==== 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 29-MAY-06 2DQS . COMPND 2 MOLECULE: SARCOPLASMIC/ENDOPLASMIC RETICULUM CALCIUM ATPASE . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR C.TOYOSHIMA,Y.NORIMATSU,J.TSUEDA . 994 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45695.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 716 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 109 11.0 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 . 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 . 57 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 121 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 365 36.7 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 4 3 5 2 1 2 3 3 1 1 0 1 1 1 2 1 1 0 1 0 1 0 1 0 0 0 1 RESIDUES PER ALPHA HELIX . 2 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 . 2 3 4 3 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 1 0 1 0 0 0 1 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 20 0, 0.0 3,-1.9 0, 0.0 224,-0.1 0.000 360.0 360.0 360.0 75.7 64.8 -11.8 131.0 2 2 A E T 3 + 0 0 152 1,-0.3 3,-0.4 2,-0.1 223,-0.1 0.747 360.0 50.9 -50.7 -34.1 61.1 -12.2 130.3 3 3 A A T >> + 0 0 38 1,-0.2 3,-2.9 2,-0.1 4,-0.8 0.316 68.4 125.8 -92.4 8.9 60.1 -12.5 134.0 4 4 A A T <4 + 0 0 2 -3,-1.9 3,-0.4 1,-0.3 -1,-0.2 0.682 65.2 65.2 -38.7 -32.3 61.9 -9.3 135.1 5 5 A H T 34 S+ 0 0 5 -3,-0.4 189,-3.1 1,-0.2 -1,-0.3 0.813 105.7 42.8 -65.1 -32.9 58.7 -7.9 136.6 6 6 A S T <4 S+ 0 0 26 -3,-2.9 -1,-0.2 187,-0.2 -2,-0.2 0.575 101.6 84.2 -90.2 -10.4 58.6 -10.6 139.2 7 7 A K S < S- 0 0 79 -4,-0.8 187,-0.2 -3,-0.4 2,-0.1 -0.552 86.9-105.1 -89.3 158.7 62.3 -10.5 140.0 8 8 A S > - 0 0 17 -2,-0.2 4,-1.6 185,-0.1 5,-0.1 -0.335 29.7-110.1 -75.4 165.8 63.8 -8.1 142.5 9 9 A T H > S+ 0 0 26 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.870 122.5 47.1 -63.2 -38.3 65.7 -5.1 141.3 10 10 A E H > S+ 0 0 128 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.837 106.4 60.8 -73.0 -33.0 69.0 -6.6 142.6 11 11 A E H > S+ 0 0 91 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.872 103.3 48.4 -62.9 -38.5 68.0 -9.9 141.0 12 12 A C H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.920 112.5 47.7 -71.2 -40.9 68.0 -8.5 137.5 13 13 A L H X>S+ 0 0 25 -4,-1.4 5,-2.0 2,-0.2 4,-0.7 0.916 114.3 47.7 -64.1 -41.0 71.4 -6.8 138.0 14 14 A A H ><5S+ 0 0 77 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.954 108.6 55.8 -64.1 -46.3 72.7 -10.0 139.3 15 15 A Y H 3<5S+ 0 0 134 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.866 116.5 33.8 -52.4 -45.2 71.2 -11.9 136.4 16 16 A F H 3<5S- 0 0 12 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.406 105.9-123.9 -93.8 1.2 73.0 -9.8 133.8 17 17 A G T <<5 + 0 0 50 -3,-1.1 2,-0.4 -4,-0.7 -3,-0.2 0.936 64.4 136.4 55.9 49.2 76.1 -9.2 135.8 18 18 A V < - 0 0 14 -5,-2.0 2,-0.5 -6,-0.1 -1,-0.2 -0.955 51.0-132.2-129.7 150.3 75.8 -5.5 135.5 19 19 A S > - 0 0 55 4,-0.4 4,-2.3 -2,-0.4 131,-0.2 -0.865 12.6-138.9-102.7 130.2 76.2 -2.6 138.0 20 20 A E T 4 S+ 0 0 58 -2,-0.5 -1,-0.1 1,-0.2 4,-0.1 0.818 102.5 45.9 -54.8 -34.9 73.6 0.1 138.2 21 21 A T T 4 S+ 0 0 122 2,-0.1 -1,-0.2 1,-0.1 110,-0.0 0.890 124.1 26.9 -79.9 -39.8 76.2 2.8 138.5 22 22 A T T 4 S- 0 0 69 1,-0.1 112,-0.3 108,-0.0 -2,-0.2 0.889 90.1-153.9 -90.6 -45.2 78.7 1.8 135.8 23 23 A G < - 0 0 1 -4,-2.3 -4,-0.4 108,-0.2 108,-0.3 -0.435 43.4 -23.1 95.8-174.1 76.6 -0.1 133.2 24 24 A L B -a 131 0A 0 106,-0.7 108,-1.5 -2,-0.1 109,-0.5 -0.405 60.9-127.5 -75.2 149.3 77.8 -2.7 130.8 25 25 A T >> - 0 0 54 106,-0.2 4,-2.6 107,-0.2 3,-0.6 -0.600 30.2-105.6 -90.8 154.2 81.4 -3.0 129.6 26 26 A P H 3> S+ 0 0 90 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.776 123.0 56.0 -50.8 -28.8 82.2 -3.0 125.9 27 27 A D H 3> S+ 0 0 86 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.929 109.8 45.0 -69.8 -44.3 82.9 -6.8 126.2 28 28 A Q H <> S+ 0 0 26 -3,-0.6 4,-3.6 2,-0.2 5,-0.3 0.927 111.2 52.9 -63.2 -47.2 79.4 -7.3 127.6 29 29 A V H X S+ 0 0 25 -4,-2.6 4,-3.4 2,-0.2 5,-0.2 0.971 114.0 42.9 -50.1 -60.1 77.8 -5.1 125.0 30 30 A K H X S+ 0 0 129 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.916 117.6 45.1 -51.2 -54.3 79.5 -7.1 122.3 31 31 A R H X S+ 0 0 123 -4,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.862 116.4 46.3 -61.8 -38.0 78.8 -10.5 123.9 32 32 A H H X S+ 0 0 17 -4,-3.6 4,-2.8 2,-0.2 5,-0.4 0.892 106.6 58.0 -72.1 -40.4 75.2 -9.5 124.6 33 33 A L H X S+ 0 0 32 -4,-3.4 4,-1.9 -5,-0.3 -2,-0.2 0.882 108.7 46.7 -57.5 -39.2 74.6 -8.1 121.2 34 34 A E H < S+ 0 0 144 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.815 114.1 47.2 -73.8 -29.9 75.5 -11.5 119.7 35 35 A K H < S+ 0 0 146 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.852 129.1 21.8 -78.5 -36.0 73.3 -13.5 122.1 36 36 A Y H < S- 0 0 71 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.478 97.3-140.5-112.6 -4.8 70.2 -11.3 121.7 37 37 A G < - 0 0 31 -4,-1.9 -1,-0.2 -5,-0.4 -2,-0.1 -0.068 47.4 -34.3 69.4-178.1 70.7 -9.6 118.4 38 38 A H - 0 0 54 1,-0.1 2,-1.4 -4,-0.1 106,-0.2 -0.385 63.8-107.5 -74.7 156.0 69.8 -6.0 117.7 39 39 A N S S+ 0 0 12 104,-2.0 2,-0.3 106,-0.3 106,-0.2 -0.687 83.5 87.5 -87.5 88.8 66.8 -4.3 119.4 40 40 A E S S- 0 0 71 -2,-1.4 188,-0.4 104,-0.1 3,-0.1 -0.894 78.7-100.9-177.1 148.5 64.4 -4.1 116.4 41 41 A L - 0 0 14 -2,-0.3 186,-0.1 186,-0.2 192,-0.0 -0.449 56.2 -88.2 -74.8 153.6 61.8 -6.2 114.7 42 42 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.241 49.5-100.7 -62.2 152.7 62.9 -7.9 111.5 43 43 A A - 0 0 79 1,-0.1 3,-0.0 -3,-0.1 74,-0.0 -0.318 41.0 -94.0 -72.5 156.3 62.5 -5.9 108.2 44 44 A E - 0 0 103 1,-0.1 2,-0.8 73,-0.0 -1,-0.1 -0.352 48.4 -97.0 -66.7 152.6 59.7 -6.5 105.8 45 45 A E - 0 0 186 1,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.631 42.7-123.4 -76.0 111.4 60.4 -9.0 103.0 46 46 A G - 0 0 67 -2,-0.8 2,-0.7 1,-0.1 -1,-0.1 -0.392 24.9-164.5 -61.9 113.8 61.4 -6.8 100.0 47 47 A K - 0 0 98 -2,-0.4 -1,-0.1 4,-0.0 2,-0.1 -0.894 15.7-141.2-103.1 113.9 59.2 -7.6 97.0 48 48 A S > - 0 0 53 -2,-0.7 4,-3.0 1,-0.1 5,-0.2 -0.308 20.3-114.4 -76.6 156.5 60.8 -6.2 93.8 49 49 A L H > S+ 0 0 119 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.867 119.3 52.4 -54.1 -39.5 58.9 -4.5 90.9 50 50 A W H >> S+ 0 0 183 2,-0.2 4,-2.5 1,-0.2 3,-1.3 0.984 113.1 41.2 -60.6 -58.0 60.0 -7.5 88.8 51 51 A E H 3> S+ 0 0 89 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.808 112.2 57.1 -59.1 -32.3 58.6 -10.0 91.2 52 52 A L H 3< S+ 0 0 15 -4,-3.0 4,-0.4 1,-0.2 -1,-0.3 0.744 112.4 42.0 -71.2 -23.1 55.6 -7.8 91.7 53 53 A V H << S+ 0 0 36 -3,-1.3 3,-0.3 -4,-1.1 4,-0.3 0.802 108.6 56.6 -91.7 -35.3 55.1 -8.0 87.9 54 54 A I H >< S+ 0 0 66 -4,-2.5 3,-1.1 1,-0.2 -2,-0.2 0.794 101.2 59.0 -66.7 -29.4 55.8 -11.7 87.5 55 55 A E G >< S+ 0 0 62 -4,-1.4 3,-2.3 1,-0.3 4,-0.4 0.852 89.5 71.1 -67.5 -34.0 53.1 -12.5 90.0 56 56 A Q G 3 S+ 0 0 38 -4,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.711 99.0 51.9 -54.4 -19.5 50.6 -10.8 87.8 57 57 A F G < S+ 0 0 48 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 -0.101 83.8 89.4-109.6 33.1 51.1 -13.8 85.6 58 58 A E < + 0 0 128 -3,-2.3 -1,-0.1 5,-0.0 -2,-0.1 0.730 61.4 97.1 -98.2 -27.4 50.4 -16.5 88.2 59 59 A D S > S- 0 0 65 -4,-0.4 4,-1.3 -3,-0.2 3,-0.4 -0.395 78.4-127.8 -66.2 135.2 46.7 -16.8 87.6 60 60 A L H > S+ 0 0 52 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.857 107.1 49.6 -50.2 -41.1 45.6 -19.7 85.4 61 61 A L H > S+ 0 0 20 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.847 108.1 49.3 -72.3 -36.0 43.5 -17.3 83.2 62 62 A V H > S+ 0 0 15 -3,-0.4 4,-1.1 2,-0.2 -1,-0.2 0.659 112.6 52.6 -77.0 -13.0 46.1 -14.6 82.7 63 63 A R H X S+ 0 0 124 -4,-1.3 4,-2.8 2,-0.2 -2,-0.2 0.889 108.2 46.9 -83.8 -47.0 48.4 -17.4 81.7 64 64 A I H X S+ 0 0 31 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.943 113.7 51.2 -57.7 -46.0 46.0 -18.9 79.1 65 65 A L H X S+ 0 0 13 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.882 108.7 49.9 -57.4 -43.9 45.5 -15.4 77.8 66 66 A L H >X S+ 0 0 67 -4,-1.1 4,-1.5 2,-0.2 3,-0.8 0.957 108.2 53.8 -60.1 -50.6 49.3 -14.9 77.5 67 67 A L H >X S+ 0 0 96 -4,-2.8 4,-2.6 1,-0.3 3,-0.6 0.895 108.1 49.8 -50.3 -45.1 49.6 -18.2 75.6 68 68 A A H 3X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.3 -1,-0.3 0.795 104.2 58.3 -66.2 -28.9 47.0 -17.0 73.2 69 69 A A H X S+ 0 0 81 -4,-3.2 4,-2.1 1,-0.2 3,-1.4 0.908 116.8 45.5 -43.0 -56.8 53.3 -16.2 65.9 75 75 A L H 3< S+ 0 0 19 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.928 104.5 60.4 -55.4 -48.8 50.3 -16.5 63.5 76 76 A A H 3< S+ 0 0 12 -4,-3.0 3,-0.3 -5,-0.2 -1,-0.3 0.749 114.6 41.0 -51.5 -21.4 50.1 -12.7 62.9 77 77 A W H << S+ 0 0 189 -3,-1.4 2,-3.0 -4,-1.2 -2,-0.2 0.931 113.2 44.8 -87.8 -74.6 53.7 -13.2 61.7 78 78 A F S < S+ 0 0 149 -4,-2.1 2,-0.3 -5,-0.1 -1,-0.2 -0.121 94.8 124.9 -67.3 43.8 53.7 -16.4 59.6 79 79 A E - 0 0 95 -2,-3.0 2,-0.1 -3,-0.3 -3,-0.0 -0.817 59.5-118.9-111.6 152.2 50.5 -15.2 57.9 80 80 A E S S+ 0 0 145 -2,-0.3 3,-0.2 2,-0.0 2,-0.2 -0.343 71.9 38.6 -82.1 163.0 49.5 -14.7 54.3 81 81 A G S S- 0 0 58 1,-0.1 -2,-0.1 -2,-0.1 3,-0.0 -0.541 81.6-101.2 95.5-164.8 48.4 -11.4 52.7 82 82 A E S S+ 0 0 151 -2,-0.2 2,-1.6 5,-0.0 -1,-0.1 0.289 73.1 121.2-143.8 7.9 49.8 -8.0 53.4 83 83 A E > + 0 0 113 -3,-0.2 4,-0.6 1,-0.2 3,-0.4 -0.599 20.8 155.4 -79.6 87.8 47.3 -6.3 55.7 84 84 A T H > + 0 0 95 -2,-1.6 4,-0.7 1,-0.2 -1,-0.2 0.433 59.0 80.0 -91.6 -0.7 49.6 -5.6 58.7 85 85 A I H 4 S+ 0 0 112 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.735 114.6 15.6 -75.7 -24.9 47.3 -2.7 59.8 86 86 A T H >> S+ 0 0 21 -3,-0.4 4,-0.7 3,-0.1 3,-0.5 0.422 112.2 82.4-124.5 -9.3 44.9 -5.2 61.4 87 87 A A H 3< S+ 0 0 19 -4,-0.6 3,-0.4 1,-0.2 -3,-0.1 0.967 99.5 33.9 -62.5 -58.5 47.2 -8.2 61.5 88 88 A F T 3X S+ 0 0 64 -4,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.288 98.3 88.2 -83.6 10.7 49.1 -7.5 64.7 89 89 A V H <> S+ 0 0 32 -3,-0.5 4,-2.6 2,-0.2 5,-0.3 0.963 82.1 55.7 -71.2 -52.0 46.1 -5.8 66.3 90 90 A E H X S+ 0 0 29 -4,-0.7 4,-1.8 -3,-0.4 5,-0.2 0.911 112.8 40.9 -45.8 -54.8 44.8 -9.1 67.7 91 91 A P H > S+ 0 0 8 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.865 114.5 51.7 -67.1 -34.3 48.0 -9.8 69.6 92 92 A F H X S+ 0 0 118 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.801 107.4 52.8 -73.0 -28.1 48.6 -6.2 70.7 93 93 A V H X S+ 0 0 39 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.944 111.4 46.3 -69.8 -46.1 45.1 -6.0 72.1 94 94 A I H X S+ 0 0 1 -4,-1.8 4,-2.0 -5,-0.3 3,-0.4 0.944 113.1 49.6 -58.6 -49.5 45.6 -9.1 74.2 95 95 A L H X S+ 0 0 79 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.885 106.3 56.6 -57.7 -42.6 49.0 -7.9 75.3 96 96 A L H X S+ 0 0 83 -4,-2.1 4,-3.4 2,-0.2 5,-0.3 0.846 107.2 47.9 -58.7 -39.0 47.6 -4.5 76.3 97 97 A I H X S+ 0 0 40 -4,-1.6 4,-2.2 -3,-0.4 -1,-0.2 0.902 111.5 50.4 -69.1 -40.6 45.1 -6.1 78.7 98 98 A L H X S+ 0 0 6 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.786 115.1 45.5 -65.7 -27.4 47.9 -8.2 80.1 99 99 A I H X S+ 0 0 67 -4,-1.7 4,-3.3 2,-0.2 -2,-0.2 0.936 112.4 46.0 -80.5 -52.9 49.8 -4.9 80.5 100 100 A A H X S+ 0 0 49 -4,-3.4 4,-2.7 1,-0.3 5,-0.2 0.867 111.9 57.1 -57.0 -33.8 47.0 -2.8 82.1 101 101 A N H X S+ 0 0 59 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.3 0.907 110.7 41.0 -63.5 -43.2 46.5 -5.8 84.2 102 102 A A H X S+ 0 0 12 -4,-1.1 4,-3.4 -3,-0.2 5,-0.4 0.966 112.9 53.4 -69.2 -52.7 50.0 -5.7 85.5 103 103 A I H X S+ 0 0 107 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.908 113.6 43.7 -47.5 -50.0 50.1 -1.9 85.8 104 104 A V H X S+ 0 0 74 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.951 113.9 49.8 -62.8 -50.8 47.0 -2.1 88.0 105 105 A G H X S+ 0 0 15 -4,-2.3 4,-1.2 1,-0.2 3,-0.3 0.935 115.1 42.9 -53.5 -51.6 48.2 -5.0 90.0 106 106 A V H X S+ 0 0 22 -4,-3.4 4,-1.7 1,-0.2 -1,-0.2 0.878 108.8 60.7 -62.9 -38.4 51.6 -3.4 90.7 107 107 A W H X S+ 0 0 160 -4,-2.4 4,-1.4 -5,-0.4 -1,-0.2 0.862 102.1 52.0 -57.1 -40.4 49.9 -0.1 91.4 108 108 A Q H < S+ 0 0 106 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.866 107.1 52.3 -66.2 -38.7 47.9 -1.5 94.3 109 109 A E H < S+ 0 0 86 -4,-1.2 3,-0.4 -5,-0.2 -1,-0.2 0.851 101.5 60.3 -68.1 -34.7 50.9 -2.9 96.0 110 110 A R H < S+ 0 0 232 -4,-1.7 2,-1.0 1,-0.3 -1,-0.2 0.974 112.9 37.6 -57.2 -55.4 52.8 0.4 95.9 111 111 A N S < S+ 0 0 92 -4,-1.4 -1,-0.3 2,-0.0 2,-0.2 -0.763 90.4 99.9-102.5 91.1 50.1 2.1 98.0 112 112 A A - 0 0 60 -2,-1.0 2,-0.1 -3,-0.4 -4,-0.0 -0.636 55.8-149.5-170.9 103.7 49.0 -0.5 100.6 113 113 A E - 0 0 123 -2,-0.2 2,-0.4 3,-0.0 3,-0.1 -0.339 7.9-144.4 -77.9 161.7 50.2 -0.5 104.2 114 114 A N > - 0 0 62 1,-0.1 4,-0.9 -2,-0.1 616,-0.1 -0.989 16.8-126.3-130.1 138.6 50.6 -3.6 106.3 115 115 A A H >> S+ 0 0 10 614,-0.6 3,-1.7 -2,-0.4 4,-1.0 0.908 106.7 53.8 -45.2 -58.4 50.0 -3.8 110.1 116 116 A I H >> S+ 0 0 33 1,-0.3 3,-1.6 2,-0.2 4,-0.7 0.912 108.1 48.9 -46.2 -54.6 53.4 -5.3 110.9 117 117 A E H 34 S+ 0 0 59 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.678 105.7 61.5 -62.5 -15.5 55.3 -2.5 109.2 118 118 A A H X< S+ 0 0 8 -3,-1.7 3,-1.4 -4,-0.9 -1,-0.3 0.702 89.1 68.1 -83.3 -22.2 53.1 -0.0 111.1 119 119 A L H X< S+ 0 0 3 -3,-1.6 3,-2.8 -4,-1.0 -1,-0.2 0.851 84.5 72.3 -64.1 -34.4 54.3 -1.3 114.4 120 120 A K G >< S+ 0 0 44 -4,-0.7 3,-0.8 1,-0.3 -1,-0.3 0.524 77.7 77.1 -60.8 -3.9 57.7 0.2 113.7 121 121 A E G < S+ 0 0 111 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.714 92.7 55.7 -75.5 -20.0 56.2 3.7 114.2 122 122 A Y G < S+ 0 0 33 -3,-2.8 -1,-0.2 -4,-0.2 -2,-0.2 0.402 87.5 86.0 -93.9 0.1 56.5 2.7 117.8 123 123 A E S < S- 0 0 60 -3,-0.8 36,-0.1 -4,-0.1 2,-0.0 -0.904 73.6-139.4-103.5 121.2 60.2 2.1 117.9 124 124 A P - 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0 0 37 -54,-0.4 -1,-0.2 -3,-0.2 5,-0.0 -0.656 18.1-123.9 -91.0 139.1 38.7 -11.2 129.5 680 680 A E >> - 0 0 64 -2,-0.3 3,-0.6 1,-0.1 4,-0.6 -0.007 29.9 -98.6 -69.8 175.6 42.4 -11.8 129.3 681 681 A P T 34 S+ 0 0 93 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.909 121.6 44.1 -63.4 -43.1 44.9 -10.6 126.6 682 682 A S T 3> S+ 0 0 51 1,-0.2 4,-1.8 2,-0.1 5,-0.1 0.486 94.5 86.3 -80.4 -6.4 44.9 -13.8 124.6 683 683 A H H <> S+ 0 0 0 -3,-0.6 4,-3.3 2,-0.2 5,-0.3 0.927 79.8 53.3 -66.5 -49.2 41.2 -14.3 124.8 684 684 A K H X S+ 0 0 17 -4,-0.6 4,-2.1 -3,-0.3 -1,-0.2 0.916 113.9 47.2 -51.9 -43.5 39.8 -12.4 121.8 685 685 A S H > S+ 0 0 25 -4,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.898 112.5 47.8 -65.3 -43.4 42.2 -14.3 119.6 686 686 A K H X S+ 0 0 69 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.915 110.5 52.1 -65.7 -40.9 41.3 -17.7 121.2 687 687 A I H X S+ 0 0 1 -4,-3.3 4,-2.7 2,-0.2 -2,-0.2 0.896 108.7 50.7 -61.9 -40.3 37.6 -16.9 120.8 688 688 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 5,-0.2 0.970 110.2 50.6 -60.3 -51.4 38.1 -16.1 117.1 689 689 A E H X S+ 0 0 101 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.910 112.0 46.1 -51.9 -49.6 39.9 -19.4 116.7 690 690 A Y H < S+ 0 0 21 -4,-2.7 4,-0.5 1,-0.2 3,-0.4 0.894 110.6 53.0 -62.9 -41.4 37.1 -21.3 118.3 691 691 A L H ><>S+ 0 0 0 -4,-2.7 5,-1.7 1,-0.2 3,-1.2 0.889 107.6 51.9 -61.2 -38.2 34.5 -19.5 116.3 692 692 A Q H ><5S+ 0 0 53 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.748 96.2 67.5 -71.1 -23.5 36.4 -20.4 113.1 693 693 A S T 3<5S+ 0 0 48 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.685 102.4 48.0 -70.2 -15.5 36.5 -24.1 114.1 694 694 A Y T < 5S- 0 0 52 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.124 121.8-114.2-105.9 15.5 32.7 -24.0 113.6 695 695 A D T < 5 + 0 0 140 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.785 61.5 155.1 55.8 36.5 33.2 -22.3 110.3 696 696 A E < - 0 0 49 -5,-1.7 2,-0.8 -350,-0.0 19,-0.2 -0.781 48.0-125.8 -96.5 131.3 31.6 -19.0 111.3 697 697 A I - 0 0 20 -2,-0.4 -351,-3.1 -353,-0.4 -350,-2.2 -0.663 39.6-153.4 -74.2 113.0 32.7 -15.7 109.5 698 698 A T E -l 347 0D 0 -2,-0.8 18,-2.4 -352,-0.2 2,-0.5 -0.731 20.8-162.4-100.6 141.8 33.7 -13.6 112.5 699 699 A A E -lo 348 716D 0 -352,-2.2 -350,-3.5 -2,-0.3 2,-0.4 -0.980 18.6-179.5-117.4 124.6 33.7 -9.9 113.0 700 700 A M E -lo 349 717D 0 16,-1.9 18,-3.7 -2,-0.5 2,-0.2 -0.972 13.9-144.6-128.5 141.8 35.8 -8.7 116.0 701 701 A T E + o 0 718D 1 -352,-1.4 2,-0.3 -2,-0.4 18,-0.2 -0.672 29.3 138.9-104.4 161.0 36.5 -5.1 117.3 702 702 A G E - o 0 719D 0 16,-1.4 18,-1.2 -2,-0.2 21,-0.1 -0.967 29.0-163.9-179.4 175.7 39.6 -3.6 118.8 703 703 A D + 0 0 63 -2,-0.3 21,-2.6 16,-0.2 24,-0.5 0.495 63.1 69.6-153.2 -18.7 41.8 -0.4 119.0 704 704 A G S >> S- 0 0 0 19,-0.2 3,-2.4 23,-0.1 4,-0.8 -0.654 86.6-105.2-106.3 166.6 45.3 -1.0 120.5 705 705 A V G >4 S+ 0 0 0 -526,-1.5 3,-0.9 1,-0.3 -525,-0.2 0.851 120.3 66.4 -57.0 -31.0 48.3 -2.9 119.1 706 706 A N G 34 S+ 0 0 54 -527,-0.9 4,-0.3 1,-0.3 -1,-0.3 0.701 101.5 46.7 -65.0 -15.9 47.3 -5.6 121.6 707 707 A D G <> S+ 0 0 20 -3,-2.4 4,-3.0 1,-0.1 -1,-0.3 0.590 89.2 91.3 -96.7 -15.2 44.1 -6.2 119.7 708 708 A A H S+ 0 0 6 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.975 113.7 43.7 -58.9 -49.4 46.6 -10.1 116.4 710 710 A A H > S+ 0 0 5 -4,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.940 113.5 51.4 -58.7 -48.4 42.9 -10.8 117.0 711 711 A L H < S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.2 6,-0.2 0.891 109.3 50.2 -56.9 -43.2 41.8 -8.2 114.4 712 712 A K H < S+ 0 0 49 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.944 113.4 46.6 -62.2 -44.7 44.1 -9.7 111.8 713 713 A K H < S+ 0 0 54 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.887 92.2 87.0 -65.5 -44.9 42.8 -13.2 112.5 714 714 A A S < S- 0 0 0 -4,-2.7 3,-0.5 -5,-0.2 -15,-0.1 -0.296 86.7-121.7 -57.6 142.6 39.0 -12.4 112.5 715 715 A E S S+ 0 0 40 1,-0.3 2,-0.4 -19,-0.2 -16,-0.2 0.866 108.9 26.2 -53.6 -37.6 37.5 -12.6 109.0 716 716 A I E S-o 699 0D 1 -18,-2.4 -16,-1.9 -375,-0.1 2,-0.4 -0.854 77.6-166.7-130.5 95.3 36.5 -9.0 109.6 717 717 A G E -o 700 0D 0 -3,-0.5 16,-2.1 -2,-0.4 15,-1.3 -0.694 12.1-157.1 -80.1 129.6 38.6 -7.1 112.0 718 718 A I E -op 701 733D 0 -18,-3.7 -16,-1.4 -2,-0.4 2,-0.3 -0.945 7.1-165.5-114.6 120.5 36.8 -3.9 112.9 719 719 A A E -op 702 734D 0 14,-3.1 16,-3.5 -2,-0.5 -16,-0.2 -0.733 21.9-114.5-103.4 152.2 38.8 -0.9 114.2 720 720 A M E > - 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