==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 24-NOV-10 3AR3 . COMPND 2 MOLECULE: SARCOPLASMIC/ENDOPLASMIC RETICULUM CALCIUM ATPASE . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR C.TOYOSHIMA,S.YONEKURA,J.TSUEDA,S.IWASAWA . 994 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46310.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 717 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 113 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 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 . 56 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 368 37.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.1 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 1 6 3 1 1 4 3 1 1 0 1 2 1 1 1 1 0 0 1 0 1 1 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 5 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 0 0 PARALLEL BRIDGES PER LADDER . 3 3 4 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 25 0, 0.0 3,-1.3 0, 0.0 223,-0.0 0.000 360.0 360.0 360.0 99.3 64.7 -12.1 131.3 2 2 A E T 3 + 0 0 149 1,-0.2 3,-0.3 2,-0.1 223,-0.1 0.842 360.0 48.3 -64.8 -32.9 61.1 -12.9 130.5 3 3 A A T >> S+ 0 0 40 1,-0.2 3,-1.9 2,-0.1 4,-0.5 0.190 71.6 124.7 -94.1 15.4 60.2 -12.9 134.2 4 4 A A G X4 + 0 0 1 -3,-1.3 3,-2.0 1,-0.3 -1,-0.2 0.808 63.7 64.4 -43.3 -44.8 61.9 -9.6 135.2 5 5 A H G 34 S+ 0 0 6 -3,-0.3 189,-3.1 1,-0.3 -1,-0.3 0.784 105.1 46.1 -54.1 -32.5 58.7 -8.1 136.7 6 6 A S G <4 S+ 0 0 26 -3,-1.9 -1,-0.3 187,-0.2 2,-0.3 0.505 99.5 90.1 -88.4 -7.3 58.6 -10.7 139.4 7 7 A K S << S- 0 0 81 -3,-2.0 187,-0.2 -4,-0.5 2,-0.0 -0.642 82.7-113.1 -91.1 148.7 62.4 -10.4 140.1 8 8 A S > - 0 0 24 -2,-0.3 4,-1.4 1,-0.1 5,-0.2 -0.316 32.3-107.8 -69.7 162.9 63.8 -8.0 142.7 9 9 A T H > S+ 0 0 23 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.863 122.0 50.6 -57.7 -40.2 65.9 -5.1 141.3 10 10 A E H > S+ 0 0 132 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.884 103.7 56.8 -69.7 -39.0 69.0 -6.8 142.7 11 11 A E H > S+ 0 0 90 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.846 105.7 51.5 -64.5 -30.7 68.2 -10.2 141.1 12 12 A C H X S+ 0 0 1 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.871 109.5 49.1 -73.4 -35.1 68.1 -8.6 137.6 13 13 A L H X>S+ 0 0 29 -4,-1.2 5,-1.7 2,-0.2 4,-1.3 0.952 114.6 46.1 -66.2 -45.3 71.4 -6.9 138.1 14 14 A A H ><5S+ 0 0 76 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.926 106.7 58.7 -62.5 -46.0 72.8 -10.3 139.3 15 15 A Y H 3<5S+ 0 0 140 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.918 117.4 31.5 -50.7 -47.8 71.2 -12.2 136.4 16 16 A F H 3<5S- 0 0 15 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.563 102.9-128.0 -90.0 -6.8 73.1 -10.1 133.8 17 17 A G T <<5 + 0 0 50 -4,-1.3 2,-0.3 -3,-0.5 -3,-0.2 0.954 60.6 138.9 60.0 50.8 76.2 -9.4 135.9 18 18 A V < - 0 0 14 -5,-1.7 2,-0.4 -6,-0.1 -1,-0.2 -0.942 52.0-126.5-128.8 148.1 76.0 -5.7 135.4 19 19 A S B >> -A 23 0A 51 4,-0.5 4,-2.7 -2,-0.3 3,-0.6 -0.806 10.5-143.1 -94.8 135.8 76.6 -2.7 137.7 20 20 A E T 34 S+ 0 0 57 -2,-0.4 -1,-0.1 1,-0.2 4,-0.1 0.715 100.4 48.4 -67.4 -22.7 73.8 -0.1 138.0 21 21 A T T 34 S+ 0 0 123 2,-0.1 -1,-0.2 1,-0.1 110,-0.1 0.593 126.1 22.3 -95.8 -10.9 76.3 2.7 138.3 22 22 A T T <4 S- 0 0 57 -3,-0.6 112,-0.2 108,-0.1 -2,-0.2 0.639 91.3-149.0-124.6 -27.8 78.5 1.8 135.3 23 23 A G B < -A 19 0A 1 -4,-2.7 -4,-0.5 108,-0.2 108,-0.2 -0.287 46.8 -19.4 84.8-174.3 76.5 -0.3 133.0 24 24 A L B -b 131 0B 0 106,-0.6 108,-1.9 -6,-0.1 109,-0.4 -0.277 63.7-124.0 -69.3 152.0 77.7 -3.1 130.7 25 25 A T > - 0 0 56 106,-0.2 4,-2.7 107,-0.2 5,-0.2 -0.545 30.6-104.9 -90.2 160.9 81.4 -3.4 129.7 26 26 A P H > S+ 0 0 86 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.859 123.8 53.9 -56.2 -31.6 82.3 -3.4 126.0 27 27 A D H > S+ 0 0 81 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.923 109.2 48.0 -68.0 -41.0 82.9 -7.2 126.2 28 28 A Q H > S+ 0 0 22 -3,-0.2 4,-3.3 1,-0.2 5,-0.3 0.963 109.3 52.6 -61.0 -51.6 79.4 -7.7 127.7 29 29 A V H X S+ 0 0 25 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.873 111.4 48.7 -50.3 -41.8 77.8 -5.5 124.9 30 30 A K H X S+ 0 0 131 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.971 115.4 40.8 -64.3 -56.6 79.6 -7.7 122.4 31 31 A R H X S+ 0 0 119 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.870 115.9 50.9 -59.8 -42.1 78.6 -11.1 123.8 32 32 A H H X S+ 0 0 16 -4,-3.3 4,-3.3 2,-0.2 5,-0.3 0.895 110.4 48.1 -64.3 -43.1 75.0 -9.9 124.6 33 33 A L H X S+ 0 0 49 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.875 113.0 50.4 -63.9 -38.3 74.5 -8.6 121.1 34 34 A E H < S+ 0 0 146 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.906 117.1 39.7 -65.0 -44.8 75.8 -11.9 119.8 35 35 A K H < S+ 0 0 151 -4,-2.4 -2,-0.2 1,-0.1 -1,-0.2 0.863 130.4 25.0 -74.9 -40.6 73.5 -13.8 122.1 36 36 A Y H < S- 0 0 78 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.546 96.7-138.6-105.0 -9.6 70.3 -11.7 121.7 37 37 A G < - 0 0 29 -4,-2.1 -1,-0.2 -5,-0.3 2,-0.1 -0.195 46.2 -37.0 77.1-176.7 70.7 -10.0 118.4 38 38 A H - 0 0 63 1,-0.1 2,-1.7 -4,-0.1 106,-0.2 -0.451 63.6-105.0 -79.1 157.1 69.9 -6.4 117.7 39 39 A N S S+ 0 0 13 104,-2.0 2,-0.3 106,-0.4 106,-0.2 -0.559 83.5 94.3 -86.0 75.7 66.8 -4.7 119.3 40 40 A E S S- 0 0 74 -2,-1.7 188,-0.3 103,-0.1 3,-0.1 -0.984 75.5-106.6-160.6 155.9 64.5 -4.6 116.3 41 41 A L - 0 0 8 -2,-0.3 186,-0.1 186,-0.2 -2,-0.0 -0.624 55.2 -91.3 -83.8 145.2 61.7 -6.6 114.6 42 42 A P - 0 0 55 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.180 44.3-107.6 -58.2 151.6 62.9 -8.4 111.4 43 43 A A - 0 0 84 1,-0.1 3,-0.1 -3,-0.1 74,-0.0 -0.553 39.2 -99.6 -81.1 147.3 62.5 -6.5 108.1 44 44 A E - 0 0 103 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.201 53.0 -73.4 -65.0 155.9 59.7 -7.6 105.7 45 45 A E - 0 0 162 1,-0.1 2,-2.1 2,-0.0 -1,-0.1 -0.111 42.8-117.3 -50.8 140.3 60.4 -9.8 102.7 46 46 A G + 0 0 70 -3,-0.1 2,-0.8 1,-0.0 -1,-0.1 -0.392 39.0 179.8 -81.1 63.7 62.3 -8.2 99.8 47 47 A K - 0 0 86 -2,-2.1 2,-0.1 4,-0.1 -3,-0.0 -0.543 16.4-156.4 -68.3 105.9 59.5 -8.6 97.2 48 48 A S > - 0 0 55 -2,-0.8 4,-2.8 1,-0.1 5,-0.1 -0.340 26.3-109.6 -83.2 165.7 61.0 -7.0 94.1 49 49 A L H > S+ 0 0 116 2,-0.2 4,-3.8 1,-0.2 5,-0.2 0.905 119.7 51.8 -58.6 -46.3 59.2 -5.5 91.1 50 50 A W H > S+ 0 0 204 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 113.1 45.5 -57.2 -45.5 60.4 -8.3 88.8 51 51 A E H > S+ 0 0 96 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.889 114.1 49.5 -64.5 -41.5 59.0 -10.8 91.4 52 52 A L H X S+ 0 0 13 -4,-2.8 4,-0.8 2,-0.2 -2,-0.2 0.951 111.4 48.3 -62.4 -50.4 55.8 -8.7 91.6 53 53 A V H >< S+ 0 0 53 -4,-3.8 3,-1.1 1,-0.2 -2,-0.2 0.907 110.3 51.4 -57.0 -46.2 55.4 -8.6 87.9 54 54 A I H >< S+ 0 0 82 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.848 101.9 61.7 -60.8 -35.5 55.9 -12.3 87.5 55 55 A E H >< S+ 0 0 68 -4,-1.7 3,-1.5 1,-0.3 4,-0.3 0.734 87.4 71.8 -63.5 -23.8 53.3 -13.0 90.1 56 56 A Q T << S+ 0 0 40 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.1 0.184 98.5 52.5 -78.4 19.9 50.7 -11.3 87.9 57 57 A F T < S+ 0 0 43 -3,-1.1 -1,-0.3 45,-0.1 -2,-0.2 -0.015 77.9 94.6-142.1 26.5 51.1 -14.4 85.8 58 58 A E < + 0 0 109 -3,-1.5 -2,-0.1 4,-0.0 -3,-0.1 0.763 60.4 100.6 -89.0 -31.5 50.5 -17.1 88.5 59 59 A D S > S- 0 0 70 -4,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.281 73.8-135.8 -58.3 134.9 46.8 -17.4 87.6 60 60 A L H > S+ 0 0 63 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.930 104.4 50.7 -58.0 -46.9 45.8 -20.4 85.5 61 61 A L H > S+ 0 0 22 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.862 107.4 51.6 -62.3 -38.2 43.5 -18.2 83.3 62 62 A V H > S+ 0 0 16 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.837 109.5 52.8 -68.9 -27.6 46.2 -15.6 82.7 63 63 A R H X S+ 0 0 116 -4,-1.6 4,-3.0 -3,-0.2 -2,-0.2 0.894 106.3 51.4 -71.0 -42.4 48.5 -18.4 81.6 64 64 A I H X S+ 0 0 34 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.955 112.5 46.2 -58.4 -50.0 46.0 -19.7 79.1 65 65 A L H X S+ 0 0 14 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.868 110.2 54.1 -60.5 -38.1 45.6 -16.3 77.6 66 66 A L H X S+ 0 0 71 -4,-1.8 4,-1.9 2,-0.2 3,-0.3 0.961 109.8 47.5 -60.5 -50.2 49.4 -15.9 77.6 67 67 A L H X S+ 0 0 104 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.933 111.3 50.0 -55.2 -49.0 49.7 -19.1 75.7 68 68 A A H X S+ 0 0 6 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.794 105.9 57.4 -61.7 -29.0 47.0 -18.0 73.2 69 69 A A H X S+ 0 0 9 -4,-1.8 4,-2.3 -3,-0.3 -1,-0.2 0.908 106.8 49.5 -67.4 -40.9 48.8 -14.7 72.8 70 70 A C H X S+ 0 0 70 -4,-1.9 4,-2.1 -3,-0.2 -2,-0.2 0.952 113.0 45.0 -62.1 -51.2 51.9 -16.7 71.7 71 71 A I H X S+ 0 0 36 -4,-2.3 4,-2.8 1,-0.2 3,-0.4 0.959 114.4 49.1 -57.8 -50.5 49.9 -18.8 69.2 72 72 A S H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.3 -1,-0.2 0.863 111.2 51.4 -55.2 -37.3 48.2 -15.7 67.9 73 73 A F H < S+ 0 0 119 -4,-2.3 -1,-0.3 2,-0.2 -2,-0.2 0.820 110.8 47.9 -70.2 -32.6 51.6 -14.1 67.7 74 74 A V H >X S+ 0 0 78 -4,-2.1 4,-2.6 -3,-0.4 3,-1.0 0.902 111.4 48.7 -75.3 -42.9 52.9 -17.0 65.7 75 75 A L H 3< S+ 0 0 15 -4,-2.8 2,-0.2 1,-0.3 -2,-0.2 0.914 102.9 60.5 -63.6 -43.5 50.0 -17.1 63.2 76 76 A A T 3< S+ 0 0 14 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.1 0.116 116.4 37.9 -72.6 27.9 50.2 -13.4 62.6 77 77 A W T <4 S+ 0 0 180 -3,-1.0 2,-1.2 -2,-0.2 -2,-0.2 0.486 107.6 53.9-139.8 -53.6 53.6 -14.3 61.3 78 78 A F S < S+ 0 0 144 -4,-2.6 2,-0.3 2,-0.0 -2,-0.1 -0.295 89.9 113.5 -87.4 50.1 53.7 -17.6 59.5 79 79 A E - 0 0 103 -2,-1.2 2,-0.4 2,-0.1 -3,-0.0 -0.861 64.8-120.0-122.6 158.6 50.9 -16.4 57.2 80 80 A E + 0 0 160 -2,-0.3 3,-0.1 2,-0.0 2,-0.1 -0.799 69.1 40.0-100.3 136.3 50.7 -15.7 53.4 81 81 A G S S- 0 0 58 -2,-0.4 -2,-0.1 1,-0.1 0, 0.0 -0.351 81.9 -94.6 115.3 163.0 49.7 -12.3 52.0 82 82 A E S S+ 0 0 151 1,-0.1 2,-1.9 -2,-0.1 3,-0.4 0.118 78.8 119.5-102.6 21.5 50.4 -8.6 52.8 83 83 A E > + 0 0 106 1,-0.2 3,-0.9 -3,-0.1 -1,-0.1 -0.215 29.7 133.0 -78.6 48.6 47.3 -8.1 55.0 84 84 A T G >> + 0 0 88 -2,-1.9 3,-1.2 1,-0.2 4,-0.8 0.620 47.2 84.3 -74.7 -14.0 49.6 -7.2 57.9 85 85 A I G 34 S+ 0 0 115 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.792 107.9 22.9 -59.3 -29.3 47.6 -4.1 58.7 86 86 A T G <4 S+ 0 0 32 -3,-0.9 4,-0.4 2,-0.1 -1,-0.3 0.029 104.7 90.8-125.2 23.9 45.2 -6.3 60.7 87 87 A A T X4 S+ 0 0 23 -3,-1.2 3,-0.5 1,-0.1 -2,-0.1 0.964 90.8 34.2 -83.4 -61.7 47.6 -9.2 61.5 88 88 A F T 3X S+ 0 0 79 -4,-0.8 4,-1.8 1,-0.2 5,-0.1 0.294 95.9 90.0 -79.9 9.7 49.3 -8.3 64.7 89 89 A V H 3> S+ 0 0 38 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.977 86.3 49.5 -67.3 -55.1 46.1 -6.6 66.1 90 90 A E H <> S+ 0 0 32 -3,-0.5 4,-2.1 -4,-0.4 5,-0.2 0.935 114.5 42.4 -48.8 -59.5 44.8 -9.7 67.7 91 91 A P H > S+ 0 0 7 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.905 114.3 51.0 -59.2 -41.8 48.1 -10.7 69.5 92 92 A F H X S+ 0 0 127 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.858 108.0 54.4 -65.0 -33.5 48.8 -7.1 70.6 93 93 A V H X S+ 0 0 39 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.968 110.8 43.7 -63.1 -54.0 45.2 -6.9 72.0 94 94 A I H >X S+ 0 0 4 -4,-2.1 4,-2.2 1,-0.2 3,-0.7 0.968 116.9 46.4 -54.1 -57.4 45.6 -10.0 74.2 95 95 A L H 3X S+ 0 0 79 -4,-2.5 4,-2.8 1,-0.3 -1,-0.2 0.891 108.7 56.8 -52.1 -45.2 49.1 -9.0 75.3 96 96 A L H 3X S+ 0 0 87 -4,-2.8 4,-2.8 -5,-0.2 -1,-0.3 0.851 106.8 49.0 -57.4 -37.4 47.9 -5.4 76.0 97 97 A I H X S+ 0 0 122 -4,-1.8 3,-1.4 -3,-0.4 4,-0.6 0.959 106.5 52.1 -70.7 -52.9 48.1 -2.2 94.3 109 109 A E H >< S+ 0 0 81 -4,-1.7 3,-0.5 1,-0.3 -2,-0.2 0.798 106.0 57.4 -54.4 -30.4 51.1 -3.9 96.0 110 110 A R H 3< S+ 0 0 204 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.792 114.5 37.0 -72.6 -26.5 52.9 -0.6 95.9 111 111 A N H << S+ 0 0 85 -3,-1.4 2,-0.7 -4,-0.7 -1,-0.2 0.261 93.4 99.7-109.7 12.7 50.1 1.1 97.9 112 112 A A << - 0 0 63 -4,-0.6 2,-0.3 -3,-0.5 -4,-0.0 -0.878 52.7-167.6-104.0 111.8 49.2 -1.8 100.3 113 113 A E - 0 0 122 -2,-0.7 2,-0.3 3,-0.0 -2,-0.0 -0.699 10.5-141.0 -95.8 149.5 50.7 -1.4 103.8 114 114 A N > - 0 0 67 -2,-0.3 4,-0.5 1,-0.1 3,-0.2 -0.824 18.1-121.3-111.2 152.3 50.7 -4.3 106.2 115 115 A A H >> S+ 0 0 8 614,-0.5 3,-1.0 -2,-0.3 4,-0.6 0.845 107.9 60.2 -57.5 -38.7 50.1 -4.2 110.0 116 116 A I H >> S+ 0 0 22 1,-0.3 3,-1.9 2,-0.2 4,-0.6 0.948 104.5 47.4 -57.5 -50.1 53.5 -5.7 110.9 117 117 A E H 34 S+ 0 0 51 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.609 104.5 65.3 -68.3 -7.2 55.4 -2.9 109.2 118 118 A A H X< S+ 0 0 8 -3,-1.0 3,-0.8 -4,-0.5 -1,-0.3 0.628 89.8 64.1 -86.7 -16.6 53.1 -0.6 111.0 119 119 A L H X< S+ 0 0 1 -3,-1.9 3,-2.3 -4,-0.6 4,-0.3 0.787 85.3 73.7 -74.9 -28.1 54.6 -1.7 114.4 120 120 A K T 3< S+ 0 0 52 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.372 81.6 72.9 -68.7 9.2 57.9 -0.3 113.4 121 121 A E T < S+ 0 0 120 -3,-0.8 -1,-0.3 1,-0.1 -2,-0.2 0.671 91.3 56.5 -93.6 -20.2 56.4 3.1 114.0 122 122 A Y S < S+ 0 0 37 -3,-2.3 -2,-0.2 -4,-0.1 89,-0.2 0.484 87.0 88.5 -89.4 -5.0 56.5 2.4 117.8 123 123 A E S S- 0 0 64 -4,-0.3 20,-0.1 87,-0.1 36,-0.1 -0.845 75.0-135.7 -98.7 118.8 60.3 1.7 117.9 124 124 A P - 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0 0 60 0, 0.0 4,-1.6 0, 0.0 3,-1.6 -0.495 36.0-101.5 -74.0 147.7 39.6 -27.9 129.5 663 663 A L H 3> S+ 0 0 132 1,-0.3 4,-1.6 2,-0.2 5,-0.1 0.759 122.9 54.9 -38.0 -38.7 40.4 -27.2 125.8 664 664 A A H 3> S+ 0 0 81 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.907 110.5 44.8 -65.4 -42.2 37.5 -29.4 124.7 665 665 A E H <> S+ 0 0 103 -3,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.736 107.0 58.2 -75.2 -25.2 35.0 -27.5 126.8 666 666 A Q H X S+ 0 0 15 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.904 104.9 52.2 -69.7 -40.9 36.3 -24.1 125.9 667 667 A R H X S+ 0 0 89 -4,-1.6 4,-0.8 -5,-0.3 -2,-0.2 0.930 112.2 45.5 -59.5 -45.8 35.6 -24.9 122.3 668 668 A E H >X S+ 0 0 72 -4,-1.4 3,-1.3 1,-0.2 4,-0.9 0.934 108.6 55.3 -64.0 -47.0 32.0 -25.9 123.2 669 669 A A H >X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.3 3,-0.5 0.831 102.8 58.9 -55.5 -34.2 31.5 -22.8 125.4 670 670 A C H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.767 98.0 57.8 -68.9 -26.3 32.4 -20.6 122.4 671 671 A R H << S+ 0 0 119 -3,-1.3 -1,-0.2 -4,-0.8 -2,-0.2 0.767 120.5 26.6 -77.8 -21.3 29.6 -22.0 120.2 672 672 A R H << S+ 0 0 75 -4,-0.9 -2,-0.2 -3,-0.5 -1,-0.2 0.635 96.4 105.0-112.9 -17.2 26.9 -21.0 122.6 673 673 A A < + 0 0 0 -4,-2.2 -21,-0.2 -5,-0.2 -22,-0.1 -0.307 30.2 170.6 -71.0 146.7 28.3 -18.1 124.6 674 674 A C + 0 0 5 -23,-2.4 -51,-3.0 1,-0.2 2,-0.4 0.338 66.1 58.4-131.3 -1.4 27.2 -14.5 124.0 675 675 A C E +no 623 652E 1 -24,-1.1 -22,-2.3 -53,-0.2 2,-0.5 -0.970 50.3 176.0-141.3 122.3 29.0 -12.8 127.0 676 676 A F E -no 624 653E 0 -53,-2.8 -51,-2.6 -2,-0.4 2,-0.3 -0.980 13.9-175.8-126.5 115.7 32.6 -12.7 127.9 677 677 A A E +no 625 654E 0 -24,-2.6 -22,-1.1 -2,-0.5 -51,-0.2 -0.797 62.5 7.8-111.8 154.0 33.6 -10.6 131.0 678 678 A R S S- 0 0 105 -53,-1.3 -23,-1.9 -51,-0.5 -22,-0.4 0.933 86.5-172.2 41.3 64.6 37.0 -9.8 132.5 679 679 A V - 0 0 38 -54,-0.4 -1,-0.2 -3,-0.3 5,-0.1 -0.726 19.2-120.0 -96.7 138.3 38.7 -11.4 129.5 680 680 A E >> - 0 0 64 -2,-0.4 3,-0.7 1,-0.1 4,-0.5 -0.140 29.4-104.8 -67.1 163.6 42.5 -12.0 129.2 681 681 A P T 34 S+ 0 0 95 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.699 119.9 45.1 -63.5 -21.1 44.7 -10.5 126.5 682 682 A S T 3> S+ 0 0 45 1,-0.1 4,-1.7 2,-0.1 3,-0.3 0.580 92.0 84.8 -98.7 -13.4 45.0 -13.8 124.6 683 683 A H H <> S+ 0 0 1 -3,-0.7 4,-2.9 1,-0.2 5,-0.2 0.822 80.1 58.5 -60.9 -37.4 41.3 -14.7 124.8 684 684 A K H X S+ 0 0 16 -4,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.926 109.6 47.0 -59.5 -43.1 40.0 -12.8 121.8 685 685 A S H > S+ 0 0 15 -3,-0.3 4,-1.9 -4,-0.2 -1,-0.2 0.912 113.9 46.1 -63.5 -45.4 42.4 -14.8 119.6 686 686 A K H X S+ 0 0 77 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.856 110.7 53.9 -66.6 -35.1 41.4 -18.1 121.2 687 687 A I H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.903 109.2 48.5 -66.7 -37.9 37.8 -17.2 120.9 688 688 A V H X S+ 0 0 0 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.859 110.1 52.3 -69.4 -34.3 38.3 -16.6 117.2 689 689 A E H X S+ 0 0 101 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.965 111.9 44.4 -64.8 -50.9 40.1 -19.9 116.7 690 690 A Y H < S+ 0 0 23 -4,-2.5 3,-0.5 1,-0.2 -2,-0.2 0.889 111.8 53.0 -60.1 -42.2 37.3 -21.9 118.4 691 691 A L H ><>S+ 0 0 0 -4,-2.2 5,-1.5 1,-0.2 3,-1.2 0.888 108.4 51.1 -61.8 -38.1 34.6 -20.0 116.4 692 692 A Q H ><5S+ 0 0 55 -4,-1.8 3,-1.8 1,-0.3 -1,-0.2 0.726 94.8 70.0 -73.0 -20.7 36.5 -20.8 113.2 693 693 A S T 3<5S+ 0 0 49 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.339 101.1 49.1 -77.7 9.0 36.6 -24.5 114.2 694 694 A Y T < 5S- 0 0 45 -3,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.133 121.8-110.6-126.8 11.3 32.8 -24.4 113.5 695 695 A D T < 5 + 0 0 134 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.838 62.8 159.6 58.9 37.7 33.3 -22.7 110.2 696 696 A E < - 0 0 43 -5,-1.5 2,-0.9 -350,-0.0 -1,-0.2 -0.675 44.2-130.8 -87.8 141.7 31.8 -19.4 111.5 697 697 A I - 0 0 15 -353,-0.4 -351,-2.5 -2,-0.3 -350,-1.9 -0.856 37.8-159.0 -93.1 107.5 32.6 -16.2 109.6 698 698 A T E -m 347 0E 0 -2,-0.9 18,-2.7 -352,-0.2 17,-0.5 -0.756 22.0-166.5-101.2 136.2 33.7 -14.0 112.6 699 699 A A E -mp 348 716E 0 -352,-2.7 -350,-3.1 -2,-0.4 2,-0.4 -0.939 16.0-178.1-112.2 134.6 33.9 -10.2 112.9 700 700 A M E -mp 349 717E 1 16,-1.6 18,-3.7 -2,-0.4 2,-0.2 -0.997 15.6-140.9-136.9 137.7 35.8 -9.0 116.0 701 701 A T E + p 0 718E 1 -352,-1.4 2,-0.3 -2,-0.4 18,-0.2 -0.656 30.7 148.1 -97.8 157.7 36.4 -5.4 117.2 702 702 A G E - p 0 719E 0 16,-1.9 18,-1.1 -2,-0.2 21,-0.1 -0.971 26.2-168.3-173.2 170.3 39.6 -4.0 118.6 703 703 A D + 0 0 65 -2,-0.3 21,-2.6 1,-0.2 24,-0.5 0.599 60.7 61.5-146.7 -24.2 41.7 -0.8 118.9 704 704 A G S >> S- 0 0 1 19,-0.2 3,-3.2 23,-0.1 4,-0.7 -0.713 89.1 -97.8-110.0 164.3 45.3 -1.2 120.3 705 705 A V G >4 S+ 0 0 0 -526,-0.9 3,-0.7 1,-0.3 -525,-0.2 0.759 121.6 65.5 -50.3 -25.2 48.3 -3.2 119.1 706 706 A N G 34 S+ 0 0 46 -527,-0.9 4,-0.3 1,-0.2 -1,-0.3 0.716 100.9 48.2 -71.3 -19.4 47.3 -5.9 121.6 707 707 A D G <> S+ 0 0 17 -3,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.522 86.4 95.3 -93.6 -7.4 44.1 -6.5 119.6 708 708 A A H S+ 0 0 4 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.967 113.3 43.1 -63.3 -51.7 46.4 -10.5 116.4 710 710 A A H > S+ 0 0 4 -4,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.882 113.8 53.7 -62.2 -35.6 42.7 -11.3 116.9 711 711 A L H < S+ 0 0 0 -4,-2.5 6,-0.3 1,-0.2 -1,-0.2 0.907 111.4 44.6 -63.5 -43.9 41.8 -8.6 114.4 712 712 A K H < S+ 0 0 57 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.879 115.0 49.0 -68.9 -38.3 44.1 -10.2 111.8 713 713 A K H < S+ 0 0 57 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.958 92.8 86.7 -68.1 -50.7 42.8 -13.6 112.6 714 714 A A S >< S- 0 0 0 -4,-2.8 3,-0.5 -5,-0.2 -15,-0.1 -0.078 86.3-121.9 -49.1 147.4 39.1 -12.9 112.4 715 715 A E T 3 S+ 0 0 37 -17,-0.5 2,-0.4 1,-0.3 -16,-0.2 0.884 108.9 23.8 -61.0 -36.2 37.5 -13.1 109.0 716 716 A I E 3 S-p 699 0E 1 -18,-2.7 -16,-1.6 -375,-0.1 -1,-0.3 -0.807 78.8-164.9-133.1 93.4 36.5 -9.5 109.5 717 717 A G E < -p 700 0E 0 -3,-0.5 16,-2.0 -2,-0.4 15,-1.8 -0.605 11.1-155.7 -75.2 135.9 38.6 -7.5 111.9 718 718 A I E -pq 701 733E 0 -18,-3.7 -16,-1.9 -2,-0.3 2,-0.3 -0.945 8.6-167.7-121.7 118.1 36.9 -4.3 113.0 719 719 A A E -pq 702 734E 0 14,-2.9 16,-2.8 -2,-0.5 2,-0.2 -0.715 24.6-111.6-104.7 151.2 38.8 -1.3 114.2 720 720 A M E > - q 0 735E 12 -18,-1.1 3,-2.0 -2,-0.3 16,-0.1 -0.559 15.7-136.5 -77.5 139.1 37.7 1.9 115.9 721 721 A G T 3 S+ 0 0 21 14,-2.3 15,-0.1 1,-0.3 -1,-0.1 0.806 112.2 48.6 -64.5 -25.2 38.0 5.1 113.9 722 722 A S T 3 S+ 0 0 95 13,-0.3 -1,-0.3 2,-0.0 14,-0.1 0.247 100.3 96.1 -96.0 12.0 39.3 6.5 117.2 723 723 A G S < S- 0 0 21 -3,-2.0 -19,-0.2 1,-0.2 -20,-0.1 -0.162 85.2 -63.9 -91.3-171.4 41.7 3.6 117.7 724 724 A T > - 0 0 28 -21,-2.6 4,-1.9 1,-0.1 -1,-0.2 -0.323 38.8-120.5 -74.1 156.4 45.4 3.1 116.9 725 725 A A H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.808 112.6 55.7 -66.4 -28.6 46.8 3.2 113.4 726 726 A V H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.946 104.6 49.7 -70.3 -48.1 48.1 -0.4 113.9 727 727 A A H >> S+ 0 0 0 -24,-0.5 3,-0.7 1,-0.2 4,-0.7 0.943 112.5 50.9 -54.1 -45.2 44.7 -1.9 114.8 728 728 A K H >< S+ 0 0 65 -4,-1.9 3,-1.2 1,-0.3 -1,-0.2 0.914 107.8 50.2 -58.3 -47.6 43.2 -0.2 111.7 729 729 A T H 3< S+ 0 0 28 -4,-2.1 -614,-0.5 1,-0.3 -1,-0.3 0.701 110.6 51.8 -67.6 -17.6 45.9 -1.5 109.4 730 730 A A H << S+ 0 0 7 -4,-1.3 -1,-0.3 -3,-0.7 -2,-0.2 0.549 101.1 80.8 -94.2 -6.9 45.2 -5.0 110.8 731 731 A S << - 0 0 1 -3,-1.2 -13,-0.2 -4,-0.7 3,-0.1 -0.569 69.3-143.0-100.8 160.2 41.5 -4.8 110.2 732 732 A E S S+ 0 0 33 -15,-1.8 -398,-3.1 1,-0.2 -397,-1.0 0.739 90.7 24.9 -87.4 -23.9 39.2 -5.3 107.2 733 733 A M E -Kq 333 718E 2 -16,-2.0 -14,-2.9 -400,-0.2 2,-0.4 -0.992 63.0-153.7-144.4 148.9 37.0 -2.4 108.3 734 734 A V E -Kq 332 719E 10 -402,-2.6 -402,-2.6 -2,-0.3 2,-0.9 -0.974 16.9-138.3-121.8 132.1 37.1 0.7 110.4 735 735 A L E > -Kq 331 720E 0 -16,-2.8 -14,-2.3 -2,-0.4 3,-0.9 -0.794 9.6-163.1 -91.9 106.6 34.1 2.3 112.2 736 736 A A T 3 S+ 0 0 53 -406,-2.1 -1,-0.2 -2,-0.9 -405,-0.1 0.805 96.5 32.8 -57.8 -28.0 34.4 6.0 111.6 737 737 A D T 3 S- 0 0 49 -407,-0.5 -1,-0.3 2,-0.1 3,-0.1 0.391 101.6-130.3-108.9 0.4 31.9 6.4 114.5 738 738 A D < + 0 0 24 -3,-0.9 2,-0.3 -408,-0.2 -2,-0.1 0.489 57.4 149.3 64.4 2.8 32.9 3.4 116.6 739 739 A N >> - 0 0 8 1,-0.1 3,-2.2 -409,-0.1 4,-0.6 -0.517 50.8-143.2 -76.9 125.2 29.2 2.4 116.7 740 740 A F H >> S+ 0 0 0 -385,-2.3 3,-2.1 -2,-0.3 4,-1.1 0.900 100.9 62.0 -48.7 -45.1 28.2 -1.2 116.9 741 741 A S H 3> S+ 0 0 19 -386,-0.3 4,-2.0 1,-0.3 -1,-0.3 0.666 91.1 67.2 -60.1 -15.8 25.2 -0.5 114.6 742 742 A T H <> S+ 0 0 6 -3,-2.2 4,-1.5 2,-0.2 -1,-0.3 0.804 98.0 53.8 -74.0 -27.1 27.6 0.5 111.8 743 743 A I H S+ 0 0 3 -4,-2.1 5,-2.1 -5,-0.3 4,-0.3 0.902 113.1 47.8 -64.5 -41.2 32.0 -24.4 64.2 779 779 A A H <5S+ 0 0 1 -4,-1.6 3,-0.3 3,-0.2 -2,-0.2 0.850 113.4 47.6 -69.0 -35.2 35.1 -26.5 64.9 780 780 A A H <5S+ 0 0 23 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.950 116.1 42.2 -70.4 -49.9 33.1 -29.7 64.9 781 781 A L T <5S- 0 0 91 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.392 108.5-124.4 -77.5 2.4 31.3 -29.0 61.6 782 782 A G T 5 + 0 0 19 -3,-0.3 -3,-0.2 -4,-0.3 -4,-0.1 0.801 55.9 159.5 57.7 31.5 34.5 -27.6 60.1 783 783 A L < - 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