==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 22-MAR-01 1IA0 . COMPND 2 MOLECULE: TUBULIN ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.KIKKAWA,E.P.SABLIN,Y.OKADA,H.YAJIMA,R.J.FLETTERICK, . 1195 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47873.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 766 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 75 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 105 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 134 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 305 25.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 2.3 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 3 4 3 5 1 1 3 4 0 1 4 3 3 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 4 2 2 2 1 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 . 5 4 0 5 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 1 2 2 0 0 0 0 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 1 A M 0 0 51 0, 0.0 129,-0.3 0, 0.0 535,-0.1 0.000 360.0 360.0 360.0 12.8 -30.7 -116.5 82.6 2 2 A R - 0 0 20 131,-0.1 130,-0.3 533,-0.1 29,-0.3 -0.939 360.0-171.2 -85.9 48.5 -29.4 -119.2 84.2 3 3 A E - 0 0 13 128,-3.2 2,-0.3 127,-0.5 27,-0.1 -0.064 15.6-135.6 -61.8 155.8 -29.3 -118.0 87.7 4 4 A C - 0 0 3 127,-0.0 2,-0.5 131,-0.0 131,-0.2 -0.666 11.0-138.8-102.1 161.1 -27.8 -119.6 90.5 5 5 A I - 0 0 2 129,-0.4 131,-3.8 -2,-0.3 2,-0.7 -0.999 19.4-143.9-122.0 126.7 -29.4 -119.9 93.7 6 6 A S E +a 136 0A 1 -2,-0.5 2,-0.4 58,-0.5 131,-0.2 -0.870 21.1 176.5-106.5 116.5 -27.2 -119.3 96.6 7 7 A I E -a 137 0A 4 129,-2.6 131,-1.0 -2,-0.7 2,-0.2 -0.924 12.3-160.7-116.1 136.6 -27.5 -121.2 99.8 8 8 A H - 0 0 0 58,-1.8 3,-0.1 -2,-0.4 131,-0.1 -0.576 7.0-177.9-100.8 169.8 -25.4 -121.1 102.8 9 9 A V - 0 0 0 1,-0.5 2,-0.3 -2,-0.2 130,-0.1 0.557 52.0 -8.9-138.3 -45.5 -25.3 -123.8 105.3 10 10 A G S >> S- 0 0 4 128,-0.2 3,-4.2 136,-0.1 4,-1.4 -0.960 83.2 -66.6-157.3 173.0 -23.1 -123.1 108.2 11 11 A Q H 3> S+ 0 0 98 1,-0.4 4,-1.6 -2,-0.3 5,-0.3 0.756 135.5 49.9 -28.9 -50.5 -20.5 -121.0 109.9 12 12 A A H 3> S+ 0 0 27 1,-0.2 4,-1.7 2,-0.1 -1,-0.4 0.905 118.9 41.0 -54.5 -42.7 -18.3 -122.3 107.2 13 13 A G H <> S+ 0 0 0 -3,-4.2 4,-2.0 125,-0.2 -2,-0.3 0.922 107.6 53.8 -79.3 -47.2 -21.0 -121.2 104.8 14 14 A V H X S+ 0 0 0 -4,-1.4 4,-0.7 1,-0.2 -3,-0.2 0.920 119.6 38.0 -64.2 -29.6 -22.3 -117.8 106.1 15 15 A Q H >X S+ 0 0 45 -4,-1.6 3,-2.1 -5,-0.3 4,-1.2 0.931 106.5 62.1 -79.2 -51.6 -18.9 -116.5 106.1 16 16 A I H 3X S+ 0 0 4 -4,-1.7 4,-3.0 -5,-0.3 -1,-0.2 0.780 103.5 53.7 -44.9 -34.7 -17.8 -118.1 103.0 17 17 A G H 3X>S+ 0 0 0 -4,-2.0 4,-8.0 2,-0.3 5,-0.6 0.886 97.3 62.5 -66.4 -31.1 -20.5 -116.1 101.3 18 18 A N H - 0 0 2 -2,-0.1 4,-0.6 214,-0.1 2,-0.2 -0.953 49.0 -58.0-161.1 160.8 -24.5 -111.2 90.9 30 30 A I T 4 S- 0 0 4 -2,-0.3 -27,-0.2 1,-0.2 -24,-0.0 -0.542 109.2 -33.4 -59.2 128.4 -25.8 -114.8 90.6 31 31 A Q T 4 S+ 0 0 14 -29,-0.3 -1,-0.2 1,-0.2 -28,-0.1 -0.221 127.5 68.5 -6.0 9.3 -27.0 -115.0 87.2 32 32 A P T 4 + 0 0 23 0, 0.0 2,-9.9 0, 0.0 28,-0.3 -0.035 44.3 142.9-107.6 12.3 -28.3 -111.8 86.4 33 33 A D < + 0 0 18 -4,-0.6 3,-0.1 1,-0.3 -2,-0.1 0.076 19.6 145.3 -56.8 43.1 -25.4 -109.3 86.1 34 34 A G - 0 0 27 -2,-9.9 -1,-0.3 1,-0.2 -6,-0.1 0.400 66.9 -74.6 -73.8 11.6 -27.2 -108.1 83.7 35 35 A Q - 0 0 150 -8,-0.3 -1,-0.2 -3,-0.2 26,-0.1 0.309 43.8-168.1 149.2 157.8 -25.7 -104.9 85.0 36 36 A M - 0 0 20 -3,-0.1 -1,-0.0 2,-0.1 25,-0.0 -0.957 21.6-152.7-158.1 147.4 -25.7 -102.2 87.6 37 37 A P S S+ 0 0 103 0, 0.0 2,-0.4 0, 0.0 5,-0.0 0.076 72.4 101.9 -92.0 -10.7 -24.3 -98.7 88.1 38 38 A S + 0 0 8 7,-0.1 2,-0.3 -11,-0.1 -2,-0.1 -0.745 44.9 168.7 -85.9 172.8 -24.3 -99.2 91.8 39 39 A D > + 0 0 82 -2,-0.4 3,-2.3 -13,-0.1 5,-0.4 -0.664 43.0 33.0 148.6 163.0 -21.4 -99.9 93.5 40 40 A K T 3 S- 0 0 194 -2,-0.3 -13,-0.1 1,-0.3 -2,-0.1 -0.285 127.8 -13.1 58.3-133.5 -20.4 -100.0 97.0 41 41 A T T 3 S- 0 0 61 -16,-0.0 -1,-0.3 1,-0.0 -3,-0.0 0.554 92.5-113.6 -73.0 -9.0 -23.0 -101.1 99.4 42 42 A I S < S+ 0 0 50 -3,-2.3 -2,-0.2 -5,-0.0 3,-0.1 0.546 90.8 116.6 88.0 4.8 -25.2 -100.6 96.8 43 43 A G S > S+ 0 0 50 -4,-0.2 3,-0.7 1,-0.2 -3,-0.1 0.744 75.2 54.2 -72.9 -45.6 -26.9 -97.6 98.8 44 44 A G T 3 S+ 0 0 74 -5,-0.4 -1,-0.2 1,-0.2 3,-0.1 0.405 87.2 79.8 -69.4 -14.6 -25.8 -95.2 96.1 45 45 A G T 3 S- 0 0 13 1,-0.3 -1,-0.2 -6,-0.3 2,-0.2 0.547 106.4-104.3 -71.1 -12.0 -27.4 -97.1 93.4 46 46 A D < - 0 0 115 -3,-0.7 2,-0.3 1,-0.1 -1,-0.3 -0.459 15.3-105.7 117.6 160.4 -30.7 -95.6 94.4 47 47 A D - 0 0 141 -2,-0.2 2,-0.9 -3,-0.1 3,-0.1 -0.946 27.7-172.5-126.2 113.1 -33.9 -96.4 96.2 48 48 A S - 0 0 46 -2,-0.3 2,-0.3 0, 0.0 8,-0.2 -0.921 58.9 -72.9-103.8 93.6 -36.7 -96.9 93.9 49 49 A F S S+ 0 0 194 -2,-0.9 5,-0.0 1,-0.1 0, 0.0 -0.382 89.4 112.3 64.3-144.8 -39.6 -97.1 96.1 50 50 A N - 0 0 53 -2,-0.3 2,-0.2 -3,-0.1 4,-0.1 0.623 45.7-138.7 101.8-139.7 -39.6 -100.6 97.9 51 51 A T - 0 0 116 2,-0.4 5,-0.1 1,-0.2 4,-0.1 -0.441 64.8 -5.7 153.5-177.2 -39.2 -102.3 101.2 52 52 A F S S+ 0 0 119 -2,-0.2 -1,-0.2 2,-0.1 3,-0.2 -0.258 125.9 8.4 -53.6 140.1 -37.4 -105.4 102.4 53 53 A F S S- 0 0 60 36,-0.3 2,-0.5 1,-0.2 -2,-0.4 -0.041 103.6 -96.0 66.8 154.4 -36.0 -107.4 99.6 54 54 A S + 0 0 15 1,-0.2 -1,-0.2 -4,-0.1 8,-0.1 -0.561 43.9 168.8-130.5 116.1 -36.3 -105.4 96.6 55 55 A E S S+ 0 0 176 -2,-0.5 -1,-0.2 1,-0.2 -6,-0.1 0.870 87.9 63.1 -77.1 -33.2 -38.9 -105.4 93.9 56 56 A T S S+ 0 0 45 -3,-0.3 2,-0.3 -8,-0.2 -1,-0.2 0.857 108.8 45.1 -59.2 -31.3 -37.4 -102.2 92.6 57 57 A G S S- 0 0 10 -4,-0.1 2,-0.0 1,-0.1 -3,-0.0 -0.807 77.1-126.2-122.6 162.0 -34.3 -104.0 91.9 58 58 A A >> - 0 0 53 -2,-0.3 4,-2.3 1,-0.1 3,-0.9 -0.235 47.3 -90.8 -87.3 174.6 -33.1 -107.2 90.4 59 59 A G T 34 S+ 0 0 19 1,-0.3 -29,-0.2 2,-0.2 6,-0.1 0.835 129.1 66.5 -49.3 -32.0 -30.8 -109.8 92.0 60 60 A K T 34 S+ 0 0 69 -28,-0.3 -1,-0.3 1,-0.2 -24,-0.1 0.897 103.9 38.4 -51.6 -54.3 -28.3 -107.6 90.3 61 61 A H T <4 S+ 0 0 49 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.837 142.2 10.9 -71.2 -33.3 -29.0 -104.6 92.5 62 62 A V S < S- 0 0 21 -4,-2.3 -1,-0.3 1,-0.2 26,-0.1 -0.926 103.0 -79.9-149.7 153.2 -29.3 -107.0 95.2 63 63 A P - 0 0 15 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.561 13.7-120.0 -63.0-177.5 -28.4 -110.7 95.2 64 64 A R S S+ 0 0 18 -4,-0.1 -58,-0.5 -5,-0.0 -4,-0.1 0.614 73.0 157.7 -91.0 -44.7 -29.1 -114.4 94.4 65 65 A A + 0 0 1 -60,-0.2 2,-0.2 -6,-0.1 -58,-0.1 0.772 36.5 154.8 61.4 102.9 -28.9 -114.9 98.0 66 66 A V - 0 0 2 -61,-0.1 -58,-1.8 2,-0.0 2,-0.4 -0.528 17.0-169.6-166.2 106.7 -30.0 -117.3 100.9 67 67 A F E -d 92 0B 2 24,-1.8 26,-2.3 -60,-0.2 2,-0.5 -0.873 3.4-163.8 -94.1 127.0 -28.1 -117.6 104.2 68 68 A V E +d 93 0B 0 -2,-0.4 2,-0.4 24,-0.2 -54,-0.2 -0.984 12.9 172.8-111.2 120.2 -28.9 -120.3 106.8 69 69 A D E -d 94 0B 2 24,-0.9 26,-1.3 -2,-0.5 -59,-0.1 -0.855 21.7-171.8-120.6 124.6 -27.6 -119.9 110.2 70 70 A L S S+ 0 0 7 -2,-0.4 27,-0.4 1,-0.3 28,-0.1 0.219 87.6 36.6 -99.3 12.4 -28.5 -122.1 113.0 71 71 A E S > S- 0 0 70 27,-0.1 4,-0.6 25,-0.1 -1,-0.3 -0.934 84.9-128.4-155.5 147.5 -26.9 -119.8 115.4 72 72 A P H > S+ 0 0 50 0, 0.0 4,-3.8 0, 0.0 5,-0.4 0.761 86.3 100.8 -73.3 -25.7 -27.0 -115.9 114.9 73 73 A T H >> S+ 0 0 60 2,-0.3 4,-1.1 1,-0.2 3,-1.1 0.798 91.9 18.5 -26.4 -90.7 -23.4 -115.9 115.3 74 74 A V H >> S+ 0 0 2 1,-0.3 4,-2.2 2,-0.2 3,-0.7 0.910 127.4 55.6 -60.3 -36.5 -22.2 -115.6 111.7 75 75 A I H 3X S+ 0 0 0 -4,-0.6 4,-0.5 1,-0.3 -1,-0.3 0.679 99.9 58.1 -67.7 -34.8 -25.5 -114.4 110.6 76 76 A D H << S+ 0 0 91 -4,-3.8 -1,-0.3 -3,-1.1 -2,-0.2 0.783 106.9 52.8 -64.5 -26.7 -25.3 -111.6 113.1 77 77 A E H << S+ 0 0 64 -4,-1.1 6,-0.5 -3,-0.7 -2,-0.2 0.866 108.2 44.0 -63.4 -69.1 -22.2 -110.7 111.4 78 78 A V H < S+ 0 0 10 -4,-2.2 9,-0.3 1,-0.2 -1,-0.3 0.580 129.6 32.1 -46.4 -32.3 -23.7 -110.6 108.0 79 79 A R S >< S+ 0 0 111 -4,-0.5 3,-1.2 -5,-0.3 -2,-0.3 0.481 100.2 127.5 -86.3 -15.2 -26.4 -108.7 109.8 80 80 A T G > S- 0 0 38 -6,-0.3 3,-3.1 1,-0.3 4,-0.1 -0.078 90.4 -32.3 -49.1 134.3 -23.8 -107.4 112.1 81 81 A G G 3 S- 0 0 69 1,-0.3 -1,-0.3 2,-0.2 3,-0.3 0.661 113.6 -62.9 14.8 65.1 -23.8 -103.7 112.6 82 82 A T G < S- 0 0 87 -3,-1.2 2,-3.2 1,-0.3 -1,-0.3 0.756 72.4-135.9 18.3 66.4 -24.9 -103.5 109.0 83 83 A Y < - 0 0 89 -3,-3.1 -1,-0.3 -6,-0.5 -2,-0.2 -0.018 43.1 -82.0 -39.9 18.2 -21.6 -105.1 108.7 84 84 A R S S+ 0 0 189 -2,-3.2 -1,-0.3 -3,-0.3 -2,-0.1 0.398 120.2 73.5 88.2 -0.8 -20.8 -102.8 105.8 85 85 A Q - 0 0 56 -7,-0.1 2,-0.4 -43,-0.0 3,-0.2 -0.200 56.8-175.5-137.9 55.8 -22.6 -104.8 103.4 86 86 A L + 0 0 62 -4,-0.2 -7,-0.1 1,-0.2 -8,-0.0 -0.248 12.6 169.2 -65.3 103.7 -26.1 -104.7 103.5 87 87 A F - 0 0 16 -2,-0.4 -1,-0.2 1,-0.3 -8,-0.1 0.391 61.0 -55.6 -96.9 -8.5 -26.8 -107.3 101.0 88 88 A H - 0 0 13 -3,-0.2 3,-0.5 -26,-0.1 -1,-0.3 -0.143 45.6-114.0 175.3 157.9 -30.5 -107.6 101.7 89 89 A P S S+ 0 0 17 0, 0.0 -36,-0.3 0, 0.0 -10,-0.0 -0.682 96.5 29.7 -86.8 150.1 -32.7 -108.2 104.6 90 90 A E S S+ 0 0 117 -2,-0.3 3,-0.1 2,-0.2 0, 0.0 0.868 91.2 88.6 73.8 22.3 -34.8 -111.3 104.5 91 91 A Q S S+ 0 0 3 -3,-0.5 -24,-1.8 -38,-0.1 2,-0.4 0.313 79.3 87.4-103.0 -11.1 -32.4 -113.5 102.5 92 92 A L E -d 67 0B 22 -4,-0.3 2,-0.4 -26,-0.2 -24,-0.2 -0.640 61.2-164.4 -85.4 141.1 -31.0 -114.4 106.0 93 93 A I E -d 68 0B 3 -26,-2.3 -24,-0.9 -2,-0.4 2,-0.4 -0.958 6.8-175.8-105.3 131.4 -32.3 -117.1 108.2 94 94 A T E -d 69 0B 61 -2,-0.4 2,-0.7 -26,-0.2 -24,-0.2 -0.927 4.3-167.7-133.7 103.1 -31.2 -117.0 111.7 95 95 A G - 0 0 2 -26,-1.3 2,-1.0 -2,-0.4 3,-0.3 -0.884 13.7-166.6-101.2 116.7 -32.3 -119.8 113.8 96 96 A K + 0 0 171 -2,-0.7 -25,-0.1 1,-0.2 -26,-0.1 -0.552 52.4 121.9 -92.4 59.9 -31.9 -119.4 117.5 97 97 A E S S- 0 0 65 -2,-1.0 -1,-0.2 -27,-0.4 -26,-0.1 0.307 89.0-103.0 -98.1 2.3 -32.5 -123.1 117.9 98 98 A D - 0 0 106 -3,-0.3 -27,-0.1 -28,-0.1 12,-0.1 0.611 45.9 -84.9 73.0 128.8 -29.4 -123.1 119.4 99 99 A A - 0 0 12 11,-0.0 2,-0.4 1,-0.0 -28,-0.1 -0.204 40.9-156.6 -66.2 152.8 -26.8 -124.5 117.3 100 100 A A - 0 0 5 5,-0.1 2,-0.7 2,-0.1 45,-0.3 -0.988 12.7-158.5-140.7 125.1 -26.0 -128.1 117.0 101 101 A N + 0 0 82 -2,-0.4 2,-0.3 43,-0.2 42,-0.1 -0.910 59.8 88.7 -94.7 113.7 -22.9 -129.9 116.0 102 102 A N S S- 0 0 13 -2,-0.7 46,-0.5 3,-0.3 5,-0.4 -0.743 75.1-126.1 163.6 146.5 -24.0 -133.3 114.9 103 103 A Y S S+ 0 0 2 -2,-0.3 4,-0.3 1,-0.2 5,-0.3 0.858 119.0 51.3 -79.2 -25.6 -25.0 -134.6 111.7 104 104 A A S >>S+ 0 0 0 3,-0.2 4,-2.7 44,-0.1 5,-1.2 0.872 100.9 72.4 -70.7 -46.3 -27.9 -135.7 113.6 105 105 A R T 45S+ 0 0 42 2,-0.2 2,-1.4 3,-0.2 44,-0.3 -0.567 111.2 6.7 -82.6 141.1 -28.6 -132.3 115.1 106 106 A G T 45S+ 0 0 1 -2,-0.2 6,-0.4 1,-0.2 8,-0.2 -0.543 130.3 61.4 82.3 -52.5 -30.0 -129.6 113.1 107 107 A H T 45S+ 0 0 15 -2,-1.4 -2,-0.2 -5,-0.4 -1,-0.2 0.939 126.7 10.7 -65.6 -60.9 -30.3 -132.2 110.3 108 108 A Y T <5S+ 0 0 25 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.1 0.914 141.1 31.9 -80.8 -45.1 -32.7 -134.5 112.1 109 109 A T S >> S+ 0 0 19 1,-0.3 4,-1.1 2,-0.2 3,-0.4 0.858 127.0 59.5 -64.5 -37.9 -33.6 -128.3 115.0 111 111 A G H 34 S+ 0 0 0 1,-0.2 3,-0.5 -5,-0.2 -1,-0.3 0.838 94.3 59.6 -62.0 -42.9 -33.1 -128.2 111.4 112 112 A K H X4 S+ 0 0 96 -3,-0.6 3,-0.6 -6,-0.4 4,-0.4 0.783 105.0 52.7 -48.1 -46.6 -36.0 -130.2 110.4 113 113 A E H 3X S+ 0 0 134 -4,-0.8 4,-0.5 -3,-0.4 -1,-0.2 0.791 121.7 29.5 -63.8 -27.6 -38.1 -127.6 112.0 114 114 A I T 3< S+ 0 0 27 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 -0.055 97.1 81.7-131.8 38.5 -36.5 -124.8 110.1 115 115 A I T <> S+ 0 0 0 -3,-0.6 4,-1.7 3,-0.1 -1,-0.1 0.452 93.6 55.4 -96.2 -22.5 -35.5 -126.4 106.8 116 116 A D H >> S+ 0 0 77 -4,-0.4 4,-2.7 2,-0.3 3,-0.6 0.993 102.0 48.8 -71.0 -71.4 -39.0 -125.9 105.7 117 117 A L H 3X S+ 0 0 88 -4,-0.5 4,-1.4 1,-0.3 -1,-0.2 0.767 116.3 50.6 -39.7 -33.0 -39.5 -122.2 106.2 118 118 A V H 3> S+ 0 0 3 2,-0.2 4,-3.1 1,-0.2 -1,-0.3 0.899 102.7 55.3 -72.6 -46.7 -36.3 -122.1 104.4 119 119 A L H X S+ 0 0 140 -4,-2.3 4,-1.5 1,-0.2 3,-1.0 0.923 118.7 47.8 -60.4 -43.2 -40.1 -118.0 96.4 125 125 A L H 3< S+ 0 0 28 -4,-2.8 -2,-0.3 1,-0.3 -1,-0.2 0.828 106.0 57.2 -64.0 -38.4 -36.6 -117.2 95.7 126 126 A A T 3< S+ 0 0 8 -4,-3.5 -1,-0.3 1,-0.2 -2,-0.2 0.565 110.2 48.5 -71.6 -5.3 -36.4 -119.9 93.1 127 127 A D T <4 S+ 0 0 82 -3,-1.0 2,-1.3 -4,-0.4 -2,-0.2 0.801 79.3 89.5-108.0 -35.0 -39.3 -118.2 91.4 128 128 A Q S < S+ 0 0 124 -4,-1.5 2,-0.3 2,-0.0 -1,-0.1 -0.494 98.6 8.5 -72.9 101.2 -38.6 -114.4 91.0 129 129 A C S S- 0 0 72 -2,-1.3 2,-0.3 -71,-0.0 3,-0.1 -0.892 91.4 -79.6 127.7-163.1 -36.8 -114.4 87.7 130 130 A T S S+ 0 0 93 1,-0.4 -127,-0.5 -2,-0.3 405,-0.1 -0.989 87.5 16.9-143.0 146.7 -36.1 -117.0 85.0 131 131 A G - 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0 0 38 -3,-1.3 2,-0.3 -264,-0.0 -263,-0.2 0.495 29.0-152.4 109.0 147.3 -10.1 -130.8 72.8 617 178 B S S S+ 0 0 42 4,-0.2 2,-0.7 -265,-0.1 4,-0.3 -0.919 79.6 2.3-145.7 148.0 -13.2 -129.2 74.2 618 179 B D - 0 0 14 -2,-0.3 -267,-0.3 1,-0.1 4,-0.1 -0.452 70.0-126.1 91.7-128.2 -15.6 -131.0 76.3 619 180 B T S S+ 0 0 12 -2,-0.7 -1,-0.1 2,-0.1 -269,-0.1 -0.339 109.7 66.3-121.1 -19.9 -14.6 -134.7 77.1 620 181 B V S > S+ 0 0 2 2,-0.1 4,-2.6 -39,-0.1 2,-1.3 0.548 76.2 96.7 -78.5 -13.9 -17.8 -135.8 75.8 621 182 B V T 4 + 0 0 7 -4,-0.3 -4,-0.2 2,-0.2 -2,-0.1 -0.831 65.8 68.2 -78.8 75.1 -16.8 -134.6 72.4 622 183 B E T >> S+ 0 0 7 -2,-1.3 4,-0.8 -4,-0.1 3,-0.8 -0.439 117.3 21.8 -82.6 -83.9 -15.7 -137.7 71.1 623 184 B P H 3> S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.718 114.6 69.2 -62.5 -38.8 -19.0 -139.3 71.0 624 185 B Y H 3X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.3 -3,-0.2 0.872 108.7 38.6 -48.9 -49.7 -21.1 -135.9 70.9 625 186 B N H <4 S+ 0 0 3 -3,-0.8 -1,-0.3 -5,-0.2 4,-0.2 0.734 110.6 62.8 -82.4 -9.3 -19.9 -135.1 67.4 626 187 B A H >X S+ 0 0 2 -4,-0.8 4,-1.6 2,-0.2 3,-0.9 0.948 108.1 40.1 -84.8 -29.4 -20.1 -138.8 66.6 627 188 B T H 3X S+ 0 0 3 -4,-2.8 4,-1.4 1,-0.3 5,-0.2 0.890 109.1 59.6 -81.5 -31.9 -23.8 -138.7 67.2 628 189 B L H 3< S+ 0 0 0 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.739 108.1 55.7 -56.3 -15.6 -23.8 -135.3 65.4 629 190 B S H X> S+ 0 0 6 -3,-0.9 3,-7.5 2,-0.3 4,-1.3 0.968 91.4 56.9 -81.3 -70.1 -22.4 -137.5 62.7 630 191 B V H >X S+ 0 0 15 -4,-1.6 4,-0.9 1,-0.4 3,-0.5 0.760 117.2 45.7 -40.4 -31.6 -24.7 -140.3 62.0 631 192 B H H 3< S+ 0 0 4 -4,-1.4 -1,-0.4 1,-0.3 6,-0.3 0.722 107.7 55.0 -79.4 -20.1 -27.0 -137.3 61.4 632 193 B Q H <4 S+ 0 0 14 -3,-7.5 -1,-0.3 -5,-0.2 -2,-0.2 0.648 113.9 39.7 -90.2 -20.6 -24.5 -135.3 59.3 633 194 B L H << S+ 0 0 3 -4,-1.3 71,-0.3 -3,-0.5 -2,-0.2 0.787 132.4 22.3 -76.2 -74.3 -24.0 -138.2 56.7 634 195 B V S < S+ 0 0 60 -4,-0.9 -2,-0.2 -5,-0.3 -3,-0.1 -0.301 107.1 86.6 104.5 6.5 -27.5 -139.6 56.4 635 196 B E S S- 0 0 48 -4,-0.3 -38,-0.4 2,-0.2 -37,-0.1 -0.006 105.7 -97.6-134.1 24.3 -29.2 -136.4 57.6 636 197 B N S S+ 0 0 9 1,-0.3 2,-0.8 -3,-0.2 -31,-0.7 0.771 76.2 138.0 66.1 24.3 -29.5 -134.3 54.4 637 198 B T E -l 605 0E 5 -6,-0.3 -1,-0.3 1,-0.2 -2,-0.2 -0.934 39.3-161.9 -90.8 116.5 -26.7 -132.4 54.8 638 199 B D E + 0 0 21 -33,-1.6 67,-0.6 -2,-0.8 2,-0.3 0.942 66.7 4.6 -77.1 -61.4 -25.3 -132.4 51.3 639 200 B E E S-l 606 0E 0 -34,-1.8 -32,-0.9 -3,-0.1 2,-0.4 -0.666 71.4-147.8-126.8 163.4 -21.8 -131.4 51.7 640 201 B T E -l 607 0E 1 65,-0.4 67,-2.4 -2,-0.3 2,-0.3 -0.928 3.9-147.6-152.6 121.6 -20.1 -130.7 54.8 641 202 B Y - 0 0 1 -34,-2.8 2,-0.4 -2,-0.4 67,-0.1 -0.626 6.8-148.3 -99.4 154.4 -17.4 -128.4 55.6 642 203 B C + 0 0 3 -2,-0.3 -32,-0.2 65,-0.2 99,-0.1 -0.952 21.1 168.9-123.8 149.2 -14.7 -128.8 58.1 643 204 B I - 0 0 2 -2,-0.4 -32,-0.2 -34,-0.1 99,-0.2 -0.534 19.1-168.5 167.4 59.8 -13.1 -126.0 60.0 644 205 B D > - 0 0 0 -34,-0.2 4,-1.2 1,-0.2 3,-0.2 -0.414 15.8-149.1 -66.0 133.9 -11.0 -127.8 62.7 645 206 B N H > S+ 0 0 33 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.665 97.5 59.1 -79.8 -17.6 -9.9 -125.3 65.2 646 207 B E H 4 S+ 0 0 42 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.691 113.6 38.6 -81.4 -19.1 -6.7 -127.3 65.8 647 208 B A H > S+ 0 0 4 -3,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.641 103.7 69.6 -98.0 -25.4 -5.9 -126.9 62.0 648 209 B L H X S+ 0 0 2 -4,-1.2 4,-2.1 1,-0.2 -2,-0.2 0.812 96.2 56.3 -63.9 -28.2 -7.1 -123.3 61.9 649 210 B Y H < S+ 0 0 18 -4,-0.7 -1,-0.2 2,-0.2 5,-0.2 0.900 95.9 59.4 -72.6 -52.0 -4.2 -122.4 64.0 650 211 B D H >>>S+ 0 0 55 -4,-0.4 4,-1.6 1,-0.2 3,-0.9 0.928 112.9 44.1 -39.6 -46.1 -1.6 -123.7 61.7 651 212 B I H 3<>S+ 0 0 0 -4,-1.3 5,-2.0 1,-0.3 4,-0.3 0.928 110.8 50.6 -67.2 -49.2 -3.0 -121.3 59.2 652 213 B C T 3<5S+ 0 0 1 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.176 124.7 30.7 -78.6 25.1 -3.4 -118.3 61.4 653 214 B F T <45S+ 0 0 80 -3,-0.9 -1,-0.2 -5,-0.1 -2,-0.2 0.549 122.9 38.0-159.5 -13.9 0.0 -118.7 62.5 654 215 B R T <5S+ 0 0 151 -4,-1.6 -3,-0.2 -3,-0.3 -2,-0.1 0.719 129.8 27.7-103.3 -74.1 2.1 -120.2 59.8 655 216 B T T - 0 0 51 1,-0.1 4,-1.6 -337,-0.1 5,-0.1 -0.977 33.5-112.6-172.1 154.6 -7.8 -115.3 68.6 663 224 B Y H > S+ 0 0 42 -2,-0.4 4,-0.8 2,-0.2 -1,-0.1 0.842 119.6 51.0 -68.1 -36.5 -11.0 -116.7 68.4 664 225 B G H >> S+ 0 0 28 1,-0.2 3,-1.4 2,-0.2 4,-0.7 0.993 109.5 51.1 -71.5 -28.0 -12.2 -113.5 66.7 665 226 B D H >> S+ 0 0 41 1,-0.3 4,-1.5 2,-0.2 3,-0.7 0.820 98.5 63.6 -74.2 -27.7 -9.4 -113.7 64.2 666 227 B L H 3X S+ 0 0 4 -4,-1.6 4,-1.5 1,-0.3 -1,-0.3 0.733 94.5 63.9 -64.7 -19.8 -10.3 -117.2 63.3 667 228 B N H X S+ 0 0 14 -4,-1.5 4,-1.0 1,-0.3 3,-0.9 0.740 108.5 42.2 -30.3 -61.7 -10.3 -117.4 58.3 670 231 B V H 3X S+ 0 0 2 -4,-1.5 4,-1.8 1,-0.3 5,-0.4 0.868 99.3 68.1 -62.6 -40.2 -13.7 -118.9 57.7 671 232 B S H S+ 0 0 0 -4,-1.8 4,-4.8 -3,-0.3 5,-0.6 0.802 105.9 59.8 -88.2 -45.2 -17.6 -119.5 52.8 675 236 B S H X>S+ 0 0 13 -4,-2.9 5,-3.5 -5,-0.4 4,-0.9 0.893 105.7 52.0 -56.5 -36.6 -17.5 -116.4 50.6 676 237 B G H <5S+ 0 0 0 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.950 120.8 32.4 -65.1 -40.6 -15.9 -118.5 47.9 677 238 B V H <5S+ 0 0 4 -4,-0.5 -2,-0.2 -5,-0.2 -1,-0.2 0.909 132.8 29.7 -78.5 -57.6 -18.6 -121.0 48.1 678 239 B T H <5S+ 0 0 4 -4,-4.8 -3,-0.2 1,-0.1 -2,-0.2 0.844 135.4 24.5 -73.3 -65.2 -21.5 -118.7 49.0 679 240 B T T >X> - 0 0 54 -2,-0.6 3,-5.4 1,-0.1 4,-1.1 -0.652 39.1 -94.5 -77.6 157.4 -24.0 -122.9 41.7 691 252 B L H 3> S+ 0 0 6 1,-0.3 4,-0.9 -2,-0.3 3,-0.4 0.693 125.3 61.5 -42.8 -30.9 -24.2 -124.5 45.0 692 253 B R H 3> S+ 0 0 124 1,-0.3 4,-0.9 2,-0.3 -1,-0.3 0.814 94.6 59.5 -74.1 -22.2 -25.5 -127.6 43.4 693 254 B K H <> S+ 0 0 69 -3,-5.4 4,-1.6 1,-0.3 3,-0.4 0.830 100.0 62.5 -67.2 -28.9 -22.3 -128.0 41.5 694 255 B L H X S+ 0 0 3 -4,-1.1 4,-1.2 -3,-0.4 -1,-0.3 0.825 102.1 46.8 -63.9 -37.8 -21.0 -128.1 44.9 695 256 B A H < S+ 0 0 8 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.613 118.5 38.9 -85.7 -20.1 -22.9 -131.2 45.7 696 257 B V H < S+ 0 0 108 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.505 113.8 55.8 -95.6 -18.0 -22.0 -133.2 42.5 697 258 B N H < S+ 0 0 44 -4,-1.6 57,-0.2 -5,-0.2 -3,-0.2 0.870 119.5 26.5 -82.6 -38.9 -18.6 -132.0 42.4 698 259 B M S < S+ 0 0 0 -4,-1.2 -3,-0.1 -5,-0.2 -2,-0.1 0.590 110.6 69.2-102.3 -25.2 -17.6 -133.2 45.9 699 260 B V + 0 0 23 -5,-0.3 5,-0.1 1,-0.1 54,-0.1 -0.926 49.7 176.9 -96.6 129.2 -19.8 -136.0 46.5 700 261 B P S S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.218 73.3 0.7-117.7 45.6 -19.2 -139.0 44.5 701 262 B F S S- 0 0 89 2,-0.1 4,-0.3 1,-0.1 -3,-0.0 -0.873 90.0 -80.0 157.7 173.1 -21.7 -140.9 46.1 702 263 B P S S+ 0 0 117 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.814 85.3 92.2 -74.0 -40.3 -24.3 -140.6 48.8 703 264 B R S S- 0 0 90 1,-0.2 2,-0.6 -69,-0.1 -69,-0.1 -0.295 103.9 -72.8 -57.2 154.6 -23.0 -141.0 52.2 704 265 B L - 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