2,-0.2 0.744 101.6 50.1 -68.9 -22.4 -4.8 6.9 -1.4 71 72 A Y S < S- 0 0 49 -3,-1.6 2,-0.8 294,-0.4 3,-0.4 -0.619 93.7 -90.9-117.7 172.5 -3.0 9.0 1.2 72 73 A D B S-n 352 0C 99 279,-1.2 281,-2.2 1,-0.2 282,-0.3 -0.738 100.3 -29.1 -86.5 106.1 -0.5 11.9 1.5 73 74 A N S S+ 0 0 42 -2,-0.8 2,-0.3 279,-0.2 -1,-0.2 0.877 93.8 149.2 55.5 48.4 3.0 10.6 1.6 74 75 A C E -J 68 0B 0 -6,-0.5 -6,-2.6 -3,-0.4 2,-0.3 -0.883 24.7-165.1-112.4 151.9 2.2 7.2 3.2 75 76 A W E -Jk 67 355B 10 279,-2.1 281,-3.1 -2,-0.3 2,-0.4 -0.906 11.6-143.2-138.7 154.1 4.2 4.0 2.5 76 77 A L E -Jk 66 356B 5 -10,-2.7 -10,-2.4 -2,-0.3 2,-0.4 -0.988 9.6-171.1-126.6 127.8 3.8 0.2 3.0 77 78 A A E - k 0 357B 0 279,-2.6 281,-2.8 -2,-0.4 2,-0.5 -0.966 5.1-164.0-113.2 131.9 6.6 -2.3 3.8 78 79 A L - 0 0 26 -2,-0.4 2,-0.1 -14,-0.4 308,-0.1 -0.979 17.7-153.4-114.2 126.9 5.9 -6.1 3.7 79 80 A T - 0 0 1 -2,-0.5 5,-0.1 1,-0.1 128,-0.1 -0.394 28.2 -86.7 -97.2 169.1 8.4 -8.2 5.5 80 81 A D > - 0 0 2 1,-0.1 3,-2.5 3,-0.1 -1,-0.1 -0.567 46.1-122.0 -60.6 131.8 9.8 -11.8 5.3 81 82 A P T 3 S+ 0 0 65 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.647 111.3 64.2 -61.4 -10.8 7.3 -13.7 7.5 82 83 A R T 3 S+ 0 0 109 1,-0.2 2,-0.4 2,-0.1 3,-0.1 0.479 99.7 54.6 -84.5 -4.3 10.3 -14.8 9.7 83 84 A D S < S+ 0 0 3 -3,-2.5 -1,-0.2 1,-0.1 -3,-0.1 -0.739 70.2 113.9-134.0 79.5 10.9 -11.1 10.7 84 85 A V S S+ 0 0 25 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.468 73.0 4.4-132.9 -9.3 7.7 -9.8 12.1 85 86 A A S S- 0 0 7 -3,-0.1 382,-0.2 149,-0.1 -1,-0.2 -0.932 89.4 -57.9-163.6 177.6 8.1 -9.0 15.9 86 87 A R - 0 0 10 380,-2.1 2,-0.5 -2,-0.3 -2,-0.1 -0.350 39.3-147.4 -63.5 153.5 10.6 -8.9 18.8 87 88 A I > - 0 0 37 380,-0.2 3,-1.3 1,-0.1 131,-0.2 -0.887 13.6-175.9-125.2 98.5 12.4 -12.1 19.6 88 89 A E G > S+ 0 0 30 -2,-0.5 3,-1.8 1,-0.3 26,-0.2 0.866 82.3 60.6 -61.6 -35.5 13.1 -12.2 23.3 89 90 A S G 3 S+ 0 0 48 1,-0.3 -1,-0.3 24,-0.0 -2,-0.0 0.627 108.3 45.4 -70.8 -13.2 15.1 -15.4 23.1 90 91 A K G < S+ 0 0 70 -3,-1.3 128,-2.9 127,-0.0 2,-0.5 0.154 93.0 95.6-113.1 18.0 17.5 -13.7 20.8 91 92 A T E < +c 218 0A 15 -3,-1.8 23,-0.5 126,-0.2 2,-0.3 -0.941 54.5 171.5-113.6 120.9 17.8 -10.5 23.0 92 93 A V E -c 219 0A 6 126,-2.5 128,-1.6 -2,-0.5 2,-0.4 -0.943 29.0-147.3-136.8 153.0 20.7 -10.4 25.4 93 94 A I E -cd 220 115A 9 21,-2.1 23,-1.8 -2,-0.3 2,-0.5 -0.986 18.4-147.0-119.7 134.1 22.6 -8.2 27.8 94 95 A I E + d 0 116A 7 126,-2.8 129,-0.5 -2,-0.4 2,-0.3 -0.887 30.6 147.8-103.7 124.3 26.4 -8.6 28.3 95 96 A T - 0 0 4 21,-0.6 23,-0.3 -2,-0.5 6,-0.1 -0.953 56.7-108.4-145.5 165.0 28.0 -7.9 31.7 96 97 A Q S S+ 0 0 139 -2,-0.3 2,-0.4 1,-0.1 22,-0.1 0.896 107.9 37.4 -60.1 -43.9 30.9 -9.3 33.6 97 98 A E S >> S- 0 0 97 1,-0.1 3,-1.0 20,-0.1 4,-0.6 -0.941 72.7-144.2-116.0 129.5 28.7 -11.1 36.1 98 99 A Q H >> S+ 0 0 73 -2,-0.4 4,-2.0 1,-0.2 3,-1.8 0.905 98.1 62.3 -54.8 -43.5 25.4 -12.7 35.2 99 100 A R H 34 S+ 0 0 118 1,-0.3 -1,-0.2 2,-0.2 389,-0.2 0.737 93.9 62.2 -63.5 -21.2 23.7 -11.7 38.5 100 101 A D H <4 S+ 0 0 101 -3,-1.0 388,-2.2 1,-0.2 -1,-0.3 0.828 113.0 37.1 -69.2 -26.6 24.1 -8.0 37.7 101 102 A T H << S- 0 0 4 -3,-1.8 -2,-0.2 -4,-0.6 388,-0.2 0.832 132.5 -1.2 -91.9 -38.1 21.9 -8.6 34.6 102 103 A V S < S- 0 0 0 -4,-2.0 -1,-0.3 386,-0.2 386,-0.2 -0.991 75.7-102.9-153.8 145.6 19.3 -11.1 35.9 103 104 A P - 0 0 0 0, 0.0 9,-0.2 0, 0.0 497,-0.1 -0.374 43.3-108.5 -66.2 159.6 18.6 -13.0 39.1 104 105 A I - 0 0 71 495,-0.2 497,-0.2 6,-0.1 2,-0.2 -0.817 34.6-130.0 -91.0 116.1 19.7 -16.6 39.1 105 106 A P > - 0 0 15 0, 0.0 3,-0.6 0, 0.0 493,-0.2 -0.465 3.9-138.2 -73.6 139.1 16.5 -18.8 39.0 106 107 A K T 3 S+ 0 0 139 491,-2.3 492,-0.1 1,-0.2 491,-0.1 0.872 103.4 38.7 -57.6 -39.1 16.3 -21.5 41.6 107 108 A S T 3 S- 0 0 87 1,-0.2 -1,-0.2 490,-0.1 491,-0.1 0.545 122.3 -96.4 -89.7 -14.4 14.9 -24.1 39.1 108 109 A G S < S+ 0 0 43 -3,-0.6 -1,-0.2 489,-0.2 -2,-0.1 0.118 87.6 64.6 99.6 140.3 17.0 -23.0 36.1 109 110 A Q - 0 0 134 -4,-0.2 2,-0.1 -3,-0.1 -2,-0.1 0.952 68.5-129.5 82.4 92.7 16.1 -20.7 33.2 110 111 A S - 0 0 20 3,-0.1 3,-0.2 1,-0.1 -6,-0.1 -0.436 15.2-167.2 -75.0 143.3 15.5 -16.9 34.0 111 112 A Q S S+ 0 0 87 -2,-0.1 -1,-0.1 1,-0.1 3,-0.1 0.050 78.9 72.1-111.4 19.9 12.4 -15.1 32.8 112 113 A L S S- 0 0 1 1,-0.5 2,-0.2 -9,-0.2 -1,-0.1 0.146 114.0 -41.2-121.6 17.2 13.7 -11.6 33.6 113 114 A G - 0 0 30 -3,-0.2 -1,-0.5 -11,-0.1 2,-0.5 -0.481 55.8-100.1 136.9 152.7 16.3 -11.4 30.8 114 115 A R - 0 0 105 -23,-0.5 -21,-2.1 -26,-0.2 2,-0.3 -0.896 32.3-159.1-102.4 129.7 18.9 -13.3 28.9 115 116 A W E -d 93 0A 67 -2,-0.5 2,-0.4 -23,-0.2 -21,-0.2 -0.834 5.6-169.4-103.2 145.8 22.6 -12.8 29.9 116 117 A M E -d 94 0A 39 -23,-1.8 -21,-0.6 -2,-0.3 -2,-0.0 -0.998 24.1-119.1-132.3 138.3 25.5 -13.5 27.6 117 118 A S > - 0 0 17 -2,-0.4 4,-2.4 -23,-0.2 5,-0.2 -0.295 25.0-114.1 -70.7 158.3 29.2 -13.5 28.8 118 119 A E H > S+ 0 0 87 -23,-0.3 4,-2.2 1,-0.2 5,-0.2 0.924 117.5 52.1 -56.0 -43.9 31.7 -11.2 27.2 119 120 A E H > S+ 0 0 122 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.894 110.2 46.4 -60.4 -45.4 33.6 -14.2 25.7 120 121 A D H > S+ 0 0 94 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.895 112.0 51.6 -68.0 -39.2 30.4 -15.7 24.1 121 122 A F H X S+ 0 0 5 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.889 104.5 55.5 -64.3 -38.0 29.4 -12.4 22.7 122 123 A E H X S+ 0 0 99 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.933 110.8 46.2 -62.2 -40.7 32.8 -11.8 21.1 123 124 A K H X S+ 0 0 142 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.917 113.6 48.1 -64.5 -44.8 32.5 -15.1 19.3 124 125 A A H < S+ 0 0 13 -4,-2.4 4,-0.3 2,-0.2 -2,-0.2 0.907 112.6 49.7 -59.1 -44.4 28.9 -14.3 18.3 125 126 A F H >X S+ 0 0 24 -4,-3.2 4,-2.4 1,-0.2 3,-1.7 0.929 109.6 50.1 -61.4 -48.2 30.0 -10.9 17.0 126 127 A N H 3< S+ 0 0 96 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.760 107.2 55.9 -65.6 -24.8 32.9 -12.3 15.0 127 128 A A T 3< S+ 0 0 71 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.486 121.2 26.2 -81.5 -4.5 30.5 -14.8 13.4 128 129 A R T <4 S+ 0 0 45 -3,-1.7 -2,-0.2 -4,-0.3 -3,-0.1 0.753 113.7 46.7-123.3 -57.3 28.2 -12.0 12.1 129 130 A F S >< S+ 0 0 3 -4,-2.4 3,-2.6 -5,-0.1 4,-0.3 0.818 72.7 102.1 -78.4 -36.0 29.6 -8.6 11.5 130 131 A P T 3 S- 0 0 69 0, 0.0 -93,-0.2 0, 0.0 -94,-0.1 -0.268 108.6 -8.4 -54.9 122.7 32.9 -8.9 9.6 131 132 A G T > S+ 0 0 24 -95,-2.8 3,-1.7 -96,-0.1 -94,-0.2 0.523 92.9 136.5 73.8 5.5 32.0 -8.0 5.9 132 133 A C T < + 0 0 2 -3,-2.6 65,-0.3 1,-0.3 -94,-0.1 0.704 68.4 46.9 -66.4 -19.7 28.2 -7.9 6.7 133 134 A M T > S+ 0 0 0 -96,-2.2 3,-2.8 -4,-0.3 -93,-0.7 0.280 75.2 146.1-105.0 12.1 27.5 -4.7 4.8 134 135 A K T < S+ 0 0 113 -3,-1.7 65,-2.9 -97,-0.4 3,-0.1 -0.189 75.8 12.2 -51.9 129.1 29.4 -5.6 1.6 135 136 A G T 3 S+ 0 0 28 -97,-0.5 -1,-0.3 1,-0.3 2,-0.2 0.417 115.4 95.4 83.8 -2.5 27.5 -4.1 -1.4 136 137 A R S < S- 0 0 51 -3,-2.8 -96,-2.4 -98,-0.2 -95,-1.5 -0.627 76.8-104.0-117.1 172.2 25.3 -1.9 0.8 137 138 A T E -b 41 0A 20 24,-0.3 2,-0.7 -97,-0.2 -95,-0.2 -0.846 22.3-144.7 -96.8 130.4 25.2 1.6 2.2 138 139 A M E -b 42 0A 0 -97,-3.0 -95,-2.7 -2,-0.5 2,-0.4 -0.876 19.3-155.5 -88.3 116.1 26.1 2.3 5.8 139 140 A Y E -bE 43 160A 9 21,-3.4 21,-1.8 -2,-0.7 2,-0.6 -0.753 4.6-147.2 -91.2 139.8 23.8 5.1 7.0 140 141 A V E -bE 44 159A 0 -97,-3.0 -95,-2.5 -2,-0.4 19,-0.2 -0.937 15.8-168.2-110.2 110.7 25.0 7.2 9.9 141 142 A I E - E 0 158A 0 17,-2.8 17,-2.5 -2,-0.6 2,-0.6 -0.876 7.3-163.5-108.5 103.5 21.9 8.3 11.9 142 143 A P E + E 0 157A 0 0, 0.0 34,-2.3 0, 0.0 2,-0.3 -0.777 26.2 174.6 -84.9 120.4 22.6 11.0 14.6 143 144 A F E -FE 175 156A 0 13,-2.7 13,-2.9 -2,-0.6 2,-0.5 -0.964 28.6-148.2-133.7 151.4 19.6 10.9 16.9 144 145 A S E -FE 174 155A 0 30,-2.5 30,-1.8 -2,-0.3 2,-0.7 -0.964 8.0-152.0-116.7 130.1 18.3 12.4 20.1 145 146 A M E S+ E 0 154A 1 9,-2.9 9,-2.3 -2,-0.5 183,-0.2 -0.916 80.6 19.4 -94.7 113.7 16.1 10.6 22.6 146 147 A G S S- 0 0 0 181,-1.8 28,-0.2 -2,-0.7 3,-0.1 -0.200 118.3 -38.1 100.1 159.2 14.2 13.5 24.2 147 148 A P S > S- 0 0 13 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.221 78.9 -88.0 -59.4 141.9 13.7 17.0 22.8 148 149 A L T 3 S+ 0 0 73 1,-0.3 31,-0.1 -4,-0.1 -2,-0.0 -0.165 108.4 5.3 -54.0 129.4 16.8 18.5 21.0 149 150 A G T 3 S+ 0 0 56 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.429 88.1 143.2 78.8 -3.3 19.2 20.2 23.3 150 151 A S X - 0 0 14 -3,-2.1 3,-0.6 1,-0.1 -1,-0.3 -0.424 58.5-129.3 -61.9 142.0 17.3 19.3 26.5 151 152 A P T 3 S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.623 111.7 50.8 -66.3 -12.2 19.8 18.6 29.4 152 153 A L T 3 S+ 0 0 84 270,-0.1 173,-0.1 -5,-0.1 -7,-0.0 0.556 87.1 104.4-102.2 -10.4 17.8 15.4 29.8 153 154 A A < - 0 0 20 -3,-0.6 2,-0.4 -6,-0.2 -7,-0.2 -0.329 59.8-149.8 -63.8 151.4 18.0 14.3 26.2 154 155 A K E -E 145 0A 67 -9,-2.3 -9,-2.9 173,-0.1 2,-0.3 -0.999 9.3-145.9-127.1 133.0 20.4 11.5 25.4 155 156 A I E +E 144 0A 27 -2,-0.4 34,-2.1 32,-0.4 2,-0.3 -0.708 18.1 177.3-100.4 143.4 22.1 11.3 22.0 156 157 A G E -Eg 143 189A 0 -13,-2.9 -13,-2.7 -2,-0.3 2,-0.4 -0.899 23.9-139.3-131.7 168.8 23.1 8.3 20.0 157 158 A I E -Eg 142 190A 0 32,-2.3 34,-2.6 -2,-0.3 2,-0.5 -0.996 19.4-164.9-123.9 122.5 24.6 7.4 16.6 158 159 A E E -Eg 141 191A 0 -17,-2.5 -17,-2.8 -2,-0.4 2,-0.5 -0.953 3.6-161.9-107.9 123.7 23.0 4.4 14.9 159 160 A L E +Eg 140 192A 0 32,-2.7 34,-2.6 -2,-0.5 2,-0.3 -0.877 24.6 160.9 -95.8 132.5 24.9 2.8 11.9 160 161 A T E -E 139 0A 0 -21,-1.8 -21,-3.4 -2,-0.5 34,-0.2 -0.990 44.7-148.0-148.3 152.7 22.6 0.7 9.8 161 162 A D S S+ 0 0 6 32,-0.4 -24,-0.3 -2,-0.3 33,-0.1 0.212 77.4 94.7 -99.2 13.0 22.5 -0.8 6.3 162 163 A S > - 0 0 11 1,-0.1 4,-1.9 31,-0.1 3,-0.2 -0.907 53.7-167.5-111.8 115.0 18.7 -0.5 6.2 163 164 A P H > S+ 0 0 27 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.828 94.6 62.0 -67.9 -25.1 17.0 2.5 4.6 164 165 A Y H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.909 104.2 48.2 -60.0 -42.1 13.8 1.3 6.2 165 166 A V H > S+ 0 0 0 2,-0.2 4,-2.7 -3,-0.2 5,-0.2 0.916 109.9 52.4 -65.3 -42.3 15.5 1.8 9.6 166 167 A V H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.953 111.5 45.5 -56.6 -49.8 16.7 5.3 8.5 167 168 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.920 115.1 47.1 -62.1 -43.1 13.1 6.3 7.6 168 169 A S H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.866 110.0 53.0 -68.9 -37.4 11.6 4.9 10.7 169 170 A M H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.840 102.4 59.0 -65.6 -33.1 14.3 6.5 12.9 170 171 A R H < S+ 0 0 71 -4,-2.0 5,-0.3 -5,-0.2 -1,-0.2 0.865 114.2 38.2 -62.4 -36.1 13.5 9.9 11.3 171 172 A I H < S+ 0 0 8 -4,-1.2 238,-0.4 -3,-0.2 -2,-0.2 0.900 120.3 43.6 -76.6 -46.2 9.9 9.4 12.6 172 173 A M H < S+ 0 0 3 -4,-2.8 157,-2.0 -5,-0.1 158,-0.6 0.583 121.3 24.8 -85.0 -10.2 10.6 7.8 16.0 173 174 A T S < S- 0 0 3 -4,-1.9 2,-0.7 156,-0.2 -28,-0.2 -0.836 87.6 -96.3-138.2 170.6 13.5 10.0 17.1 174 175 A R E +F 144 0A 22 -30,-1.8 -30,-2.5 -2,-0.3 2,-0.4 -0.888 59.2 177.9 -85.1 118.3 14.9 13.5 16.5 175 176 A M E +F 143 0A 21 -2,-0.7 2,-0.3 -5,-0.3 -32,-0.2 -0.941 16.2 40.6-134.2 150.8 17.5 13.0 13.8 176 177 A G S >> S- 0 0 0 -34,-2.3 4,-1.3 -2,-0.4 3,-1.1 -0.780 94.1 -23.7 129.0-159.9 20.0 14.7 11.6 177 178 A T H 3> S+ 0 0 58 -131,-1.6 4,-2.1 1,-0.3 5,-0.2 0.818 123.3 61.3 -62.3 -35.1 22.5 17.5 11.5 178 179 A S H 3> S+ 0 0 59 -132,-0.4 4,-2.0 1,-0.2 -1,-0.3 0.836 102.5 53.9 -62.5 -30.8 21.0 19.5 14.4 179 180 A V H <> S+ 0 0 0 -3,-1.1 4,-2.4 -37,-0.2 -1,-0.2 0.921 106.8 50.1 -69.0 -42.3 21.7 16.5 16.7 180 181 A L H X S+ 0 0 22 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.875 110.3 51.2 -61.3 -37.2 25.3 16.4 15.7 181 182 A E H < S+ 0 0 146 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.900 111.8 45.9 -69.2 -38.5 25.6 20.1 16.5 182 183 A A H < S+ 0 0 50 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.853 111.5 54.6 -69.7 -33.8 24.0 19.6 19.9 183 184 A L H >< S+ 0 0 15 -4,-2.4 3,-2.2 1,-0.1 -2,-0.2 0.931 73.6 158.6 -64.0 -49.2 26.3 16.6 20.5 184 185 A G T 3< S- 0 0 31 -4,-2.1 -1,-0.1 1,-0.3 -2,-0.1 -0.321 78.4 -23.8 53.7-134.9 29.6 18.4 19.9 185 186 A D T 3 S+ 0 0 141 -162,-0.1 -1,-0.3 -161,-0.1 -2,-0.1 0.210 109.6 121.9 -90.7 20.0 32.4 16.4 21.6 186 187 A G S < S- 0 0 39 -3,-2.2 2,-0.1 1,-0.1 -161,-0.1 -0.113 70.1 -85.2 -75.2 172.5 30.0 14.8 24.1 187 188 A E - 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