==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 08-JAN-13 4IOT . COMPND 2 MOLECULE: TRIOSEPHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.VINAIK,G.KOZLOV,K.GEHRING,MONTREAL-KINGSTON BACTERIAL STRU . 508 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19815.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 365 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 0.2 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 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 180 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 0 4 4 3 1 0 0 0 0 1 2 3 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 8 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 190 0, 0.0 2,-0.5 0, 0.0 252,-0.0 0.000 360.0 360.0 360.0 -30.5 15.5 -5.3 -20.0 2 2 A R - 0 0 39 203,-0.1 202,-0.1 1,-0.0 203,-0.0 -0.783 360.0-139.0 -96.3 125.6 12.4 -3.1 -19.6 3 3 A H - 0 0 103 -2,-0.5 33,-0.1 1,-0.1 247,-0.1 -0.694 32.5-119.2 -80.3 124.1 11.4 -1.9 -16.2 4 4 A P - 0 0 3 0, 0.0 33,-2.4 0, 0.0 2,-0.4 -0.211 22.2-155.5 -69.3 157.2 7.6 -2.2 -16.0 5 5 A L E -ab 37 229A 6 223,-1.9 225,-1.0 31,-0.2 2,-0.5 -0.997 6.1-169.4-130.3 127.4 5.2 0.8 -15.4 6 6 A V E -ab 38 230A 0 31,-2.6 33,-1.6 -2,-0.4 2,-0.4 -0.981 13.8-173.4-115.8 120.9 1.8 0.5 -13.9 7 7 A M E -ab 39 231A 0 223,-2.6 225,-3.2 -2,-0.5 2,-0.6 -0.935 17.6-140.2-120.3 135.1 -0.2 3.8 -14.1 8 8 A G E -ab 40 232A 0 31,-2.5 33,-2.6 -2,-0.4 2,-0.9 -0.849 7.6-164.0 -96.6 117.1 -3.6 4.6 -12.7 9 9 A N E -a 41 0A 2 223,-3.1 227,-0.2 -2,-0.6 228,-0.1 -0.893 5.1-173.9 -96.6 101.9 -6.0 6.5 -14.9 10 10 A W - 0 0 2 31,-1.5 -1,-0.1 -2,-0.9 223,-0.1 0.646 18.1-167.5 -70.4 -15.9 -8.5 7.7 -12.3 11 11 A K - 0 0 40 30,-0.4 2,-1.8 1,-0.2 -1,-0.2 -0.260 63.0 -14.8 54.3-144.2 -10.7 9.2 -15.1 12 12 A L B S+I 327 0B 0 315,-2.0 315,-1.7 30,-0.1 2,-0.4 -0.463 108.6 111.1 -88.5 68.5 -13.5 11.5 -13.8 13 13 A N + 0 0 41 -2,-1.8 2,-0.2 313,-0.2 313,-0.1 -0.976 39.2 97.6-143.2 124.2 -13.2 10.3 -10.2 14 14 A G + 0 0 19 -2,-0.4 2,-0.3 28,-0.1 3,-0.1 -0.837 24.2 173.2 166.6 155.3 -12.0 12.4 -7.3 15 15 A S > - 0 0 32 -2,-0.2 4,-3.1 1,-0.1 5,-0.2 -0.912 50.3-100.2-164.5 163.1 -12.5 14.6 -4.3 16 16 A R H > S+ 0 0 114 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.947 126.4 46.7 -56.2 -47.6 -10.2 16.1 -1.6 17 17 A H H > S+ 0 0 131 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 114.3 47.4 -58.1 -46.6 -11.4 13.3 0.8 18 18 A M H > S+ 0 0 38 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.880 110.3 51.7 -63.1 -42.8 -10.9 10.7 -1.8 19 19 A V H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 5,-0.4 0.936 111.9 46.5 -61.3 -47.8 -7.5 11.9 -2.8 20 20 A H H X S+ 0 0 99 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.944 117.8 42.2 -58.7 -49.1 -6.2 11.8 0.8 21 21 A E H X S+ 0 0 107 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.937 118.1 44.4 -66.1 -48.4 -7.7 8.4 1.4 22 22 A L H X S+ 0 0 9 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.924 116.2 44.5 -66.3 -47.3 -6.6 6.8 -1.9 23 23 A V H X S+ 0 0 0 -4,-2.6 4,-3.1 -5,-0.3 -1,-0.2 0.929 114.0 50.8 -65.6 -41.9 -3.1 8.2 -1.9 24 24 A S H X S+ 0 0 43 -4,-2.1 4,-1.9 -5,-0.4 -2,-0.2 0.928 113.6 45.3 -56.6 -46.5 -2.5 7.4 1.8 25 25 A N H X S+ 0 0 78 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.896 112.4 51.7 -64.7 -41.2 -3.7 3.8 1.1 26 26 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.933 106.8 53.8 -60.1 -47.7 -1.6 3.6 -2.1 27 27 A R H X S+ 0 0 84 -4,-3.1 4,-0.7 1,-0.2 -1,-0.2 0.918 113.4 42.6 -52.2 -46.9 1.5 4.8 -0.1 28 28 A K H >< S+ 0 0 178 -4,-1.9 3,-0.8 1,-0.2 4,-0.3 0.941 115.7 46.9 -68.0 -47.8 1.0 2.0 2.4 29 29 A E H 3< S+ 0 0 72 -4,-2.8 3,-0.2 1,-0.2 -1,-0.2 0.764 120.6 38.8 -66.1 -26.4 0.2 -0.8 -0.1 30 30 A L H >< S+ 0 0 17 -4,-2.3 3,-1.8 -5,-0.2 -1,-0.2 0.385 82.5 103.2-107.0 1.9 3.1 0.2 -2.4 31 31 A A T << S+ 0 0 84 -3,-0.8 -1,-0.1 -4,-0.7 -2,-0.1 0.796 86.0 44.6 -58.0 -32.4 5.8 1.0 0.3 32 32 A G T 3 S+ 0 0 76 -4,-0.3 2,-0.4 -3,-0.2 -1,-0.3 0.276 85.8 116.3 -97.1 11.5 7.6 -2.4 -0.2 33 33 A V < + 0 0 17 -3,-1.8 25,-0.1 1,-0.2 -3,-0.0 -0.677 23.8 155.5 -85.2 129.5 7.5 -2.4 -4.1 34 34 A A + 0 0 85 -2,-0.4 -1,-0.2 3,-0.1 -4,-0.0 0.707 63.3 55.7-116.2 -36.5 10.9 -2.2 -5.8 35 35 A G S S+ 0 0 24 1,-0.1 2,-0.3 212,-0.1 218,-0.1 0.107 98.4 57.9-100.1 22.1 10.5 -3.7 -9.3 36 36 A C S S- 0 0 9 -33,-0.1 -31,-0.2 -30,-0.0 2,-0.2 -0.937 70.7-134.0-152.2 125.6 7.7 -1.7 -10.8 37 37 A A E -a 5 0A 23 -33,-2.4 -31,-2.6 -2,-0.3 2,-0.4 -0.498 24.9-153.5 -72.7 147.8 7.4 2.1 -11.4 38 38 A V E +ac 6 59A 9 20,-0.5 22,-2.9 -33,-0.2 2,-0.3 -0.992 17.0 172.7-131.8 129.9 4.0 3.6 -10.4 39 39 A A E -ac 7 60A 0 -33,-1.6 -31,-2.5 -2,-0.4 2,-0.3 -0.954 11.3-159.7-129.9 153.1 2.2 6.7 -11.7 40 40 A I E -ac 8 61A 0 20,-2.2 22,-1.4 -2,-0.3 -31,-0.2 -0.987 5.8-160.7-130.9 144.5 -1.3 8.1 -11.0 41 41 A A E +a 9 0A 0 -33,-2.6 -31,-1.5 -2,-0.3 -30,-0.4 -0.825 17.7 178.9-124.2 89.0 -3.4 10.6 -13.1 42 42 A P - 0 0 0 0, 0.0 22,-0.3 0, 0.0 5,-0.1 -0.319 49.2 -68.1 -75.9 169.5 -6.1 12.2 -11.0 43 43 A P > - 0 0 1 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.305 59.1-103.8 -52.6 148.5 -8.5 14.8 -12.4 44 44 A E G > S+ 0 0 28 288,-0.3 3,-1.4 1,-0.3 4,-0.4 0.796 118.2 57.7 -51.4 -42.2 -6.5 18.0 -13.2 45 45 A M G 3 S+ 0 0 0 1,-0.2 258,-0.3 2,-0.1 4,-0.3 0.682 108.8 48.5 -65.1 -16.3 -7.7 20.1 -10.2 46 46 A Y G <> S+ 0 0 0 -3,-2.3 4,-2.6 2,-0.1 -1,-0.2 0.380 81.2 93.3-104.3 0.3 -6.3 17.4 -7.8 47 47 A I H <> S+ 0 0 0 -3,-1.4 4,-2.8 -4,-0.4 5,-0.2 0.940 88.0 48.6 -58.9 -48.3 -2.8 16.9 -9.3 48 48 A D H > S+ 0 0 0 -4,-0.4 4,-2.0 252,-0.3 -1,-0.2 0.930 114.0 45.9 -57.8 -48.4 -1.3 19.4 -6.9 49 49 A M H > S+ 0 0 29 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.921 114.4 47.5 -62.1 -45.9 -3.0 17.9 -3.9 50 50 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.873 109.1 54.5 -64.2 -38.8 -2.0 14.3 -4.9 51 51 A K H X S+ 0 0 58 -4,-2.8 4,-0.7 -5,-0.2 -1,-0.2 0.896 110.5 46.2 -61.4 -41.7 1.6 15.4 -5.6 52 52 A R H < S+ 0 0 119 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.876 112.6 49.9 -69.6 -36.8 1.9 16.8 -2.1 53 53 A E H < S+ 0 0 49 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.811 110.4 51.5 -68.9 -31.5 0.3 13.6 -0.6 54 54 A A H >< S+ 0 0 3 -4,-2.1 3,-2.6 -5,-0.1 5,-0.4 0.596 78.8 120.9 -82.6 -13.5 2.7 11.4 -2.6 55 55 A E T 3< S+ 0 0 128 -4,-0.7 3,-0.1 -3,-0.5 -3,-0.0 -0.321 76.0 29.1 -55.9 125.7 5.8 13.3 -1.4 56 56 A G T 3 S+ 0 0 71 1,-0.5 -1,-0.3 -2,-0.1 2,-0.2 0.134 110.7 83.2 105.9 -17.7 8.1 10.7 0.4 57 57 A S S < S- 0 0 34 -3,-2.6 -1,-0.5 2,-0.2 -30,-0.1 -0.481 86.7-116.2-104.2 177.3 6.8 7.8 -1.7 58 58 A H S S+ 0 0 164 -2,-0.2 -20,-0.5 -3,-0.1 2,-0.5 0.260 72.6 125.6 -95.0 11.5 7.8 6.6 -5.2 59 59 A I E -c 38 0A 11 -5,-0.4 2,-0.2 -22,-0.1 -20,-0.2 -0.590 49.6-153.6 -74.4 116.8 4.3 7.3 -6.6 60 60 A M E -c 39 0A 58 -22,-2.9 -20,-2.2 -2,-0.5 2,-0.2 -0.615 9.8-122.3 -92.3 153.1 4.8 9.6 -9.6 61 61 A L E +cd 40 88A 1 26,-0.5 28,-2.4 -2,-0.2 29,-1.8 -0.572 32.3 163.5 -97.9 161.2 2.2 12.0 -10.9 62 62 A G E - d 0 90A 0 -22,-1.4 2,-0.3 26,-0.3 29,-0.2 -0.879 23.1-129.6-156.6-179.5 0.5 12.4 -14.2 63 63 A A E - d 0 91A 2 27,-1.8 29,-2.7 -2,-0.3 3,-0.1 -0.934 17.5-127.1-143.8 167.2 -2.5 13.9 -16.0 64 64 A Q S S- 0 0 9 -22,-0.3 2,-0.3 -2,-0.3 31,-0.3 0.494 83.5 -6.5 -97.1 -7.6 -5.3 12.8 -18.3 65 65 A N - 0 0 12 28,-0.1 2,-0.3 29,-0.1 -1,-0.2 -0.968 52.6-157.4-173.4 165.8 -4.8 15.3 -21.2 66 66 A V - 0 0 0 -2,-0.3 13,-0.2 25,-0.1 2,-0.2 -0.967 14.0-137.6-150.2 155.5 -3.0 18.4 -22.4 67 67 A D - 0 0 28 11,-2.3 13,-0.3 -2,-0.3 48,-0.0 -0.434 29.7-104.0-105.5-172.5 -3.7 21.1 -25.0 68 68 A L S S+ 0 0 59 -2,-0.2 2,-0.3 11,-0.1 11,-0.1 0.688 88.0 79.2 -90.8 -20.8 -1.3 22.7 -27.6 69 69 A N - 0 0 52 9,-0.2 11,-0.4 1,-0.1 -2,-0.2 -0.653 55.9-157.4 -96.1 146.1 -0.5 26.1 -26.1 70 70 A L S S- 0 0 63 1,-0.3 2,-0.3 -2,-0.3 12,-0.2 0.825 77.8 -22.4 -82.9 -37.7 2.0 26.9 -23.3 71 71 A S S S+ 0 0 70 197,-0.1 -1,-0.3 10,-0.1 2,-0.3 -0.953 86.7 82.4-159.3 170.4 0.3 30.2 -22.3 72 72 A G B S-J 267 0C 23 195,-1.9 195,-1.9 -2,-0.3 2,-1.9 -0.782 83.9 -22.2 125.6-165.0 -2.0 32.9 -23.8 73 73 A A S S+ 0 0 43 -2,-0.3 2,-0.2 193,-0.2 193,-0.1 -0.517 82.2 123.9 -88.6 73.1 -5.7 33.8 -24.4 74 74 A F > - 0 0 45 -2,-1.9 3,-2.1 3,-0.1 -1,-0.1 -0.637 50.3-152.7-135.1 68.2 -7.0 30.2 -24.4 75 75 A T T 3 S+ 0 0 1 1,-0.2 -2,-0.1 -2,-0.2 189,-0.0 -0.170 76.9 8.9 -50.0 127.1 -9.8 30.1 -21.8 76 76 A G T 3 S+ 0 0 22 1,-0.2 -1,-0.2 244,-0.1 2,-0.1 0.401 96.6 129.0 86.4 -1.2 -10.3 26.6 -20.3 77 77 A E < - 0 0 13 -3,-2.1 2,-0.5 242,-0.0 222,-0.3 -0.340 55.0-124.5 -85.0 167.2 -7.2 24.9 -21.9 78 78 A T - 0 0 13 220,-0.1 -11,-2.3 -2,-0.1 2,-0.4 -0.960 20.7-146.8-115.6 128.3 -4.4 22.9 -20.2 79 79 A S > - 0 0 0 -2,-0.5 4,-2.3 -13,-0.2 3,-0.2 -0.799 12.8-147.2-100.3 132.2 -0.8 23.9 -20.6 80 80 A A H > S+ 0 0 0 -2,-0.4 4,-2.1 -11,-0.4 5,-0.2 0.869 104.0 56.7 -58.3 -38.2 2.2 21.4 -20.8 81 81 A A H > S+ 0 0 33 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.884 109.2 45.8 -60.0 -39.7 4.3 24.1 -19.0 82 82 A M H > S+ 0 0 6 2,-0.2 4,-2.4 -12,-0.2 -2,-0.2 0.860 107.8 55.4 -73.7 -39.4 1.8 24.2 -16.1 83 83 A L H X>S+ 0 0 0 -4,-2.3 5,-2.3 2,-0.2 4,-0.7 0.914 111.9 45.5 -57.3 -42.7 1.5 20.4 -15.9 84 84 A K H ><5S+ 0 0 103 -4,-2.1 3,-0.9 3,-0.2 -2,-0.2 0.924 111.3 52.6 -63.7 -45.6 5.3 20.3 -15.5 85 85 A D H 3<5S+ 0 0 51 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.873 109.1 49.2 -59.0 -40.0 5.2 23.2 -13.0 86 86 A I H 3<5S- 0 0 0 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.571 124.0-101.3 -82.4 -10.3 2.6 21.4 -10.8 87 87 A G T <<5S+ 0 0 17 -3,-0.9 -26,-0.5 -4,-0.7 2,-0.2 0.488 70.9 141.5 109.0 4.9 4.6 18.1 -10.8 88 88 A A E < +d 61 0A 2 -5,-2.3 -1,-0.3 -6,-0.2 -26,-0.3 -0.580 14.2 166.4 -76.6 140.7 3.0 15.9 -13.4 89 89 A Q E + 0 0 68 -28,-2.4 33,-3.0 -2,-0.2 2,-0.7 0.688 59.4 61.5-118.9 -44.5 5.3 13.8 -15.5 90 90 A Y E -de 62 122A 36 -29,-1.8 -27,-1.8 -50,-0.2 2,-0.7 -0.820 66.9-169.0 -97.8 109.6 3.2 11.1 -17.2 91 91 A I E -de 63 123A 0 31,-2.8 33,-2.8 -2,-0.7 2,-0.3 -0.866 13.7-143.2-111.8 110.6 0.7 12.7 -19.5 92 92 A I E + e 0 124A 0 -29,-2.7 2,-0.4 -2,-0.7 33,-0.2 -0.519 26.7 175.7 -66.9 124.1 -2.0 10.5 -21.1 93 93 A I E + e 0 125A 0 31,-2.6 33,-2.7 -2,-0.3 -28,-0.1 -0.995 55.8 17.5-132.0 144.5 -2.8 11.6 -24.6 94 94 A G S S+ 0 0 1 -2,-0.4 5,-0.1 1,-0.2 -1,-0.1 0.679 71.6 175.8 74.7 19.9 -5.2 10.1 -27.2 95 95 A H >> - 0 0 8 -31,-0.3 4,-2.2 1,-0.1 3,-1.4 -0.266 43.3-114.9 -52.3 142.4 -7.3 8.1 -24.8 96 96 A S H 3> S+ 0 0 8 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.835 116.4 60.3 -52.3 -36.5 -10.1 6.4 -26.6 97 97 A E H 3> S+ 0 0 20 1,-0.2 4,-1.8 2,-0.2 5,-0.3 0.850 110.3 41.2 -61.0 -33.1 -12.6 8.5 -24.6 98 98 A R H <> S+ 0 0 24 -3,-1.4 6,-1.5 3,-0.2 4,-1.1 0.834 111.6 54.0 -85.0 -34.7 -11.1 11.7 -26.0 99 99 A R H < S+ 0 0 38 -4,-2.2 -2,-0.2 4,-0.2 -1,-0.2 0.858 122.8 30.7 -62.3 -35.8 -10.7 10.4 -29.6 100 100 A T H >< S+ 0 0 91 -4,-2.1 3,-0.6 -5,-0.2 -2,-0.2 0.950 126.3 36.2 -87.5 -64.8 -14.4 9.5 -29.6 101 101 A Y H 3< S+ 0 0 133 -4,-1.8 -3,-0.2 -5,-0.3 -2,-0.1 0.744 131.9 29.8 -65.0 -28.0 -16.2 12.0 -27.3 102 102 A H T 3< S- 0 0 63 -4,-1.1 -1,-0.2 -5,-0.3 -3,-0.1 0.233 100.6-126.0-122.1 10.0 -14.0 15.0 -28.3 103 103 A K < + 0 0 182 -3,-0.6 2,-0.4 1,-0.2 -4,-0.2 0.740 38.8 179.4 56.0 31.9 -13.1 14.0 -31.8 104 104 A E - 0 0 16 -6,-1.5 -1,-0.2 1,-0.1 -2,-0.1 -0.530 18.6-139.5 -70.9 123.0 -9.3 14.3 -31.3 105 105 A S > - 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0 0 8 -40,-3.4 2,-2.2 -2,-0.7 3,-0.2 -0.896 14.5-153.1-103.0 107.7 -18.5 40.0 -24.8 423 168 B P >> + 0 0 1 0, 0.0 3,-2.5 0, 0.0 4,-1.0 -0.511 20.9 176.8 -75.2 78.6 -18.4 42.5 -27.7 424 169 B V G >4 S+ 0 0 42 -2,-2.2 3,-0.5 -40,-0.3 -39,-0.2 0.828 75.5 61.0 -52.4 -35.9 -16.2 40.1 -29.8 425 170 B W G 34 S+ 0 0 18 -41,-1.2 6,-0.3 -40,-0.2 -1,-0.3 0.680 111.5 38.8 -63.4 -22.0 -16.5 42.6 -32.7 426 171 B A G X4 S+ 0 0 12 -3,-2.5 2,-1.0 4,-0.1 3,-0.6 0.508 87.7 104.7-108.2 -9.8 -14.8 45.2 -30.6 427 172 B I T << S- 0 0 63 -4,-1.0 5,-0.1 -3,-0.5 39,-0.0 -0.658 108.2 -28.1 -86.7 102.5 -12.1 43.2 -28.7 428 173 B G T 3 S+ 0 0 81 -2,-1.0 -1,-0.3 3,-0.2 -2,-0.1 0.853 111.0 109.9 65.7 40.2 -8.7 43.8 -30.2 429 174 B T S < S- 0 0 66 -3,-0.6 -2,-0.1 2,-0.4 3,-0.1 0.490 93.5-101.5-122.7 -10.9 -10.1 44.6 -33.6 430 175 B G S S+ 0 0 81 1,-0.4 2,-0.3 -4,-0.3 -4,-0.1 0.122 92.7 108.3 99.3 -18.6 -9.6 48.4 -34.1 431 176 B K - 0 0 81 -6,-0.3 -2,-0.4 2,-0.0 -1,-0.4 -0.726 57.1-150.3 -91.5 141.6 -13.3 49.0 -33.2 432 177 B S - 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0 0 63 -4,-2.5 4,-2.3 1,-0.1 -1,-0.2 -0.830 53.5-168.0-152.9 109.1 -39.8 37.0 -15.2 454 199 B A H > S+ 0 0 65 -4,-0.4 4,-2.0 -2,-0.3 -4,-0.1 0.860 91.7 54.2 -65.4 -39.5 -39.2 40.6 -14.1 455 200 B N H > S+ 0 0 110 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.912 110.6 46.0 -60.3 -46.6 -38.1 39.6 -10.6 456 201 B I H >> S+ 0 0 7 1,-0.2 3,-1.1 2,-0.2 4,-0.9 0.941 110.9 53.2 -61.4 -48.5 -35.4 37.2 -11.9 457 202 B A H >< S+ 0 0 2 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.860 103.2 57.9 -54.4 -40.3 -34.2 39.8 -14.5 458 203 B E H 3< S+ 0 0 108 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.751 110.2 43.1 -65.6 -25.7 -33.7 42.5 -11.7 459 204 B Q H << S+ 0 0 48 -3,-1.1 -1,-0.2 -4,-0.8 2,-0.2 0.507 84.0 111.1-101.5 -7.3 -31.3 40.2 -9.8 460 205 B V << - 0 0 0 -4,-0.9 2,-0.7 -3,-0.6 -42,-0.2 -0.491 67.0-131.6 -67.7 134.0 -29.1 38.8 -12.6 461 206 B I E -q 418 0D 27 -44,-1.7 -42,-2.7 -2,-0.2 2,-0.7 -0.804 22.2-165.6 -87.3 114.3 -25.6 40.2 -12.5 462 207 B I E -q 419 0D 0 -2,-0.7 21,-2.9 -44,-0.2 22,-0.4 -0.887 7.2-166.6-107.5 106.2 -24.7 41.4 -16.1 463 208 B Q E -q 420 0D 0 -44,-2.9 -42,-2.7 -2,-0.7 2,-0.5 -0.623 21.0-124.0 -89.4 146.0 -21.0 42.0 -16.5 464 209 B Y E -qr 421 485D 5 20,-2.6 22,-1.9 -2,-0.3 -42,-0.2 -0.794 23.0-174.6 -86.5 128.8 -19.3 43.8 -19.4 465 210 B G + 0 0 13 -44,-3.4 -43,-0.2 -2,-0.5 -1,-0.1 0.272 50.5 96.7-110.4 9.6 -16.7 41.6 -21.0 466 211 B G S S- 0 0 7 -45,-0.4 2,-0.2 1,-0.2 22,-0.2 -0.139 92.6 -48.8 -83.3-173.2 -15.2 44.0 -23.5 467 212 B S + 0 0 76 -44,-0.2 2,-0.4 -41,-0.1 -1,-0.2 -0.404 62.0 175.6 -63.9 123.5 -12.0 46.1 -23.0 468 213 B V + 0 0 16 -2,-0.2 2,-0.2 -3,-0.1 22,-0.2 -0.999 8.4 150.3-130.3 131.1 -12.0 47.9 -19.7 469 214 B N >> - 0 0 79 -2,-0.4 4,-2.7 30,-0.1 3,-0.7 -0.769 64.4 -76.8-137.3-172.3 -9.1 49.9 -18.3 470 215 B A T 34 S+ 0 0 72 1,-0.2 4,-0.5 -2,-0.2 26,-0.0 0.762 131.3 53.1 -62.8 -25.9 -8.8 52.9 -15.9 471 216 B S T 34 S+ 0 0 81 1,-0.1 4,-0.3 2,-0.1 -1,-0.2 0.787 118.9 35.5 -75.3 -28.6 -9.9 55.2 -18.7 472 217 B N T <> S+ 0 0 33 -3,-0.7 4,-2.4 2,-0.1 3,-0.3 0.793 97.9 78.2 -90.9 -39.4 -13.0 53.1 -19.3 473 218 B A H X S+ 0 0 2 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.825 91.9 45.9 -54.6 -51.6 -14.1 51.8 -15.9 474 219 B A H > S+ 0 0 65 -4,-0.5 4,-0.9 1,-0.2 -1,-0.2 0.889 115.6 46.8 -63.4 -42.2 -15.9 54.8 -14.3 475 220 B E H 4 S+ 0 0 101 -3,-0.3 4,-0.4 -4,-0.3 -1,-0.2 0.903 116.2 45.8 -67.0 -40.8 -18.0 55.6 -17.5 476 221 B L H >< S+ 0 0 1 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.934 112.7 48.4 -64.2 -48.0 -18.9 51.9 -17.9 477 222 B F H 3< S+ 0 0 2 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.609 98.7 68.4 -76.5 -10.8 -19.8 51.3 -14.3 478 223 B A T 3< S+ 0 0 68 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.696 78.2 102.2 -74.9 -18.9 -22.0 54.4 -14.1 479 224 B Q S X S- 0 0 49 -3,-1.4 3,-1.4 -4,-0.4 -43,-0.0 -0.472 77.1-132.7 -72.1 133.3 -24.5 52.7 -16.5 480 225 B P T 3 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.732 101.2 43.4 -62.7 -26.1 -27.5 51.3 -14.7 481 226 B D T 3 S+ 0 0 18 -20,-0.0 2,-0.6 2,-0.0 -19,-0.1 0.366 90.1 93.0-103.8 5.5 -27.5 47.9 -16.3 482 227 B I < + 0 0 0 -3,-1.4 -19,-0.2 -6,-0.2 3,-0.1 -0.899 48.4 179.9-101.1 115.2 -23.7 47.2 -16.1 483 228 B D - 0 0 2 -21,-2.9 -223,-2.2 -2,-0.6 2,-0.3 0.130 57.6 -57.6-103.6 16.0 -23.0 45.2 -12.9 484 229 B G E -l 260 0D 1 -22,-0.4 -20,-2.6 -225,-0.2 2,-0.3 -0.953 63.1 -79.6 137.8-159.8 -19.3 44.8 -13.2 485 230 B A E -lr 261 464D 1 -225,-1.0 -223,-2.7 -2,-0.3 2,-0.7 -0.999 9.8-138.4-149.3 141.9 -16.8 43.3 -15.6 486 231 B L E -l 262 0D 9 -22,-1.9 2,-0.4 -2,-0.3 -223,-0.2 -0.940 39.5-155.3 -97.6 113.8 -15.3 40.0 -16.7 487 232 B V E +l 263 0D 5 -225,-3.4 -223,-3.4 -2,-0.7 -20,-0.1 -0.767 19.3 179.7-103.6 133.4 -11.6 41.0 -17.1 488 233 B G S > S+ 0 0 23 -2,-0.4 3,-2.1 -225,-0.2 4,-0.2 0.671 72.3 6.3 -92.5-108.0 -9.1 39.4 -19.3 489 234 B G G > S+ 0 0 58 1,-0.3 3,-1.8 2,-0.2 4,-0.1 0.779 122.8 62.3 -50.4 -39.1 -5.4 40.6 -19.6 490 235 B A G > S+ 0 0 30 1,-0.3 3,-1.4 -22,-0.2 7,-0.6 0.709 88.5 72.4 -64.2 -19.3 -5.7 43.2 -16.8 491 236 B S G < S+ 0 0 1 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.632 86.3 65.8 -71.0 -11.3 -6.5 40.4 -14.3 492 237 B L G < S+ 0 0 36 -3,-1.8 2,-0.5 -4,-0.2 -1,-0.3 0.471 94.5 65.0 -89.2 -3.9 -2.8 39.3 -14.5 493 238 B K S <> S- 0 0 123 -3,-1.4 4,-2.8 1,-0.1 5,-0.3 -0.970 73.1-152.7-122.4 113.3 -1.6 42.6 -12.9 494 239 B A H > S+ 0 0 9 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.885 94.8 47.3 -54.1 -45.2 -2.8 43.2 -9.3 495 240 B D H > S+ 0 0 94 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.937 114.0 45.6 -64.1 -47.3 -2.7 47.0 -9.6 496 241 B A H > S+ 0 0 39 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.905 114.8 48.4 -62.2 -43.8 -4.6 47.2 -12.9 497 242 B F H X S+ 0 0 1 -4,-2.8 4,-2.1 -7,-0.6 3,-0.4 0.932 110.7 50.6 -62.2 -45.9 -7.2 44.7 -11.7 498 243 B A H X S+ 0 0 2 -4,-2.5 4,-2.8 -5,-0.3 -1,-0.2 0.800 103.1 60.2 -64.0 -31.7 -7.7 46.5 -8.4 499 244 B V H X S+ 0 0 70 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.908 107.8 45.7 -60.3 -41.3 -8.2 49.8 -10.3 500 245 B I H X S+ 0 0 2 -4,-1.3 4,-2.3 -3,-0.4 -2,-0.2 0.940 112.3 50.1 -67.7 -48.8 -11.2 48.2 -12.0 501 246 B V H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.926 112.2 47.5 -53.1 -49.8 -12.6 46.7 -8.8 502 247 B K H X S+ 0 0 90 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.848 109.1 53.7 -65.1 -34.6 -12.3 50.1 -7.0 503 248 B A H X S+ 0 0 21 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.901 109.3 49.2 -63.8 -41.3 -14.0 51.9 -9.9 504 249 B A H X S+ 0 0 1 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.923 112.4 47.9 -62.1 -46.1 -16.9 49.5 -9.7 505 250 B E H X S+ 0 0 46 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.932 114.3 46.1 -58.7 -49.2 -17.2 50.0 -5.9 506 251 B A H < S+ 0 0 68 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.861 111.5 51.4 -64.4 -38.8 -17.1 53.8 -6.3 507 252 B A H < S+ 0 0 35 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.880 113.2 43.1 -69.1 -39.8 -19.6 53.9 -9.2 508 253 B K H < 0 0 62 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.566 360.0 360.0 -83.4 -10.6 -22.2 51.9 -7.4 509 254 B Q < 0 0 209 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.328 360.0 360.0 64.2 360.0 -21.5 53.9 -4.2