==== 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 16-SEP-05 2D2V . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN SLR0953; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR S.FIEULAINE,J.E.LUNN,J.-L.FERRER . 244 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11064.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 78.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 . 19 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.9 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 1 0 0 0 1 1 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 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 . 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 0 193 0, 0.0 2,-0.2 0, 0.0 174,-0.1 0.000 360.0 360.0 360.0 2.0 55.2 31.9 98.8 2 2 A R - 0 0 76 1,-0.1 33,-0.2 2,-0.0 32,-0.1 -0.632 360.0-121.0-105.9 169.1 55.2 29.5 101.7 3 3 A Q S S+ 0 0 68 31,-0.8 2,-0.4 -2,-0.2 240,-0.2 0.579 89.7 40.0 -88.8 -7.6 58.3 27.9 103.2 4 4 A L E -a 35 0A 0 30,-0.8 32,-2.7 238,-0.1 2,-0.6 -0.992 50.3-165.3-148.5 138.1 57.2 24.3 102.6 5 5 A L E -ab 36 181A 0 175,-2.4 177,-2.5 -2,-0.4 2,-0.6 -0.975 24.5-163.3-117.5 106.1 55.5 22.2 100.0 6 6 A L E +ab 37 182A 0 30,-2.9 32,-2.8 -2,-0.6 2,-0.5 -0.870 10.9 178.3-100.3 116.0 54.6 19.0 101.8 7 7 A I E +ab 38 183A 0 175,-2.8 177,-2.0 -2,-0.6 2,-0.3 -0.971 10.3 159.4-120.7 126.3 53.7 16.0 99.6 8 8 A S E -ab 39 184A 0 30,-2.1 32,-2.1 -2,-0.5 177,-0.2 -0.996 38.2-121.3-148.7 150.0 52.8 12.6 101.0 9 9 A D > - 0 0 8 175,-1.6 5,-1.2 -2,-0.3 32,-0.2 -0.364 27.4-142.0 -78.1 169.3 51.0 9.4 100.2 10 10 A L T > >S+ 0 0 0 3,-0.2 5,-3.9 4,-0.2 3,-1.8 0.887 70.9 69.8-100.3 -71.2 48.1 8.5 102.5 11 11 A D B 3 5S-h 15 0B 47 1,-0.3 5,-0.2 3,-0.2 -1,-0.1 -0.353 123.2 -8.5 -60.6 120.5 47.8 4.8 103.3 12 12 A N T 3 5S+ 0 0 72 3,-1.1 217,-0.6 -2,-0.2 -1,-0.3 0.428 137.5 58.9 67.8 10.2 50.6 3.6 105.6 13 13 A T T < 5S+ 0 0 0 -3,-1.8 220,-0.2 2,-0.1 -3,-0.2 0.505 126.8 4.6-121.3 -70.3 52.4 6.9 105.1 14 14 A W T - 0 0 58 -3,-0.3 4,-2.9 1,-0.2 5,-0.2 -0.898 65.6-167.7-120.2 95.5 48.9 5.1 113.0 18 18 A Q H > S+ 0 0 76 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.892 84.9 50.4 -52.5 -47.1 46.0 7.2 114.2 19 19 A Q H > S+ 0 0 148 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.919 114.0 44.8 -59.6 -44.6 47.9 8.6 117.2 20 20 A A H > S+ 0 0 5 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.887 112.0 53.2 -66.7 -39.1 50.8 9.7 115.0 21 21 A L H X S+ 0 0 1 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.945 110.4 48.5 -60.5 -46.8 48.4 11.0 112.4 22 22 A E H X S+ 0 0 106 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.923 112.1 45.1 -63.1 -46.0 46.7 13.1 115.0 23 23 A H H X S+ 0 0 87 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.748 112.1 54.6 -73.2 -16.7 49.8 14.6 116.6 24 24 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.908 111.0 44.2 -76.6 -42.2 51.1 15.3 113.1 25 25 A Q H X S+ 0 0 29 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.755 110.8 56.2 -73.1 -23.1 48.0 17.2 112.2 26 26 A E H X S+ 0 0 127 -4,-1.7 4,-0.8 -5,-0.2 -2,-0.2 0.965 109.8 44.4 -70.3 -52.1 48.1 19.0 115.6 27 27 A Y H >< S+ 0 0 60 -4,-1.8 3,-1.1 1,-0.2 -2,-0.2 0.938 118.5 42.3 -54.9 -53.2 51.6 20.3 114.9 28 28 A L H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.826 104.8 66.3 -64.7 -33.4 50.8 21.4 111.3 29 29 A G H >< S+ 0 0 43 -4,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.727 95.0 59.8 -61.7 -20.9 47.5 22.8 112.4 30 30 A D T << S+ 0 0 125 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.386 117.5 27.4 -88.6 2.5 49.3 25.4 114.4 31 31 A R T X S+ 0 0 76 -3,-2.0 3,-2.3 -4,-0.1 -1,-0.2 -0.098 72.5 147.2-152.7 39.7 51.1 26.8 111.4 32 32 A R G X + 0 0 66 -3,-0.6 3,-0.9 1,-0.3 -2,-0.1 0.736 68.9 60.2 -55.4 -26.8 48.8 26.1 108.5 33 33 A G G 3 S+ 0 0 51 1,-0.2 -1,-0.3 -4,-0.1 -4,-0.1 0.568 91.9 69.9 -80.3 -6.0 49.7 29.2 106.6 34 34 A N G < S+ 0 0 70 -3,-2.3 -30,-0.8 -6,-0.2 -31,-0.8 0.378 101.0 35.8 -92.6 4.8 53.4 28.2 106.3 35 35 A F E < -a 4 0A 0 -3,-0.9 2,-0.4 -32,-0.2 -30,-0.2 -0.999 65.2-129.7-157.5 153.0 53.0 25.3 103.9 36 36 A Y E -a 5 0A 27 -32,-2.7 -30,-2.9 -2,-0.3 2,-0.4 -0.836 30.9-149.0 -98.0 139.5 51.1 23.9 100.9 37 37 A L E +a 6 0A 0 -2,-0.4 25,-2.2 -32,-0.2 24,-1.6 -0.937 18.4 175.4-115.9 133.9 49.8 20.4 101.4 38 38 A A E -ac 7 62A 0 -32,-2.8 -30,-2.1 -2,-0.4 2,-0.6 -0.993 20.6-148.9-138.8 130.0 49.4 17.8 98.7 39 39 A Y E -ac 8 63A 0 23,-1.6 25,-3.4 -2,-0.4 2,-0.7 -0.876 9.6-167.1 -97.3 122.3 48.3 14.2 99.0 40 40 A A E + c 0 64A 0 -32,-2.1 2,-0.3 -2,-0.6 25,-0.2 -0.820 27.8 159.6-110.3 86.8 50.0 12.1 96.3 41 41 A T - 0 0 2 23,-1.5 26,-2.3 -2,-0.7 27,-0.6 -0.736 51.5-135.0-112.5 158.4 47.9 8.9 96.5 42 42 A G S S+ 0 0 18 24,-0.3 -1,-0.1 -2,-0.3 23,-0.1 0.671 81.3 98.3 -80.7 -17.0 47.3 5.9 94.2 43 43 A R S S- 0 0 58 23,-0.1 23,-3.4 1,-0.1 24,-0.2 -0.234 83.7-104.3 -68.0 158.9 43.6 6.2 95.1 44 44 A S > - 0 0 31 21,-0.2 4,-2.1 66,-0.1 5,-0.2 -0.273 37.8-102.8 -73.8 169.2 41.0 7.9 93.0 45 45 A Y H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.925 122.9 49.3 -61.1 -46.1 39.8 11.3 94.1 46 46 A H H > S+ 0 0 133 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.906 111.3 48.7 -60.6 -44.1 36.6 9.9 95.4 47 47 A S H > S+ 0 0 26 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.866 111.3 50.5 -65.4 -36.0 38.3 7.1 97.3 48 48 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.928 109.0 50.9 -66.4 -45.5 40.8 9.6 98.9 49 49 A R H X S+ 0 0 58 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.866 108.9 52.8 -58.7 -37.4 37.9 11.9 100.0 50 50 A E H X S+ 0 0 78 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.918 107.7 50.2 -65.9 -42.7 36.3 8.8 101.5 51 51 A L H X S+ 0 0 7 -4,-2.0 4,-2.6 1,-0.2 5,-0.4 0.925 104.5 58.8 -61.0 -44.6 39.5 8.1 103.5 52 52 A Q H X>S+ 0 0 21 -4,-2.5 4,-1.6 1,-0.2 5,-1.2 0.884 106.9 47.5 -51.3 -42.9 39.6 11.6 104.7 53 53 A K H <5S+ 0 0 143 -4,-1.5 -1,-0.2 3,-0.2 -2,-0.2 0.874 111.8 51.1 -68.0 -37.5 36.2 11.1 106.3 54 54 A Q H <5S+ 0 0 139 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.943 127.2 19.0 -66.3 -49.8 37.2 7.9 107.9 55 55 A V H <5S- 0 0 28 -4,-2.6 -2,-0.2 -34,-0.0 -1,-0.2 0.399 106.3-111.2-104.4 1.0 40.4 9.0 109.6 56 56 A G T <5 - 0 0 42 -4,-1.6 2,-0.2 -5,-0.4 -3,-0.2 0.967 40.3-165.1 68.9 54.1 39.8 12.8 109.6 57 57 A L < - 0 0 6 -5,-1.2 -1,-0.2 -6,-0.2 2,-0.1 -0.520 24.4-112.3 -72.3 135.0 42.5 13.8 107.1 58 58 A M - 0 0 29 -2,-0.2 -1,-0.1 1,-0.1 -6,-0.0 -0.434 41.1 -94.2 -69.4 142.4 43.2 17.6 107.2 59 59 A E - 0 0 94 -2,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.362 44.9-149.4 -58.7 122.7 42.1 19.4 104.1 60 60 A P - 0 0 9 0, 0.0 -22,-0.2 0, 0.0 3,-0.1 -0.520 18.5-127.0 -92.5 164.0 45.1 19.7 101.6 61 61 A D S S+ 0 0 32 -24,-1.6 2,-0.3 1,-0.2 -23,-0.2 0.846 93.5 17.0 -76.9 -33.6 45.7 22.5 99.1 62 62 A Y E -c 38 0A 22 -25,-2.2 -23,-1.6 11,-0.1 2,-0.5 -0.972 63.7-146.1-139.5 153.8 46.0 20.0 96.3 63 63 A W E -cD 39 72A 8 9,-1.8 9,-2.6 -2,-0.3 2,-1.0 -0.971 6.9-169.7-121.0 114.3 45.1 16.3 95.6 64 64 A L E -cD 40 71A 0 -25,-3.4 -23,-1.5 -2,-0.5 3,-0.3 -0.837 29.6-178.5-102.7 93.5 47.5 14.4 93.3 65 65 A T E >>> + D 0 70A 0 5,-1.8 5,-1.5 -2,-1.0 4,-1.3 -0.360 46.1 24.8 -94.7 172.1 45.3 11.3 92.7 66 66 A A G >45S- 0 0 3 -23,-3.4 3,-0.8 1,-0.3 -24,-0.3 0.877 136.1 -50.3 43.4 50.3 45.6 7.9 90.9 67 67 A V G 345S- 0 0 0 -26,-2.3 95,-0.7 -3,-0.3 -1,-0.3 0.829 109.8 -51.8 62.1 33.5 49.3 8.0 91.1 68 68 A G G <45S+ 0 0 0 -3,-0.9 -1,-0.2 -27,-0.6 -2,-0.2 0.660 108.0 120.7 80.7 14.8 49.4 11.6 89.7 69 69 A S T <<5S+ 0 0 0 -4,-1.3 2,-0.4 -3,-0.8 -3,-0.2 0.665 80.3 34.7 -83.2 -15.0 47.2 10.8 86.7 70 70 A E E < -D 65 0A 31 -5,-1.5 -5,-1.8 2,-0.0 2,-0.4 -0.999 69.9-162.0-139.7 135.7 44.7 13.4 87.9 71 71 A I E -D 64 0A 0 -2,-0.4 7,-2.6 7,-0.3 2,-0.5 -0.976 4.8-159.6-121.8 127.7 45.4 16.7 89.8 72 72 A Y E -DE 63 77A 42 -9,-2.6 -9,-1.8 -2,-0.4 5,-0.3 -0.925 4.5-166.4-112.0 121.3 42.7 18.6 91.8 73 73 A H E > - E 0 76A 34 3,-3.2 3,-1.1 -2,-0.5 -11,-0.1 -0.391 44.7 -96.5 -89.8 173.7 43.1 22.3 92.6 74 74 A P T 3 S+ 0 0 109 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.942 131.0 46.8 -57.7 -40.9 40.8 24.0 95.2 75 75 A E T 3 S- 0 0 106 1,-0.2 2,-0.3 -3,-0.0 -3,-0.0 0.550 124.9 -91.5 -76.1 -10.9 38.7 25.1 92.2 76 76 A G E < -E 73 0A 26 -3,-1.1 -3,-3.2 2,-0.0 -1,-0.2 -0.831 69.0 -2.0 135.9-173.0 38.7 21.6 90.6 77 77 A L E -E 72 0A 65 -2,-0.3 2,-1.0 -5,-0.3 -5,-0.2 -0.218 63.9-119.1 -57.2 141.4 40.3 19.1 88.1 78 78 A D > - 0 0 13 -7,-2.6 4,-1.7 1,-0.2 -7,-0.3 -0.754 28.1-176.3 -88.6 105.2 43.3 20.4 86.2 79 79 A Q H > S+ 0 0 112 -2,-1.0 4,-2.2 2,-0.2 5,-0.2 0.732 81.5 59.0 -73.3 -23.6 42.3 20.2 82.6 80 80 A H H > S+ 0 0 112 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.939 106.5 47.2 -68.8 -47.5 45.8 21.3 81.4 81 81 A W H > S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.921 112.6 50.3 -58.7 -46.0 47.4 18.4 83.2 82 82 A A H X S+ 0 0 5 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.912 111.3 46.0 -60.7 -47.0 44.8 16.0 81.7 83 83 A D H X S+ 0 0 94 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.893 112.0 54.5 -63.1 -37.7 45.3 17.3 78.1 84 84 A Y H >< S+ 0 0 82 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.934 109.6 44.9 -60.9 -48.4 49.0 17.1 78.7 85 85 A L H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.720 105.9 64.0 -69.6 -20.9 48.9 13.4 79.7 86 86 A S H >< S+ 0 0 56 -4,-1.4 3,-1.5 -5,-0.2 2,-0.2 0.697 73.9 111.5 -76.9 -19.7 46.5 12.6 76.8 87 87 A E T << S- 0 0 99 -3,-0.9 3,-0.1 -4,-0.8 -3,-0.0 -0.376 100.4 -15.4 -60.7 119.7 49.2 13.5 74.2 88 88 A H T 3 S+ 0 0 139 -2,-0.2 2,-0.4 1,-0.2 -1,-0.3 0.557 97.7 143.5 65.0 7.8 50.2 10.4 72.4 89 89 A W < - 0 0 27 -3,-1.5 2,-0.4 53,-0.1 -1,-0.2 -0.660 31.4-169.4 -82.3 131.2 48.7 8.2 75.0 90 90 A Q > + 0 0 94 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 -0.667 11.9 170.9-122.9 77.0 47.1 5.0 73.7 91 91 A R H > S+ 0 0 47 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.906 75.1 52.3 -53.7 -51.3 45.1 3.4 76.5 92 92 A D H > S+ 0 0 124 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.902 110.5 46.9 -54.3 -47.8 43.3 0.7 74.4 93 93 A I H > S+ 0 0 81 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.955 114.5 46.5 -61.1 -49.9 46.5 -0.6 72.8 94 94 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.936 113.0 50.4 -57.2 -47.7 48.4 -0.8 76.1 95 95 A Q H X S+ 0 0 63 -4,-2.9 4,-3.1 -5,-0.2 -1,-0.2 0.868 105.4 56.0 -59.2 -40.5 45.4 -2.4 77.8 96 96 A A H X S+ 0 0 68 -4,-2.4 4,-0.7 -5,-0.2 -1,-0.2 0.926 111.8 44.0 -59.3 -43.7 45.1 -5.1 75.1 97 97 A I H >< S+ 0 0 41 -4,-1.8 3,-1.2 2,-0.2 4,-0.2 0.959 115.3 45.9 -65.5 -53.9 48.7 -6.1 75.7 98 98 A A H >< S+ 0 0 0 -4,-2.7 3,-2.1 1,-0.3 6,-0.2 0.911 107.0 60.0 -56.8 -43.7 48.5 -6.1 79.5 99 99 A D H 3< S+ 0 0 76 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.750 94.5 67.5 -56.9 -24.5 45.2 -8.0 79.4 100 100 A G T << S+ 0 0 64 -3,-1.2 2,-0.7 -4,-0.7 -1,-0.3 0.538 76.0 97.1 -76.1 -7.4 47.0 -10.8 77.6 101 101 A F X - 0 0 27 -3,-2.1 3,-1.9 -4,-0.2 -3,-0.0 -0.753 62.1-154.8 -88.5 116.0 49.1 -11.8 80.6 102 102 A E T 3 S+ 0 0 92 -2,-0.7 -1,-0.2 1,-0.3 -3,-0.0 0.845 94.2 60.1 -54.5 -35.7 47.6 -14.7 82.5 103 103 A A T 3 S+ 0 0 19 -3,-0.1 19,-2.3 18,-0.1 2,-0.4 0.641 95.7 77.1 -69.8 -14.7 49.4 -13.5 85.7 104 104 A L E < -I 121 0C 4 -3,-1.9 17,-0.2 -6,-0.2 15,-0.0 -0.827 57.2-172.7-104.9 138.0 47.6 -10.2 85.6 105 105 A K E -I 120 0C 124 15,-1.9 15,-2.7 -2,-0.4 -3,-0.0 -0.987 32.7-110.5-123.6 132.3 44.0 -9.6 86.7 106 106 A P E -I 119 0C 79 0, 0.0 13,-0.3 0, 0.0 2,-0.1 -0.261 29.7-125.7 -60.4 149.1 42.3 -6.3 86.1 107 107 A Q - 0 0 24 11,-2.3 11,-0.1 1,-0.2 5,-0.1 -0.475 50.9 -65.3 -85.8 169.0 41.6 -4.2 89.2 108 108 A S > - 0 0 81 -2,-0.1 3,-2.0 1,-0.1 4,-0.3 -0.078 48.2-111.5 -52.1 153.9 38.0 -3.1 89.7 109 109 A P G > S+ 0 0 112 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.847 115.8 64.9 -56.7 -35.6 36.7 -0.6 87.1 110 110 A L G 3 S+ 0 0 150 1,-0.3 -66,-0.1 -66,-0.0 -2,-0.1 0.513 96.0 57.5 -68.1 -4.1 36.6 2.1 89.8 111 111 A E G < S+ 0 0 63 -3,-2.0 -1,-0.3 7,-0.1 2,-0.2 0.483 96.6 81.9-101.1 -5.5 40.4 2.0 90.0 112 112 A Q < + 0 0 45 -3,-1.8 5,-0.2 -4,-0.3 -46,-0.0 -0.633 50.5 164.4 -98.7 157.0 40.7 2.8 86.3 113 113 A N B > -L 116 0D 27 3,-1.6 3,-1.8 -2,-0.2 -2,-0.0 -0.912 56.9 -77.9-155.4 174.2 40.6 6.2 84.6 114 114 A P T 3 S+ 0 0 70 0, 0.0 -23,-0.2 0, 0.0 3,-0.1 0.776 131.1 33.0 -52.2 -28.5 41.6 7.5 81.2 115 115 A W T 3 S+ 0 0 25 1,-0.1 2,-0.3 42,-0.0 46,-0.1 0.129 111.2 68.8-117.0 20.3 45.3 7.6 82.1 116 116 A K B < -L 113 0D 5 -3,-1.8 -3,-1.6 41,-0.1 2,-0.6 -0.936 47.8-179.1-146.6 118.0 45.6 4.6 84.5 117 117 A I E - 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K 0 145C 0 -12,-2.2 -12,-2.5 -2,-0.6 -41,-0.1 -0.934 43.4 -90.1-138.3 159.4 50.5 5.4 83.2 158 158 A P E > - K 0 144C 4 0, 0.0 3,-1.5 0, 0.0 -14,-0.3 -0.325 41.3-115.9 -64.6 157.0 51.7 7.9 80.6 159 159 A Q T 3 S+ 0 0 95 -16,-1.6 -15,-0.1 1,-0.3 6,-0.1 0.832 115.4 61.7 -63.9 -29.0 55.4 8.7 80.9 160 160 A R T 3 S+ 0 0 83 -17,-0.3 -1,-0.3 -75,-0.1 -75,-0.1 0.579 102.2 67.1 -73.3 -7.8 54.5 12.2 81.7 161 161 A S < + 0 0 0 -3,-1.5 4,-0.4 -76,-0.1 -93,-0.1 -0.066 48.8 99.1 -98.6-159.4 52.7 11.1 84.8 162 162 A N S > S- 0 0 7 -95,-0.7 4,-2.2 -96,-0.2 5,-0.3 -0.010 84.1 -73.1 94.2 160.9 53.4 9.5 88.2 163 163 A K H > S+ 0 0 1 26,-0.4 4,-2.1 1,-0.2 -1,-0.1 0.863 129.3 51.8 -52.6 -42.5 53.7 11.2 91.6 164 164 A G H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.924 110.4 45.7 -62.9 -48.3 57.1 12.7 90.9 165 165 A N H > S+ 0 0 52 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.873 113.3 50.4 -64.3 -36.7 56.1 14.3 87.6 166 166 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.899 110.3 52.3 -66.5 -38.2 52.9 15.7 89.1 167 167 A T H X S+ 0 0 0 -4,-2.1 4,-3.1 -5,-0.3 -2,-0.2 0.949 109.3 46.5 -61.7 -52.1 55.0 17.0 92.0 168 168 A Q H X S+ 0 0 84 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.899 112.0 52.8 -58.2 -40.0 57.4 18.9 89.7 169 169 A Y H X S+ 0 0 48 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.928 111.6 45.7 -59.4 -46.0 54.4 20.2 87.8 170 170 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.906 108.5 55.8 -64.6 -43.4 52.9 21.4 91.1 171 171 A Q H X>S+ 0 0 14 -4,-3.1 5,-2.4 1,-0.2 4,-0.9 0.912 109.4 46.6 -55.7 -45.4 56.3 23.0 92.2 172 172 A Q H ><5S+ 0 0 79 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.943 110.3 53.5 -62.4 -46.9 56.4 25.0 89.0 173 173 A H H 3<5S+ 0 0 100 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.795 118.2 35.3 -57.7 -33.3 52.8 26.1 89.4 174 174 A L H 3<5S- 0 0 18 -4,-2.0 -1,-0.3 -3,-0.1 -2,-0.2 0.432 106.2-123.2-101.4 -2.0 53.4 27.3 93.0 175 175 A A T <<5 + 0 0 82 -4,-0.9 2,-0.4 -3,-0.8 -3,-0.2 0.931 59.2 152.1 58.6 44.4 57.0 28.6 92.3 176 176 A M < - 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0 0 0 -18,-1.9 3,-1.3 -2,-0.6 25,-0.2 -0.233 17.9-117.0 -63.0 155.5 58.7 5.7 106.3 204 204 A R T 3 S+ 0 0 122 23,-2.1 24,-0.2 1,-0.3 -1,-0.1 0.836 114.7 54.5 -62.3 -34.6 60.0 2.9 108.6 205 205 A N T 3 S+ 0 0 46 -193,-0.2 -1,-0.3 22,-0.1 -2,-0.1 -0.053 82.9 151.2 -90.3 32.1 57.2 0.6 107.5 206 206 A A < - 0 0 11 -3,-1.3 -19,-0.2 1,-0.1 -20,-0.1 -0.280 51.3-101.2 -66.4 147.8 58.2 1.0 103.8 207 207 A Q >> - 0 0 55 -21,-4.4 4,-1.8 1,-0.1 3,-0.8 -0.335 33.5-107.3 -68.0 151.5 57.5 -1.7 101.3 208 208 A P H 3> S+ 0 0 93 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.829 116.9 56.1 -45.6 -43.8 60.4 -4.0 100.2 209 209 A E H 3> S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.898 106.5 48.2 -62.7 -41.0 60.6 -2.4 96.7 210 210 A L H <> S+ 0 0 0 -3,-0.8 4,-2.7 -24,-0.3 -1,-0.2 0.927 112.0 49.2 -66.3 -42.4 61.1 1.1 98.0 211 211 A L H X S+ 0 0 36 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.952 110.4 51.1 -60.6 -47.3 63.8 0.1 100.5 212 212 A H H X S+ 0 0 105 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.910 109.3 51.4 -55.6 -42.7 65.6 -1.8 97.6 213 213 A W H >X S+ 0 0 24 -4,-2.1 4,-3.3 1,-0.2 3,-0.9 0.944 108.2 51.3 -59.3 -48.2 65.3 1.4 95.6 214 214 A Y H 3X S+ 0 0 60 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.876 103.6 58.6 -57.2 -40.2 66.9 3.4 98.3 215 215 A D H 3< S+ 0 0 122 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.807 117.9 32.0 -60.6 -30.0 69.8 1.0 98.6 216 216 A Q H << S+ 0 0 128 -4,-1.1 -2,-0.2 -3,-0.9 -1,-0.2 0.831 135.7 21.0 -97.2 -38.8 70.6 1.6 95.0 217 217 A W H < S+ 0 0 169 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.462 80.8 137.9-111.3 -1.1 69.7 5.2 94.4 218 218 A G < - 0 0 33 -4,-2.5 2,-0.2 -5,-0.4 -4,-0.0 -0.160 29.6-178.1 -49.6 128.0 69.6 6.7 97.9 219 219 A D > - 0 0 96 1,-0.0 3,-1.4 4,-0.0 -1,-0.1 -0.584 44.9 -88.8-118.3-174.8 71.1 10.2 97.9 220 220 A S T 3 S+ 0 0 113 1,-0.3 -2,-0.1 -2,-0.2 -21,-0.0 0.699 124.2 60.0 -69.0 -18.6 71.8 12.8 100.6 221 221 A R T 3 S+ 0 0 51 -27,-0.1 -21,-2.6 -22,-0.1 2,-0.6 0.562 90.8 86.2 -84.9 -7.3 68.4 14.3 100.1 222 222 A H E < -g 200 0A 8 -3,-1.4 2,-0.5 -23,-0.2 -21,-0.2 -0.835 62.3-164.4-100.3 123.2 66.7 11.0 101.0 223 223 A Y E -g 201 0A 53 -23,-2.7 -21,-2.7 -2,-0.6 2,-0.9 -0.916 13.1-150.2-113.3 125.7 66.1 10.2 104.7 224 224 A R E -g 202 0A 94 -2,-0.5 -21,-0.1 -23,-0.2 -23,-0.1 -0.802 27.4-145.1 -91.1 101.2 65.3 6.8 106.1 225 225 A A - 0 0 1 -23,-1.8 7,-0.1 -2,-0.9 8,-0.0 -0.310 16.1-148.3 -70.9 150.2 63.1 7.5 109.1 226 226 A Q S S+ 0 0 150 5,-0.1 -1,-0.1 6,-0.1 2,-0.1 0.800 82.8 75.1 -81.9 -33.1 63.1 5.5 112.3 227 227 A S S S- 0 0 50 4,-0.2 -23,-2.1 5,-0.1 2,-0.3 -0.437 76.5-137.6 -80.0 153.5 59.5 6.3 112.8 228 228 A S > - 0 0 43 -25,-0.2 3,-1.1 -24,-0.2 4,-0.3 -0.708 61.1 -7.9-107.2 161.7 56.7 4.6 110.8 229 229 A H T >> S- 0 0 33 -217,-0.6 3,-1.9 -2,-0.3 4,-0.6 -0.109 130.1 -7.5 53.3-148.7 53.6 6.3 109.3 230 230 A A H >> S+ 0 0 0 -216,-0.5 4,-1.3 1,-0.3 3,-1.1 0.775 127.9 68.6 -48.0 -33.8 52.8 9.9 110.2 231 231 A G H <> S+ 0 0 11 -3,-1.1 4,-2.6 1,-0.3 -1,-0.3 0.863 91.7 60.0 -56.7 -36.6 55.6 9.9 112.8 232 232 A A H <> S+ 0 0 0 -3,-1.9 4,-2.5 -4,-0.3 -1,-0.3 0.815 101.4 54.7 -61.6 -30.4 58.2 9.7 109.9 233 233 A I H S+ 0 0 4 -4,-2.1 5,-2.6 1,-0.2 -1,-0.2 0.837 111.8 43.4 -58.3 -34.4 60.5 17.9 109.2 238 238 A A H ><5S+ 0 0 75 -4,-1.6 3,-0.7 -3,-0.2 -1,-0.2 0.878 112.9 53.9 -78.0 -38.7 62.8 18.1 112.1 239 239 A H H 3<5S+ 0 0 101 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.942 115.4 36.1 -61.0 -52.3 65.6 16.5 110.2 240 240 A F T 3<5S- 0 0 38 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.368 109.9-125.7 -84.1 8.1 65.5 18.8 107.2 241 241 A D T < 5 + 0 0 105 -3,-0.7 3,-0.5 -5,-0.3 -3,-0.2 0.908 47.4 169.7 48.8 52.3 64.8 21.6 109.6 242 242 A F < + 0 0 21 -5,-2.6 -1,-0.1 1,-0.2 -238,-0.1 -0.556 59.4 28.2 -88.7 159.8 61.6 22.7 107.8 243 243 A L 0 0 12 -2,-0.2 -1,-0.2 -240,-0.2 -2,-0.1 0.908 360.0 360.0 55.5 41.1 59.2 25.2 109.3 244 244 A S 0 0 137 -3,-0.5 -1,-0.1 -241,-0.1 -2,-0.0 -0.041 360.0 360.0 -45.7 360.0 62.2 26.6 111.1