==== 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 22-APR-10 3MOF . COMPND 2 MOLECULE: PHOSPHOENOLPYRUVATE CARBOXYKINASE, CYTOSOLIC [GTP . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR T.A.JOHNSON,T.HOLYOAK . 1240 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48877.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 809 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 97 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 170 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 1 0.1 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 . 71 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 150 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 254 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.7 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 4 4 2 2 0 3 7 1 1 2 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 4 3 7 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 . 6 10 10 4 6 2 2 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 . 2 0 3 2 0 0 0 1 2 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 G 0 0 13 0, 0.0 2,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 154.8 43.8 11.7 36.7 2 0 A S - 0 0 76 1,-0.1 22,-0.0 22,-0.1 21,-0.0 -0.476 360.0 -93.6 -81.9 150.3 46.2 12.7 34.0 3 1 A M - 0 0 126 -2,-0.1 -1,-0.1 1,-0.1 9,-0.1 -0.383 46.1-119.8 -55.7 127.5 45.5 15.4 31.4 4 2 A P - 0 0 28 0, 0.0 8,-0.1 0, 0.0 7,-0.1 -0.424 30.1-105.1 -69.7 147.1 44.1 13.6 28.3 5 3 A P + 0 0 119 0, 0.0 2,-0.3 0, 0.0 3,-0.0 -0.281 49.5 166.3 -64.1 160.6 46.1 14.1 25.2 6 4 A Q - 0 0 55 -3,-0.1 -3,-0.0 5,-0.1 0, 0.0 -0.915 42.5-144.7-169.0 150.4 44.6 16.4 22.6 7 5 A L S S+ 0 0 167 -2,-0.3 2,-0.1 0, 0.0 -1,-0.1 0.572 95.9 13.4 -95.7 -8.8 45.6 18.3 19.5 8 6 A H S S- 0 0 164 -3,-0.0 -2,-0.1 0, 0.0 0, 0.0 -0.032 98.6 -85.8-131.3-126.9 43.4 21.2 20.5 9 7 A N S S+ 0 0 129 -2,-0.1 -3,-0.0 2,-0.1 0, 0.0 0.086 91.1 98.1-143.7 20.3 41.6 22.2 23.7 10 8 A G S S+ 0 0 53 1,-0.1 -4,-0.1 3,-0.0 3,-0.0 0.553 78.9 49.0 -93.3 -6.2 38.4 20.3 23.5 11 9 A L S S+ 0 0 71 -7,-0.1 2,-0.8 1,-0.1 27,-0.1 0.762 88.6 77.1-106.0 -32.4 39.0 17.2 25.7 12 10 A D - 0 0 31 1,-0.1 3,-0.5 -8,-0.1 -1,-0.1 -0.768 55.9-173.2 -83.9 109.3 40.5 18.5 28.9 13 11 A F > + 0 0 14 -2,-0.8 3,-2.2 1,-0.2 4,-0.4 0.306 50.7 112.8 -84.8 9.5 37.6 19.9 31.0 14 12 A S G > S+ 0 0 44 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.859 70.2 59.4 -49.9 -42.5 39.8 21.3 33.8 15 13 A A G 3 S+ 0 0 104 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.626 105.4 51.9 -66.6 -13.7 39.0 25.0 32.9 16 14 A K G < S+ 0 0 89 -3,-2.2 29,-2.5 28,-0.1 2,-0.7 0.362 79.3 112.4-100.8 4.3 35.3 24.2 33.5 17 15 A V E < +a 45 0A 30 -3,-1.9 29,-0.2 -4,-0.4 3,-0.1 -0.674 36.8 177.3 -87.8 116.6 35.7 22.7 37.0 18 16 A I E S+ 0 0 88 27,-2.5 2,-0.3 -2,-0.7 28,-0.2 0.528 71.8 25.1 -98.3 -9.9 34.1 24.9 39.6 19 17 A Q E S-a 46 0A 54 26,-0.9 28,-2.5 29,-0.0 -1,-0.3 -0.910 113.8 -1.3-150.8 133.5 34.7 22.7 42.6 20 18 A G S S- 0 0 57 -2,-0.3 2,-0.3 26,-0.1 3,-0.1 -0.469 78.9 -82.7 89.3-161.2 37.4 20.0 43.1 21 19 A S >> - 0 0 43 -2,-0.2 3,-0.8 1,-0.1 4,-0.6 -0.963 7.4-153.2-156.0 122.5 40.2 18.9 40.7 22 20 A L G >4 S+ 0 0 3 -2,-0.3 3,-0.7 1,-0.2 8,-0.1 0.822 100.5 63.1 -64.9 -31.2 40.3 16.4 37.8 23 21 A D G 34 S+ 0 0 106 1,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.708 103.5 47.5 -63.7 -25.7 44.0 16.0 38.6 24 22 A S G <4 S+ 0 0 95 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.538 90.0 101.5-100.5 -5.9 43.2 14.6 42.0 25 23 A L S << S- 0 0 6 -3,-0.7 -3,-0.0 -4,-0.6 158,-0.0 -0.454 88.0 -96.0 -69.5 145.1 40.6 12.1 40.9 26 24 A P >> - 0 0 21 0, 0.0 4,-2.4 0, 0.0 3,-0.8 -0.375 45.3-106.9 -57.5 148.4 41.5 8.5 40.6 27 25 A Q H 3> S+ 0 0 68 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.857 117.7 44.4 -50.5 -52.5 42.4 7.8 36.9 28 26 A E H 3> S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.766 111.1 55.9 -70.2 -23.4 39.3 5.9 35.9 29 27 A V H <> S+ 0 0 1 -3,-0.8 4,-2.9 2,-0.2 -2,-0.2 0.949 108.1 47.5 -70.6 -47.2 37.1 8.4 37.7 30 28 A R H X S+ 0 0 1 -4,-2.4 4,-3.4 1,-0.2 5,-0.4 0.937 111.3 51.6 -55.3 -46.0 38.5 11.3 35.7 31 29 A K H X S+ 0 0 113 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.897 111.4 47.4 -60.0 -40.6 38.0 9.2 32.5 32 30 A F H X S+ 0 0 18 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.928 116.9 42.9 -64.2 -48.2 34.4 8.6 33.4 33 31 A V H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.952 118.7 42.5 -63.3 -49.9 33.8 12.3 34.2 34 32 A E H X S+ 0 0 9 -4,-3.4 4,-2.3 2,-0.2 5,-0.2 0.874 111.6 53.3 -70.1 -38.6 35.6 13.7 31.3 35 33 A G H X S+ 0 0 32 -4,-2.2 4,-1.4 -5,-0.4 -1,-0.2 0.918 112.8 44.9 -63.8 -43.1 34.3 11.3 28.7 36 34 A N H X S+ 0 0 25 -4,-1.7 4,-3.2 -5,-0.2 5,-0.2 0.830 109.9 55.2 -73.3 -28.7 30.8 12.0 29.7 37 35 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.902 105.6 52.4 -62.1 -42.7 31.5 15.8 29.8 38 36 A Q H < S+ 0 0 65 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.887 117.3 40.8 -61.0 -36.4 32.8 15.6 26.2 39 37 A L H < S+ 0 0 44 -4,-1.4 95,-3.1 -5,-0.2 -2,-0.2 0.948 122.7 34.8 -75.5 -52.1 29.5 13.9 25.3 40 38 A C H < S- 0 0 0 -4,-3.2 96,-2.4 93,-0.2 97,-0.3 0.614 91.5-143.6 -83.2 -16.8 26.9 15.9 27.4 41 39 A Q < - 0 0 74 -4,-2.3 97,-0.5 -5,-0.2 98,-0.2 0.852 24.0-173.6 54.5 46.4 28.7 19.3 27.0 42 40 A P B -J 137 0B 2 0, 0.0 95,-0.2 0, 0.0 98,-0.2 -0.332 27.3-134.7 -62.1 154.1 28.0 20.7 30.5 43 41 A E S S+ 0 0 88 96,-2.2 2,-0.3 93,-0.6 97,-0.2 0.791 85.9 15.6 -77.8 -32.0 29.1 24.3 31.0 44 42 A Y E - b 0 140A 96 95,-1.5 97,-3.2 -27,-0.0 2,-0.4 -0.953 63.8-143.3-140.6 159.5 30.6 23.5 34.4 45 43 A I E -ab 17 141A 0 -29,-2.5 -27,-2.5 -2,-0.3 -26,-0.9 -0.997 13.6-170.1-129.1 126.1 31.7 20.5 36.4 46 44 A H E -ab 19 142A 26 95,-2.4 97,-2.7 -2,-0.4 2,-0.7 -0.954 11.0-153.1-117.5 111.3 31.2 20.5 40.2 47 45 A I E - b 0 143A 9 -28,-2.5 97,-0.1 -2,-0.5 133,-0.1 -0.756 26.0-126.1 -88.7 118.2 32.9 17.6 42.0 48 46 A C - 0 0 1 95,-2.5 131,-0.1 -2,-0.7 -1,-0.0 -0.321 26.8-176.4 -69.9 136.9 30.8 17.0 45.2 49 47 A D - 0 0 56 130,-0.2 131,-1.6 2,-0.1 132,-0.3 0.517 36.7-128.5-104.0 -12.1 32.6 17.1 48.5 50 48 A G + 0 0 12 129,-0.3 128,-0.1 1,-0.2 -2,-0.1 0.524 55.2 150.5 79.3 2.2 29.6 16.2 50.7 51 49 A S > - 0 0 25 1,-0.1 4,-2.0 4,-0.0 -1,-0.2 -0.250 57.7-122.4 -66.0 155.0 30.1 19.2 53.0 52 50 A E H > S+ 0 0 147 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.871 115.0 54.4 -63.9 -34.9 27.3 20.9 54.9 53 51 A E H > S+ 0 0 125 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.940 107.2 49.1 -66.7 -45.1 28.3 24.2 53.3 54 52 A E H > S+ 0 0 16 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.928 115.9 44.6 -53.9 -46.3 28.1 22.6 49.8 55 53 A Y H X S+ 0 0 16 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.954 113.0 49.5 -64.9 -49.2 24.6 21.3 50.8 56 54 A G H X S+ 0 0 34 -4,-3.5 4,-2.6 1,-0.2 -2,-0.2 0.928 113.8 45.4 -57.5 -49.3 23.4 24.6 52.4 57 55 A R H X S+ 0 0 184 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.882 110.8 51.9 -63.4 -42.0 24.5 26.7 49.4 58 56 A L H X S+ 0 0 18 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.901 111.5 48.3 -63.1 -42.5 23.0 24.3 46.8 59 57 A L H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.938 111.1 50.3 -58.8 -48.9 19.7 24.4 48.7 60 58 A A H X S+ 0 0 41 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.901 109.5 52.6 -57.7 -40.5 19.8 28.2 48.9 61 59 A H H X S+ 0 0 82 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.896 109.0 47.0 -62.7 -44.6 20.5 28.2 45.1 62 60 A M H <>S+ 0 0 3 -4,-2.2 5,-2.2 1,-0.2 6,-1.2 0.854 110.3 57.6 -63.9 -33.0 17.5 26.0 44.3 63 61 A Q H ><5S+ 0 0 83 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.955 107.7 42.4 -62.6 -51.9 15.5 28.3 46.6 64 62 A E H 3<5S+ 0 0 175 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.793 112.1 56.9 -69.5 -24.6 16.2 31.5 44.7 65 63 A E T 3<5S- 0 0 114 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.457 112.3-120.3 -80.7 -2.9 15.7 29.7 41.4 66 64 A G T < 5S+ 0 0 44 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.607 83.0 117.8 70.8 13.5 12.1 28.7 42.5 67 65 A V S - 0 0 0 6,-2.6 3,-1.9 -2,-0.3 6,-0.4 -0.817 19.9-170.2 -95.4 91.1 9.4 24.9 54.9 72 70 A K T 3 S+ 0 0 169 -2,-1.0 296,-0.1 1,-0.3 297,-0.1 0.610 74.8 69.6 -69.8 -10.9 9.9 27.5 57.6 73 71 A K T 3 S+ 0 0 105 295,-1.8 -1,-0.3 -3,-0.1 296,-0.1 0.761 103.4 50.1 -70.8 -22.7 7.8 25.7 60.2 74 72 A Y S < S- 0 0 44 -3,-1.9 2,-0.7 294,-0.5 3,-0.2 -0.413 95.2 -90.3-113.3-178.1 10.6 23.1 60.5 75 73 A D B S-o 355 0D 97 279,-2.0 281,-2.1 1,-0.2 282,-0.4 -0.863 98.0 -30.2 -99.6 110.1 14.4 22.9 60.9 76 74 A N S S+ 0 0 41 -2,-0.7 2,-0.3 279,-0.2 281,-0.2 0.900 95.9 147.3 49.0 48.9 16.2 22.8 57.5 77 75 A C - 0 0 0 -6,-0.4 -6,-2.6 -3,-0.2 2,-0.3 -0.895 25.7-166.6-115.2 154.2 13.3 21.2 55.6 78 76 A W E -Kl 70 358C 11 279,-2.0 281,-3.6 -2,-0.3 2,-0.4 -0.944 13.0-142.9-142.6 153.7 12.4 21.8 52.0 79 77 A L E -Kl 69 359C 5 -10,-3.0 -10,-2.2 -2,-0.3 2,-0.4 -0.972 10.4-173.9-126.6 124.3 9.7 21.2 49.5 80 78 A A E - l 0 360C 0 279,-2.8 281,-2.4 -2,-0.4 2,-0.4 -0.950 8.1-160.5-110.6 136.2 10.0 20.4 45.7 81 79 A L - 0 0 26 -2,-0.4 2,-0.1 -14,-0.4 308,-0.1 -0.972 18.4-150.6-113.2 131.3 6.9 20.2 43.5 82 80 A T - 0 0 1 -2,-0.4 5,-0.1 1,-0.1 129,-0.0 -0.421 28.1 -87.7 -97.1 168.4 7.4 18.3 40.2 83 81 A D > - 0 0 4 3,-0.1 3,-2.4 -2,-0.1 -1,-0.1 -0.609 46.6-123.6 -63.0 130.3 6.0 18.3 36.7 84 82 A P T 3 S+ 0 0 59 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.566 109.0 63.8 -65.0 -5.8 3.0 16.0 37.1 85 83 A R T 3 S+ 0 0 122 1,-0.2 2,-0.5 2,-0.1 3,-0.2 0.580 100.6 55.5 -85.5 -9.7 4.3 13.8 34.3 86 84 A D S < S+ 0 0 4 -3,-2.4 -1,-0.2 1,-0.1 -3,-0.1 -0.699 70.6 114.3-126.1 74.1 7.3 13.0 36.4 87 85 A V S S+ 0 0 22 -2,-0.5 2,-0.3 -3,-0.2 -1,-0.1 0.441 73.2 4.8-126.5 -4.3 5.9 11.6 39.7 88 86 A A S S- 0 0 10 -3,-0.2 382,-0.2 149,-0.1 -1,-0.2 -0.948 88.7 -59.6-163.8 175.1 6.9 7.9 40.1 89 87 A R - 0 0 10 380,-1.7 2,-0.5 -2,-0.3 -2,-0.1 -0.370 40.7-146.6 -60.7 151.4 8.9 5.1 38.6 90 88 A I > - 0 0 33 380,-0.2 3,-1.1 1,-0.1 131,-0.2 -0.912 11.5-172.0-125.6 107.2 7.9 4.0 35.1 91 89 A E G > S+ 0 0 29 -2,-0.5 3,-1.4 1,-0.3 -1,-0.1 0.841 82.4 60.5 -69.3 -33.9 8.4 0.3 34.7 92 90 A S G 3 S+ 0 0 37 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.632 108.8 44.0 -68.7 -15.4 7.8 0.4 30.9 93 91 A K G < S+ 0 0 75 -3,-1.1 128,-3.0 2,-0.0 2,-0.5 0.194 92.2 96.4-112.4 17.4 10.8 2.7 30.4 94 92 A T E < +c 221 0A 11 -3,-1.4 2,-0.3 126,-0.2 128,-0.2 -0.929 56.8 174.1-113.2 120.6 13.1 0.8 32.7 95 93 A V E -c 222 0A 7 126,-2.8 128,-1.3 -2,-0.5 2,-0.4 -0.936 29.1-145.5-134.7 153.7 15.3 -1.6 30.8 96 94 A I E -cd 223 118A 10 21,-2.7 23,-2.1 -2,-0.3 2,-0.5 -0.967 17.7-145.5-120.3 137.2 18.2 -4.0 31.2 97 95 A I E + d 0 119A 1 126,-2.9 129,-0.4 -2,-0.4 2,-0.3 -0.915 32.1 147.2-106.4 120.5 20.8 -4.5 28.4 98 96 A T - 0 0 1 21,-0.6 23,-0.3 -2,-0.5 6,-0.1 -0.955 56.1-111.7-144.0 158.7 22.4 -7.9 27.9 99 97 A Q S S+ 0 0 149 -2,-0.3 2,-0.4 1,-0.1 22,-0.1 0.934 107.1 34.5 -55.7 -48.7 23.6 -9.9 24.9 100 98 A E S >> S- 0 0 115 1,-0.1 3,-1.1 -3,-0.1 4,-0.5 -0.921 75.0-139.2-116.6 136.8 20.8 -12.4 25.2 101 99 A Q H >> S+ 0 0 69 -2,-0.4 4,-2.1 1,-0.3 3,-1.6 0.851 100.7 63.6 -59.1 -38.7 17.3 -11.6 26.3 102 100 A R H 34 S+ 0 0 114 1,-0.3 -1,-0.3 2,-0.2 389,-0.2 0.712 92.9 63.6 -63.6 -23.1 17.0 -14.8 28.4 103 101 A D H <4 S+ 0 0 83 -3,-1.1 388,-1.9 1,-0.1 -1,-0.3 0.811 113.0 35.7 -68.7 -25.9 19.8 -13.5 30.7 104 102 A T H << S+ 0 0 2 -3,-1.6 -2,-0.2 -4,-0.5 -1,-0.1 0.833 132.8 0.6 -95.0 -40.8 17.5 -10.6 31.6 105 103 A V S < S- 0 0 0 -4,-2.1 -1,-0.3 386,-0.2 386,-0.2 -0.985 79.7 -98.7-143.4 149.9 14.0 -12.2 31.7 106 104 A P - 0 0 0 0, 0.0 9,-0.2 0, 0.0 497,-0.1 -0.389 49.3-103.5 -60.4 150.9 12.6 -15.7 31.1 107 105 A I - 0 0 38 495,-0.2 497,-0.3 -5,-0.0 498,-0.1 -0.692 42.8-135.8 -80.6 112.0 11.2 -16.0 27.6 108 106 A P - 0 0 6 0, 0.0 493,-0.2 0, 0.0 492,-0.1 -0.465 6.0-138.8 -75.3 144.0 7.5 -15.8 28.2 109 107 A K S S+ 0 0 79 491,-2.5 492,-0.1 490,-0.2 491,-0.1 0.903 106.2 51.2 -64.3 -40.1 5.2 -18.2 26.4 110 108 A S S S- 0 0 32 2,-0.2 -1,-0.2 490,-0.2 3,-0.1 0.721 112.9-120.9 -73.8 -23.0 2.6 -15.4 25.8 111 109 A G S S+ 0 0 7 489,-0.2 2,-0.5 1,-0.1 -2,-0.1 0.297 86.0 86.9 104.0 -10.4 5.3 -13.2 24.4 112 110 A Q - 0 0 56 941,-0.1 2,-0.3 -5,-0.1 -2,-0.2 -0.976 68.1-145.7-121.5 118.8 5.1 -10.3 26.8 113 111 A S - 0 0 30 -2,-0.5 3,-0.2 3,-0.1 -6,-0.0 -0.638 17.1-172.2 -84.6 141.3 7.1 -10.5 29.9 114 112 A Q S S+ 0 0 92 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.110 77.9 73.3-109.5 16.6 5.9 -9.1 33.2 115 113 A L S S- 0 0 3 1,-0.4 2,-0.2 -9,-0.2 373,-0.2 0.232 111.7 -38.6-119.9 16.9 9.3 -9.8 34.9 116 114 A G - 0 0 35 -3,-0.2 2,-0.4 -11,-0.1 -1,-0.4 -0.834 58.4 -99.8 147.3 175.4 11.5 -7.1 33.4 117 115 A R - 0 0 103 -2,-0.2 -21,-2.7 -23,-0.1 2,-0.4 -0.990 29.3-158.1-135.6 121.5 12.2 -5.3 30.1 118 116 A W E -d 96 0A 74 -2,-0.4 2,-0.4 -23,-0.2 -21,-0.2 -0.795 8.4-175.7 -98.7 141.0 15.0 -6.3 27.9 119 117 A M E -d 97 0A 44 -23,-2.1 -21,-0.6 -2,-0.4 -2,-0.0 -1.000 27.9-117.3-134.7 136.1 16.7 -4.1 25.3 120 118 A S > - 0 0 14 -2,-0.4 4,-2.6 -23,-0.2 5,-0.2 -0.314 25.1-117.3 -65.2 153.7 19.4 -5.1 22.9 121 119 A E H > S+ 0 0 60 -23,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.857 116.2 50.0 -57.3 -38.3 22.8 -3.4 23.1 122 120 A E H > S+ 0 0 131 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.885 110.3 48.9 -73.9 -36.4 22.4 -2.0 19.5 123 121 A D H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.902 111.8 50.6 -64.2 -43.8 18.8 -0.7 20.2 124 122 A F H X S+ 0 0 4 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.890 104.4 56.7 -60.2 -42.5 20.1 1.0 23.4 125 123 A E H X S+ 0 0 91 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.920 109.4 47.0 -57.3 -43.3 23.0 2.6 21.5 126 124 A K H X S+ 0 0 115 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.916 112.5 48.1 -62.1 -45.4 20.5 4.2 19.2 127 125 A A H < S+ 0 0 14 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.914 112.7 50.8 -59.5 -41.0 18.3 5.4 22.1 128 126 A F H >X S+ 0 0 26 -4,-3.0 4,-2.4 1,-0.2 3,-1.5 0.901 108.5 49.9 -65.8 -44.9 21.4 6.7 23.8 129 127 A N H 3< S+ 0 0 98 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.724 106.8 56.6 -66.5 -27.3 22.6 8.7 20.8 130 128 A A T 3< S+ 0 0 70 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.433 121.0 26.2 -81.5 0.8 19.1 10.2 20.4 131 129 A R T <4 S+ 0 0 45 -3,-1.5 -2,-0.2 -4,-0.1 -3,-0.1 0.696 114.6 44.3-125.2 -59.6 19.3 11.6 24.0 132 130 A F S >< S+ 0 0 4 -4,-2.4 3,-2.5 -5,-0.1 4,-0.3 0.753 72.8 104.1 -80.2 -31.6 22.6 12.3 25.6 133 131 A P T 3 S- 0 0 69 0, 0.0 -93,-0.2 0, 0.0 -94,-0.1 -0.357 108.9 -8.2 -56.1 122.6 24.8 14.2 23.1 134 132 A G T > S+ 0 0 25 -95,-3.1 3,-1.6 -96,-0.1 -94,-0.2 0.573 93.6 136.6 71.3 12.2 24.8 17.8 24.2 135 133 A C T < + 0 0 2 -3,-2.5 65,-0.3 1,-0.3 -94,-0.1 0.714 67.7 49.4 -71.3 -20.9 22.1 17.1 26.8 136 134 A M T > S+ 0 0 0 -96,-2.4 3,-2.6 -4,-0.3 -93,-0.6 0.243 75.1 151.6-100.1 14.9 23.8 19.2 29.6 137 135 A K B < S+J 42 0B 103 -3,-1.6 65,-2.9 -97,-0.3 3,-0.1 -0.157 74.5 6.5 -49.0 128.0 24.3 22.3 27.5 138 136 A G T 3 S+ 0 0 30 -97,-0.5 -1,-0.3 1,-0.2 2,-0.3 0.579 113.8 103.0 72.4 8.8 24.3 25.4 29.8 139 137 A R S < S- 0 0 49 -3,-2.6 -96,-2.2 -98,-0.2 -95,-1.5 -0.769 74.5-107.1-116.1 166.0 24.2 23.3 33.0 140 138 A T E -b 44 0A 25 24,-0.3 2,-0.8 -2,-0.3 -95,-0.2 -0.785 23.4-143.8 -86.9 132.5 26.5 22.1 35.8 141 139 A M E -b 45 0A 0 -97,-3.2 -95,-2.4 -2,-0.4 2,-0.3 -0.899 19.2-155.1 -91.3 112.0 27.5 18.5 35.7 142 140 A Y E -bE 46 163A 17 21,-3.1 21,-1.9 -2,-0.8 2,-0.6 -0.701 3.0-149.0 -84.8 139.7 27.7 17.4 39.4 143 141 A V E -bE 47 162A 0 -97,-2.7 -95,-2.5 -2,-0.3 19,-0.2 -0.932 13.4-167.3-113.3 111.1 29.9 14.5 40.2 144 142 A I E - E 0 161A 0 17,-3.1 17,-2.5 -2,-0.6 2,-0.6 -0.846 6.6-163.9-103.8 102.2 28.6 12.5 43.2 145 143 A P E + E 0 160A 0 0, 0.0 34,-2.3 0, 0.0 2,-0.3 -0.792 26.0 174.2 -81.8 125.9 31.0 10.0 44.8 146 144 A F E -FE 178 159A 0 13,-2.9 13,-3.0 -2,-0.6 2,-0.4 -0.983 28.0-146.9-139.8 150.6 28.8 7.8 46.9 147 145 A S E -FE 177 158A 0 30,-2.8 30,-1.9 -2,-0.3 2,-0.7 -0.939 9.8-148.1-117.0 129.5 29.0 4.6 49.0 148 146 A M E S+ E 0 157A 1 9,-3.0 9,-1.7 -2,-0.4 183,-0.2 -0.908 80.4 11.3 -94.8 113.9 26.2 2.1 49.4 149 147 A G S S- 0 0 0 181,-2.1 28,-0.2 -2,-0.7 274,-0.1 -0.183 118.6 -40.7 95.2 161.8 26.6 0.8 53.0 150 148 A P S S- 0 0 15 0, 0.0 6,-0.2 0, 0.0 -2,-0.1 -0.142 70.4 -97.6 -54.7 153.7 28.9 2.3 55.6 151 149 A L S S+ 0 0 79 1,-0.2 -3,-0.1 -4,-0.1 5,-0.1 0.895 120.3 31.2 -43.6 -48.0 32.3 3.4 54.3 152 150 A G S S+ 0 0 67 3,-0.0 -1,-0.2 2,-0.0 4,-0.2 0.971 79.4 131.3 -71.9 -54.5 33.9 0.2 55.5 153 151 A S > - 0 0 4 270,-0.2 3,-1.8 1,-0.2 273,-0.1 0.590 58.1-134.6 -19.1 131.9 31.4 -2.6 55.3 154 152 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.2 0, 0.0 272,-0.1 0.790 112.7 53.7 -51.1 -25.4 32.6 -5.8 53.6 155 153 A L T 3 S+ 0 0 45 270,-0.4 -2,-0.1 161,-0.1 2,-0.1 0.558 87.9 109.8 -91.8 -8.5 29.2 -5.5 52.0 156 154 A A < - 0 0 24 -3,-1.8 2,-0.4 -6,-0.2 -7,-0.2 -0.352 44.4-167.6 -81.3 147.2 29.6 -1.9 50.7 157 155 A K E -E 148 0A 58 -9,-1.7 -9,-3.0 173,-0.1 2,-0.3 -0.987 13.3-135.7-136.2 139.8 30.0 -0.8 47.1 158 156 A I E -E 147 0A 25 32,-0.4 34,-2.0 -2,-0.4 2,-0.3 -0.741 20.3-177.9-100.1 139.6 31.0 2.7 45.6 159 157 A G E -Eg 146 192A 0 -13,-3.0 -13,-2.9 -2,-0.3 2,-0.5 -0.919 20.2-146.1-123.5 160.2 29.4 4.5 42.7 160 158 A I E -Eg 145 193A 0 32,-2.2 34,-2.6 -2,-0.3 2,-0.5 -0.996 19.6-165.6-118.3 122.4 30.0 7.8 40.9 161 159 A E E -Eg 144 194A 0 -17,-2.5 -17,-3.1 -2,-0.5 2,-0.5 -0.946 5.3-160.8-108.2 132.5 26.8 9.5 39.7 162 160 A L E +Eg 143 195A 0 32,-2.8 34,-2.8 -2,-0.5 2,-0.3 -0.896 24.6 162.3-106.6 131.0 27.0 12.3 37.2 163 161 A T E -Eg 142 196A 0 -21,-1.9 -21,-3.1 -2,-0.5 34,-0.2 -0.990 44.5-149.6-144.8 151.7 23.9 14.4 37.1 164 162 A D S S+ 0 0 6 32,-0.6 -24,-0.3 -2,-0.3 33,-0.1 0.236 77.7 94.7 -96.6 12.4 22.7 17.9 35.9 165 163 A S >> - 0 0 12 1,-0.1 4,-1.7 31,-0.1 3,-0.6 -0.901 54.2-167.4-111.8 113.8 20.2 18.1 38.8 166 164 A P H 3> S+ 0 0 25 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.809 94.8 62.4 -62.2 -30.3 21.0 19.8 42.1 167 165 A Y H 3> S+ 0 0 7 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.891 103.3 48.0 -59.2 -38.4 17.8 18.1 43.5 168 166 A V H <> S+ 0 0 0 -3,-0.6 4,-2.7 2,-0.2 5,-0.2 0.891 110.0 53.4 -67.2 -42.4 19.5 14.7 42.8 169 167 A V H X S+ 0 0 3 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.939 111.2 43.5 -57.3 -51.2 22.6 16.0 44.5 170 168 A A H X S+ 0 0 2 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.923 115.5 49.0 -63.4 -47.7 20.8 17.0 47.7 171 169 A S H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-0.5 0.893 109.3 52.1 -61.1 -39.4 18.7 13.8 47.7 172 170 A M H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.835 101.5 61.7 -67.1 -30.9 21.8 11.6 47.2 173 171 A R H < S+ 0 0 72 -4,-1.7 5,-0.3 -5,-0.2 -1,-0.2 0.873 113.3 36.1 -59.9 -34.8 23.4 13.3 50.1 174 172 A I H < S+ 0 0 9 -4,-1.0 238,-0.4 -3,-0.5 -2,-0.2 0.912 121.1 44.6 -81.6 -43.5 20.6 12.0 52.3 175 173 A M H < S+ 0 0 2 -4,-2.8 157,-2.1 -5,-0.1 158,-0.6 0.629 120.7 25.3 -87.5 -12.7 20.1 8.6 50.7 176 174 A T S < S- 0 0 2 -4,-2.2 2,-0.7 156,-0.2 -28,-0.2 -0.848 89.6 -94.4-134.6 170.2 23.7 7.6 50.4 177 175 A R E -F 147 0A 26 -30,-1.9 -30,-2.8 -2,-0.3 2,-0.4 -0.868 59.4-171.0 -85.9 119.4 27.1 8.3 52.1 178 176 A M E +F 146 0A 22 -2,-0.7 2,-0.3 -5,-0.3 -32,-0.2 -0.927 18.4 23.8-127.7 126.9 28.4 11.1 49.8 179 177 A G S >> S- 0 0 1 -34,-2.3 3,-1.0 -2,-0.4 4,-1.0 -0.869 91.4 -14.4 141.9-149.5 31.5 13.1 49.2 180 178 A T H 3> S+ 0 0 60 -131,-1.6 4,-2.0 -2,-0.3 3,-0.4 0.832 120.1 59.6 -62.0 -40.8 35.3 13.4 49.4 181 179 A S H 3> S+ 0 0 58 -132,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.782 100.7 58.3 -59.1 -28.9 35.8 10.5 51.9 182 180 A V H <> S+ 0 0 1 -3,-1.0 4,-1.7 -37,-0.2 -1,-0.2 0.866 105.9 47.5 -68.4 -40.9 34.2 8.2 49.3 183 181 A L H X S+ 0 0 24 -4,-1.0 4,-2.3 -3,-0.4 -2,-0.2 0.902 111.2 51.2 -64.0 -40.6 36.9 9.1 46.7 184 182 A E H < S+ 0 0 151 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.907 113.3 45.8 -64.5 -37.6 39.6 8.6 49.3 185 183 A A H < S+ 0 0 57 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.763 112.0 51.9 -74.6 -28.1 38.0 5.1 50.1 186 184 A L H >< S+ 0 0 16 -4,-1.7 3,-2.0 1,-0.1 -2,-0.2 0.940 72.9 160.0 -76.1 -46.7 37.7 4.2 46.4 187 185 A G T 3< S- 0 0 31 -4,-2.3 -1,-0.1 1,-0.3 -2,-0.1 -0.381 79.6 -23.2 58.1-131.9 41.3 4.9 45.3 188 186 A D T 3 S+ 0 0 144 -162,-0.1 -1,-0.3 -161,-0.1 -2,-0.1 0.066 110.6 125.3 -95.9 25.5 41.9 3.0 42.1 189 187 A G < - 0 0 37 -3,-2.0 2,-0.2 1,-0.1 -161,-0.1 -0.150 68.3 -83.6 -81.7 174.3 39.1 0.5 42.9 190 188 A E + 0 0 132 -162,-0.0 -32,-0.4 -4,-0.0 2,-0.3 -0.481 47.0 179.5 -77.8 148.3 36.1 -0.5 40.9 191 189 A F - 0 0 13 -2,-0.2 2,-0.4 -34,-0.1 -32,-0.3 -0.991 34.2-105.4-145.3 155.0 32.9 1.6 40.9 192 190 A I E -g 159 0A 9 -34,-2.0 -32,-2.2 -2,-0.3 2,-0.6 -0.686 35.3-135.9 -78.4 127.6 29.5 1.6 39.4 193 191 A K E -gh 160 229A 62 35,-2.6 37,-2.6 -2,-0.4 2,-0.5 -0.748 25.6-175.7 -85.5 119.2 29.3 4.2 36.6 194 192 A C E -gh 161 230A 0 -34,-2.6 -32,-2.8 -2,-0.6 2,-0.5 -0.971 5.5-174.1-123.7 127.5 26.0 6.1 36.9 195 193 A L E +gh 162 231A 4 35,-2.8 37,-3.2 -2,-0.5 2,-0.4 -0.964 7.3 174.6-122.4 126.6 24.9 8.8 34.4 196 194 A H E +gh 163 232A 0 -34,-2.8 -32,-0.6 -2,-0.5 2,-0.4 -0.988 7.0 172.0-131.4 139.1 21.8 10.9 34.8 197 195 A S E - h 0 233A 0 35,-2.1 37,-2.4 -2,-0.4 38,-0.3 -0.996 32.9-142.7-141.1 142.9 20.4 13.8 32.9 198 196 A V - 0 0 6 -2,-0.4 38,-0.1 35,-0.2 -1,-0.1 0.648 45.7-127.0 -72.2 -14.7 17.0 15.6 33.2 199 197 A G S S+ 0 0 3 -64,-0.1 15,-0.1 15,-0.1 -63,-0.1 0.761 74.1 114.8 82.0 25.2 17.1 15.9 29.3 200 198 A C - 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