==== 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 2B1R . 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) . 11137.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 76.6 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 . 15 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 15.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.5 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 0 1 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 0 199 0, 0.0 2,-0.2 0, 0.0 174,-0.1 0.000 360.0 360.0 360.0 4.5 55.0 31.9 98.7 2 2 A R - 0 0 71 1,-0.1 33,-0.2 178,-0.0 32,-0.1 -0.712 360.0-123.3-110.1 165.2 55.1 29.4 101.6 3 3 A Q S S+ 0 0 74 31,-0.8 2,-0.4 -2,-0.2 32,-0.2 0.695 88.9 37.7 -82.6 -16.7 58.1 27.8 103.2 4 4 A L E -a 35 0A 0 30,-1.1 32,-2.7 238,-0.1 2,-0.6 -0.995 50.7-163.8-142.8 142.4 57.1 24.2 102.6 5 5 A L E -ab 36 181A 0 175,-2.2 177,-2.6 -2,-0.4 2,-0.6 -0.971 23.8-164.6-118.8 106.4 55.4 22.0 100.0 6 6 A L E +ab 37 182A 0 30,-2.9 32,-2.5 -2,-0.6 2,-0.5 -0.867 10.1 178.5-101.4 121.0 54.4 18.8 101.8 7 7 A I E +ab 38 183A 0 175,-2.8 177,-2.3 -2,-0.6 2,-0.3 -0.981 9.9 165.5-124.5 124.2 53.4 15.8 99.6 8 8 A S E -ab 39 184A 0 30,-2.0 32,-2.1 -2,-0.5 177,-0.2 -0.994 34.9-125.6-144.6 147.4 52.5 12.5 101.1 9 9 A D > - 0 0 7 175,-1.8 5,-1.2 -2,-0.3 32,-0.2 -0.361 25.1-145.8 -76.6 168.0 50.9 9.2 100.2 10 10 A L T > > + 0 0 0 3,-0.2 5,-3.4 4,-0.2 3,-2.1 0.860 69.5 70.8-102.5 -71.7 48.0 8.2 102.4 11 11 A D B 3 5S-h 15 0B 50 1,-0.3 5,-0.1 3,-0.2 -1,-0.1 -0.292 123.3 -7.2 -55.0 124.7 47.6 4.5 103.1 12 12 A N T 3 5S+ 0 0 75 3,-0.7 217,-0.5 1,-0.2 -1,-0.3 0.437 136.2 60.6 68.3 1.3 50.4 3.3 105.4 13 13 A T T < 5S+ 0 0 0 -3,-2.1 219,-0.2 215,-0.1 -3,-0.2 0.593 124.0 4.5-116.3 -82.2 52.1 6.7 105.2 14 14 A W T - 0 0 61 -3,-0.2 4,-2.8 -4,-0.2 213,-0.2 -0.892 64.1-168.4-122.8 96.0 48.6 5.0 113.0 18 18 A Q H > S+ 0 0 73 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.867 85.9 51.6 -55.1 -42.4 45.7 7.1 114.2 19 19 A Q H > S+ 0 0 142 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.938 113.7 44.3 -61.8 -44.9 47.6 8.5 117.2 20 20 A A H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.890 111.6 53.5 -66.6 -39.0 50.5 9.6 115.0 21 21 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.952 110.5 49.0 -59.8 -46.6 48.1 11.0 112.3 22 22 A E H X S+ 0 0 103 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.906 112.1 44.3 -63.2 -44.9 46.4 13.1 115.0 23 23 A H H X S+ 0 0 82 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.823 112.4 54.1 -73.9 -22.6 49.5 14.6 116.5 24 24 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.937 111.8 44.5 -69.7 -44.9 50.9 15.2 113.1 25 25 A Q H X S+ 0 0 31 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.838 110.8 54.4 -68.7 -31.3 47.8 17.1 112.2 26 26 A E H X S+ 0 0 136 -4,-2.1 4,-0.6 2,-0.2 -1,-0.2 0.946 111.7 44.6 -66.1 -47.0 47.8 19.0 115.5 27 27 A Y H >< S+ 0 0 64 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.963 118.4 41.8 -60.3 -53.6 51.3 20.2 114.9 28 28 A L H >< S+ 0 0 0 -4,-2.7 3,-1.9 1,-0.3 -1,-0.2 0.850 106.0 66.2 -62.6 -34.8 50.6 21.2 111.3 29 29 A G H 3< S+ 0 0 45 -4,-2.5 3,-0.4 1,-0.3 -1,-0.3 0.667 94.1 59.6 -61.5 -17.8 47.3 22.6 112.3 30 30 A D T << S+ 0 0 126 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.476 117.7 27.6 -90.5 -2.0 49.1 25.3 114.3 31 31 A R S X S+ 0 0 75 -3,-1.9 3,-2.3 -4,-0.2 -1,-0.2 -0.114 73.0 145.8-149.1 39.9 50.9 26.7 111.3 32 32 A R G > + 0 0 65 -3,-0.4 3,-1.1 1,-0.3 -2,-0.1 0.784 69.8 58.9 -52.2 -35.7 48.6 25.9 108.4 33 33 A G G 3 S+ 0 0 50 1,-0.2 -1,-0.3 -4,-0.1 -4,-0.1 0.577 93.1 70.3 -74.5 -6.8 49.4 29.0 106.5 34 34 A N G < S+ 0 0 70 -3,-2.3 -30,-1.1 -6,-0.2 -31,-0.8 0.457 101.3 35.1 -90.2 -1.0 53.1 28.1 106.4 35 35 A F E < -a 4 0A 0 -3,-1.1 2,-0.4 -4,-0.2 -30,-0.2 -0.998 66.5-128.8-152.4 154.8 52.8 25.2 103.9 36 36 A Y E -a 5 0A 28 -32,-2.7 -30,-2.9 -2,-0.3 2,-0.4 -0.847 31.3-151.3 -98.3 137.9 51.0 23.8 100.9 37 37 A L E +a 6 0A 0 -2,-0.4 24,-2.9 -32,-0.2 25,-2.1 -0.945 18.3 173.4-117.9 134.9 49.6 20.3 101.4 38 38 A A E -ac 7 62A 0 -32,-2.5 -30,-2.0 -2,-0.4 2,-0.6 -0.997 22.1-146.7-139.4 131.2 49.0 17.7 98.7 39 39 A Y E -ac 8 63A 0 23,-1.6 25,-3.4 -2,-0.4 2,-0.8 -0.887 11.3-165.5 -97.8 122.3 48.0 14.1 99.1 40 40 A A E + c 0 64A 0 -32,-2.1 2,-0.3 -2,-0.6 25,-0.2 -0.873 27.0 164.3-110.1 94.8 49.6 12.0 96.4 41 41 A T - 0 0 1 23,-1.6 26,-2.4 -2,-0.8 27,-0.6 -0.759 52.0-135.3-117.4 158.6 47.7 8.7 96.5 42 42 A G S S+ 0 0 18 24,-0.3 -1,-0.1 -2,-0.3 2,-0.1 0.632 83.4 97.6 -80.9 -14.8 47.1 5.6 94.4 43 43 A R S S- 0 0 59 23,-0.1 23,-2.9 1,-0.1 -2,-0.2 -0.352 83.3-107.5 -74.5 153.1 43.4 6.0 95.3 44 44 A S > - 0 0 33 21,-0.2 4,-2.5 66,-0.1 5,-0.2 -0.270 38.1-103.3 -69.6 166.3 40.8 7.7 93.0 45 45 A Y H > S+ 0 0 65 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.935 123.2 50.0 -58.5 -47.9 39.6 11.1 94.1 46 46 A H H > S+ 0 0 135 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.905 111.8 47.6 -57.8 -45.0 36.3 9.7 95.4 47 47 A S H > S+ 0 0 30 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.893 111.6 50.6 -65.2 -39.7 38.1 7.0 97.4 48 48 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.900 109.7 50.5 -64.8 -40.6 40.5 9.5 98.9 49 49 A R H X S+ 0 0 62 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.854 109.7 51.5 -65.2 -35.0 37.6 11.7 99.9 50 50 A E H X S+ 0 0 84 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.913 108.2 50.7 -68.4 -41.5 36.0 8.7 101.5 51 51 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.900 104.1 59.5 -62.5 -39.2 39.2 7.9 103.4 52 52 A Q H X>S+ 0 0 25 -4,-2.2 4,-1.6 1,-0.2 5,-1.2 0.888 106.7 46.5 -56.0 -41.2 39.3 11.6 104.6 53 53 A K H <5S+ 0 0 148 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.843 111.4 53.0 -70.2 -34.3 35.9 11.1 106.3 54 54 A Q H <5S+ 0 0 152 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.910 126.3 18.5 -69.3 -43.7 37.0 7.8 107.8 55 55 A V H <5S- 0 0 20 -4,-2.4 -2,-0.2 -34,-0.0 -1,-0.2 0.413 105.8-110.4-110.0 0.1 40.1 9.0 109.6 56 56 A G T <5 - 0 0 43 -4,-1.6 -3,-0.2 -5,-0.3 -4,-0.2 0.927 41.2-165.4 72.5 46.2 39.6 12.8 109.6 57 57 A L < - 0 0 6 -5,-1.2 -1,-0.2 -6,-0.2 2,-0.1 -0.408 23.3-114.2 -65.1 135.6 42.2 13.8 107.1 58 58 A M - 0 0 29 1,-0.1 -1,-0.1 -2,-0.1 -6,-0.0 -0.411 41.3 -91.7 -70.3 149.4 43.0 17.5 107.2 59 59 A E - 0 0 96 -2,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.444 44.1-150.4 -65.5 121.8 42.0 19.4 104.0 60 60 A P - 0 0 8 0, 0.0 -22,-0.2 0, 0.0 3,-0.1 -0.375 19.2-127.5 -86.5 170.6 44.9 19.5 101.6 61 61 A D S S+ 0 0 31 -24,-2.9 2,-0.3 1,-0.2 -23,-0.2 0.797 93.1 14.5 -85.3 -30.6 45.5 22.3 99.1 62 62 A Y E -c 38 0A 23 -25,-2.1 -23,-1.6 11,-0.1 2,-0.5 -0.964 63.0-144.7-142.6 157.6 45.7 19.8 96.3 63 63 A W E -cD 39 72A 6 9,-1.8 9,-2.8 -2,-0.3 2,-0.9 -0.986 6.1-168.9-124.9 117.9 44.9 16.1 95.5 64 64 A L E -cD 40 71A 0 -25,-3.4 -23,-1.6 -2,-0.5 3,-0.3 -0.849 30.9-177.9-105.9 91.7 47.3 14.2 93.3 65 65 A T E >>> + D 0 70A 0 5,-2.0 5,-1.7 -2,-0.9 4,-1.1 -0.380 46.4 24.7 -93.9 169.8 45.1 11.1 92.8 66 66 A A G >45S- 0 0 4 -23,-2.9 3,-1.1 1,-0.3 -24,-0.3 0.896 136.6 -49.3 44.3 53.1 45.3 7.7 91.0 67 67 A V G 345S- 0 0 1 -26,-2.4 95,-0.8 -3,-0.3 -1,-0.3 0.821 109.9 -51.9 59.4 36.1 49.1 7.8 91.1 68 68 A G G <45S+ 0 0 0 -3,-0.6 -1,-0.3 -27,-0.6 -2,-0.2 0.612 109.1 120.3 80.4 11.6 49.2 11.4 89.8 69 69 A S T <<5S+ 0 0 1 -4,-1.1 2,-0.4 -3,-1.1 -3,-0.2 0.718 79.5 35.4 -79.7 -19.3 47.0 10.6 86.8 70 70 A E E < -D 65 0A 30 -5,-1.7 -5,-2.0 2,-0.0 2,-0.5 -0.999 69.3-163.2-135.7 135.2 44.5 13.2 88.0 71 71 A I E -D 64 0A 2 -2,-0.4 7,-2.9 7,-0.3 2,-0.5 -0.971 5.6-161.4-120.8 125.6 45.2 16.5 89.8 72 72 A Y E -DE 63 77A 39 -9,-2.8 -9,-1.8 -2,-0.5 5,-0.3 -0.923 2.3-164.0-111.5 125.6 42.5 18.3 91.7 73 73 A H E > - E 0 76A 36 3,-3.5 3,-1.6 -2,-0.5 -11,-0.1 -0.518 43.9 -97.9 -94.3 167.8 42.8 22.0 92.6 74 74 A P T 3 S+ 0 0 109 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.864 131.1 47.8 -54.7 -30.6 40.6 23.7 95.2 75 75 A E T 3 S- 0 0 106 1,-0.3 2,-0.3 0, 0.0 -3,-0.0 0.577 124.6 -90.1 -85.7 -12.5 38.5 24.8 92.2 76 76 A G E < -E 73 0A 28 -3,-1.6 -3,-3.5 2,-0.0 -1,-0.3 -0.855 69.7 -3.9 137.9-172.3 38.4 21.3 90.5 77 77 A L E -E 72 0A 67 -2,-0.3 2,-1.1 -5,-0.3 -5,-0.2 -0.279 64.3-118.5 -59.9 137.0 40.1 18.9 88.1 78 78 A D > - 0 0 15 -7,-2.9 4,-1.9 1,-0.2 -7,-0.3 -0.665 29.5-176.5 -81.6 100.7 43.1 20.2 86.3 79 79 A Q H > S+ 0 0 109 -2,-1.1 4,-2.2 1,-0.2 5,-0.2 0.795 81.0 58.7 -68.8 -29.0 42.1 20.0 82.6 80 80 A H H > S+ 0 0 113 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.928 106.9 47.9 -65.0 -44.0 45.6 21.2 81.4 81 81 A W H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.921 110.3 52.3 -61.4 -45.7 47.1 18.2 83.2 82 82 A A H X S+ 0 0 4 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.915 111.6 45.0 -58.5 -46.2 44.6 15.8 81.6 83 83 A D H X S+ 0 0 95 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.887 111.3 53.9 -65.5 -39.1 45.3 17.1 78.1 84 84 A Y H < S+ 0 0 87 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.903 112.0 44.6 -61.0 -41.7 49.0 16.9 78.7 85 85 A L H < S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.766 107.0 60.1 -74.6 -26.9 48.7 13.3 79.8 86 86 A S H >< S+ 0 0 53 -4,-1.7 3,-1.4 -5,-0.2 2,-0.3 0.708 77.4 110.8 -74.1 -21.3 46.4 12.4 76.9 87 87 A E T 3< S- 0 0 94 -4,-1.0 3,-0.1 -3,-0.4 -3,-0.0 -0.389 99.7 -13.0 -61.8 116.9 49.0 13.4 74.3 88 88 A H T 3 S+ 0 0 130 -2,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.463 99.4 140.8 71.9 1.2 50.2 10.3 72.5 89 89 A W < - 0 0 28 -3,-1.4 2,-0.4 53,-0.1 -1,-0.2 -0.588 32.6-170.8 -78.7 135.7 48.6 8.0 75.1 90 90 A Q > + 0 0 94 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.737 10.4 172.0-128.6 82.5 47.0 4.8 73.7 91 91 A R H > S+ 0 0 50 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.904 75.2 52.6 -58.9 -47.1 45.0 3.2 76.5 92 92 A D H > S+ 0 0 122 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 109.6 47.3 -58.5 -47.4 43.3 0.5 74.4 93 93 A I H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.950 114.7 46.7 -60.2 -48.2 46.4 -0.9 72.8 94 94 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.893 112.8 50.0 -61.1 -41.0 48.2 -1.0 76.2 95 95 A Q H X S+ 0 0 63 -4,-2.7 4,-3.3 2,-0.2 5,-0.2 0.900 106.0 55.4 -65.1 -42.5 45.2 -2.7 77.8 96 96 A A H X S+ 0 0 67 -4,-2.6 4,-0.8 -5,-0.2 -1,-0.2 0.928 111.8 45.0 -56.4 -44.4 44.9 -5.3 75.1 97 97 A I H >< S+ 0 0 41 -4,-1.9 3,-0.8 2,-0.2 -2,-0.2 0.949 115.7 44.3 -65.8 -50.0 48.5 -6.2 75.7 98 98 A A H >< S+ 0 0 0 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.899 107.3 59.7 -62.9 -41.0 48.3 -6.3 79.5 99 99 A D H 3< S+ 0 0 75 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.754 95.7 67.1 -58.7 -23.8 45.0 -8.2 79.4 100 100 A G T << S+ 0 0 64 -3,-0.8 2,-0.6 -4,-0.8 -1,-0.3 0.522 76.6 95.3 -76.8 -7.4 46.9 -10.9 77.6 101 101 A F X - 0 0 29 -3,-2.0 3,-1.8 -4,-0.2 -3,-0.0 -0.783 63.8-153.4 -89.5 118.5 49.0 -11.9 80.6 102 102 A E T 3 S+ 0 0 109 -2,-0.6 -1,-0.1 1,-0.3 -3,-0.0 0.809 93.6 59.7 -57.8 -33.6 47.5 -14.9 82.5 103 103 A A T 3 S+ 0 0 19 18,-0.1 19,-2.6 23,-0.1 2,-0.4 0.552 94.8 80.5 -74.3 -7.5 49.2 -13.8 85.7 104 104 A L E < -I 121 0C 14 -3,-1.8 17,-0.2 17,-0.2 15,-0.0 -0.866 56.6-173.2-107.0 134.4 47.4 -10.4 85.6 105 105 A K E -I 120 0C 51 15,-1.9 15,-2.3 -2,-0.4 -3,-0.0 -0.988 33.7-109.0-122.9 129.7 43.8 -9.9 86.7 106 106 A P E -I 119 0C 89 0, 0.0 13,-0.3 0, 0.0 2,-0.1 -0.235 29.5-127.6 -56.6 143.0 42.1 -6.5 86.1 107 107 A Q - 0 0 19 11,-2.6 11,-0.1 1,-0.2 5,-0.1 -0.437 50.7 -65.3 -81.8 168.0 41.5 -4.4 89.2 108 108 A S > - 0 0 80 -2,-0.1 3,-2.6 1,-0.1 4,-0.3 -0.137 46.2-112.1 -55.2 149.2 37.9 -3.2 89.7 109 109 A P G > S+ 0 0 111 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.837 116.0 63.7 -50.6 -36.6 36.5 -0.7 87.1 110 110 A L G 3 S+ 0 0 150 1,-0.3 -66,-0.1 -66,-0.0 -2,-0.1 0.579 96.3 57.8 -68.7 -8.2 36.5 2.0 89.8 111 111 A E G < S+ 0 0 69 -3,-2.6 -1,-0.3 7,-0.1 2,-0.2 0.462 97.0 83.7 -96.7 -4.6 40.3 1.8 90.0 112 112 A Q < + 0 0 47 -3,-1.9 5,-0.2 -4,-0.3 -46,-0.0 -0.652 49.2 164.3 -99.9 154.9 40.6 2.7 86.3 113 113 A N B > -L 116 0D 23 3,-1.8 3,-2.2 -2,-0.2 -2,-0.0 -0.935 56.4 -80.9-155.1 170.5 40.5 6.0 84.6 114 114 A P T 3 S+ 0 0 73 0, 0.0 -23,-0.2 0, 0.0 3,-0.0 0.776 131.3 33.4 -48.5 -29.8 41.5 7.3 81.1 115 115 A W T 3 S+ 0 0 25 1,-0.1 2,-0.4 -25,-0.0 46,-0.1 0.128 111.7 70.7-115.1 20.0 45.2 7.4 82.1 116 116 A K B < +L 113 0D 4 -3,-2.2 -3,-1.8 41,-0.1 2,-0.5 -0.947 46.8 178.0-145.5 120.5 45.3 4.5 84.4 117 117 A I E - 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0 0 0 -18,-2.1 3,-1.5 -2,-0.6 25,-0.2 -0.263 15.4-120.0 -63.8 151.3 58.5 5.5 106.3 204 204 A R T 3 S+ 0 0 135 23,-1.9 24,-0.2 1,-0.3 -1,-0.1 0.855 114.2 55.5 -58.6 -37.9 59.9 2.7 108.6 205 205 A N T 3 S+ 0 0 43 -193,-0.2 -1,-0.3 22,-0.1 -2,-0.1 0.047 83.9 147.8 -85.2 26.4 57.0 0.5 107.6 206 206 A A < - 0 0 12 -3,-1.5 -19,-0.2 1,-0.1 -20,-0.1 -0.239 52.3-102.3 -65.0 151.3 57.9 0.9 103.9 207 207 A Q >> - 0 0 58 -21,-3.7 4,-1.8 1,-0.1 3,-0.8 -0.334 33.5-107.0 -70.2 153.9 57.3 -1.9 101.4 208 208 A P H 3> S+ 0 0 91 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.859 115.5 55.9 -48.9 -46.9 60.3 -4.1 100.2 209 209 A E H 3> S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 -22,-0.1 0.836 107.8 48.0 -61.6 -33.8 60.5 -2.5 96.7 210 210 A L H <> S+ 0 0 0 -3,-0.8 4,-2.5 -24,-0.3 -1,-0.2 0.904 112.0 49.1 -73.4 -40.3 60.9 1.0 98.0 211 211 A L H X S+ 0 0 38 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.921 111.6 49.9 -63.1 -42.2 63.6 -0.1 100.5 212 212 A H H X S+ 0 0 107 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.915 109.2 52.4 -62.0 -41.4 65.4 -1.9 97.6 213 213 A W H >X S+ 0 0 25 -4,-1.9 4,-3.2 -5,-0.2 3,-0.5 0.927 108.2 51.2 -59.4 -45.0 65.0 1.3 95.6 214 214 A Y H 3X S+ 0 0 60 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.884 104.0 56.6 -60.2 -42.2 66.6 3.3 98.4 215 215 A D H 3< S+ 0 0 121 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.806 118.5 33.8 -61.1 -29.7 69.6 1.0 98.7 216 216 A Q H << S+ 0 0 129 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.832 136.5 17.4 -95.9 -38.4 70.4 1.5 95.0 217 217 A W H < S+ 0 0 167 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.459 83.9 133.9-114.8 -2.8 69.4 5.1 94.3 218 218 A G < - 0 0 32 -4,-2.3 2,-0.2 -5,-0.5 -4,-0.0 -0.244 32.0-178.6 -53.5 127.2 69.2 6.7 97.8 219 219 A D > - 0 0 95 1,-0.0 3,-1.5 4,-0.0 -1,-0.1 -0.545 45.2 -85.0-117.6-175.5 70.9 10.0 98.0 220 220 A S T 3 S+ 0 0 111 1,-0.3 -2,-0.1 -2,-0.2 -21,-0.0 0.771 124.2 60.2 -64.2 -25.7 71.6 12.6 100.7 221 221 A R T 3 S+ 0 0 51 -22,-0.1 -21,-2.6 -27,-0.1 2,-0.4 0.599 91.9 85.3 -77.7 -10.5 68.2 14.2 100.1 222 222 A H E < -g 200 0A 9 -3,-1.5 2,-0.5 -23,-0.2 -21,-0.2 -0.793 64.4-160.6 -96.8 131.8 66.5 10.9 101.0 223 223 A Y E -g 201 0A 47 -23,-2.7 -21,-2.6 -2,-0.4 2,-1.0 -0.950 12.4-150.0-121.7 124.0 65.8 10.1 104.7 224 224 A R E -g 202 0A 93 -2,-0.5 -21,-0.1 -23,-0.2 2,-0.1 -0.768 28.1-146.5 -87.3 100.2 65.1 6.7 106.1 225 225 A A - 0 0 1 -23,-1.8 7,-0.1 -2,-1.0 8,-0.0 -0.346 17.5-151.8 -73.4 149.4 62.9 7.4 109.1 226 226 A Q S S+ 0 0 151 5,-0.1 2,-0.1 6,-0.1 -1,-0.1 0.776 81.3 74.5 -83.7 -32.6 62.9 5.4 112.3 227 227 A S S S- 0 0 47 4,-0.2 -23,-1.9 5,-0.1 2,-0.2 -0.469 77.6-136.3 -80.6 153.9 59.2 6.2 112.9 228 228 A S > - 0 0 42 -25,-0.2 3,-1.3 -24,-0.2 4,-0.4 -0.683 60.4 -8.2-107.7 163.3 56.5 4.6 110.9 229 229 A H T >> S- 0 0 32 -217,-0.5 3,-1.8 1,-0.3 4,-0.5 -0.140 131.2 -8.3 53.5-143.5 53.4 6.1 109.4 230 230 A A H >> S+ 0 0 0 -216,-0.3 4,-1.5 1,-0.3 3,-0.9 0.751 127.6 70.0 -56.2 -28.2 52.7 9.8 110.2 231 231 A G H <> S+ 0 0 13 -3,-1.3 4,-2.3 1,-0.3 -1,-0.3 0.828 91.5 60.2 -60.7 -30.3 55.4 9.8 112.8 232 232 A A H <> S+ 0 0 0 -3,-1.8 4,-2.3 -4,-0.4 -1,-0.3 0.816 100.9 55.2 -67.2 -29.0 57.9 9.6 110.0 233 233 A I H S+ 0 0 3 -4,-2.4 5,-2.6 1,-0.2 4,-0.2 0.908 112.6 43.1 -58.5 -40.6 60.2 17.7 109.1 238 238 A A H ><5S+ 0 0 75 -4,-2.0 3,-0.8 3,-0.2 -2,-0.2 0.904 112.7 53.6 -71.1 -41.7 62.6 18.0 112.1 239 239 A H H 3<5S+ 0 0 99 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.928 115.1 37.9 -58.6 -50.1 65.4 16.3 110.2 240 240 A F T 3<5S- 0 0 41 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.406 110.0-123.9 -83.9 3.1 65.3 18.6 107.2 241 241 A D T X 5 + 0 0 110 -3,-0.8 3,-0.5 -4,-0.2 -3,-0.2 0.885 49.3 168.0 56.9 43.5 64.6 21.6 109.6 242 242 A F T 3 < + 0 0 22 -5,-2.6 -1,-0.2 1,-0.2 -238,-0.1 -0.507 58.7 22.9 -84.2 157.6 61.4 22.6 107.8 243 243 A L T 3 0 0 12 -2,-0.2 -1,-0.2 -209,-0.1 -2,-0.1 0.890 360.0 360.0 54.6 42.2 59.0 25.1 109.4 244 244 A S < 0 0 140 -3,-0.5 -2,-0.0 -6,-0.0 -6,-0.0 0.126 360.0 360.0 -47.1 360.0 61.9 26.5 111.4