==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 16-JUL-02 1M6J . COMPND 2 MOLECULE: TRIOSEPHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; . AUTHOR A.RODRIGUEZ-ROMERO,A.HERNANDEZ-SANTOYO,D.A.FERNANDEZ-VELASCO . 520 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19922.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 395 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 79 15.2 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 . 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 . 44 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 179 34.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 4 6 0 2 2 0 0 0 2 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 2 4 5 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 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 2 A G 0 0 36 0, 0.0 210,-0.1 0, 0.0 209,-0.1 0.000 360.0 360.0 360.0 154.4 23.3 -0.6 29.0 2 3 A A + 0 0 88 208,-1.2 209,-0.1 210,-0.1 2,-0.1 0.426 360.0 105.0 -88.7 -0.9 20.7 -3.4 29.3 3 4 A G S S- 0 0 22 207,-0.5 2,-0.2 209,-0.2 209,-0.1 -0.371 85.6 -86.9 -79.2 160.8 18.6 -1.7 26.6 4 5 A K - 0 0 95 207,-0.1 -1,-0.1 1,-0.1 35,-0.1 -0.467 51.8 -98.9 -69.1 133.1 18.4 -3.0 23.1 5 6 A F E -a 39 0A 10 33,-0.5 35,-2.8 -2,-0.2 2,-0.4 -0.256 46.5-166.9 -52.9 130.7 21.1 -1.7 20.7 6 7 A V E -ab 40 236A 0 229,-1.9 231,-1.3 33,-0.2 2,-0.5 -0.980 12.7-170.0-133.2 125.2 19.6 1.2 18.8 7 8 A V E -ab 41 237A 0 33,-2.7 35,-2.4 -2,-0.4 2,-0.4 -0.950 5.6-169.9-117.6 118.8 21.1 2.9 15.7 8 9 A G E -ab 42 238A 1 229,-3.2 231,-3.3 -2,-0.5 2,-0.7 -0.868 12.1-150.7-107.8 140.0 19.6 6.1 14.4 9 10 A G E -ab 43 239A 1 33,-3.0 35,-3.4 -2,-0.4 2,-1.0 -0.908 8.7-160.0-111.7 103.9 20.6 7.6 11.0 10 11 A N E -a 44 0A 1 229,-2.6 233,-0.2 -2,-0.7 234,-0.1 -0.730 8.2-174.7 -86.7 100.7 20.2 11.4 11.2 11 12 A W - 0 0 2 33,-1.9 3,-0.4 -2,-1.0 -1,-0.2 0.561 20.4-173.8 -71.2 -8.3 20.0 12.5 7.5 12 13 A K - 0 0 30 1,-0.2 2,-1.1 32,-0.1 -1,-0.2 -0.116 60.4 -18.7 47.7-139.1 20.0 16.1 8.7 13 14 A C B S+I 339 0B 0 326,-2.1 326,-2.2 -3,-0.1 2,-0.3 -0.517 109.7 107.1 -98.2 67.2 19.5 18.6 5.8 14 15 A N + 0 0 43 -2,-1.1 2,-0.1 -3,-0.4 -3,-0.0 -0.987 40.2 63.7-141.9 150.6 20.3 16.3 2.9 15 16 A G - 0 0 22 -2,-0.3 2,-0.3 30,-0.1 3,-0.0 -0.255 40.2-138.8 121.2 153.4 18.4 14.5 0.2 16 17 A T > - 0 0 59 -2,-0.1 4,-2.8 336,-0.1 5,-0.3 -0.879 43.7-100.0-135.9 165.0 16.2 14.5 -2.9 17 18 A L H > S+ 0 0 59 -2,-0.3 4,-1.9 1,-0.2 5,-0.2 0.927 125.2 47.5 -56.3 -40.0 13.3 12.3 -3.7 18 19 A A H > S+ 0 0 70 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.933 114.4 43.3 -67.5 -46.6 15.6 10.2 -5.9 19 20 A S H > S+ 0 0 54 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.867 114.6 51.3 -69.0 -34.1 18.4 9.9 -3.4 20 21 A I H X S+ 0 0 1 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.851 106.6 52.8 -71.9 -34.4 16.0 9.1 -0.6 21 22 A E H X S+ 0 0 66 -4,-1.9 4,-2.0 -5,-0.3 5,-0.2 0.944 113.7 43.9 -66.0 -44.0 14.2 6.4 -2.5 22 23 A T H X S+ 0 0 107 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.925 117.5 45.6 -65.1 -44.2 17.5 4.7 -3.2 23 24 A L H X S+ 0 0 13 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.938 112.3 49.2 -65.2 -49.0 18.7 5.2 0.4 24 25 A T H X S+ 0 0 3 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.907 112.3 48.2 -59.6 -43.4 15.4 4.1 2.0 25 26 A K H X S+ 0 0 80 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.899 112.9 49.3 -64.8 -38.4 15.2 0.9 -0.0 26 27 A G H X S+ 0 0 23 -4,-1.9 4,-1.3 -5,-0.2 -2,-0.2 0.896 111.2 48.5 -67.2 -40.3 18.9 0.2 0.8 27 28 A V H X S+ 0 0 1 -4,-2.7 4,-0.5 2,-0.2 3,-0.4 0.942 113.4 46.5 -65.5 -47.3 18.4 0.7 4.5 28 29 A A H >< S+ 0 0 1 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.929 110.0 54.3 -60.0 -44.8 15.3 -1.5 4.6 29 30 A A H 3< S+ 0 0 71 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.794 103.9 57.8 -60.3 -27.7 17.1 -4.2 2.5 30 31 A S H 3< S+ 0 0 25 -4,-1.3 2,-0.6 -3,-0.4 -1,-0.3 0.578 98.8 63.3 -81.4 -10.2 19.9 -4.2 5.1 31 32 A V << + 0 0 0 -3,-1.6 34,-0.2 -4,-0.5 -1,-0.2 -0.821 63.7 172.6-122.6 95.5 17.7 -5.1 8.1 32 33 A D > - 0 0 78 -2,-0.6 4,-2.5 -3,-0.1 3,-0.2 -0.255 51.5 -85.3 -87.9-179.4 16.0 -8.4 8.0 33 34 A A H > S+ 0 0 54 1,-0.2 4,-1.1 2,-0.2 -1,-0.0 0.888 125.7 50.9 -53.8 -47.1 14.0 -10.1 10.8 34 35 A E H 4 S+ 0 0 126 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.871 114.0 43.0 -62.6 -39.0 17.0 -11.7 12.5 35 36 A L H >> S+ 0 0 18 1,-0.2 4,-2.3 -3,-0.2 3,-1.5 0.875 107.2 61.2 -75.0 -35.9 19.0 -8.4 12.6 36 37 A A H 3< S+ 0 0 17 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.768 96.9 60.8 -60.4 -26.1 15.9 -6.4 13.7 37 38 A K T 3< S+ 0 0 156 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.758 112.8 37.2 -72.3 -23.9 15.8 -8.6 16.8 38 39 A K T <4 S+ 0 0 102 -3,-1.5 -33,-0.5 -4,-0.4 2,-0.4 0.740 122.6 35.6 -97.7 -29.9 19.3 -7.3 17.7 39 40 A V E < -a 5 0A 1 -4,-2.3 2,-0.5 -35,-0.1 -33,-0.2 -0.981 61.4-145.2-136.5 132.0 19.0 -3.7 16.6 40 41 A E E -a 6 0A 34 -35,-2.8 -33,-2.7 -2,-0.4 2,-0.5 -0.783 26.7-157.0 -89.0 126.6 16.4 -1.1 16.5 41 42 A V E +ac 7 66A 1 24,-0.7 26,-2.7 -2,-0.5 2,-0.4 -0.933 14.3 177.5-114.4 127.7 16.9 1.0 13.5 42 43 A I E -ac 8 67A 2 -35,-2.4 -33,-3.0 -2,-0.5 2,-0.5 -0.963 13.8-155.9-128.4 141.1 15.7 4.6 13.1 43 44 A V E -ac 9 68A 2 24,-2.7 26,-2.8 -2,-0.4 2,-0.7 -0.979 11.5-143.9-121.4 127.3 16.1 7.1 10.3 44 45 A G E -ac 10 69A 1 -35,-3.4 -33,-1.9 -2,-0.5 26,-0.2 -0.812 27.4-170.8 -89.5 118.6 15.8 10.9 10.9 45 46 A V E - c 0 70A 0 24,-2.6 26,-0.6 -2,-0.7 5,-0.1 -0.875 29.0-104.1-118.2 141.4 14.1 12.4 7.8 46 47 A P >> - 0 0 2 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.326 42.8-112.0 -58.1 142.2 13.6 16.1 6.7 47 48 A F G >4 S+ 0 0 7 1,-0.3 3,-1.5 2,-0.2 298,-0.0 0.852 113.4 52.8 -42.1 -53.4 9.9 17.0 7.4 48 49 A I G 34 S+ 0 0 2 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.699 110.2 48.6 -63.0 -20.0 8.9 17.3 3.7 49 50 A Y G <> S+ 0 0 1 -3,-1.8 4,-2.5 1,-0.1 -1,-0.3 0.439 82.9 93.6-100.2 -0.4 10.2 13.8 2.9 50 51 A I H S+ 0 0 32 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.927 111.9 49.4 -59.9 -41.7 5.5 11.0 3.7 52 53 A K H > S+ 0 0 49 -4,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.929 111.2 48.1 -61.6 -47.2 7.7 9.7 0.9 53 54 A V H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.908 111.3 51.5 -60.9 -41.0 9.9 7.6 3.2 54 55 A Q H X S+ 0 0 57 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.914 110.6 48.5 -61.1 -43.6 6.7 6.2 4.9 55 56 A Q H X S+ 0 0 136 -4,-2.4 4,-0.8 -5,-0.2 -2,-0.2 0.914 112.3 48.5 -62.7 -45.0 5.3 5.2 1.5 56 57 A I H >< S+ 0 0 11 -4,-2.6 3,-1.1 1,-0.2 4,-0.5 0.945 111.4 48.7 -62.0 -50.2 8.6 3.6 0.4 57 58 A L H >< S+ 0 0 14 -4,-2.8 3,-1.2 1,-0.3 6,-0.3 0.867 104.6 59.6 -59.5 -37.4 9.0 1.6 3.6 58 59 A A H 3< S+ 0 0 90 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.766 108.2 47.3 -63.0 -23.6 5.4 0.4 3.4 59 60 A G T << S+ 0 0 63 -3,-1.1 2,-0.3 -4,-0.8 -1,-0.3 0.461 96.1 87.4 -97.6 -2.3 6.3 -1.2 0.1 60 61 A E S X S- 0 0 68 -3,-1.2 3,-1.2 -4,-0.5 4,-0.3 -0.764 77.5-128.1-101.1 145.8 9.5 -2.9 1.1 61 62 A A T 3 S+ 0 0 104 -2,-0.3 3,-0.3 1,-0.3 -1,-0.1 0.881 112.7 34.6 -54.7 -43.9 9.7 -6.4 2.6 62 63 A N T > S+ 0 0 41 1,-0.2 3,-2.5 2,-0.1 4,-0.3 0.307 85.3 116.0 -95.1 7.5 11.8 -5.3 5.6 63 64 A G G X + 0 0 5 -3,-1.2 3,-1.6 -6,-0.3 -1,-0.2 0.788 67.6 59.7 -46.0 -40.2 10.1 -1.9 5.8 64 65 A A G 3 S+ 0 0 93 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.653 94.8 66.4 -66.8 -14.8 8.6 -2.5 9.2 65 66 A N G < S+ 0 0 44 -3,-2.5 -24,-0.7 -34,-0.2 2,-0.5 0.537 92.1 71.2 -83.4 -7.6 12.1 -3.0 10.6 66 67 A I E < S-c 41 0A 8 -3,-1.6 2,-0.3 -4,-0.3 -24,-0.2 -0.950 70.4-156.0-115.0 123.9 12.9 0.7 10.0 67 68 A L E -c 42 0A 56 -26,-2.7 -24,-2.7 -2,-0.5 2,-0.4 -0.762 12.6-130.8 -99.9 144.0 11.3 3.4 12.1 68 69 A V E -c 43 0A 9 -2,-0.3 28,-1.6 -26,-0.2 2,-0.4 -0.764 24.4-176.9 -96.1 136.5 10.9 7.0 11.0 69 70 A S E -cd 44 96A 0 -26,-2.8 -24,-2.6 -2,-0.4 28,-0.3 -0.965 22.2-129.9-129.5 146.1 11.9 9.9 13.1 70 71 A A E -cd 45 97A 0 26,-2.2 28,-2.2 -2,-0.4 3,-0.1 -0.536 17.0-133.2 -86.7 161.9 11.6 13.6 12.6 71 72 A E S S- 0 0 3 -26,-0.6 2,-0.3 1,-0.2 30,-0.3 0.527 80.4 -12.4 -94.3 -5.0 14.7 15.8 13.1 72 73 A N - 0 0 3 271,-0.1 2,-0.3 27,-0.1 -1,-0.2 -0.951 59.5-160.2-176.9 171.4 13.0 18.4 15.3 73 74 A A - 0 0 0 -2,-0.3 12,-0.3 -3,-0.1 2,-0.2 -0.935 19.7-121.5-166.9 147.8 9.6 19.6 16.4 74 75 A W B -j 85 0C 16 10,-2.8 12,-1.9 -2,-0.3 3,-0.1 -0.542 32.2-111.8 -89.6 162.3 8.0 22.7 17.8 75 76 A T S S- 0 0 20 10,-0.2 2,-0.3 -2,-0.2 12,-0.2 0.916 80.5 -21.4 -61.7 -50.8 6.1 22.6 21.2 76 77 A K S S- 0 0 96 9,-0.1 -1,-0.1 10,-0.1 198,-0.0 -0.935 72.1 -74.0-154.4 177.7 2.6 23.3 20.0 77 78 A S S S+ 0 0 61 -2,-0.3 2,-0.3 -3,-0.1 198,-0.2 -0.236 73.7 73.4 -72.7 163.8 0.2 24.6 17.4 78 79 A G B S-K 274 0D 19 196,-1.8 2,-2.2 2,-0.1 196,-1.9 -0.918 90.1 -7.6 135.1-160.2 -0.4 28.2 16.8 79 80 A A S S+ 0 0 47 -2,-0.3 2,-0.2 194,-0.2 194,-0.1 -0.455 82.5 120.6 -78.7 70.6 1.3 31.3 15.3 80 81 A Y > - 0 0 51 -2,-2.2 3,-2.3 3,-0.1 -1,-0.1 -0.600 51.6-155.1-134.1 69.6 4.7 29.8 14.6 81 82 A T T 3 S+ 0 0 0 1,-0.3 3,-0.1 -2,-0.2 -2,-0.1 -0.187 77.6 18.9 -50.4 127.5 5.2 30.2 10.9 82 83 A G T 3 S+ 0 0 5 1,-0.3 -1,-0.3 251,-0.1 2,-0.2 0.172 100.0 115.4 97.3 -15.9 7.6 27.6 9.5 83 84 A E < - 0 0 8 -3,-2.3 2,-0.5 249,-0.1 -1,-0.3 -0.526 51.9-152.0 -91.8 154.6 7.3 25.2 12.4 84 85 A V - 0 0 0 -2,-0.2 -10,-2.8 -3,-0.1 2,-0.1 -0.984 22.8-146.7-121.3 116.3 6.0 21.6 12.6 85 86 A H B >> -j 74 0C 22 -2,-0.5 3,-1.6 -12,-0.3 4,-1.1 -0.454 25.3-105.5 -87.9 161.4 4.7 20.8 16.1 86 87 A V H 3> S+ 0 0 8 -12,-1.9 4,-1.9 1,-0.3 3,-0.3 0.813 116.3 61.6 -49.5 -37.0 4.8 17.4 17.9 87 88 A G H 3> S+ 0 0 27 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.816 99.4 54.9 -62.6 -31.6 1.1 16.8 17.3 88 89 A M H <> S+ 0 0 0 -3,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.854 105.6 52.9 -70.7 -33.7 1.6 16.9 13.5 89 90 A L H <>S+ 0 0 0 -4,-1.1 5,-2.8 -3,-0.3 -2,-0.2 0.936 111.7 44.8 -66.0 -45.3 4.2 14.1 13.9 90 91 A V H ><5S+ 0 0 61 -4,-1.9 3,-1.8 1,-0.2 -2,-0.2 0.912 110.7 54.7 -64.2 -41.4 1.8 11.9 15.8 91 92 A D H 3<5S+ 0 0 51 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.853 109.6 47.5 -59.6 -35.6 -1.0 12.7 13.4 92 93 A C T 3<5S- 0 0 11 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.288 118.9-114.0 -89.4 9.8 1.2 11.5 10.6 93 94 A Q T < 5 + 0 0 164 -3,-1.8 -3,-0.2 1,-0.2 -25,-0.2 0.828 59.7 156.8 60.8 36.1 2.1 8.4 12.6 94 95 A V < - 0 0 3 -5,-2.8 -1,-0.2 1,-0.1 -25,-0.1 -0.818 26.5-163.7 -89.7 119.6 5.7 9.3 13.0 95 96 A P + 0 0 39 0, 0.0 33,-2.9 0, 0.0 2,-0.3 0.811 62.2 43.3 -76.9 -28.0 6.9 7.4 16.1 96 97 A Y E -de 69 128A 6 -28,-1.6 -26,-2.2 31,-0.2 2,-0.3 -0.801 51.4-172.9-122.7 161.2 10.1 9.3 16.8 97 98 A V E -de 70 129A 0 31,-1.4 33,-2.4 -28,-0.3 2,-0.5 -0.981 20.1-138.5-149.2 136.9 11.6 12.7 17.0 98 99 A I E - e 0 130A 3 -28,-2.2 2,-0.4 -2,-0.3 33,-0.2 -0.858 30.5-174.9 -95.0 129.0 15.2 13.9 17.5 99 100 A L E + e 0 131A 1 31,-2.8 33,-2.9 -2,-0.5 -27,-0.1 -0.973 53.1 15.0-132.0 144.3 15.4 16.8 19.9 100 101 A G S S+ 0 0 1 -2,-0.4 -1,-0.1 31,-0.2 5,-0.1 0.702 70.6 176.6 73.9 20.1 18.2 19.1 21.2 101 102 A H >> - 0 0 8 -30,-0.3 4,-2.3 1,-0.1 3,-1.2 -0.276 41.6-115.7 -55.7 144.7 20.7 18.1 18.5 102 103 A S H 3> S+ 0 0 12 1,-0.3 4,-2.6 2,-0.2 5,-0.4 0.837 114.7 60.7 -52.5 -37.6 23.8 20.2 18.9 103 104 A E H 3>>S+ 0 0 19 1,-0.2 4,-2.1 2,-0.2 5,-0.5 0.867 110.5 40.8 -60.9 -34.6 23.3 21.9 15.5 104 105 A R H <>5S+ 0 0 2 -3,-1.2 6,-1.3 3,-0.2 4,-0.9 0.851 113.1 52.8 -82.2 -35.2 19.9 23.2 16.8 105 106 A R H <5S+ 0 0 30 -4,-2.3 -2,-0.2 4,-0.2 -3,-0.2 0.893 122.5 31.4 -65.2 -37.7 21.3 24.2 20.2 106 107 A Q H <5S+ 0 0 90 -4,-2.6 3,-0.2 -5,-0.2 -2,-0.2 0.932 128.2 34.0 -86.4 -53.1 24.1 26.1 18.6 107 108 A I H <5S+ 0 0 60 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.1 0.900 132.2 29.7 -72.4 -42.6 22.7 27.5 15.3 108 109 A F S < - 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0 0 3 -40,-3.5 2,-2.4 -2,-0.6 3,-0.2 -0.907 14.6-152.4-107.7 111.0 27.4 14.4 21.2 174 175 A P > + 0 0 0 0, 0.0 3,-3.0 0, 0.0 4,-0.3 -0.531 21.6 177.4 -80.0 77.5 31.0 15.1 21.9 175 176 A V G > S+ 0 0 22 -2,-2.4 3,-1.3 -40,-0.3 -39,-0.2 0.830 74.6 65.7 -50.1 -35.3 30.7 18.5 20.2 176 177 A W G 3 S+ 0 0 4 -41,-1.4 -1,-0.3 1,-0.3 6,-0.3 0.661 111.1 35.5 -61.8 -17.3 34.3 19.2 21.1 177 178 A A G < S+ 0 0 10 -3,-3.0 2,-1.0 4,-0.1 7,-0.3 0.211 85.5 108.5-123.6 13.4 35.3 16.4 18.8 178 179 A I S < S- 0 0 54 -3,-1.3 5,-0.1 -4,-0.3 -1,-0.0 -0.788 109.2 -32.2 -98.5 98.9 32.8 16.6 15.9 179 180 A G S S+ 0 0 78 -2,-1.0 -1,-0.2 3,-0.2 4,-0.1 0.605 110.0 113.5 71.0 13.8 34.8 17.9 12.9 180 181 A T S S- 0 0 75 2,-0.4 3,-0.1 -5,-0.1 -2,-0.1 0.657 92.9-104.2 -89.6 -18.0 37.0 20.0 15.1 181 182 A G S S+ 0 0 77 1,-0.5 2,-0.4 -4,-0.2 -4,-0.1 0.246 91.3 109.3 109.8 -10.7 40.3 18.1 14.5 182 183 A K - 0 0 81 -6,-0.3 2,-0.5 2,-0.0 -1,-0.5 -0.829 61.1-143.1 -99.4 137.8 40.1 16.4 17.8 183 184 A T - 0 0 120 -2,-0.4 2,-0.7 -3,-0.1 -5,-0.1 -0.891 5.5-142.2-106.0 124.7 39.3 12.6 17.9 184 185 A A - 0 0 15 -2,-0.5 34,-0.0 -7,-0.3 -7,-0.0 -0.752 22.3-144.7 -85.1 116.9 37.1 11.2 20.7 185 186 A T > - 0 0 61 -2,-0.7 4,-2.4 1,-0.1 5,-0.2 -0.338 24.2-108.9 -77.6 161.3 38.5 7.8 21.7 186 187 A P H > S+ 0 0 37 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.889 121.7 54.0 -57.3 -36.8 36.3 4.9 22.7 187 188 A D H > S+ 0 0 109 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.909 108.3 47.6 -63.5 -43.2 37.6 5.4 26.3 188 189 A Q H > S+ 0 0 62 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.889 113.9 47.7 -65.8 -38.9 36.7 9.1 26.3 189 190 A A H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 3,-0.2 0.952 111.1 50.3 -66.1 -48.8 33.2 8.3 25.0 190 191 A Q H X S+ 0 0 12 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.865 105.9 58.2 -57.1 -38.2 32.7 5.5 27.5 191 192 A E H X S+ 0 0 129 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.923 110.5 40.7 -59.5 -46.9 33.7 7.8 30.3 192 193 A V H X S+ 0 0 5 -4,-1.5 4,-2.5 -3,-0.2 -2,-0.2 0.912 114.3 52.6 -70.6 -39.9 31.0 10.4 29.5 193 194 A H H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.902 108.4 52.7 -60.6 -39.9 28.4 7.6 28.9 194 195 A Q H X S+ 0 0 100 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.910 109.6 47.8 -61.7 -42.8 29.3 6.2 32.3 195 196 A Y H X S+ 0 0 37 -4,-1.8 4,-3.2 2,-0.2 -2,-0.2 0.889 108.1 54.1 -70.5 -33.9 28.7 9.5 33.9 196 197 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.944 110.7 47.6 -60.5 -42.6 25.4 9.9 32.1 197 198 A R H X S+ 0 0 11 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.908 112.8 48.8 -62.6 -43.2 24.4 6.5 33.5 198 199 A K H X S+ 0 0 107 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.891 109.0 53.0 -64.1 -41.5 25.6 7.6 37.0 199 200 A W H X S+ 0 0 12 -4,-3.2 4,-2.8 1,-0.2 5,-0.3 0.930 110.6 46.3 -61.3 -46.0 23.7 10.9 36.7 200 201 A M H X>S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-1.3 0.885 110.6 54.4 -64.6 -37.4 20.5 9.1 35.9 201 202 A T H <5S+ 0 0 52 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.918 116.9 35.1 -62.7 -44.0 21.1 6.6 38.7 202 203 A E H <5S+ 0 0 132 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.830 125.1 40.1 -81.2 -33.6 21.5 9.3 41.4 203 204 A N H <5S+ 0 0 72 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.652 137.4 4.3 -91.3 -16.1 19.0 11.8 40.0 204 205 A I T <5S- 0 0 35 -4,-2.1 2,-0.3 -5,-0.3 -3,-0.2 0.472 111.5 -67.2-127.0 -81.7 16.2 9.3 39.0 205 206 A S >< - 0 0 13 -5,-1.3 4,-2.3 1,-0.1 5,-0.1 -0.953 30.7-108.1-173.7 159.7 16.8 5.7 39.8 206 207 A K H > S+ 0 0 133 -2,-0.3 4,-2.6 -5,-0.2 5,-0.2 0.881 117.6 56.6 -65.6 -36.2 19.1 2.7 39.0 207 208 A E H > S+ 0 0 111 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.933 110.9 41.4 -59.9 -49.7 16.2 1.1 37.1 208 209 A V H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.908 113.2 54.7 -66.0 -41.6 15.6 4.1 34.8 209 210 A A H < S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.929 112.6 42.2 -58.0 -46.3 19.4 4.6 34.3 210 211 A E H < S+ 0 0 87 -4,-2.6 -208,-1.2 1,-0.2 -207,-0.5 0.826 114.5 50.3 -72.1 -31.6 19.9 1.0 33.2 211 212 A A H < S+ 0 0 66 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.2 0.789 91.6 90.8 -76.9 -27.6 16.8 0.9 31.0 212 213 A T S < S- 0 0 6 -4,-2.1 2,-0.2 -5,-0.2 -209,-0.2 -0.581 74.9-136.5 -76.3 119.8 17.6 4.1 29.2 213 214 A R - 0 0 35 -2,-0.5 -43,-2.8 -45,-0.5 2,-0.6 -0.552 11.9-156.3 -75.3 136.4 19.7 3.6 26.0 214 215 A I E -g 170 0A 0 -2,-0.2 21,-2.4 -45,-0.2 22,-0.5 -0.937 10.3-161.8-117.7 106.2 22.6 6.0 25.6 215 216 A Q E -g 171 0A 0 -45,-3.6 -43,-2.9 -2,-0.6 2,-0.6 -0.580 19.1-125.0 -83.7 147.9 23.7 6.4 22.0 216 217 A Y E -gh 172 237A 8 20,-2.5 22,-2.0 -2,-0.2 -43,-0.2 -0.846 27.9-178.7 -93.6 123.9 27.0 7.8 21.0 217 218 A G + 0 0 8 -45,-3.3 -44,-0.1 -2,-0.6 -1,-0.1 0.013 42.2 104.4-114.9 29.0 26.4 10.6 18.7 218 219 A G S S- 0 0 4 1,-0.2 2,-0.7 -46,-0.2 22,-0.3 0.026 94.1 -43.2 -85.9-156.9 29.9 11.8 17.8 219 220 A S - 0 0 59 -42,-0.2 2,-0.5 -45,-0.2 -1,-0.2 -0.611 67.7-176.0 -77.3 114.2 31.4 11.0 14.4 220 221 A V + 0 0 8 -2,-0.7 22,-0.5 18,-0.1 20,-0.2 -0.949 11.8 152.0-115.6 131.2 30.6 7.4 13.6 221 222 A N >> - 0 0 58 -2,-0.5 4,-1.9 20,-0.1 3,-0.6 -0.895 58.5 -88.5-145.7 174.1 31.9 5.6 10.6 222 223 A P T 34 S+ 0 0 47 0, 0.0 4,-0.4 0, 0.0 -1,-0.0 0.847 121.8 53.5 -56.9 -33.9 32.8 2.1 9.3 223 224 A A T 34 S+ 0 0 98 1,-0.2 4,-0.2 2,-0.1 -3,-0.0 0.791 120.5 27.0 -73.6 -29.5 36.4 2.5 10.5 224 225 A N T <> S+ 0 0 48 -3,-0.6 4,-1.1 2,-0.1 -1,-0.2 0.526 93.7 90.2-113.1 -4.6 35.6 3.4 14.2 225 226 A C H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 3,-0.2 0.874 83.5 54.0 -63.6 -39.9 32.2 1.9 15.0 226 227 A N H > S+ 0 0 54 -4,-0.4 4,-1.3 1,-0.2 -1,-0.2 0.928 106.7 49.9 -62.7 -45.6 33.3 -1.5 16.3 227 228 A E H 4 S+ 0 0 105 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.805 115.1 45.9 -63.6 -27.1 35.7 -0.1 18.9 228 229 A L H >< S+ 0 0 5 -4,-1.1 3,-1.8 -3,-0.2 -2,-0.2 0.902 107.4 56.7 -79.0 -42.1 33.0 2.2 20.2 229 230 A A H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.734 96.1 66.5 -61.1 -23.5 30.3 -0.6 20.2 230 231 A K T 3< S+ 0 0 107 -4,-1.3 -1,-0.3 -5,-0.2 2,-0.2 0.707 78.6 106.2 -71.3 -20.0 32.5 -2.6 22.5 231 232 A K S X S- 0 0 51 -3,-1.8 3,-1.5 -4,-0.2 -3,-0.0 -0.408 74.1-131.0 -69.2 134.3 32.0 -0.1 25.3 232 233 A A T 3 S+ 0 0 67 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.805 103.1 37.8 -51.4 -41.1 29.7 -1.0 28.2 233 234 A D T 3 S+ 0 0 26 -20,-0.0 2,-0.9 1,-0.0 -1,-0.3 0.267 87.8 98.9-102.1 13.5 27.7 2.1 28.2 234 235 A I < + 0 0 0 -3,-1.5 -19,-0.2 -6,-0.2 3,-0.1 -0.861 44.8 173.8-100.0 100.8 27.4 2.8 24.4 235 236 A D - 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0 0 94 207,-0.1 -1,-0.1 1,-0.1 35,-0.1 -0.465 53.7 -99.5 -67.0 133.2 -2.8 40.6 -10.4 266 6 B F - 0 0 10 33,-0.5 35,-2.8 -2,-0.2 2,-0.4 -0.277 45.5-164.3 -54.7 133.0 -4.5 40.5 -7.0 267 7 B V E -lm 301 497E 0 229,-2.0 231,-1.3 33,-0.2 2,-0.5 -0.976 12.8-170.4-133.4 125.2 -2.9 37.8 -4.9 268 8 B V E -lm 302 498E 0 33,-3.0 35,-2.3 -2,-0.4 2,-0.4 -0.948 5.6-171.3-117.1 119.5 -4.3 36.2 -1.7 269 9 B G E -lm 303 499E 1 229,-3.3 231,-3.2 -2,-0.5 2,-0.7 -0.871 13.0-150.0-109.1 141.6 -2.1 33.8 0.3 270 10 B G E -lm 304 500E 1 33,-2.9 35,-3.4 -2,-0.4 2,-1.0 -0.908 8.4-161.1-112.8 102.9 -3.4 31.8 3.2 271 11 B N E -l 305 0E 3 229,-2.6 233,-0.2 -2,-0.7 35,-0.1 -0.742 7.6-174.9 -86.0 102.3 -0.7 31.3 5.8 272 12 B W - 0 0 2 33,-1.8 3,-0.3 -2,-1.0 -1,-0.2 0.606 21.4-168.3 -71.5 -11.5 -1.9 28.3 7.9 273 13 B K - 0 0 40 1,-0.2 2,-1.3 32,-0.1 -1,-0.2 -0.216 60.7 -20.0 54.3-144.2 1.1 28.8 10.2 274 14 B C B S+K 78 0D 0 -196,-1.9 -196,-1.8 -3,-0.1 2,-0.3 -0.446 111.0 109.7 -93.7 64.1 1.7 25.9 12.6 275 15 B N + 0 0 37 -2,-1.3 2,-0.1 -3,-0.3 -3,-0.1 -0.987 37.8 66.8-139.6 147.0 -1.9 24.5 12.3 276 16 B G - 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0 0 15 -5,-1.0 4,-2.3 1,-0.1 5,-0.1 -0.966 29.9-110.8-167.9 158.3 12.5 51.3 -11.1 467 207 B K H > S+ 0 0 139 -2,-0.3 4,-2.5 -5,-0.2 5,-0.2 0.905 118.0 55.3 -62.6 -39.5 8.9 52.5 -11.5 468 208 B E H > S+ 0 0 139 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.927 109.8 43.4 -58.6 -50.0 8.2 49.5 -13.6 469 209 B V H > S+ 0 0 20 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 112.4 54.8 -64.1 -40.5 9.4 47.0 -11.0 470 210 B A H < S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.928 112.6 41.4 -58.6 -47.7 7.6 48.9 -8.3 471 211 B E H < S+ 0 0 70 -4,-2.5 -208,-1.9 1,-0.2 -207,-0.9 0.815 114.6 51.5 -71.3 -31.5 4.2 48.8 -10.1 472 212 B A H < S+ 0 0 63 -4,-2.1 2,-0.5 -5,-0.2 -1,-0.2 0.779 91.7 89.2 -75.7 -27.3 4.6 45.1 -11.2 473 213 B T S < S- 0 0 5 -4,-2.0 2,-0.3 -5,-0.2 -209,-0.2 -0.596 76.4-135.3 -77.7 120.7 5.4 44.0 -7.6 474 214 B R - 0 0 35 -2,-0.5 -43,-2.7 -45,-0.4 2,-0.6 -0.575 12.3-156.8 -75.1 135.1 2.4 43.0 -5.6 475 215 B I E -r 431 0E 0 -2,-0.3 21,-2.5 -45,-0.2 22,-0.5 -0.928 11.7-160.2-115.1 104.0 2.3 44.3 -2.1 476 216 B Q E -r 432 0E 0 -45,-3.6 -43,-2.8 -2,-0.6 2,-0.6 -0.554 18.5-124.0 -81.1 146.5 0.1 42.1 0.1 477 217 B Y E -rs 433 498E 6 20,-2.5 22,-2.0 -2,-0.2 -43,-0.2 -0.830 26.5-175.9 -91.7 124.6 -1.3 43.4 3.3 478 218 B G + 0 0 12 -45,-3.4 -44,-0.1 -2,-0.6 -1,-0.1 0.111 46.0 100.5-108.9 20.9 -0.2 41.0 6.0 479 219 B G S S- 0 0 10 -46,-0.2 2,-0.4 1,-0.2 22,-0.3 -0.052 93.3 -40.7 -86.3-162.7 -2.0 42.4 9.0 480 220 B S + 0 0 79 -45,-0.1 2,-0.4 -42,-0.1 -1,-0.2 -0.469 67.0 179.4 -66.8 117.2 -5.2 41.1 10.5 481 221 B V + 0 0 8 -2,-0.4 22,-0.5 -3,-0.1 20,-0.3 -0.984 8.3 155.4-125.6 128.4 -7.5 40.3 7.6 482 222 B N >> - 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0 0 4 -21,-2.5 -229,-2.0 -2,-0.8 2,-0.3 0.164 60.0 -37.3-100.0 16.8 -2.5 44.3 -4.0 497 237 B G E -m 267 0E 0 -22,-0.5 -20,-2.5 -231,-0.2 2,-0.3 -0.969 65.1 -91.9 156.5-168.0 -3.6 41.3 -2.0 498 238 B F E -ms 268 477E 0 -231,-1.3 -229,-3.3 -2,-0.3 2,-0.7 -0.989 2.1-149.6-143.7 148.5 -3.5 39.7 1.4 499 239 B L E -m 269 0E 9 -22,-2.0 2,-0.3 -2,-0.3 -229,-0.2 -0.934 37.7-155.8-115.7 97.8 -1.4 37.3 3.4 500 240 B V E -m 270 0E 0 -231,-3.2 -229,-2.6 -2,-0.7 -20,-0.1 -0.572 17.1-175.9 -82.9 138.8 -4.1 35.9 5.6 501 241 B G > + 0 0 19 -2,-0.3 3,-2.2 -22,-0.3 4,-0.3 0.578 70.0 2.5 -95.8-113.0 -3.6 34.4 9.0 502 242 B G G > S+ 0 0 60 1,-0.3 3,-2.0 2,-0.2 4,-0.1 0.804 124.4 60.5 -45.9 -44.7 -6.3 32.8 11.1 503 243 B A G > S+ 0 0 11 -22,-0.5 3,-1.3 1,-0.3 7,-0.6 0.705 91.0 71.4 -61.8 -18.6 -9.1 33.3 8.6 504 244 B S G < S+ 0 0 0 -3,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.634 84.3 68.7 -73.7 -10.6 -7.3 31.1 6.1 505 245 B L G < S+ 0 0 70 -3,-2.0 2,-0.5 -4,-0.3 -1,-0.3 0.484 93.6 63.7 -84.7 -3.1 -8.0 28.1 8.2 506 246 B D S <> S- 0 0 70 -3,-1.3 4,-2.8 -4,-0.1 3,-0.3 -0.975 72.3-154.7-123.8 112.7 -11.7 28.3 7.3 507 247 B A H > S+ 0 0 23 -2,-0.5 4,-2.0 1,-0.2 -1,-0.1 0.814 94.8 54.4 -56.8 -33.4 -12.4 27.9 3.6 508 248 B A H > S+ 0 0 55 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.905 112.0 42.2 -69.3 -41.6 -15.6 29.9 3.9 509 249 B K H > S+ 0 0 99 -3,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.931 114.3 51.4 -69.0 -45.2 -13.9 32.9 5.4 510 250 B F H X S+ 0 0 0 -4,-2.8 4,-2.7 -7,-0.6 -2,-0.2 0.878 105.3 58.2 -58.5 -38.8 -11.0 32.6 3.0 511 251 B K H X S+ 0 0 97 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.908 104.3 50.1 -57.8 -45.5 -13.5 32.5 0.1 512 252 B T H < S+ 0 0 55 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.899 111.9 48.6 -61.7 -40.2 -14.9 35.9 1.2 513 253 B I H >< S+ 0 0 0 -4,-1.8 3,-1.3 2,-0.2 -2,-0.2 0.910 108.7 52.3 -67.6 -43.1 -11.4 37.4 1.3 514 254 B I H >< S+ 0 0 0 -4,-2.7 3,-1.3 1,-0.3 -2,-0.2 0.929 107.8 53.6 -58.1 -43.8 -10.4 36.0 -2.1 515 255 B N G >< S+ 0 0 70 -4,-2.2 3,-1.8 1,-0.3 -1,-0.3 0.564 82.2 86.4 -70.2 -8.6 -13.5 37.6 -3.6 516 256 B S G X + 0 0 1 -3,-1.3 3,-1.9 -4,-0.4 -1,-0.3 0.541 63.2 91.2 -69.8 -2.4 -12.7 41.0 -2.2 517 257 B V G X + 0 0 6 -3,-1.3 3,-2.4 1,-0.3 4,-0.5 0.761 66.3 81.6 -60.8 -22.1 -10.7 41.4 -5.5 518 258 B S G X S+ 0 0 61 -3,-1.8 3,-1.0 1,-0.3 -1,-0.3 0.781 75.0 69.9 -54.5 -28.4 -14.0 42.8 -6.8 519 259 B E G < S+ 0 0 78 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.730 99.3 50.3 -63.1 -19.8 -13.0 46.1 -5.2 520 260 B K G < 0 0 79 -3,-2.4 -1,-0.2 -4,-0.2 -2,-0.2 0.586 360.0 360.0 -92.7 -15.5 -10.3 46.4 -7.9 521 261 B L < 0 0 159 -3,-1.0 -3,-0.0 -4,-0.5 0, 0.0 -0.353 360.0 360.0 -88.2 360.0 -12.5 45.7 -10.9