==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-AUG-11 3TLM . COMPND 2 MOLECULE: SARCOPLASMIC/ENDOPLASMIC RETICULUM CALCIUM ATPASE . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR R.SACCHETTO,I.BERTIPAGLIA,S.GIANNETTI,L.CENDRON,F.MASCARELLO . 987 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42918.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 730 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 3 0.3 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 . 74 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 135 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 348 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.5 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 1 4 2 1 1 2 3 2 2 0 2 0 0 2 3 0 0 0 0 0 0 1 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 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 0 0 PARALLEL BRIDGES PER LADDER . 2 4 3 2 3 3 2 1 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 1 0 1 0 1 0 0 1 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 58 0, 0.0 224,-0.2 0, 0.0 223,-0.1 0.000 360.0 360.0 360.0 66.5 27.5 -36.5 -23.7 2 2 A E - 0 0 10 221,-0.3 2,-2.2 1,-0.1 146,-0.1 -0.348 360.0-120.8 -57.1 131.1 26.1 -39.3 -21.4 3 3 A A S S+ 0 0 106 2,-0.0 2,-0.3 -2,-0.0 -1,-0.1 -0.311 76.9 49.8 -76.2 58.5 22.9 -40.6 -23.0 4 4 A A - 0 0 31 -2,-2.2 160,-0.1 220,-0.2 -2,-0.1 -0.961 38.1-169.5 178.0 165.0 20.5 -39.8 -20.1 5 5 A H S S+ 0 0 8 -2,-0.3 189,-0.2 189,-0.2 -1,-0.1 0.268 78.0 97.1-134.6 -18.5 18.9 -37.6 -17.5 6 6 A S S S+ 0 0 20 187,-0.2 -2,-0.1 189,-0.1 190,-0.1 0.851 70.5 71.8 -43.0 -50.4 17.2 -40.7 -16.0 7 7 A K S S- 0 0 121 1,-0.1 187,-0.1 186,-0.1 -3,-0.0 -0.322 87.9-112.5 -71.3 156.2 19.8 -41.0 -13.3 8 8 A T > - 0 0 49 185,-0.1 4,-1.0 3,-0.0 -1,-0.1 0.086 41.4 -72.0 -78.6-169.2 20.0 -38.6 -10.5 9 9 A T H >> S+ 0 0 39 1,-0.2 3,-2.1 2,-0.2 4,-1.6 0.960 126.0 48.4 -44.3 -77.1 22.5 -35.9 -9.4 10 10 A E H 3> S+ 0 0 145 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.748 104.5 58.9 -37.0 -46.1 25.2 -38.2 -8.2 11 11 A E H 3> S+ 0 0 71 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.769 109.6 42.7 -64.0 -27.4 25.3 -40.5 -11.2 12 12 A C H S+ 0 0 30 -4,-1.6 5,-2.2 2,-0.2 4,-1.0 0.902 121.1 40.6 -68.5 -39.8 28.7 -36.0 -11.5 14 14 A A H <5S+ 0 0 74 -4,-3.0 -2,-0.2 -5,-0.3 -3,-0.2 0.842 108.0 61.7 -74.8 -36.1 30.1 -39.5 -11.0 15 15 A Y H <5S+ 0 0 128 -4,-1.4 -2,-0.2 -5,-0.3 -1,-0.2 0.912 121.0 25.0 -57.3 -43.4 29.5 -40.4 -14.6 16 16 A F H <5S- 0 0 15 -4,-1.9 -1,-0.2 132,-0.1 -2,-0.2 0.579 110.7-125.6 -95.8 -12.7 31.9 -37.6 -15.6 17 17 A G T <5 + 0 0 41 -4,-1.0 2,-0.3 1,-0.2 -3,-0.3 0.999 58.4 136.0 64.7 74.5 33.7 -37.7 -12.3 18 18 A V < - 0 0 20 -5,-2.2 2,-0.4 6,-0.1 -1,-0.2 -0.996 54.5-120.8-152.2 148.8 33.4 -34.1 -11.2 19 19 A S > - 0 0 56 -2,-0.3 4,-2.1 1,-0.1 3,-0.4 -0.749 19.1-139.2 -90.1 136.0 32.6 -32.1 -8.1 20 20 A E T 4 S+ 0 0 54 -2,-0.4 -1,-0.1 1,-0.2 146,-0.0 0.822 102.8 50.4 -63.4 -29.8 29.7 -29.8 -8.5 21 21 A T T 4 S+ 0 0 108 1,-0.1 -1,-0.2 2,-0.0 110,-0.1 0.734 124.1 22.4 -82.7 -23.7 31.6 -27.2 -6.5 22 22 A T T 4 S- 0 0 67 -3,-0.4 112,-0.2 108,-0.1 -2,-0.2 0.783 89.5-161.4-109.7 -44.3 34.9 -27.2 -8.4 23 23 A G < - 0 0 1 -4,-2.1 109,-0.2 108,-0.1 108,-0.1 0.061 42.4 -12.0 80.7 165.9 34.1 -28.6 -11.8 24 24 A L - 0 0 0 106,-0.2 108,-2.5 107,-0.2 109,-0.3 0.191 64.2-124.5 -35.3 146.5 36.4 -30.1 -14.5 25 25 A T > - 0 0 54 106,-0.2 4,-2.1 107,-0.1 5,-0.2 -0.645 31.7-105.2 -91.9 153.1 40.2 -29.7 -14.2 26 26 A P H > S+ 0 0 88 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.777 122.4 55.5 -52.1 -24.1 42.0 -28.2 -17.2 27 27 A D H >> S+ 0 0 78 2,-0.2 4,-2.2 1,-0.2 3,-0.7 0.986 104.7 48.6 -71.3 -58.9 43.2 -31.7 -18.0 28 28 A Q H 3> S+ 0 0 26 1,-0.3 4,-3.3 2,-0.2 5,-0.4 0.898 108.5 55.9 -44.6 -49.3 39.7 -33.2 -18.2 29 29 A V H 3X S+ 0 0 20 -4,-2.1 4,-2.1 1,-0.2 -1,-0.3 0.907 105.9 51.1 -51.8 -45.6 38.6 -30.3 -20.4 30 30 A K H X S+ 0 0 126 -4,-2.2 4,-3.0 2,-0.2 3,-0.6 0.985 113.8 48.7 -60.3 -66.6 40.3 -34.8 -22.9 32 32 A H H 3X S+ 0 0 15 -4,-3.3 4,-4.0 1,-0.3 5,-0.4 0.840 112.0 54.6 -43.7 -38.1 36.5 -34.4 -23.0 33 33 A L H 3X S+ 0 0 42 -4,-2.1 4,-2.5 -5,-0.4 -1,-0.3 0.928 110.7 41.4 -65.3 -47.2 37.1 -31.9 -25.8 34 34 A E H << S+ 0 0 158 -4,-1.8 -2,-0.2 -3,-0.6 -1,-0.2 0.916 123.0 42.7 -65.5 -42.1 39.1 -34.2 -28.0 35 35 A K H < S+ 0 0 154 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.968 130.0 23.4 -66.3 -57.1 36.7 -37.0 -27.1 36 36 A Y H < S- 0 0 41 -4,-4.0 -3,-0.2 -5,-0.3 -2,-0.2 0.600 101.5-139.3 -90.0 -15.4 33.4 -35.1 -27.4 37 37 A G < - 0 0 27 -4,-2.5 2,-0.3 -5,-0.4 -1,-0.1 0.025 41.8 -35.2 80.8 171.1 34.4 -32.2 -29.7 38 38 A H - 0 0 73 1,-0.1 2,-2.6 -4,-0.1 106,-0.2 -0.525 60.8-120.4 -70.4 126.0 33.5 -28.5 -29.8 39 39 A N S S+ 0 0 13 104,-0.9 106,-0.2 106,-0.8 2,-0.2 -0.382 79.1 94.1 -67.4 73.4 30.0 -27.9 -28.5 40 40 A E - 0 0 94 -2,-2.6 186,-0.0 103,-0.1 3,-0.0 -0.630 67.2-107.8-140.7-160.7 28.8 -26.2 -31.7 41 41 A L > - 0 0 54 -2,-0.2 3,-1.1 1,-0.1 186,-0.0 -0.989 17.8-127.8-144.8 152.8 27.0 -27.2 -34.9 42 42 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 186,-0.0 0.661 82.2 114.0 -67.9 -11.3 27.6 -27.7 -38.6 43 43 A A T > + 0 0 48 1,-0.3 2,-4.1 2,-0.1 3,-1.9 0.682 44.5 96.1 -29.6 -29.3 24.6 -25.3 -38.8 44 44 A E T < + 0 0 115 -3,-1.1 -1,-0.3 1,-0.3 3,-0.0 -0.326 66.0 78.2 -66.5 63.7 27.2 -23.0 -40.3 45 45 A E T 3 + 0 0 104 -2,-4.1 -1,-0.3 0, 0.0 2,-0.2 0.318 52.8 136.1-147.7 -12.5 25.8 -24.2 -43.7 46 46 A G < + 0 0 38 -3,-1.9 2,-0.2 1,-0.0 71,-0.0 -0.259 21.2 132.3 -51.0 109.1 22.7 -22.2 -44.0 47 47 A K - 0 0 116 -2,-0.2 3,-0.2 -3,-0.0 63,-0.0 -0.658 57.9-116.3-165.4 99.5 22.6 -20.9 -47.5 48 48 A S - 0 0 35 -2,-0.2 5,-0.1 1,-0.1 65,-0.0 -0.014 47.4 -82.6 -42.3 135.4 19.4 -21.3 -49.6 49 49 A L > - 0 0 103 1,-0.1 4,-1.8 2,-0.1 5,-0.2 -0.064 38.5-114.5 -44.9 132.8 19.7 -23.5 -52.7 50 50 A W T 4 S+ 0 0 173 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.849 119.3 23.7 -33.5 -50.0 21.2 -21.8 -55.7 51 51 A E T >4 S+ 0 0 128 2,-0.2 3,-0.8 1,-0.2 -1,-0.3 0.749 102.3 81.2 -92.3 -31.3 17.8 -22.3 -57.4 52 52 A L T 34 S+ 0 0 103 1,-0.3 -2,-0.2 2,-0.1 -1,-0.2 0.854 98.9 50.7 -43.8 -32.9 15.6 -22.6 -54.3 53 53 A V T 3< S+ 0 0 21 -4,-1.8 2,-4.6 1,-0.2 -1,-0.3 0.852 83.8 85.9 -75.1 -38.6 15.9 -18.8 -54.5 54 54 A L < + 0 0 70 -3,-0.8 -1,-0.2 -4,-0.4 3,-0.1 -0.231 56.0 118.4 -63.2 61.2 14.9 -18.4 -58.1 55 55 A E + 0 0 69 -2,-4.6 -1,-0.2 1,-0.1 4,-0.1 -0.324 18.5 119.2-124.7 47.1 11.3 -18.3 -57.1 56 56 A Q + 0 0 33 1,-0.2 2,-0.9 2,-0.1 3,-0.4 0.408 64.8 84.0 -84.5 -3.2 10.5 -14.8 -58.3 57 57 A F S S+ 0 0 63 1,-0.2 -1,-0.2 -3,-0.1 5,-0.1 -0.677 74.1 64.0-102.0 74.0 8.1 -17.0 -60.3 58 58 A E + 0 0 121 -2,-0.9 -1,-0.2 3,-0.1 -2,-0.1 0.328 64.1 113.4-162.8 -23.1 5.2 -17.4 -57.8 59 59 A D S > S- 0 0 28 -3,-0.4 4,-0.7 -4,-0.1 -3,-0.0 -0.104 80.8-101.5 -57.3 162.8 3.7 -14.0 -57.1 60 60 A L H > S+ 0 0 62 2,-0.1 3,-0.6 3,-0.1 4,-0.6 0.969 111.3 41.1 -49.4 -68.5 0.1 -13.5 -58.4 61 61 A L H 4 S+ 0 0 4 1,-0.2 2,-4.1 2,-0.2 -3,-0.1 0.142 103.3 53.4 -62.1-164.8 1.0 -11.5 -61.5 62 62 A V H > S+ 0 0 7 1,-0.3 4,-2.5 245,-0.1 -1,-0.2 -0.101 100.6 67.3 65.0 -48.6 4.1 -12.9 -63.4 63 63 A R H X S+ 0 0 127 -2,-4.1 4,-2.8 -4,-0.7 -1,-0.3 0.917 97.2 55.9 -63.2 -39.0 2.3 -16.2 -63.4 64 64 A I H X S+ 0 0 64 -4,-0.6 4,-3.5 1,-0.2 5,-0.3 0.949 106.7 46.7 -53.7 -54.3 -0.0 -14.2 -65.7 65 65 A L H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.872 111.2 52.2 -56.9 -38.4 2.9 -13.4 -67.9 66 66 A L H X S+ 0 0 52 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.884 112.3 46.2 -65.3 -37.8 3.9 -17.1 -67.8 67 67 A L H >X S+ 0 0 103 -4,-2.8 4,-1.9 2,-0.2 3,-1.2 0.972 111.4 49.6 -66.8 -55.1 0.4 -18.0 -68.8 68 68 A A H 3X S+ 0 0 4 -4,-3.5 4,-1.2 1,-0.3 -2,-0.2 0.823 107.5 57.3 -52.7 -32.7 0.3 -15.5 -71.6 69 69 A A H 3X S+ 0 0 12 -4,-1.9 4,-1.4 -5,-0.3 -1,-0.3 0.840 105.3 51.8 -68.1 -32.3 3.6 -16.9 -72.7 70 70 A C H XX S+ 0 0 82 -3,-1.2 4,-2.2 -4,-1.1 3,-0.7 0.981 109.7 44.9 -67.8 -57.4 1.9 -20.3 -72.9 71 71 A I H 3X S+ 0 0 60 -4,-1.9 4,-1.7 1,-0.3 -1,-0.2 0.748 113.8 53.3 -59.8 -22.5 -1.0 -19.2 -75.1 72 72 A S H 3X S+ 0 0 9 -4,-1.2 4,-2.1 -5,-0.3 -1,-0.3 0.808 108.1 50.1 -80.3 -29.2 1.6 -17.3 -77.2 73 73 A F H S+ 0 0 76 1,-0.2 4,-1.9 -8,-0.1 5,-0.2 -0.098 86.4 70.1 70.1 -42.6 7.4 -18.0 -86.9 85 85 A V T 4 S+ 0 0 79 -2,-2.5 -1,-0.2 1,-0.2 -2,-0.1 0.662 116.7 22.9 -75.8 -16.7 10.2 -15.4 -86.8 86 86 A T T > S+ 0 0 12 3,-0.1 4,-0.8 -10,-0.1 -1,-0.2 0.470 122.4 59.5-120.0 -17.8 7.6 -13.1 -85.2 87 87 A A T 4 S+ 0 0 2 1,-0.1 -11,-0.3 2,-0.1 -2,-0.2 0.952 111.3 37.1 -76.9 -51.9 5.3 -15.8 -83.9 88 88 A F T X S+ 0 0 61 -4,-1.9 4,-0.6 -12,-0.2 -1,-0.1 0.567 107.0 67.0 -78.3 -11.6 7.9 -17.5 -81.6 89 89 A V H >> S+ 0 0 43 -5,-0.2 4,-1.8 1,-0.2 3,-0.9 0.927 85.1 71.3 -74.1 -45.4 9.6 -14.3 -80.5 90 90 A E H 3X S+ 0 0 6 -4,-0.8 4,-1.2 1,-0.2 -1,-0.2 0.830 93.6 53.6 -37.0 -54.8 6.6 -13.0 -78.6 91 91 A P H 3> S+ 0 0 7 0, 0.0 4,-1.7 0, 0.0 3,-0.4 0.892 109.7 47.0 -54.0 -43.4 6.9 -15.5 -75.7 92 92 A F H S+ 0 0 1 -4,-0.4 4,-2.2 2,-0.2 5,-0.2 0.829 110.7 51.3 -73.7 -31.5 11.6 -9.1 -68.5 98 98 A L H > S+ 0 0 8 -4,-0.4 4,-3.0 2,-0.2 -2,-0.2 0.944 109.5 49.0 -68.2 -47.6 10.8 -11.8 -65.9 99 99 A I H X S+ 0 0 81 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.904 110.6 53.8 -55.6 -43.3 14.3 -13.2 -66.3 100 100 A A H X S+ 0 0 32 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.917 114.5 36.8 -59.4 -50.9 15.7 -9.7 -65.9 101 101 A N H X S+ 0 0 6 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.846 109.5 66.8 -72.4 -31.6 13.9 -8.9 -62.6 102 102 A A H X S+ 0 0 8 -4,-3.0 4,-2.7 -5,-0.2 -2,-0.2 0.949 103.6 44.4 -50.9 -54.1 14.5 -12.5 -61.6 103 103 A I H X S+ 0 0 97 -4,-2.2 4,-3.4 1,-0.2 5,-0.2 0.964 109.5 52.4 -56.0 -60.7 18.2 -11.9 -61.4 104 104 A V H X S+ 0 0 34 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.836 113.5 48.0 -46.4 -36.8 18.1 -8.5 -59.6 105 105 A G H X S+ 0 0 1 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.976 112.9 44.7 -69.6 -55.4 15.9 -10.2 -57.0 106 106 A V H X S+ 0 0 29 -4,-2.7 4,-1.8 -5,-0.2 -2,-0.2 0.881 116.4 49.1 -55.3 -41.2 18.1 -13.3 -56.5 107 107 A W H X S+ 0 0 163 -4,-3.4 4,-2.2 2,-0.2 3,-0.5 0.978 113.0 40.7 -65.8 -61.4 21.2 -11.1 -56.4 108 108 A Q H X S+ 0 0 30 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.631 116.6 57.3 -65.0 -8.3 20.2 -8.4 -53.9 109 109 A E H X S+ 0 0 66 -4,-1.0 4,-2.0 -5,-0.2 -1,-0.2 0.827 105.5 46.1 -88.2 -37.7 18.7 -11.4 -52.1 110 110 A R H X S+ 0 0 59 -4,-1.8 4,-2.7 -3,-0.5 5,-0.2 0.966 110.7 52.3 -68.1 -53.4 21.9 -13.4 -51.8 111 111 A N H X S+ 0 0 45 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.841 110.4 51.0 -51.2 -36.8 24.0 -10.4 -50.6 112 112 A A H >X S+ 0 0 2 -4,-0.6 4,-2.3 -5,-0.3 3,-0.9 0.982 111.4 43.1 -65.5 -59.6 21.4 -9.8 -47.9 113 113 A E H 3X S+ 0 0 64 -4,-2.0 4,-1.0 1,-0.3 -2,-0.2 0.847 114.2 57.2 -53.4 -33.9 21.3 -13.3 -46.5 114 114 A N H 3X S+ 0 0 84 -4,-2.7 4,-0.7 1,-0.2 -1,-0.3 0.806 108.5 42.1 -68.8 -35.3 25.0 -13.2 -46.9 115 115 A A H - 0 0 26 -2,-0.5 3,-0.9 5,-0.3 -106,-0.2 -0.809 41.4-119.3-117.1 161.5 36.3 -24.9 -13.7 132 132 A A T 3 S+ 0 0 49 -108,-2.5 -107,-0.1 -2,-0.3 -109,-0.1 0.757 104.3 72.5 -74.3 -23.0 38.9 -25.9 -11.1 133 133 A D T 3 S+ 0 0 89 -109,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.606 104.5 39.7 -67.4 -11.3 41.5 -23.3 -12.2 134 134 A R < - 0 0 40 -3,-0.9 -3,-0.2 -112,-0.2 4,-0.1 -0.998 69.0-146.6-140.3 139.8 39.4 -20.5 -10.8 135 135 A K S S+ 0 0 153 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.801 85.1 52.7 -75.1 -30.2 37.4 -20.4 -7.5 136 136 A S S S- 0 0 23 1,-0.2 -5,-0.3 289,-0.0 288,-0.0 -0.737 104.3 -75.0-107.8 155.2 34.6 -18.2 -8.9 137 137 A V - 0 0 4 -2,-0.3 2,-0.3 -7,-0.1 -7,-0.2 -0.023 49.2-161.6 -44.4 149.2 32.4 -18.6 -12.0 138 138 A Q E -A 129 0A 13 -9,-2.4 -9,-2.9 -4,-0.1 2,-0.5 -0.985 14.3-127.5-138.4 144.4 34.2 -17.8 -15.3 139 139 A R E +A 128 0A 70 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.831 31.4 172.7 -98.6 127.7 32.8 -17.0 -18.7 140 140 A I E -A 127 0A 21 -13,-2.3 -13,-2.9 -2,-0.5 5,-0.1 -0.898 44.8 -83.7-128.8 157.8 34.0 -19.0 -21.7 141 141 A K E > -A 126 0A 88 -2,-0.3 3,-2.2 -15,-0.2 -15,-0.3 -0.390 40.4-128.4 -60.3 134.4 33.0 -19.1 -25.3 142 142 A A G > S+ 0 0 10 -17,-2.3 3,-2.1 1,-0.3 -103,-0.2 0.839 107.2 65.5 -56.6 -34.5 30.0 -21.5 -25.5 143 143 A R G 3 S+ 0 0 78 -18,-0.4 -104,-0.9 1,-0.3 -1,-0.3 0.677 100.3 57.0 -62.6 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2,-0.2 -1,-0.1 0.757 86.1 17.5 -38.3 -44.3 4.8 18.8 -13.4 649 649 A D T 34 S+ 0 0 86 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.103 113.2 71.1-123.5 23.8 2.5 16.6 -15.5 650 650 A R T <4 S+ 0 0 58 -3,-2.0 23,-1.9 1,-0.2 24,-0.5 0.254 94.3 58.5-118.8 10.0 4.8 15.1 -18.0 651 651 A A < + 0 0 3 -4,-0.7 2,-0.3 21,-0.2 24,-0.2 -0.968 63.8 167.8-142.6 120.9 6.5 12.8 -15.6 652 652 A Y E -m 675 0C 26 22,-2.1 24,-2.5 -2,-0.4 2,-0.2 -0.839 22.6-137.2-129.4 166.1 4.8 10.2 -13.4 653 653 A T E > -m 676 0C 25 -2,-0.3 4,-2.7 22,-0.2 5,-0.3 -0.678 39.5 -93.3-115.9 173.3 5.7 7.2 -11.2 654 654 A G H > S+ 0 0 1 22,-1.3 4,-1.8 23,-0.3 5,-0.2 0.948 125.2 45.0 -50.4 -56.8 4.1 3.8 -11.0 655 655 A R H > S+ 0 0 177 22,-0.2 4,-1.9 1,-0.2 3,-0.4 0.935 113.9 48.2 -52.7 -56.8 1.9 4.8 -8.1 656 656 A E H > S+ 0 0 72 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.884 108.8 53.6 -53.5 -46.1 0.8 8.1 -9.6 657 657 A F H >< S+ 0 0 3 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.870 110.8 47.3 -58.6 -39.1 -0.0 6.6 -13.0 658 658 A D H 3< S+ 0 0 72 -4,-1.8 -1,-0.2 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0 0 9 -54,-2.3 -1,-0.2 -3,-0.3 5,-0.0 -0.519 24.7-122.0 -76.3 140.9 7.0 1.6 -12.9 679 679 A E >> - 0 0 56 -2,-0.2 3,-0.8 -3,-0.1 4,-0.6 -0.085 40.2 -82.2 -69.3 175.3 5.5 -1.7 -11.8 680 680 A P T >4 S+ 0 0 78 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.930 124.0 31.3 -44.5 -72.2 5.8 -4.9 -13.9 681 681 A T T 3> S+ 0 0 102 1,-0.2 4,-2.5 2,-0.1 5,-0.2 0.453 94.2 95.4 -73.2 -1.4 3.1 -4.7 -16.5 682 682 A H H <> S+ 0 0 7 -3,-0.8 4,-2.8 1,-0.2 -1,-0.2 0.888 79.6 55.3 -57.5 -42.3 3.2 -0.9 -16.7 683 683 A K H > S+ 0 0 30 -4,-0.3 4,-1.9 2,-0.2 3,-1.2 0.964 112.4 49.8 -65.7 -52.1 3.1 -3.0 -21.6 685 685 A K H 3X S+ 0 0 54 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.909 107.5 55.9 -51.2 -47.3 0.0 -1.0 -20.6 686 686 A I H 3X S+ 0 0 0 -4,-2.8 4,-1.2 1,-0.2 -1,-0.3 0.770 109.0 47.1 -57.7 -28.7 1.9 2.2 -21.6 687 687 A V H < S+ 0 0 26 -4,-2.6 3,-1.1 1,-0.3 -2,-0.2 0.933 109.1 49.7 -55.2 -49.1 -2.5 3.1 -24.6 690 690 A L H ><>S+ 0 0 0 -4,-1.2 5,-0.7 1,-0.3 3,-0.6 0.776 111.7 50.8 -62.3 -24.2 -0.3 4.6 -27.3 691 691 A Q H ><5S+ 0 0 40 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8.8 -5.6 -26.6 711 711 A K H << S+ 0 0 124 -4,-2.4 -1,-0.2 -3,-0.7 -2,-0.2 0.896 114.2 51.0 -78.8 -42.0 6.2 -8.1 -27.7 712 712 A K H < S+ 0 0 84 -4,-2.9 -2,-0.2 -5,-0.3 -3,-0.2 0.949 95.9 85.4 -60.4 -48.0 3.1 -5.8 -27.3 713 713 A A S < S- 0 0 7 -4,-3.4 3,-0.2 -5,-0.2 -15,-0.2 0.029 87.9-122.8 -49.3 160.5 4.8 -3.1 -29.3 714 714 A E S S+ 0 0 71 -17,-1.8 2,-0.4 1,-0.3 -16,-0.2 0.856 103.7 29.0 -75.0 -34.2 4.5 -3.2 -33.1 715 715 A I E S-n 698 0C 4 -18,-1.1 -16,-1.9 -374,-0.1 2,-0.5 -0.981 73.7-160.0-131.4 121.5 8.2 -3.1 -33.2 716 716 A G E -n 699 0C 0 -2,-0.4 15,-3.0 -18,-0.2 16,-1.0 -0.876 7.0-169.2-102.6 125.8 10.5 -4.6 -30.6 717 717 A I E -no 700 732C 0 -18,-2.9 -16,-1.9 -2,-0.5 2,-0.3 -0.964 7.9-169.5-117.3 120.9 14.1 -3.3 -30.5 718 718 A A E -no 701 733C 0 14,-3.3 16,-2.5 -2,-0.5 2,-0.3 -0.774 21.1-114.6-111.6 155.6 16.6 -5.2 -28.3 719 719 A M E > - o 0 734C 1 -18,-1.4 3,-2.1 -2,-0.3 16,-0.2 -0.673 15.0-135.4 -89.2 136.6 20.1 -4.4 -27.2 720 720 A G T 3 S+ 0 0 14 14,-2.3 15,-0.1 -2,-0.3 -1,-0.1 0.877 108.5 45.6 -56.3 -40.1 23.1 -6.6 -28.2 721 721 A S T 3 S+ 0 0 82 13,-0.3 -1,-0.3 -367,-0.1 -19,-0.1 0.226 101.4 94.0 -90.1 17.0 24.5 -6.6 -24.8 722 722 A G S < S- 0 0 22 -3,-2.1 -19,-0.2 1,-0.2 -20,-0.1 -0.139 86.9 -66.0 -92.4-167.9 21.1 -7.3 -23.3 723 723 A T > - 0 0 27 -21,-2.9 4,-1.8 1,-0.1 -1,-0.2 -0.364 32.5-125.0 -80.5 162.9 19.5 -10.6 -22.3 724 724 A A H > S+ 0 0 20 -568,-1.5 4,-2.4 2,-0.2 5,-0.2 0.776 110.3 64.8 -75.6 -27.7 18.4 -13.3 -24.7 725 725 A V H > S+ 0 0 20 -569,-0.8 4,-1.8 2,-0.2 -1,-0.2 0.936 107.6 39.2 -60.3 -46.9 15.0 -13.0 -23.3 726 726 A A H > S+ 0 0 0 -24,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.901 113.5 55.5 -70.3 -40.0 14.6 -9.5 -24.6 727 727 A K H < S+ 0 0 67 -4,-1.8 -2,-0.2 -25,-0.2 -1,-0.2 0.866 107.0 51.7 -60.0 -36.7 16.3 -10.3 -27.8 728 728 A T H < S+ 0 0 54 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.971 110.3 45.1 -64.1 -55.8 13.8 -13.1 -28.4 729 729 A A H < S+ 0 0 5 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.786 104.5 89.6 -57.5 -28.6 10.7 -11.0 -27.9 730 730 A S < - 0 0 0 -4,-1.8 -13,-0.2 -5,-0.2 3,-0.1 -0.200 65.4-153.6 -71.0 159.1 12.4 -8.3 -30.1 731 731 A E S S+ 0 0 53 -15,-3.0 -397,-2.0 1,-0.3 -396,-1.1 0.346 83.9 28.8-110.3 -4.2 12.2 -8.0 -33.9 732 732 A M E -Io 333 717C 0 -16,-1.0 -14,-3.3 -399,-0.2 2,-0.5 -0.981 65.1-154.8-156.7 145.7 15.5 -6.3 -34.2 733 733 A V E -Io 332 718C 6 -401,-1.8 -401,-2.5 -2,-0.3 2,-1.6 -0.964 15.6-142.5-131.2 120.7 18.8 -6.3 -32.3 734 734 A L E > -Io 331 719C 0 -16,-2.5 -14,-2.3 -2,-0.5 3,-1.9 -0.634 19.5-163.8 -77.6 93.7 21.3 -3.5 -32.2 735 735 A A T 3 S+ 0 0 39 -405,-1.7 -1,-0.2 -2,-1.6 -404,-0.1 0.837 88.6 33.2 -48.7 -37.5 24.3 -5.8 -32.2 736 736 A D T 3 S- 0 0 69 -406,-0.6 -1,-0.3 -407,-0.2 3,-0.1 0.266 110.3-115.9-105.8 11.2 26.5 -2.9 -31.0 737 737 A D < + 0 0 20 -3,-1.9 2,-1.0 1,-0.2 -2,-0.1 0.837 56.7 159.0 60.4 34.7 24.0 -1.0 -28.9 738 738 A N > - 0 0 41 1,-0.2 3,-1.3 -409,-0.2 4,-0.4 -0.785 27.3-165.5 -94.5 103.0 24.0 2.0 -31.1 739 739 A F T >> S+ 0 0 1 -2,-1.0 3,-1.4 1,-0.3 4,-0.6 0.805 81.8 70.9 -54.5 -32.9 20.8 3.9 -30.5 740 740 A S H >> S+ 0 0 44 1,-0.3 4,-1.9 2,-0.2 3,-1.1 0.837 83.2 69.4 -54.1 -39.1 21.4 5.9 -33.6 741 741 A T H <> S+ 0 0 9 -3,-1.3 4,-2.9 1,-0.3 -1,-0.3 0.831 87.7 65.8 -52.0 -35.1 20.6 3.0 -35.9 742 742 A I H <> S+ 0 0 1 -3,-1.4 4,-2.5 -4,-0.4 -1,-0.3 0.912 105.3 43.5 -54.4 -44.3 17.0 3.1 -34.8 743 743 A V H X S+ 0 0 70 -4,-2.5 4,-2.7 2,-0.2 3,-1.2 0.976 109.8 46.1 -63.3 -56.7 14.6 6.4 -42.3 748 748 A E H 3X S+ 0 0 23 -4,-2.2 4,-2.7 1,-0.3 -1,-0.2 0.862 109.3 58.5 -53.5 -37.2 15.3 3.4 -44.5 749 749 A G H 3X S+ 0 0 2 -4,-2.3 4,-0.6 2,-0.2 -1,-0.3 0.818 109.7 42.9 -63.3 -31.4 11.8 2.2 -43.6 750 750 A R H XX S+ 0 0 20 -3,-1.2 4,-2.2 -4,-1.2 3,-1.1 0.939 111.4 52.4 -78.5 -51.3 10.4 5.4 -45.1 751 751 A A H 3X S+ 0 0 7 -4,-2.7 4,-2.8 1,-0.3 5,-0.2 0.917 104.3 58.4 -49.8 -47.2 12.6 5.5 -48.2 752 752 A I H 3X S+ 0 0 8 -4,-2.7 4,-1.6 -5,-0.2 -1,-0.3 0.853 109.6 45.3 -52.7 -35.5 11.4 1.9 -48.9 753 753 A Y H X S+ 0 0 3 -4,-1.9 4,-3.2 2,-0.2 3,-0.5 0.974 116.8 38.9 -52.1 -62.3 3.4 6.3 -60.1 762 762 A Y H 3X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.3 5,-0.4 0.976 115.7 50.8 -48.6 -72.1 5.7 5.6 -63.1 763 763 A L H 3X S+ 0 0 1 -4,-2.1 4,-0.8 -5,-0.3 -1,-0.3 0.716 121.5 37.6 -39.0 -30.3 4.5 2.1 -63.7 764 764 A I H X S+ 0 0 36 -4,-2.6 4,-3.9 2,-0.2 3,-1.0 0.999 108.9 39.4 -65.1 -65.7 -2.4 4.5 -68.4 769 769 A G H 3X S+ 0 0 0 -4,-1.6 4,-0.8 1,-0.3 -1,-0.2 0.728 109.0 67.7 -54.7 -19.8 -1.5 6.6 -71.4 770 770 A E H 3X S+ 0 0 7 -4,-1.6 4,-0.6 2,-0.2 -1,-0.3 0.954 113.1 27.6 -65.8 -49.2 -0.3 3.3 -72.8 771 771 A V H XX S+ 0 0 21 -4,-1.9 4,-2.1 -3,-1.0 3,-1.5 0.895 112.9 65.9 -77.6 -39.6 -3.9 2.0 -73.0 772 772 A V H 3< S+ 0 0 43 -4,-3.9 -1,-0.2 1,-0.3 -2,-0.2 0.768 96.3 63.5 -49.5 -23.8 -5.2 5.6 -73.4 773 773 A C H 3< S+ 0 0 0 -4,-0.8 3,-0.4 -5,-0.3 4,-0.4 0.905 105.1 40.4 -67.9 -44.8 -3.3 5.2 -76.6 774 774 A I H XX S+ 0 0 19 -3,-1.5 4,-2.4 -4,-0.6 2,-1.7 0.904 109.2 58.1 -72.7 -45.1 -5.6 2.4 -77.8 775 775 A F T 3< S+ 0 0 81 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.1 -0.331 114.1 39.7 -83.5 55.4 -8.9 3.9 -76.7 776 776 A L T 34 S+ 0 0 51 -2,-1.7 -1,-0.2 -3,-0.4 6,-0.2 0.200 123.4 35.3-171.9 -15.5 -8.2 7.0 -78.7 777 777 A T T X4 S+ 0 0 1 -3,-1.1 3,-0.8 -4,-0.4 5,-0.4 0.672 117.2 48.2-115.8 -44.5 -6.7 5.5 -81.9 778 778 A A T 3< S+ 0 0 46 -4,-2.4 -3,-0.1 1,-0.3 -4,-0.1 0.410 126.0 35.4 -78.6 3.4 -8.7 2.3 -82.2 779 779 A A T 3 S+ 0 0 65 -5,-0.2 -1,-0.3 0, 0.0 -2,-0.1 -0.260 106.6 61.5-152.2 54.0 -11.7 4.5 -81.6 780 780 A L S < S- 0 0 112 -3,-0.8 -2,-0.1 2,-0.3 -3,-0.1 0.220 114.6 -87.1-161.6 12.1 -11.2 7.9 -83.3 781 781 A G S S+ 0 0 42 1,-0.3 -3,-0.1 -4,-0.2 -4,-0.1 0.202 89.1 123.6 96.2 -16.1 -10.8 7.1 -87.0 782 782 A L - 0 0 31 -5,-0.4 -1,-0.3 -6,-0.2 -2,-0.3 -0.438 63.3-109.3 -79.9 152.1 -7.0 6.4 -86.9 783 783 A P - 0 0 22 0, 0.0 -1,-0.1 0, 0.0 104,-0.1 -0.285 59.4 -55.4 -74.8 165.7 -5.5 3.1 -88.1 784 784 A E - 0 0 66 1,-0.1 3,-0.1 102,-0.1 -10,-0.0 -0.077 46.4-159.3 -39.9 132.6 -4.0 0.6 -85.7 785 785 A A - 0 0 4 1,-0.2 111,-0.3 -3,-0.1 2,-0.2 0.870 69.1 -10.1 -85.8 -42.7 -1.3 2.2 -83.7 786 786 A L - 0 0 8 109,-0.1 -1,-0.2 110,-0.0 3,-0.1 -0.792 64.0-136.6-142.3-176.1 0.6 -1.0 -82.7 787 787 A I > - 0 0 43 -2,-0.2 4,-1.1 1,-0.1 0, 0.0 -0.793 42.9 -72.4-137.6-179.6 0.2 -4.8 -82.9 788 788 A P H >> S+ 0 0 4 0, 0.0 3,-3.8 0, 0.0 4,-1.5 0.908 126.2 37.2 -39.8 -85.3 0.9 -7.8 -80.7 789 789 A V H 3> S+ 0 0 2 1,-0.3 4,-1.7 2,-0.2 163,-0.1 0.833 111.0 63.5 -38.4 -45.6 4.6 -8.1 -80.5 790 790 A Q H 3> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.750 106.5 44.6 -55.3 -24.9 4.9 -4.3 -80.5 791 791 A L H X S+ 0 0 0 -4,-1.4 4,-2.1 1,-0.2 3,-1.3 0.888 115.2 56.7 -41.4 -40.8 7.4 -1.6 -74.9 795 795 A N H >X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.3 3,-1.4 0.985 105.5 45.9 -51.3 -70.9 6.5 -3.9 -72.0 796 796 A L H 3< S+ 0 0 18 -4,-1.9 -1,-0.3 1,-0.3 5,-0.2 0.461 122.3 40.8 -54.7 0.8 9.9 -5.7 -72.0 797 797 A V H << S+ 0 0 1 -3,-1.3 -1,-0.3 -4,-0.9 -2,-0.2 0.569 125.1 25.0-128.3 -13.2 11.6 -2.3 -72.3 798 798 A T H << S+ 0 0 0 -4,-2.1 -3,-0.2 -3,-1.4 -2,-0.2 0.450 121.7 48.3-129.8 -9.2 9.7 0.2 -70.0 799 799 A D S < S+ 0 0 0 -4,-2.6 -489,-0.2 -5,-0.5 -3,-0.1 0.326 111.3 54.5-112.2 3.5 8.1 -2.0 -67.4 800 800 A G S >> S- 0 0 1 -5,-0.5 4,-2.0 3,-0.1 3,-1.8 0.427 113.2 -3.4-103.0-121.7 11.3 -3.9 -66.7 801 801 A L H 3> S+ 0 0 52 1,-0.3 4,-1.8 -5,-0.2 5,-0.2 0.831 124.8 57.0 -43.3 -51.7 14.8 -2.9 -65.7 802 802 A P H 34 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 130,-0.1 0.744 113.9 40.9 -59.3 -21.3 14.2 0.9 -65.8 803 803 A A H X4 S+ 0 0 0 -3,-1.8 3,-2.5 2,-0.2 4,-0.3 0.886 109.9 54.0 -90.8 -48.1 11.4 0.6 -63.3 804 804 A T H >< S+ 0 0 5 -4,-2.0 3,-2.0 1,-0.3 4,-0.3 0.802 99.0 67.5 -55.2 -29.3 12.9 -1.9 -60.9 805 805 A A G >< S+ 0 0 6 -4,-1.8 3,-1.8 1,-0.3 -1,-0.3 0.756 80.9 76.3 -63.7 -24.2 15.8 0.5 -60.7 806 806 A L G X S+ 0 0 0 -3,-2.5 3,-1.0 1,-0.3 -1,-0.3 0.708 82.8 68.6 -60.5 -17.1 13.5 2.8 -59.0 807 807 A G G < S+ 0 0 2 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.816 92.4 56.5 -70.3 -29.9 14.0 0.6 -56.0 808 808 A F G < S+ 0 0 43 -3,-1.8 -1,-0.3 -4,-0.3 119,-0.3 -0.034 83.1 137.8 -91.3 32.0 17.6 1.8 -55.7 809 809 A N < - 0 0 7 -3,-1.0 -54,-0.1 1,-0.1 116,-0.1 -0.556 54.9-117.1 -79.0 140.1 16.3 5.3 -55.5 810 810 A P - 0 0 34 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.270 40.3 -81.6 -74.2 163.7 17.9 7.6 -52.9 811 811 A P - 0 0 57 0, 0.0 5,-0.1 0, 0.0 -63,-0.0 -0.482 55.1-104.9 -69.2 129.9 16.1 9.1 -49.9 812 812 A D > - 0 0 18 -2,-0.2 3,-0.7 2,-0.1 4,-0.2 0.176 38.9 -90.3 -45.7 169.0 14.0 12.2 -50.7 813 813 A L T 3 S+ 0 0 78 1,-0.2 3,-0.2 2,-0.1 -1,-0.1 0.930 117.7 7.6 -49.4 -64.0 15.2 15.8 -49.8 814 814 A D T > S+ 0 0 75 1,-0.1 3,-2.0 3,-0.0 -1,-0.2 -0.127 82.9 136.9-116.4 36.7 13.5 16.1 -46.3 815 815 A I G X S+ 0 0 10 -3,-0.7 3,-0.7 1,-0.3 -1,-0.1 0.839 77.9 45.2 -51.1 -38.8 12.2 12.6 -45.9 816 816 A M G 3 S+ 0 0 19 -4,-0.2 -1,-0.3 1,-0.2 -199,-0.1 -0.117 106.4 61.3-100.1 36.0 13.4 12.5 -42.3 817 817 A D G < S+ 0 0 87 -3,-2.0 -1,-0.2 -201,-0.2 -2,-0.2 0.084 87.5 86.7-141.5 15.1 12.0 16.0 -41.5 818 818 A R S < S- 0 0 86 -3,-0.7 3,-0.1 -4,-0.1 0, 0.0 -0.923 86.1 -96.3-121.0 145.3 8.4 15.2 -42.2 819 819 A P - 0 0 106 0, 0.0 -202,-0.2 0, 0.0 -2,-0.1 -0.139 53.0 -83.0 -58.0 155.0 5.8 13.8 -39.7 820 820 A P - 0 0 27 0, 0.0 2,-0.3 0, 0.0 -476,-0.1 -0.212 48.7 -99.0 -60.3 146.9 5.1 10.0 -39.6 821 821 A R - 0 0 49 -478,-0.3 -475,-0.1 1,-0.1 -3,-0.0 -0.521 40.5-110.2 -71.8 127.5 2.6 8.5 -42.1 822 822 A T - 0 0 79 -2,-0.3 3,-0.4 1,-0.2 -1,-0.1 -0.250 19.9-127.6 -53.9 138.1 -0.9 7.9 -40.6 823 823 A P S S+ 0 0 47 0, 0.0 -1,-0.2 0, 0.0 -128,-0.1 0.665 111.6 43.2 -65.6 -10.9 -1.5 4.2 -40.2 824 824 A K S S+ 0 0 134 -130,-0.1 3,-0.1 2,-0.1 -2,-0.1 0.647 78.9 127.9-106.2 -21.4 -4.7 4.8 -42.2 825 825 A E - 0 0 67 -3,-0.4 -4,-0.0 1,-0.1 4,-0.0 -0.020 67.2-109.1 -36.7 131.2 -3.4 7.1 -44.9 826 826 A P - 0 0 79 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 -0.312 17.1-122.5 -67.4 153.5 -4.6 5.6 -48.3 827 827 A L S S+ 0 0 21 1,-0.3 2,-0.5 -3,-0.1 -2,-0.1 0.952 103.3 26.7 -59.0 -50.8 -1.9 4.1 -50.6 828 828 A I S S- 0 0 44 4,-0.0 -1,-0.3 3,-0.0 5,-0.1 -0.932 83.1-146.0-119.0 107.3 -2.8 6.5 -53.4 829 829 A S > - 0 0 48 -2,-0.5 4,-1.1 -3,-0.3 -2,-0.0 -0.108 29.4-106.4 -62.5 168.9 -4.3 9.9 -52.5 830 830 A G H >> S+ 0 0 62 2,-0.2 4,-1.5 1,-0.2 3,-0.7 0.936 120.2 51.7 -64.4 -48.0 -6.9 11.4 -54.9 831 831 A W H 3> S+ 0 0 73 1,-0.3 4,-3.2 2,-0.2 -1,-0.2 0.882 103.8 60.2 -56.5 -38.0 -4.5 14.0 -56.3 832 832 A L H 3> S+ 0 0 3 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.887 102.1 53.2 -56.7 -37.6 -2.1 11.2 -57.0 833 833 A F H X S+ 0 0 27 -4,-3.2 4,-1.3 2,-0.2 3,-0.7 0.999 112.6 38.0 -61.6 -70.7 -3.3 11.5 -70.6 842 842 A Y H >< S+ 0 0 63 -4,-2.3 3,-2.0 1,-0.3 5,-0.2 0.927 116.4 50.1 -46.3 -63.4 -0.5 13.2 -72.4 843 843 A V H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.3 -1,-0.3 0.838 114.0 49.3 -47.4 -33.1 1.7 10.1 -72.9 844 844 A G H << S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.710 116.0 41.4 -80.0 -20.0 -1.5 8.5 -74.2 845 845 A A T << S+ 0 0 54 -3,-2.0 -1,-0.2 -4,-1.3 -2,-0.2 -0.272 110.2 54.1-122.2 44.0 -2.2 11.4 -76.6 846 846 A A S < S+ 0 0 9 -3,-0.7 -1,-0.1 -77,-0.1 -2,-0.1 0.020 104.9 56.5-154.0 8.1 1.3 12.1 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857 857 A Y T 5S+ 0 0 165 6,-0.1 -3,-0.2 7,-0.1 -4,-0.1 0.510 98.7 109.0 -16.7 -30.9 1.9 17.3 -91.2 858 858 A A S > - 0 0 14 1,-0.2 4,-1.4 -8,-0.1 5,-0.9 0.593 43.8-118.2 16.1 36.0 -4.1 13.9 -95.9 865 865 A T T 45 - 0 0 96 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.557 64.3 -41.6 -0.1 107.9 -4.0 17.7 -95.1 866 866 A Y T 45S+ 0 0 201 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.737 133.9 64.3 16.8 77.9 -5.4 18.2 -91.6 867 867 A S T >45S- 0 0 57 -3,-0.4 3,-2.4 3,-0.0 -1,-0.2 0.204 93.4-126.0 174.0 -18.6 -8.3 15.8 -91.8 868 868 A Q T 3<5S- 0 0 15 -4,-1.4 -3,-0.1 1,-0.3 -4,-0.1 0.735 75.5 -68.0 58.3 22.8 -6.7 12.3 -92.2 869 869 A L T 3 S+ 0 0 130 1,-0.1 3,-1.5 2,-0.0 -1,-0.1 -0.532 72.2 147.0-130.4 60.6 -2.5 2.0 -98.5 885 889 A V G > + 0 0 20 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.533 63.9 79.2 -72.4 -6.4 -0.2 4.1 -96.4 886 890 A F G 3 S+ 0 0 36 1,-0.3 -1,-0.3 -14,-0.1 -102,-0.1 0.672 94.8 43.5 -75.8 -18.2 -2.7 3.2 -93.7 887 891 A E G < S+ 0 0 138 -3,-1.5 -1,-0.3 -104,-0.1 -2,-0.2 0.080 91.3 127.5-110.8 19.2 -1.1 -0.2 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