==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-APR-04 1V1R . COMPND 2 MOLECULE: 2-OXOISOVALERATE DEHYDROGENASE ALPHA SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.LI,R.M.WYNN,M.MACHIUS,J.L.CHUANG,S.KARTHIKEYAN,D.R.TOMCHIC . 688 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29785.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 474 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 2.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 41 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 230 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.0 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 3 1 0 0 1 1 2 2 3 0 2 1 1 1 0 0 0 0 0 1 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 5 1 2 4 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 1 1 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 0 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 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 14 A A 0 0 160 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-168.7 47.5 -0.5 38.0 2 15 A E - 0 0 189 1,-0.1 2,-0.2 0, 0.0 0, 0.0 -0.180 360.0 -97.6 -87.5 179.4 44.9 -3.1 39.2 3 16 A F - 0 0 210 -2,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.665 26.7-153.8 -92.5 156.9 45.2 -6.9 39.5 4 17 A I - 0 0 110 -2,-0.2 4,-0.0 1,-0.0 0, 0.0 -0.991 4.9-155.8-128.0 141.0 43.8 -9.3 37.0 5 18 A D S S+ 0 0 151 -2,-0.4 2,-0.3 2,-0.1 -1,-0.0 0.396 72.1 64.6-105.1 5.5 42.8 -12.8 38.0 6 19 A K S S- 0 0 114 2,-0.0 2,-0.5 0, 0.0 -2,-0.0 -0.971 86.4-111.9-122.7 149.9 43.1 -14.6 34.6 7 20 A L + 0 0 142 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.669 46.2 160.5 -83.0 122.8 46.4 -15.2 32.6 8 21 A E - 0 0 125 -2,-0.5 2,-0.3 -4,-0.0 -2,-0.0 -0.950 30.7-142.7-147.3 115.4 46.4 -13.2 29.4 9 22 A F - 0 0 185 -2,-0.3 2,-0.5 1,-0.0 -2,-0.0 -0.591 26.6-120.1 -75.1 135.4 49.5 -12.2 27.3 10 23 A I - 0 0 145 -2,-0.3 -1,-0.0 3,-0.0 -2,-0.0 -0.729 31.0-146.4 -77.4 122.3 49.3 -8.8 25.8 11 24 A Q > - 0 0 132 -2,-0.5 2,-1.6 1,-0.0 3,-1.2 -0.596 25.0-106.6 -82.0 150.9 49.5 -9.2 22.0 12 25 A P T 3 S+ 0 0 115 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.698 105.0 85.8 -70.6 88.3 51.2 -6.7 19.7 13 26 A N T 3 + 0 0 108 -2,-1.6 -3,-0.0 204,-0.0 203,-0.0 0.158 54.8 138.4-160.4 -40.4 47.7 -5.5 18.5 14 27 A V S < S- 0 0 109 -3,-1.2 2,-1.4 1,-0.2 -4,-0.0 0.038 83.0 -10.4 -12.5 110.1 47.4 -3.1 21.3 15 28 A I S S- 0 0 145 -3,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.572 112.8-102.9 65.9 -69.3 45.9 0.1 19.9 16 29 A S - 0 0 74 -2,-1.4 2,-0.7 201,-0.0 201,-0.1 -0.931 54.4 -32.4-179.0-163.8 46.2 -0.9 16.1 17 30 A G S S- 0 0 59 -2,-0.3 -2,-0.0 204,-0.0 -4,-0.0 -0.933 78.3-119.9 -72.5 119.6 48.1 -0.5 13.0 18 31 A I - 0 0 38 -2,-0.7 202,-0.1 199,-0.1 203,-0.1 -0.615 32.5-123.7 -64.5 123.2 48.9 3.1 13.8 19 32 A P - 0 0 106 0, 0.0 2,-0.6 0, 0.0 213,-0.5 -0.287 16.8-112.6 -75.3 163.3 47.3 5.1 10.9 20 33 A I - 0 0 89 211,-0.1 2,-0.3 213,-0.1 213,-0.3 -0.840 25.6-130.2-102.9 115.4 49.2 7.5 8.6 21 34 A Y B +a 233 0A 50 211,-3.0 213,-2.9 -2,-0.6 2,-0.3 -0.518 32.9 177.9 -65.0 124.8 48.3 11.2 8.9 22 35 A R + 0 0 94 -2,-0.3 3,-0.1 211,-0.2 213,-0.0 -0.953 23.6 171.4-130.1 146.6 47.7 12.7 5.5 23 36 A V S S+ 0 0 1 1,-0.4 8,-2.9 -2,-0.3 9,-0.5 0.645 72.8 38.3-116.8 -35.5 46.6 16.2 4.5 24 37 A M B S-H 30 0B 0 6,-0.2 -1,-0.4 7,-0.1 6,-0.2 -0.945 74.9-136.4-127.9 131.2 46.9 16.3 0.7 25 38 A D > - 0 0 38 4,-2.4 3,-2.3 -2,-0.4 4,-0.1 -0.293 41.6 -87.3 -82.3 179.7 46.0 13.4 -1.6 26 39 A R T 3 S+ 0 0 155 1,-0.3 249,-0.1 2,-0.1 -1,-0.1 0.591 127.9 58.2 -68.6 -9.5 48.1 12.4 -4.6 27 40 A Q T 3 S- 0 0 118 2,-0.1 -1,-0.3 248,-0.1 -2,-0.0 0.186 119.9-107.0 -98.4 13.0 46.4 14.9 -6.8 28 41 A G S < S+ 0 0 0 -3,-2.3 2,-0.3 1,-0.2 -2,-0.1 0.670 73.0 140.2 74.5 16.8 47.4 17.8 -4.5 29 42 A Q - 0 0 107 -4,-0.1 -4,-2.4 250,-0.0 2,-0.4 -0.747 58.4-115.1 -96.5 140.1 43.9 18.4 -3.0 30 43 A I B -H 24 0B 42 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.0 -0.595 23.9-161.3 -70.7 128.6 43.4 19.2 0.7 31 44 A I S S+ 0 0 92 -8,-2.9 -1,-0.1 -2,-0.4 -7,-0.1 0.839 77.9 18.8 -84.2 -33.5 41.4 16.3 2.1 32 45 A N > - 0 0 80 -9,-0.5 3,-2.4 1,-0.1 4,-0.4 -0.939 67.4-151.2-144.1 104.2 40.1 18.0 5.3 33 46 A P G > S+ 0 0 99 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.810 94.0 68.1 -52.8 -28.6 40.0 21.9 5.4 34 47 A S G 3 S+ 0 0 93 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.814 102.4 48.7 -62.5 -20.5 40.4 21.9 9.2 35 48 A E G < S+ 0 0 74 -3,-2.4 -1,-0.2 -12,-0.1 208,-0.1 0.485 79.3 117.3 -99.7 -2.6 43.9 20.5 8.6 36 49 A D < - 0 0 26 -3,-1.3 -12,-0.0 -4,-0.4 -6,-0.0 -0.508 53.4-155.7 -62.9 125.3 45.0 23.0 5.9 37 50 A P - 0 0 31 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.609 21.3-143.2 -72.9 -10.4 48.0 25.0 7.4 38 51 A H - 0 0 136 1,-0.1 3,-0.1 2,-0.0 -2,-0.1 0.939 25.8-170.4 42.1 54.5 47.1 27.8 4.9 39 52 A L - 0 0 15 1,-0.1 -1,-0.1 2,-0.1 5,-0.0 -0.530 27.5 -99.9 -72.0 143.8 50.8 28.5 4.4 40 53 A P > - 0 0 85 0, 0.0 4,-2.3 0, 0.0 3,-0.5 -0.210 29.2-111.0 -62.6 151.7 51.5 31.7 2.5 41 54 A K H > S+ 0 0 103 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.861 114.6 53.6 -48.2 -47.8 52.3 31.6 -1.2 42 55 A E H > S+ 0 0 167 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.851 111.1 45.7 -63.2 -38.4 56.0 32.7 -0.8 43 56 A K H > S+ 0 0 101 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.878 112.1 50.8 -75.5 -34.5 56.7 30.0 1.8 44 57 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.929 111.3 48.5 -66.7 -39.9 55.0 27.2 -0.3 45 58 A L H X S+ 0 0 30 -4,-2.7 4,-3.2 -5,-0.2 5,-0.2 0.874 109.0 53.5 -63.7 -36.8 57.0 28.3 -3.3 46 59 A K H X S+ 0 0 55 -4,-1.6 4,-2.3 -5,-0.2 5,-0.2 0.920 107.6 51.3 -63.7 -43.3 60.1 28.2 -1.1 47 60 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.957 114.1 44.3 -54.1 -50.5 59.2 24.6 -0.1 48 61 A Y H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.925 114.5 46.6 -62.9 -49.2 58.8 23.7 -3.8 49 62 A K H X S+ 0 0 78 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.859 111.0 53.1 -64.9 -37.0 62.0 25.4 -5.1 50 63 A S H X S+ 0 0 9 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.932 110.5 47.5 -62.3 -46.1 64.1 23.9 -2.2 51 64 A M H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.911 116.1 43.0 -63.2 -42.3 63.0 20.4 -3.0 52 65 A T H X S+ 0 0 14 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.863 111.1 53.7 -78.5 -31.7 63.6 20.8 -6.8 53 66 A L H X S+ 0 0 25 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.931 110.1 49.6 -66.1 -38.5 67.0 22.6 -6.3 54 67 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 -2,-0.2 0.913 110.3 50.6 -60.7 -45.0 68.0 19.6 -4.1 55 68 A N H X S+ 0 0 16 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.925 110.1 49.0 -63.1 -41.0 66.9 17.2 -6.8 56 69 A T H X S+ 0 0 24 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.914 113.0 47.9 -61.6 -44.4 68.9 19.1 -9.5 57 70 A M H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.918 109.2 53.5 -62.3 -48.1 72.0 19.0 -7.2 58 71 A D H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.880 107.3 52.0 -50.5 -45.2 71.5 15.3 -6.5 59 72 A R H X S+ 0 0 160 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.932 114.4 41.6 -62.2 -46.2 71.4 14.5 -10.3 60 73 A I H X S+ 0 0 29 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.914 117.3 45.1 -72.4 -43.5 74.6 16.3 -11.0 61 74 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.866 109.2 56.5 -71.8 -32.6 76.5 15.1 -7.9 62 75 A Y H X S+ 0 0 104 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.926 110.2 45.4 -60.2 -44.0 75.4 11.5 -8.4 63 76 A E H X S+ 0 0 96 -4,-1.6 4,-1.8 -5,-0.2 -2,-0.2 0.872 108.7 56.3 -67.0 -36.9 76.8 11.6 -11.9 64 77 A S H <>S+ 0 0 2 -4,-2.1 5,-2.6 2,-0.2 6,-0.7 0.914 108.7 48.1 -59.7 -38.6 80.0 13.2 -10.5 65 78 A Q H ><5S+ 0 0 50 -4,-2.3 3,-2.2 1,-0.2 -2,-0.2 0.937 107.1 54.8 -66.7 -49.0 80.3 10.2 -8.2 66 79 A R H 3<5S+ 0 0 155 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.823 110.1 48.7 -56.4 -30.5 79.8 7.7 -11.0 67 80 A Q T 3<5S- 0 0 100 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.451 115.4-115.2 -85.5 -4.8 82.6 9.4 -12.8 68 81 A G T < 5S+ 0 0 63 -3,-2.2 -3,-0.2 2,-0.3 -2,-0.1 0.599 81.1 123.1 77.1 13.5 85.0 9.3 -9.9 69 82 A R S + 0 0 3 -22,-0.2 3,-2.6 -2,-0.1 4,-0.3 0.186 42.3 153.8-117.7 13.6 67.7 12.6 -1.3 77 90 A Y T 3 S+ 0 0 90 1,-0.3 -2,-0.1 2,-0.2 -22,-0.0 -0.208 74.2 6.2 -64.3 129.3 65.2 11.1 -3.7 78 91 A G T 3 S+ 0 0 11 187,-0.1 188,-0.3 1,-0.0 -1,-0.3 0.318 118.5 76.0 83.0 -9.2 61.9 10.6 -2.0 79 92 A E <> + 0 0 9 -3,-2.6 4,-1.6 2,-0.1 5,-0.2 0.277 60.4 99.6-110.8 8.7 62.9 12.4 1.2 80 93 A E H > S+ 0 0 0 -4,-0.3 4,-2.3 1,-0.2 5,-0.3 0.897 83.9 47.9 -67.1 -36.4 62.7 15.9 -0.2 81 94 A G H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.4 0.873 107.8 52.7 -70.7 -45.4 59.2 16.4 1.4 82 95 A T H > S+ 0 0 1 153,-0.4 4,-1.4 -4,-0.2 -1,-0.2 0.895 115.2 42.5 -57.0 -39.4 60.0 15.1 4.8 83 96 A H H X S+ 0 0 1 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.920 119.2 38.5 -79.8 -43.1 63.0 17.4 5.1 84 97 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -3,-0.2 0.906 117.1 52.8 -70.7 -40.9 61.7 20.7 3.7 85 98 A G H X S+ 0 0 0 -4,-2.1 4,-0.6 -5,-0.3 -2,-0.2 0.906 114.8 39.5 -61.1 -46.1 58.3 20.2 5.3 86 99 A S H >X S+ 0 0 0 -4,-1.4 3,-0.9 -5,-0.4 4,-0.5 0.913 113.1 55.4 -70.4 -42.1 59.8 19.6 8.8 87 100 A A H >< S+ 0 0 2 -4,-2.0 3,-1.1 1,-0.3 -2,-0.2 0.865 102.4 57.0 -58.5 -37.0 62.4 22.3 8.4 88 101 A A H 3< S+ 0 0 8 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.746 103.2 55.6 -66.6 -28.2 59.8 24.9 7.5 89 102 A A H << S+ 0 0 0 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.536 96.4 83.9 -78.5 -12.2 58.1 24.1 10.9 90 103 A L S << S- 0 0 12 -3,-1.1 2,-0.2 -4,-0.5 156,-0.1 -0.548 84.1-110.9 -89.5 160.2 61.2 24.8 12.9 91 104 A D > - 0 0 71 -2,-0.2 3,-1.8 1,-0.1 82,-0.1 -0.589 37.5-110.7 -75.7 148.7 62.6 28.1 14.2 92 105 A N T 3 S+ 0 0 130 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.759 116.8 46.8 -49.1 -35.1 65.8 29.1 12.4 93 106 A T T 3 S+ 0 0 69 2,-0.1 -1,-0.3 0, 0.0 2,-0.3 0.327 78.1 120.1 -98.4 4.7 67.9 28.5 15.5 94 107 A D S < S- 0 0 0 -3,-1.8 2,-0.3 78,-0.1 80,-0.2 -0.569 70.4-117.4 -65.6 133.2 66.4 25.1 16.5 95 108 A L E -b 174 0A 7 78,-1.3 80,-2.4 -2,-0.3 2,-0.4 -0.608 27.7-154.0 -84.5 134.2 69.4 22.7 16.4 96 109 A V E -bc 175 144A 0 47,-2.5 49,-2.9 -2,-0.3 2,-0.4 -0.895 13.2-176.9-113.0 135.4 69.4 19.9 14.0 97 110 A F E +b 176 0A 4 78,-2.4 80,-2.5 -2,-0.4 2,-0.2 -0.953 24.6 140.4-122.8 145.4 71.1 16.5 14.2 98 111 A G - 0 0 4 47,-0.4 50,-0.4 -2,-0.4 56,-0.2 -0.752 39.8-126.8-157.4-160.6 70.9 14.0 11.4 99 112 A Q - 0 0 6 -2,-0.2 3,-0.3 48,-0.1 -1,-0.1 -0.038 68.4 -40.1-135.2-117.5 72.5 11.3 9.1 100 113 A Y S S+ 0 0 49 1,-0.2 3,-0.2 2,-0.1 -26,-0.1 0.561 121.6 55.3-104.1 -11.8 72.7 11.1 5.3 101 114 A R S S+ 0 0 65 1,-0.1 3,-0.3 2,-0.1 -1,-0.2 0.046 80.4 90.3-114.0 23.6 69.2 12.2 4.0 102 115 A E >> + 0 0 0 -3,-0.3 3,-1.9 1,-0.2 4,-1.0 0.301 42.9 110.0-108.6 10.7 69.0 15.6 5.7 103 116 A A H 3> S+ 0 0 5 1,-0.3 4,-2.3 -3,-0.2 -1,-0.2 0.788 72.1 67.1 -57.9 -30.1 70.5 17.9 3.0 104 117 A G H 3> S+ 0 0 1 -3,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.753 94.3 58.5 -59.1 -31.3 67.0 19.4 2.3 105 118 A V H <> S+ 0 0 0 -3,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.937 109.2 43.8 -62.7 -49.8 67.1 20.9 5.8 106 119 A L H <>S+ 0 0 0 -4,-1.0 5,-2.5 2,-0.2 -2,-0.2 0.912 112.3 52.8 -56.1 -44.1 70.2 22.7 4.9 107 120 A M H ><5S+ 0 0 8 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.939 108.1 49.7 -63.9 -43.5 68.8 23.7 1.6 108 121 A Y H 3<5S+ 0 0 18 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.874 107.7 56.0 -60.3 -37.3 65.7 25.1 3.2 109 122 A R T 3<5S- 0 0 21 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.225 122.1-109.2 -80.1 15.9 68.0 27.0 5.5 110 123 A D T < 5 + 0 0 101 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.754 50.4 176.0 63.4 34.0 69.7 28.6 2.5 111 124 A Y < - 0 0 12 -5,-2.5 -1,-0.2 -6,-0.1 2,-0.1 -0.508 39.4-105.1 -65.8 130.4 73.0 26.7 2.8 112 125 A P >> - 0 0 47 0, 0.0 4,-1.7 0, 0.0 3,-1.2 -0.335 10.2-133.3 -64.2 139.9 75.0 27.8 -0.3 113 126 A L H 3> S+ 0 0 25 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.872 108.4 63.6 -51.9 -40.5 75.4 25.4 -3.3 114 127 A E H 3> S+ 0 0 73 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.832 104.7 44.9 -56.6 -34.5 79.1 26.4 -3.1 115 128 A L H <> S+ 0 0 33 -3,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.824 108.8 52.7 -87.1 -33.5 79.4 24.9 0.4 116 129 A F H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 19,-0.3 0.959 116.1 44.0 -55.6 -49.1 77.6 21.6 -0.4 117 130 A M H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.909 108.5 56.5 -63.1 -42.9 80.0 21.3 -3.3 118 131 A A H X>S+ 0 0 0 -4,-2.2 5,-1.9 -5,-0.2 4,-1.0 0.863 108.7 48.0 -58.9 -39.2 83.1 22.3 -1.2 119 132 A Q H ><5S+ 0 0 8 -4,-1.8 3,-0.6 2,-0.2 -1,-0.2 0.949 111.7 48.5 -69.8 -47.0 82.4 19.5 1.3 120 133 A C H 3<5S+ 0 0 7 -4,-2.0 -49,-0.4 1,-0.2 -2,-0.2 0.881 119.3 39.2 -59.7 -36.1 81.9 16.9 -1.4 121 134 A Y H 3<5S- 0 0 17 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.534 100.4-132.9 -87.0 -10.5 85.1 18.0 -3.2 122 135 A G T <<5 + 0 0 16 -4,-1.0 -3,-0.2 -3,-0.6 -4,-0.1 0.917 52.0 160.6 59.3 36.6 87.1 18.6 0.1 123 136 A N > < - 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0 0 10 -6,-2.0 2,-0.6 -9,-0.1 -1,-0.2 -0.696 42.6-141.8 -95.6 132.8 120.9 2.8 44.3 598 248 B S - 0 0 43 -2,-0.3 -27,-2.4 -3,-0.1 -26,-1.1 -0.867 21.9-160.2 -93.0 118.8 119.6 6.4 43.8 599 249 B C E - r 0 572F 8 -2,-0.6 2,-0.6 -11,-0.2 -26,-0.2 -0.828 14.4-148.6-107.8 133.6 116.1 6.3 42.1 600 250 B E E - r 0 573F 9 -28,-3.3 -26,-3.1 -2,-0.4 2,-0.5 -0.882 22.1-155.3 -95.6 123.5 114.5 9.2 40.3 601 251 B V E -Qr 567 574F 0 -34,-2.2 -35,-2.2 -2,-0.6 -34,-1.2 -0.883 12.3-174.9-110.5 124.5 110.7 8.7 40.8 602 252 B I E -Qr 565 575F 0 -28,-2.7 -26,-1.7 -2,-0.5 2,-0.6 -0.970 19.3-153.4-125.9 130.2 108.2 10.2 38.4 603 253 B D E -Qr 564 576F 0 -39,-2.7 -39,-2.6 -2,-0.4 -26,-0.2 -0.914 9.7-159.8 -93.5 114.5 104.4 10.4 38.4 604 254 B L + 0 0 0 -28,-2.6 2,-2.6 -2,-0.6 7,-0.3 0.863 18.2 175.7 -62.8 -44.7 103.3 10.6 34.8 605 255 B R + 0 0 20 -29,-0.3 -91,-3.1 -91,-0.2 2,-0.6 -0.278 60.7 57.3 72.7 -62.6 99.9 12.0 35.7 606 256 B T E -P 513 0E 0 -2,-2.6 5,-0.4 -93,-0.2 -93,-0.2 -0.910 60.8-171.0-104.1 121.9 98.6 12.5 32.1 607 257 B I E + 0 0 0 -95,-2.3 3,-0.4 -2,-0.6 -94,-0.2 0.910 69.7 50.0 -78.0 -46.9 98.6 9.4 30.0 608 258 B I E S+P 512 0E 17 -96,-1.2 -96,-1.7 1,-0.4 -1,-0.3 -0.980 115.3 21.9-140.3 141.1 97.8 11.3 26.7 609 259 B P S S- 0 0 24 0, 0.0 -1,-0.4 0, 0.0 2,-0.2 0.626 101.1-163.6 -66.2 133.2 99.2 13.7 25.6 610 260 B W - 0 0 29 -3,-0.4 2,-1.8 1,-0.1 3,-0.2 -0.565 27.7-105.3 -97.4 158.5 102.0 12.6 27.8 611 261 B D > + 0 0 10 -5,-0.4 4,-1.5 -7,-0.3 3,-0.2 -0.556 43.9 166.0 -83.0 80.2 105.2 14.4 29.0 612 262 B V H > S+ 0 0 7 -2,-1.8 4,-2.6 1,-0.2 5,-0.2 0.856 71.8 59.1 -60.7 -37.2 107.8 12.8 26.8 613 263 B D H > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.885 103.8 47.4 -70.5 -40.1 110.3 15.6 27.6 614 264 B T H > S+ 0 0 36 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.929 115.2 46.1 -66.8 -41.8 110.3 15.0 31.4 615 265 B I H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.928 114.8 46.2 -69.5 -44.1 110.7 11.3 31.0 616 266 B C H X S+ 0 0 14 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.905 110.0 53.9 -65.9 -41.5 113.5 11.5 28.4 617 267 B K H X S+ 0 0 166 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.896 110.5 48.2 -58.5 -40.1 115.4 14.2 30.4 618 268 B S H X S+ 0 0 4 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.937 111.0 49.1 -67.6 -42.0 115.4 11.9 33.4 619 269 B V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.777 104.8 57.9 -71.4 -26.5 116.6 8.9 31.4 620 270 B I H < S+ 0 0 79 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.950 112.7 43.2 -67.1 -44.7 119.4 10.9 29.8 621 271 B K H < S+ 0 0 110 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.938 126.3 29.0 -61.6 -50.6 120.7 11.6 33.3 622 272 B T H < S- 0 0 8 -4,-2.6 -3,-0.2 2,-0.1 -2,-0.2 0.792 85.1-145.2 -86.6 -31.9 120.2 8.1 34.8 623 273 B G S < S+ 0 0 2 -4,-2.5 31,-2.8 -5,-0.2 32,-0.7 0.466 70.6 76.9 76.5 4.0 120.6 5.9 31.8 624 274 B R - 0 0 29 29,-0.2 -51,-2.4 -6,-0.2 2,-0.4 -0.998 55.8-168.0-147.0 150.3 118.1 3.3 33.0 625 275 B L E -s 573 0F 0 -2,-0.3 33,-2.3 -53,-0.2 2,-0.4 -0.998 9.6-179.6-144.7 133.0 114.3 3.1 33.1 626 276 B L E -st 574 658F 2 -53,-2.3 -51,-2.2 -2,-0.4 2,-0.4 -0.999 12.3-166.4-129.8 131.1 111.7 0.9 34.7 627 277 B I E -st 575 659F 0 31,-2.4 33,-2.7 -2,-0.4 2,-0.4 -0.954 6.3-169.2-118.6 140.4 108.0 1.5 34.1 628 278 B S E + t 0 660F 0 -53,-2.3 -51,-0.4 -2,-0.4 2,-0.3 -0.983 13.0 157.0-134.2 137.9 105.3 -0.0 36.2 629 279 B H E - t 0 661F 2 31,-1.4 33,-1.1 -2,-0.4 -51,-0.1 -0.983 43.0-128.0-154.1 153.9 101.5 -0.3 35.9 630 280 B E E S+ 0 0 5 -2,-0.3 3,-0.1 31,-0.2 -1,-0.1 0.798 83.2 93.6 -64.9 -33.6 98.7 -2.5 37.1 631 281 B A E S- 0 0 6 1,-0.1 31,-1.6 30,-0.1 -2,-0.2 -0.202 95.1 -78.6 -59.0 151.7 97.3 -3.0 33.6 632 282 B P E - t 0 662F 49 0, 0.0 31,-0.2 0, 0.0 32,-0.1 -0.130 38.0-123.5 -51.4 147.9 98.4 -6.0 31.6 633 283 B L S > S+ 0 0 52 29,-1.6 3,-2.1 28,-0.1 6,-0.3 0.950 88.8 80.9 -58.6 -55.4 101.8 -5.8 30.0 634 284 B T T 3 S- 0 0 103 1,-0.3 3,-0.1 4,-0.1 4,-0.0 -0.349 115.9 -3.8 -69.7 117.4 100.8 -6.5 26.4 635 285 B G T 3 S+ 0 0 60 1,-0.2 -1,-0.3 -2,-0.2 -2,-0.1 0.491 100.4 144.0 84.5 -0.8 99.5 -3.3 24.7 636 286 B G X> - 0 0 5 -3,-2.1 3,-1.6 -4,-0.1 4,-0.5 -0.248 67.8-105.3 -69.4 161.3 99.8 -1.5 28.0 637 287 B F H >> S+ 0 0 8 1,-0.3 4,-1.8 2,-0.2 3,-0.8 0.758 114.3 73.5 -66.0 -21.7 100.9 2.1 28.2 638 288 B A H 3> S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.843 89.6 61.7 -57.8 -31.0 104.4 1.1 29.3 639 289 B S H <> S+ 0 0 37 -3,-1.6 4,-2.5 -6,-0.3 -1,-0.2 0.868 103.6 47.5 -61.4 -40.1 105.0 -0.1 25.8 640 290 B E H X S+ 0 0 1 -4,-2.4 3,-1.7 -5,-0.2 4,-1.1 0.063 70.5 127.2-129.0 19.0 117.6 8.1 24.4 650 300 B F T 3< S+ 0 0 142 -4,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.809 75.4 51.9 -55.1 -38.0 119.3 5.2 22.6 651 301 B L T 34 S+ 0 0 166 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.659 114.5 44.7 -75.0 -17.9 122.9 6.5 23.2 652 302 B N T <4 S+ 0 0 53 -3,-1.7 2,-0.6 2,-0.0 -1,-0.2 0.582 83.4 105.6 -99.7 -12.3 122.2 6.9 27.0 653 303 B L < + 0 0 37 -4,-1.1 -29,-0.2 -3,-0.4 -30,-0.1 -0.623 39.8 179.4 -82.2 119.4 120.5 3.6 27.8 654 304 B E + 0 0 120 -31,-2.8 -1,-0.2 -2,-0.6 -30,-0.1 0.612 69.1 18.6 -92.3 -14.2 122.8 1.3 29.6 655 305 B A S S- 0 0 7 -32,-0.7 -30,-0.2 3,-0.0 -1,-0.1 -0.956 94.8 -79.6-149.4 158.6 120.3 -1.5 30.0 656 306 B P - 0 0 76 0, 0.0 2,-0.2 0, 0.0 -31,-0.2 -0.335 56.4-101.8 -58.8 143.0 117.0 -2.7 28.4 657 307 B I - 0 0 28 -33,-0.1 2,-0.3 -15,-0.1 -31,-0.2 -0.509 36.5-136.1 -69.4 135.2 114.0 -0.8 29.7 658 308 B S E -t 626 0F 23 -33,-2.3 -31,-2.4 -2,-0.2 2,-0.5 -0.743 14.8-166.5 -91.9 139.5 112.0 -2.8 32.3 659 309 B R E -t 627 0F 86 -2,-0.3 2,-0.7 -33,-0.2 -31,-0.2 -0.979 3.3-174.1-120.6 117.8 108.2 -3.1 32.3 660 310 B V E +t 628 0F 16 -33,-2.7 -31,-1.4 -2,-0.5 2,-0.2 -0.919 31.4 142.5-109.6 104.6 106.8 -4.4 35.5 661 311 B C E -t 629 0F 15 -2,-0.7 -31,-0.2 -33,-0.2 -28,-0.1 -0.766 54.2 -68.5-131.9 176.9 103.0 -4.8 34.9 662 312 B G E -t 632 0F 1 -31,-1.6 -29,-1.6 -33,-1.1 14,-0.1 -0.290 62.4 -98.1 -58.5 153.9 100.0 -6.9 35.5 663 313 B Y - 0 0 123 12,-0.5 2,-2.0 -31,-0.2 -1,-0.1 -0.315 39.3 -96.2 -69.5 164.3 100.0 -10.3 33.8 664 314 B D S S+ 0 0 89 -32,-0.1 -1,-0.1 -3,-0.1 -33,-0.0 -0.373 93.6 93.0 -82.7 64.6 98.2 -10.8 30.4 665 315 B T S S- 0 0 67 -2,-2.0 2,-0.0 10,-0.1 -3,-0.0 -0.882 86.9 -84.0-139.0 167.2 95.1 -12.2 32.1 666 316 B P - 0 0 90 0, 0.0 -172,-0.1 0, 0.0 -3,-0.1 -0.348 62.9 -86.8 -67.9 161.8 91.8 -10.8 33.3 667 317 B F - 0 0 16 -173,-0.3 -171,-0.1 -174,-0.1 -170,-0.1 -0.669 52.2-141.0 -79.4 113.5 92.0 -9.4 36.8 668 318 B P - 0 0 22 0, 0.0 -175,-0.5 0, 0.0 4,-0.1 -0.320 11.0-146.1 -82.9 157.4 91.4 -12.2 39.3 669 319 B H S > S+ 0 0 110 -177,-0.1 3,-1.4 2,-0.1 -176,-0.2 0.969 94.5 23.2 -74.8 -75.0 89.5 -12.3 42.5 670 320 B I T 3 S+ 0 0 120 1,-0.3 -1,-0.1 2,-0.1 -179,-0.0 0.780 123.2 55.1 -70.3 -26.7 91.3 -14.7 44.9 671 321 B F T >> + 0 0 129 1,-0.2 3,-1.7 2,-0.1 4,-0.9 0.278 68.9 114.9 -89.9 8.0 94.6 -14.4 43.2 672 322 B E H X> S+ 0 0 7 -3,-1.4 4,-1.8 1,-0.3 3,-1.5 0.868 71.1 58.5 -51.4 -44.2 95.0 -10.6 43.4 673 323 B P H 34 S+ 0 0 84 0, 0.0 -1,-0.3 0, 0.0 5,-0.2 0.804 111.7 42.4 -56.9 -28.9 98.0 -10.7 45.7 674 324 B F H <4 S+ 0 0 152 -3,-1.7 -2,-0.2 1,-0.1 -3,-0.1 0.536 113.3 54.0 -87.5 -13.5 99.9 -12.8 43.1 675 325 B Y H << S+ 0 0 6 -3,-1.5 -12,-0.5 -4,-0.9 -3,-0.1 0.853 85.8 86.7 -90.0 -42.9 98.7 -10.7 40.1 676 326 B I S < S- 0 0 11 -4,-1.8 2,-2.0 1,-0.1 5,-0.1 -0.270 83.5-115.5 -71.6 146.1 99.6 -7.1 40.9 677 327 B P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -15,-0.1 -0.569 53.5-178.0 -77.7 76.2 103.1 -5.6 40.1 678 328 B D > - 0 0 34 -2,-2.0 4,-2.4 -5,-0.2 3,-0.4 -0.120 43.2 -87.2 -78.1-179.8 103.9 -5.2 43.8 679 329 B K H > S+ 0 0 56 -322,-0.4 4,-2.5 1,-0.2 5,-0.1 0.793 126.6 51.8 -60.6 -30.8 107.0 -3.6 45.4 680 330 B W H > S+ 0 0 133 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.863 109.7 47.9 -75.8 -38.1 108.9 -7.0 45.4 681 331 B K H > S+ 0 0 54 -3,-0.4 4,-1.5 2,-0.2 -2,-0.2 0.920 116.8 43.3 -68.2 -43.3 108.2 -7.6 41.8 682 332 B C H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.889 114.3 51.3 -64.0 -42.3 109.3 -4.0 40.9 683 333 B Y H X S+ 0 0 27 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.928 109.4 49.0 -65.2 -44.6 112.3 -4.3 43.3 684 334 B D H X S+ 0 0 61 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.863 112.5 47.6 -65.1 -34.8 113.5 -7.6 41.8 685 335 B A H X S+ 0 0 22 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.886 111.5 51.0 -73.8 -35.4 113.3 -6.2 38.3 686 336 B L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.898 108.7 52.4 -65.2 -42.1 115.1 -3.1 39.3 687 337 B R H X S+ 0 0 81 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.941 110.9 46.3 -59.6 -51.4 117.8 -5.2 40.9 688 338 B K H < S+ 0 0 113 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.872 112.5 50.6 -60.2 -38.6 118.3 -7.2 37.7 689 339 B M H >< S+ 0 0 11 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.914 109.3 49.9 -66.7 -46.2 118.4 -4.1 35.6 690 340 B I H 3< S+ 0 0 41 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.884 110.9 51.2 -56.4 -40.4 121.0 -2.4 37.9 691 341 B N T 3< 0 0 108 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.439 360.0 360.0 -75.7 -2.9 123.1 -5.6 37.6 692 342 B Y < 0 0 191 -3,-1.3 -3,-0.0 -4,-0.2 -38,-0.0 -0.483 360.0 360.0 -67.2 360.0 122.9 -5.5 33.8