==== 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 HYDROLASE 08-DEC-99 1DL2 . COMPND 2 MOLECULE: CLASS I ALPHA-1,2-MANNOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR F.VALLEE,F.LIPARI,P.YIP,A.HERSCOVICS,P.L.HOWELL . 510 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18792.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 352 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 20 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 39.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.7 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 2 2 1 0 3 0 1 1 0 1 2 0 1 3 0 1 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 5 6 5 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 . 4 4 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 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 34 A G > 0 0 88 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 143.7 -13.6 85.9 12.6 2 35 A A H > + 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.915 360.0 51.1 -55.6 -47.4 -10.9 84.0 10.5 3 36 A G H > S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.864 110.9 49.3 -59.8 -37.5 -8.6 83.4 13.5 4 37 A E H > S+ 0 0 114 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.894 109.4 50.0 -68.8 -42.5 -11.5 82.1 15.6 5 38 A M H X S+ 0 0 27 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.877 109.4 54.5 -63.6 -33.2 -12.6 79.7 12.9 6 39 A R H X S+ 0 0 35 -4,-2.2 4,-2.6 -5,-0.2 5,-0.2 0.927 107.2 49.2 -62.5 -48.1 -8.9 78.6 12.7 7 40 A D H X S+ 0 0 36 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.878 112.1 49.1 -60.4 -39.3 -9.0 77.9 16.5 8 41 A R H X S+ 0 0 130 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.886 112.0 46.3 -70.3 -39.7 -12.1 75.8 16.1 9 42 A I H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.899 113.3 49.7 -69.8 -39.5 -10.9 73.8 13.2 10 43 A E H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.885 110.6 52.4 -63.8 -37.5 -7.6 73.2 15.0 11 44 A S H X S+ 0 0 24 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.906 109.2 47.8 -64.1 -43.9 -9.7 72.2 18.0 12 45 A M H X S+ 0 0 10 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.918 112.5 49.6 -64.0 -43.7 -11.7 69.7 16.0 13 46 A F H X S+ 0 0 0 -4,-2.5 4,-3.2 1,-0.2 -2,-0.2 0.944 112.5 47.1 -60.1 -48.9 -8.5 68.2 14.5 14 47 A L H X S+ 0 0 0 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.839 107.8 55.5 -64.4 -33.0 -6.9 67.9 17.9 15 48 A E H X S+ 0 0 15 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.945 114.4 40.7 -65.1 -43.5 -10.0 66.3 19.4 16 49 A S H X S+ 0 0 2 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.928 118.5 47.8 -67.0 -44.0 -9.8 63.6 16.6 17 50 A W H X S+ 0 0 0 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.876 109.2 50.7 -66.2 -41.1 -6.0 63.4 16.9 18 51 A R H X S+ 0 0 97 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.904 112.7 47.8 -64.4 -40.8 -5.8 63.1 20.7 19 52 A D H X S+ 0 0 18 -4,-1.6 4,-2.3 -5,-0.3 5,-0.4 0.920 114.1 46.1 -66.3 -43.7 -8.4 60.3 20.6 20 53 A Y H X S+ 0 0 1 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.918 113.5 48.9 -64.4 -44.6 -6.6 58.5 17.8 21 54 A S H < S+ 0 0 18 -4,-2.8 4,-0.5 1,-0.2 -1,-0.2 0.878 113.3 48.2 -63.6 -37.1 -3.2 58.9 19.5 22 55 A K H < S+ 0 0 153 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.918 129.5 16.5 -70.2 -43.5 -4.6 57.7 22.8 23 56 A H H < S+ 0 0 76 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.793 134.4 25.5-104.1 -35.2 -6.3 54.6 21.5 24 57 A G S >< S+ 0 0 0 -4,-2.3 3,-2.3 -5,-0.4 -3,-0.2 0.054 71.2 161.7-123.9 30.9 -5.1 53.6 18.0 25 58 A W T 3 S+ 0 0 43 -4,-0.5 3,-0.1 1,-0.3 -4,-0.1 -0.260 73.6 11.6 -56.0 125.2 -1.6 55.0 17.7 26 59 A G T 3 S+ 0 0 7 1,-0.3 2,-0.3 2,-0.0 22,-0.3 0.380 99.9 124.0 89.9 -3.8 0.3 53.4 14.9 27 60 A Y < - 0 0 88 -3,-2.3 23,-0.3 -7,-0.2 -1,-0.3 -0.723 57.1-145.1 -98.1 144.2 -2.7 51.7 13.4 28 61 A D S S+ 0 0 3 -2,-0.3 2,-0.4 21,-0.1 11,-0.2 0.808 87.1 39.5 -68.5 -38.1 -4.0 51.9 9.8 29 62 A V E -A 38 0A 32 9,-2.4 9,-1.5 430,-0.1 2,-0.4 -0.964 68.3-179.1-121.6 135.6 -7.7 51.7 10.6 30 63 A Y E -A 37 0A 0 428,-0.5 428,-2.6 -2,-0.4 7,-0.2 -0.991 18.0-158.5-142.3 132.7 -9.4 53.3 13.5 31 64 A G E >> -A 36 0A 3 5,-3.1 4,-1.3 -2,-0.4 5,-1.1 -0.932 6.0-165.3-109.6 111.4 -13.0 53.4 14.8 32 65 A P T 45S+ 0 0 1 0, 0.0 -1,-0.1 0, 0.0 424,-0.1 0.802 82.7 60.2 -64.0 -34.3 -13.7 56.4 17.1 33 66 A I T 45S+ 0 0 58 1,-0.2 423,-0.1 422,-0.2 409,-0.0 0.962 124.0 18.2 -60.9 -53.2 -16.9 55.1 18.6 34 67 A E T 45S- 0 0 129 2,-0.1 -1,-0.2 -3,-0.0 3,-0.1 0.466 100.8-125.1 -97.6 -3.7 -15.5 51.9 20.1 35 68 A H T <5 + 0 0 61 -4,-1.3 2,-0.2 1,-0.2 -2,-0.1 0.829 60.0 149.9 61.7 34.1 -11.8 53.1 20.0 36 69 A T E < +A 31 0A 64 -5,-1.1 -5,-3.1 420,-0.1 2,-0.3 -0.608 20.2 174.5 -97.9 158.1 -10.9 50.0 18.1 37 70 A S E +A 30 0A 41 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.993 12.3 169.7-158.7 161.6 -8.1 49.6 15.5 38 71 A H E -A 29 0A 101 -9,-1.5 -9,-2.4 -2,-0.3 2,-0.3 -0.967 32.1-107.5-164.7 165.1 -6.2 47.2 13.2 39 72 A N - 0 0 15 -2,-0.3 5,-0.1 -11,-0.2 6,-0.1 -0.696 21.1-132.0-100.8 158.0 -3.7 47.3 10.4 40 73 A M S S+ 0 0 97 -2,-0.3 -1,-0.1 5,-0.1 -13,-0.0 0.903 76.5 89.6 -77.4 -44.2 -4.4 46.5 6.8 41 74 A P S > S- 0 0 11 0, 0.0 3,-2.9 0, 0.0 -2,-0.1 -0.275 82.1-123.7 -58.4 139.2 -1.7 44.0 5.8 42 75 A R T 3 S+ 0 0 109 1,-0.3 51,-0.1 2,-0.1 -3,-0.1 0.819 113.8 55.9 -51.1 -33.9 -2.5 40.4 6.5 43 76 A G T 3 S- 0 0 58 49,-0.1 -1,-0.3 2,-0.1 -3,-0.1 0.456 113.7-119.6 -80.4 -1.9 0.6 40.2 8.6 44 77 A N < + 0 0 92 -3,-2.9 -2,-0.1 1,-0.3 -4,-0.1 0.578 63.0 144.4 75.6 11.4 -0.6 43.1 10.8 45 78 A Q - 0 0 76 1,-0.1 -1,-0.3 -6,-0.1 -5,-0.1 -0.613 52.4-111.1 -79.8 144.1 2.4 45.4 10.0 46 79 A P - 0 0 27 0, 0.0 42,-0.5 0, 0.0 -19,-0.1 -0.398 21.3-165.8 -77.1 152.4 1.4 49.0 9.8 47 80 A L - 0 0 5 -2,-0.1 -20,-0.1 40,-0.1 42,-0.0 0.491 44.8-117.7-108.0 -11.6 1.4 51.1 6.7 48 81 A G >> + 0 0 2 -22,-0.3 4,-2.0 3,-0.1 5,-0.7 0.719 55.6 162.0 77.6 25.5 1.1 54.4 8.5 49 82 A W T 45S+ 0 0 23 1,-0.2 4,-0.3 2,-0.2 -21,-0.1 0.798 73.5 25.1 -47.5 -41.9 -2.2 55.0 6.8 50 83 A I T >5S+ 0 0 2 -23,-0.3 4,-1.4 2,-0.1 -1,-0.2 0.894 123.4 48.9 -93.1 -46.1 -3.4 57.6 9.3 51 84 A I H >>5S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 3,-0.5 0.948 115.0 42.5 -59.7 -54.4 -0.2 59.0 10.7 52 85 A V H 3<5S+ 0 0 1 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.858 113.6 52.8 -62.5 -35.9 1.6 59.6 7.3 53 86 A D H 34 S+ 0 0 0 -4,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.817 107.4 54.5 -65.7 -26.8 1.5 67.7 6.8 57 90 A T H <> S+ 0 0 0 -3,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.892 107.6 51.2 -70.9 -36.2 -1.8 68.9 8.3 58 91 A L H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.914 110.9 48.9 -63.7 -41.7 -0.0 68.9 11.7 59 92 A M H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.896 110.2 50.0 -65.8 -41.5 2.7 71.0 10.1 60 93 A L H X S+ 0 0 16 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.916 115.7 42.5 -64.0 -43.2 0.3 73.5 8.5 61 94 A M H >X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 3,-0.9 0.887 110.2 56.1 -71.2 -38.1 -1.5 74.0 11.8 62 95 A Y H 3< S+ 0 0 37 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.879 104.5 57.7 -58.3 -36.9 1.7 74.1 13.8 63 96 A N H 3< S+ 0 0 76 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.740 121.9 19.5 -67.6 -25.9 2.7 76.9 11.5 64 97 A S H << S+ 0 0 36 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.457 89.0 121.9-124.5 -4.2 -0.3 79.2 12.2 65 98 A S < + 0 0 8 -4,-2.4 -58,-0.0 1,-0.1 -62,-0.0 -0.336 30.6 179.9 -64.5 140.9 -1.7 78.0 15.6 66 99 A T S S+ 0 0 108 -63,-0.1 -1,-0.1 3,-0.1 -4,-0.0 0.558 83.6 35.1-113.3 -18.6 -1.9 80.6 18.3 67 100 A L S S+ 0 0 104 2,-0.0 3,-0.1 1,-0.0 4,-0.1 0.720 130.5 24.4-106.8 -29.1 -3.5 78.4 21.0 68 101 A Y S > S+ 0 0 59 -7,-0.1 4,-2.5 1,-0.1 3,-0.5 0.153 73.9 124.0-126.5 21.5 -2.0 74.9 20.3 69 102 A K H > S+ 0 0 84 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.880 79.9 50.2 -49.7 -43.6 1.3 75.6 18.6 70 103 A S H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.871 110.1 49.4 -65.0 -37.9 3.2 73.6 21.2 71 104 A E H > S+ 0 0 52 -3,-0.5 4,-2.4 2,-0.2 5,-0.2 0.948 110.4 50.0 -67.4 -47.2 0.9 70.6 21.0 72 105 A F H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.899 109.6 52.5 -57.9 -40.8 1.1 70.5 17.2 73 106 A E H X S+ 0 0 85 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.924 109.6 47.9 -62.0 -44.1 4.9 70.6 17.4 74 107 A A H X S+ 0 0 52 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.883 111.3 50.8 -63.9 -39.1 5.0 67.7 19.9 75 108 A E H X S+ 0 0 32 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.822 106.7 54.0 -69.1 -31.6 2.7 65.6 17.7 76 109 A I H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.2 -1,-0.2 0.927 111.2 46.7 -66.4 -42.3 4.8 66.3 14.7 77 110 A Q H X S+ 0 0 58 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.914 111.4 51.2 -63.9 -43.3 7.8 64.9 16.7 78 111 A R H X S+ 0 0 105 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.934 113.8 44.4 -59.0 -47.5 5.7 61.9 17.8 79 112 A S H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.902 112.7 51.5 -64.6 -43.0 4.7 61.2 14.2 80 113 A E H X S+ 0 0 11 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.899 109.2 48.5 -63.4 -43.9 8.2 61.7 12.8 81 114 A H H X S+ 0 0 103 -4,-2.5 4,-3.2 2,-0.2 5,-0.4 0.891 113.2 48.9 -64.6 -38.3 9.9 59.3 15.3 82 115 A W H X>S+ 0 0 20 -4,-1.7 4,-2.5 -5,-0.2 5,-2.2 0.930 111.1 49.0 -66.7 -45.4 7.3 56.7 14.6 83 116 A I H <5S+ 0 0 0 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.884 119.0 40.7 -60.9 -37.5 7.7 57.0 10.9 84 117 A N H <5S+ 0 0 84 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.909 128.1 26.3 -78.9 -43.0 11.5 56.8 11.3 85 118 A D H <5S+ 0 0 118 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.738 132.4 23.2 -95.6 -27.7 11.7 54.0 14.0 86 119 A V T <5S+ 0 0 80 -4,-2.5 -3,-0.2 -5,-0.4 -4,-0.1 0.841 94.4 88.1-106.3 -52.8 8.6 51.9 13.6 87 120 A L < + 0 0 5 -5,-2.2 2,-0.3 -42,-0.1 -40,-0.1 -0.250 49.6 173.6 -54.3 131.1 7.2 52.2 10.1 88 121 A D - 0 0 85 -42,-0.5 -4,-0.0 1,-0.1 -40,-0.0 -0.911 22.2-166.4-145.8 112.8 8.7 49.7 7.7 89 122 A F + 0 0 1 -2,-0.3 2,-2.5 1,-0.1 -1,-0.1 0.435 64.1 103.9 -81.6 1.6 7.4 49.2 4.2 90 123 A D + 0 0 65 2,-0.1 2,-0.5 66,-0.0 66,-0.1 -0.533 55.9 152.1 -81.4 75.2 9.3 46.0 3.6 91 124 A I - 0 0 2 -2,-2.5 2,-2.3 2,-0.1 65,-1.0 -0.932 52.9-136.0-114.9 129.2 5.9 44.2 4.1 92 125 A D S S+ 0 0 115 -2,-0.5 2,-0.3 63,-0.2 -49,-0.1 -0.506 72.5 102.2 -80.6 72.8 5.0 40.8 2.5 93 126 A A S S- 0 0 9 -2,-2.3 62,-1.9 -51,-0.1 2,-0.4 -0.989 73.4-114.6-154.9 148.8 1.6 42.1 1.5 94 127 A E E -B 154 0B 93 -2,-0.3 2,-0.3 60,-0.2 60,-0.3 -0.740 37.0-177.4 -88.2 129.9 -0.2 43.3 -1.6 95 128 A V E -B 153 0B 14 58,-2.6 58,-2.1 -2,-0.4 2,-0.4 -0.917 35.6 -97.3-127.3 154.9 -1.3 46.9 -1.6 96 129 A N E > -B 152 0B 42 -2,-0.3 4,-2.2 56,-0.2 5,-0.3 -0.572 28.2-147.0 -71.7 124.2 -3.2 49.1 -4.0 97 130 A V H > S+ 0 0 4 54,-2.5 4,-2.1 -2,-0.4 5,-0.2 0.923 95.1 49.1 -58.1 -46.5 -0.6 51.0 -6.0 98 131 A F H > S+ 0 0 26 53,-0.5 4,-2.9 2,-0.2 5,-0.3 0.968 113.7 42.4 -59.5 -58.3 -2.9 54.1 -6.3 99 132 A E H >>S+ 0 0 54 1,-0.2 4,-2.5 2,-0.2 5,-0.6 0.908 116.4 48.1 -58.1 -44.4 -3.9 54.4 -2.7 100 133 A T H X>S+ 0 0 1 -4,-2.2 5,-2.4 3,-0.2 4,-0.7 0.867 114.2 48.4 -66.0 -34.9 -0.4 53.8 -1.4 101 134 A T H <>S+ 0 0 0 -4,-2.1 5,-2.3 -5,-0.3 -2,-0.2 0.949 116.7 39.5 -70.4 -49.3 1.0 56.3 -3.8 102 135 A I H <5S+ 0 0 4 -4,-2.9 386,-0.3 -5,-0.2 -2,-0.2 0.857 128.6 29.5 -72.7 -33.7 -1.4 59.1 -3.2 103 136 A R H X5S+ 0 0 22 -4,-2.5 4,-1.5 -5,-0.3 -3,-0.2 0.936 132.3 24.0 -89.9 -57.6 -1.6 58.7 0.6 104 137 A M H XS+ 0 0 5 -4,-2.3 5,-0.9 -5,-0.2 4,-0.7 0.894 114.0 45.1 -62.5 -36.8 9.5 70.2 6.9 116 149 A D H <5S+ 0 0 69 -4,-2.1 3,-0.3 -5,-0.2 -2,-0.2 0.973 119.8 34.9 -70.4 -59.1 11.8 72.0 4.5 117 150 A V H <5S+ 0 0 82 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.754 126.0 41.3 -71.8 -24.9 9.9 75.3 3.9 118 151 A L H <5S- 0 0 36 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.531 98.8-135.9 -99.6 -7.6 8.6 75.5 7.5 119 152 A E T <5 + 0 0 175 -4,-0.7 2,-0.4 -3,-0.3 -3,-0.2 0.911 58.1 132.8 52.1 49.5 11.9 74.3 9.1 120 153 A V < - 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0 0 116 -5,-0.1 -5,-2.2 -6,-0.0 -1,-0.3 -0.602 34.7-143.5 -77.0 129.4 5.2 41.0 -7.6 160 193 A A E -C 153 0B 24 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.648 12.7-164.2 -94.8 150.4 2.3 42.7 -9.4 161 194 A V E -C 152 0B 30 -9,-2.7 -9,-2.4 -2,-0.3 3,-0.1 -0.985 17.0-123.5-140.2 128.3 -1.3 41.5 -9.4 162 195 A K - 0 0 77 -2,-0.4 7,-0.1 -12,-0.2 -12,-0.1 -0.072 47.9 -75.1 -61.6 162.7 -4.2 42.5 -11.6 163 196 A N - 0 0 32 5,-0.5 -1,-0.2 1,-0.2 5,-0.1 -0.396 41.3-134.3 -59.0 130.5 -7.5 43.9 -10.4 164 197 A H S S+ 0 0 161 -3,-0.1 3,-0.2 4,-0.1 -1,-0.2 0.836 85.3 31.1 -59.1 -33.5 -9.4 40.9 -9.0 165 198 A A S > S+ 0 0 52 1,-0.1 3,-1.4 4,-0.1 4,-0.2 -0.431 88.9 62.0-114.0-171.9 -12.6 42.0 -10.8 166 199 A D G > S- 0 0 66 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.810 124.3 -65.2 62.7 34.2 -13.5 43.7 -14.0 167 200 A G G 3 S- 0 0 72 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.657 95.2 -60.7 65.5 14.3 -11.9 41.1 -16.2 168 201 A G G < S+ 0 0 12 -3,-1.4 -5,-0.5 1,-0.3 -1,-0.3 0.543 96.6 147.9 89.9 7.3 -8.6 42.1 -14.8 169 202 A A < - 0 0 0 -3,-1.6 -1,-0.3 -4,-0.2 55,-0.3 -0.443 44.7-126.9 -76.0 149.9 -8.8 45.6 -16.1 170 203 A S E -D 223 0C 3 53,-2.8 53,-2.8 -2,-0.1 2,-0.4 -0.631 29.6-101.8 -92.2 155.3 -7.1 48.4 -14.1 171 204 A S E >> -D 222 0C 0 -2,-0.2 4,-0.9 51,-0.2 3,-0.6 -0.674 28.6-135.3 -79.1 128.6 -9.1 51.5 -13.0 172 205 A T H >> S+ 0 0 0 49,-2.1 3,-0.8 -2,-0.4 4,-0.6 0.889 102.7 47.9 -52.0 -49.0 -8.2 54.3 -15.4 173 206 A A H >4 S+ 0 0 3 67,-2.2 3,-0.6 48,-0.3 -1,-0.3 0.807 101.2 68.9 -64.3 -28.3 -7.8 57.0 -12.7 174 207 A E H <4 S+ 0 0 29 -3,-0.6 3,-0.3 1,-0.2 -1,-0.2 0.807 108.1 33.1 -64.3 -30.1 -5.6 54.6 -10.6 175 208 A F H << S+ 0 0 2 -4,-0.9 -1,-0.2 -3,-0.8 3,-0.2 0.429 117.9 54.8-105.1 2.7 -2.7 54.6 -13.0 176 209 A T S << S+ 0 0 0 -4,-0.6 71,-0.3 -3,-0.6 -2,-0.2 0.084 98.6 63.3-116.1 18.6 -3.2 58.2 -14.1 177 210 A T S S+ 0 0 0 -3,-0.3 -1,-0.1 -4,-0.2 310,-0.1 -0.245 84.8 75.0-133.0 42.8 -3.1 59.6 -10.6 178 211 A L > + 0 0 0 -3,-0.2 4,-2.0 20,-0.1 5,-0.2 0.398 69.1 89.3-127.4 -9.2 0.5 58.6 -9.8 179 212 A Q H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.831 81.2 52.5 -65.8 -40.8 2.3 61.3 -11.8 180 213 A M H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.933 113.4 45.9 -61.5 -45.0 2.6 64.1 -9.3 181 214 A E H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.938 116.7 40.7 -64.7 -52.1 4.2 61.9 -6.7 182 215 A F H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.844 115.8 51.1 -70.0 -31.6 6.7 60.1 -8.9 183 216 A K H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.911 110.8 47.6 -72.5 -39.6 7.7 63.2 -10.8 184 217 A Y H X S+ 0 0 4 -4,-2.2 4,-2.2 -5,-0.3 -2,-0.2 0.899 112.2 51.1 -66.3 -37.2 8.3 65.2 -7.6 185 218 A L H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 6,-0.4 0.887 108.5 51.4 -65.1 -37.4 10.3 62.2 -6.3 186 219 A A H X>S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 5,-0.6 0.904 109.9 51.1 -63.9 -40.0 12.3 62.3 -9.6 187 220 A Y H <5S+ 0 0 50 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.882 112.2 45.0 -63.6 -42.3 12.9 66.0 -9.0 188 221 A L H <5S+ 0 0 48 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.826 124.2 33.2 -73.8 -32.7 14.2 65.5 -5.5 189 222 A T H <5S- 0 0 48 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.603 97.3-128.5 -98.9 -15.3 16.4 62.5 -6.3 190 223 A G T <5 + 0 0 36 -4,-2.2 2,-1.0 1,-0.2 -3,-0.2 0.633 62.2 144.6 73.8 12.3 17.5 63.5 -9.8 191 224 A N >>< - 0 0 65 -5,-0.6 3,-0.9 -6,-0.4 4,-0.6 -0.744 34.3-171.1 -91.0 101.3 16.3 60.0 -10.7 192 225 A R H 3> S+ 0 0 115 -2,-1.0 4,-2.8 1,-0.2 3,-0.3 0.724 73.4 77.9 -63.0 -25.2 14.7 60.1 -14.1 193 226 A T H 3> S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.884 90.8 52.4 -54.7 -42.3 13.4 56.6 -13.9 194 227 A Y H <> S+ 0 0 7 -3,-0.9 4,-1.7 1,-0.2 -1,-0.2 0.907 113.2 45.4 -60.1 -42.0 10.5 57.5 -11.7 195 228 A W H X S+ 0 0 4 -4,-0.6 4,-2.0 -3,-0.3 5,-0.2 0.927 113.1 48.5 -66.8 -48.3 9.5 60.2 -14.2 196 229 A E H X S+ 0 0 86 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.900 111.7 49.2 -61.5 -43.5 9.9 58.0 -17.3 197 230 A L H < S+ 0 0 37 -4,-2.5 4,-0.5 -5,-0.2 -1,-0.2 0.910 113.5 45.0 -64.9 -43.1 7.9 55.1 -15.8 198 231 A V H < S+ 0 0 0 -4,-1.7 3,-0.5 -5,-0.2 -1,-0.2 0.815 112.8 49.2 -74.5 -28.7 4.9 57.3 -14.7 199 232 A E H >< S+ 0 0 16 -4,-2.0 3,-1.2 1,-0.2 4,-0.4 0.754 95.3 77.0 -80.5 -21.7 4.6 59.3 -17.9 200 233 A R T 3< S+ 0 0 108 -4,-1.3 3,-0.5 1,-0.2 -1,-0.2 0.767 77.5 72.1 -58.9 -29.4 4.7 56.1 -20.0 201 234 A V T 3> S+ 0 0 0 -3,-0.5 4,-1.3 -4,-0.5 -1,-0.2 0.757 87.5 64.3 -62.0 -26.4 1.1 55.2 -19.3 202 235 A Y H <> S+ 0 0 0 -3,-1.2 4,-3.1 -4,-0.2 5,-0.3 0.884 90.3 60.2 -69.0 -41.9 -0.4 57.9 -21.4 203 236 A E H > S+ 0 0 71 -3,-0.5 4,-3.1 -4,-0.4 5,-0.4 0.951 110.1 40.0 -56.1 -54.7 0.7 57.0 -24.9 204 237 A P H > S+ 0 0 9 0, 0.0 4,-2.2 0, 0.0 5,-0.4 0.924 115.4 54.5 -62.2 -37.7 -0.9 53.6 -25.1 205 238 A L H X S+ 0 0 0 -4,-1.3 4,-0.6 1,-0.2 6,-0.3 0.935 118.4 33.0 -58.8 -48.2 -4.0 55.0 -23.4 206 239 A Y H X>S+ 0 0 4 -4,-3.1 5,-1.8 2,-0.1 4,-0.6 0.918 125.9 40.2 -76.0 -44.1 -4.4 57.8 -25.9 207 240 A K H <5S+ 0 0 137 -4,-3.1 3,-0.5 -5,-0.3 -2,-0.2 0.914 113.6 49.1 -73.6 -46.6 -3.1 56.0 -29.0 208 241 A N H <5S+ 0 0 65 -4,-2.2 -1,-0.2 -5,-0.4 -3,-0.2 0.712 121.8 35.5 -69.4 -19.5 -4.6 52.5 -28.6 209 242 A N H <5S- 0 0 19 -4,-0.6 -1,-0.2 -5,-0.4 -2,-0.2 0.421 98.7-126.9-112.3 -2.1 -8.1 53.9 -27.9 210 243 A D T X> + 0 0 73 -4,-0.6 4,-2.7 -3,-0.5 5,-0.8 0.949 43.6 176.7 51.3 48.1 -8.1 56.9 -30.2 211 244 A L H >< + 0 0 0 -5,-1.8 6,-2.1 -6,-0.3 4,-1.0 0.871 66.3 44.5 -53.4 -48.4 -9.1 58.8 -27.0 212 245 A L H >5S+ 0 0 44 -6,-0.3 4,-0.8 4,-0.2 -1,-0.2 0.959 122.6 34.3 -65.4 -50.8 -9.2 62.3 -28.4 213 246 A N H 45S+ 0 0 123 2,-0.2 -2,-0.2 3,-0.1 -1,-0.1 0.942 128.2 32.2 -71.4 -50.8 -11.1 61.6 -31.6 214 247 A T H <5S+ 0 0 80 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.1 0.889 133.3 25.9 -77.9 -40.7 -13.4 58.8 -30.5 215 248 A Y H >< - 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