==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 10-DEC-03 1RTT . COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR R.AGARWAL,S.SWAMINATHAN,S.K.BURLEY,NEW YORK SGX RESEARCH CEN . 174 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 11 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 31.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 0 0 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 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 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 7 A I 0 0 70 0, 0.0 31,-2.3 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 119.1 25.5 22.2 14.4 2 8 A K E -a 32 0A 96 29,-0.2 66,-2.9 64,-0.2 67,-1.6 -0.793 360.0-170.7 -93.6 119.2 26.2 19.6 17.0 3 9 A V E -ab 33 69A 2 29,-2.9 31,-2.9 -2,-0.6 2,-0.6 -0.921 12.7-147.0-111.4 131.5 25.6 20.6 20.6 4 10 A L E -ab 34 70A 1 65,-2.5 67,-2.6 -2,-0.5 2,-0.4 -0.877 12.2-150.6 -99.9 117.3 26.7 18.5 23.5 5 11 A G E -ab 35 71A 1 29,-3.2 31,-2.8 -2,-0.6 2,-0.5 -0.739 10.9-167.5 -88.2 131.8 24.4 18.7 26.5 6 12 A I E - b 0 72A 0 65,-3.1 67,-2.8 -2,-0.4 2,-0.4 -0.929 2.7-163.3-125.5 107.4 26.0 18.2 29.9 7 13 A S E - b 0 73A 14 -2,-0.5 31,-0.2 29,-0.5 67,-0.2 -0.746 10.7-154.2 -89.8 134.6 23.9 17.7 33.0 8 14 A G S S+ 0 0 0 65,-2.4 77,-0.5 -2,-0.4 2,-0.4 0.329 70.1 80.1 -88.8 9.1 25.6 18.1 36.3 9 15 A S - 0 0 13 64,-0.2 29,-0.1 75,-0.1 30,-0.1 -0.932 52.6-167.3-122.0 142.8 23.2 15.8 38.2 10 16 A L + 0 0 101 -2,-0.4 -1,-0.1 28,-0.1 2,-0.0 0.563 54.7 109.9 -99.6 -12.1 23.0 12.0 38.5 11 17 A R S > S- 0 0 122 1,-0.1 3,-1.5 2,-0.1 6,-0.2 -0.344 72.3-125.0 -70.4 147.6 19.5 11.6 40.0 12 18 A S T 3 S+ 0 0 135 1,-0.3 -1,-0.1 -2,-0.0 -3,-0.0 0.853 109.0 43.7 -59.1 -39.7 16.8 10.1 37.9 13 19 A G T 3 S+ 0 0 38 4,-0.0 -1,-0.3 5,-0.0 -2,-0.1 0.180 82.1 159.4 -94.5 19.8 14.3 13.0 38.4 14 20 A S <> - 0 0 2 -3,-1.5 4,-2.1 1,-0.1 5,-0.1 -0.107 36.9-151.5 -46.4 126.4 17.0 15.7 37.9 15 21 A Y H > S+ 0 0 64 2,-0.2 4,-2.1 1,-0.2 -1,-0.1 0.853 98.7 51.8 -68.2 -35.0 15.5 19.1 36.9 16 22 A N H > S+ 0 0 7 2,-0.2 4,-1.8 94,-0.2 -1,-0.2 0.889 110.1 46.5 -70.6 -38.5 18.7 19.9 35.1 17 23 A S H > S+ 0 0 42 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.893 112.6 51.8 -68.9 -37.3 18.6 16.7 33.0 18 24 A A H X S+ 0 0 14 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.886 106.7 53.6 -64.9 -38.4 14.9 17.3 32.3 19 25 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.914 110.3 46.9 -62.3 -43.3 15.7 20.8 31.1 20 26 A L H X S+ 0 0 3 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.898 109.1 53.9 -66.0 -40.5 18.3 19.4 28.7 21 27 A Q H X S+ 0 0 105 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.903 111.7 45.6 -60.9 -40.1 15.9 16.7 27.5 22 28 A E H >< S+ 0 0 46 -4,-2.1 3,-1.2 1,-0.2 4,-0.2 0.880 106.0 60.9 -68.6 -37.3 13.4 19.5 26.7 23 29 A A H >X S+ 0 0 0 -4,-2.2 3,-2.1 1,-0.3 4,-0.6 0.840 90.8 68.7 -58.4 -34.6 16.1 21.6 25.1 24 30 A I H 3< S+ 0 0 52 -4,-1.6 3,-0.5 1,-0.3 -1,-0.3 0.858 104.0 43.4 -53.8 -36.2 16.6 18.8 22.5 25 31 A G T << S+ 0 0 69 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.378 107.9 60.7 -91.9 4.9 13.2 19.6 21.1 26 32 A L T <4 S+ 0 0 14 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.363 74.6 115.8-110.9 1.8 13.7 23.4 21.2 27 33 A V < - 0 0 33 -4,-0.6 3,-0.1 -3,-0.5 139,-0.1 -0.330 69.7-111.3 -69.8 153.7 16.7 23.7 18.9 28 34 A P > - 0 0 14 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.409 49.9 -76.4 -80.0 163.1 16.3 25.6 15.7 29 35 A P T 3 S+ 0 0 124 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.325 121.2 37.0 -58.9 142.9 16.5 23.7 12.4 30 36 A G T 3 S+ 0 0 59 1,-0.3 2,-0.3 -3,-0.1 -3,-0.0 0.512 103.5 87.9 93.3 4.4 20.0 22.8 11.5 31 37 A M < - 0 0 12 -3,-1.3 2,-0.3 -29,-0.0 -1,-0.3 -0.973 50.2-177.3-134.9 149.0 21.0 22.1 15.1 32 38 A S E -a 2 0A 47 -31,-2.3 -29,-2.9 -2,-0.3 2,-0.4 -0.996 17.4-138.2-148.2 144.7 20.9 19.0 17.3 33 39 A I E -a 3 0A 15 -2,-0.3 2,-0.4 -9,-0.2 -29,-0.2 -0.887 13.1-169.7-107.6 132.3 21.7 18.2 20.9 34 40 A E E -a 4 0A 81 -31,-2.9 -29,-3.2 -2,-0.4 2,-0.3 -0.941 23.0-127.3-115.4 140.1 23.4 15.0 22.0 35 41 A L E -a 5 0A 70 -2,-0.4 2,-0.3 -31,-0.2 -29,-0.2 -0.709 10.7-140.4 -95.1 140.4 23.6 14.2 25.7 36 42 A A - 0 0 16 -31,-2.8 2,-0.6 -2,-0.3 -29,-0.5 -0.716 9.5-146.0 -92.9 145.8 26.8 13.4 27.6 37 43 A D + 0 0 110 -2,-0.3 3,-0.3 19,-0.1 23,-0.1 -0.944 25.3 167.2-114.3 108.5 26.6 10.6 30.2 38 44 A I > + 0 0 11 -2,-0.6 3,-1.7 -31,-0.2 -1,-0.1 0.359 47.8 103.3-102.4 6.3 29.0 11.5 33.1 39 45 A S T 3 S+ 0 0 77 1,-0.3 -1,-0.2 -30,-0.1 -29,-0.0 0.723 79.7 52.7 -61.3 -23.3 27.6 8.8 35.5 40 46 A G T 3 S+ 0 0 50 -3,-0.3 16,-0.3 16,-0.1 -1,-0.3 0.475 81.0 109.7 -92.2 -2.4 30.6 6.5 34.9 41 47 A I < - 0 0 20 -3,-1.7 3,-0.1 15,-0.2 47,-0.1 -0.618 62.6-142.0 -76.7 122.5 33.2 9.2 35.6 42 48 A P - 0 0 54 0, 0.0 49,-0.1 0, 0.0 2,-0.1 -0.259 33.0 -77.9 -78.7 169.1 35.0 8.4 38.9 43 49 A L - 0 0 146 1,-0.1 2,-0.1 48,-0.0 41,-0.0 -0.445 64.2 -95.1 -65.7 141.5 36.1 10.9 41.5 44 50 A Y + 0 0 68 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.313 48.7 167.7 -64.4 138.4 39.3 12.6 40.3 45 51 A N >> - 0 0 75 1,-0.1 4,-2.3 -3,-0.1 3,-1.2 -0.900 30.8-147.5-152.1 117.0 42.7 11.2 41.4 46 52 A E H 3> S+ 0 0 80 -2,-0.3 4,-2.5 1,-0.3 5,-0.1 0.835 100.4 60.6 -54.0 -35.6 46.0 12.3 39.8 47 53 A D H 34 S+ 0 0 119 2,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.811 108.5 42.9 -64.7 -29.8 47.4 8.9 40.5 48 54 A V H X4 S+ 0 0 64 -3,-1.2 3,-1.5 2,-0.2 4,-0.5 0.907 112.2 52.9 -79.8 -45.3 44.7 7.3 38.4 49 55 A Y H >< S+ 0 0 39 -4,-2.3 3,-1.8 1,-0.3 -2,-0.2 0.873 99.5 64.6 -55.5 -39.9 45.0 10.0 35.6 50 56 A A T 3< S+ 0 0 74 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.748 102.6 48.5 -57.5 -25.3 48.7 9.3 35.5 51 57 A L T < S- 0 0 162 -3,-1.5 -1,-0.3 1,-0.4 -2,-0.2 0.500 129.2 -75.2 -93.4 -6.0 48.0 5.8 34.2 52 58 A G < - 0 0 39 -3,-1.8 -1,-0.4 -4,-0.5 -2,-0.0 -0.544 58.5 -57.4 130.4 163.2 45.5 6.9 31.6 53 59 A F - 0 0 46 -2,-0.2 -4,-0.1 -3,-0.1 5,-0.0 -0.564 54.0-115.0 -77.1 133.3 42.0 8.2 31.2 54 60 A P >> - 0 0 22 0, 0.0 4,-2.2 0, 0.0 3,-1.0 -0.375 34.2-108.7 -62.8 148.9 39.2 6.0 32.6 55 61 A P H 3> S+ 0 0 113 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.852 118.7 53.9 -47.3 -42.2 37.0 4.8 29.7 56 62 A A H 3> S+ 0 0 26 -16,-0.3 4,-1.7 1,-0.2 -15,-0.2 0.850 109.7 47.7 -63.8 -34.5 34.1 7.1 30.7 57 63 A V H <> S+ 0 0 0 -3,-1.0 4,-2.8 2,-0.2 -1,-0.2 0.894 109.7 52.3 -73.7 -39.8 36.3 10.1 30.7 58 64 A E H X S+ 0 0 114 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.925 109.8 49.8 -61.2 -43.2 37.8 9.2 27.3 59 65 A R H X S+ 0 0 151 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.913 111.2 48.9 -61.0 -43.2 34.2 8.9 25.9 60 66 A F H X S+ 0 0 1 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.930 111.5 48.9 -62.8 -46.6 33.3 12.3 27.4 61 67 A R H X S+ 0 0 30 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.881 109.2 53.4 -61.1 -38.7 36.4 13.9 25.9 62 68 A E H X S+ 0 0 98 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.900 109.2 48.8 -63.0 -41.0 35.6 12.4 22.5 63 69 A Q H X S+ 0 0 14 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.891 110.5 50.0 -66.2 -40.5 32.1 13.9 22.6 64 70 A I H < S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.929 109.7 51.7 -63.7 -43.3 33.5 17.3 23.5 65 71 A R H < S+ 0 0 178 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.894 112.2 46.2 -59.2 -41.3 36.0 17.1 20.7 66 72 A A H < S+ 0 0 65 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.691 95.7 95.1 -76.4 -20.4 33.2 16.3 18.2 67 73 A A < - 0 0 5 -4,-1.3 -64,-0.2 -3,-0.4 3,-0.1 -0.427 58.7-157.0 -77.0 147.0 30.8 19.0 19.4 68 74 A D S S+ 0 0 88 -66,-2.9 2,-0.3 1,-0.3 -65,-0.2 0.694 82.1 5.3 -89.4 -24.7 30.5 22.4 17.8 69 75 A A E -b 3 0A 2 -67,-1.6 -65,-2.5 34,-0.1 2,-0.3 -0.975 69.9-128.4-154.6 162.7 29.1 23.9 21.0 70 76 A L E -bc 4 105A 0 34,-1.9 36,-2.1 -2,-0.3 2,-0.4 -0.894 7.2-163.0-120.1 147.5 28.3 23.0 24.6 71 77 A L E -bc 5 106A 0 -67,-2.6 -65,-3.1 -2,-0.3 2,-0.4 -0.932 13.7-163.1-131.2 105.4 25.2 23.3 26.7 72 78 A F E -bc 6 107A 0 34,-2.4 36,-2.5 -2,-0.4 2,-0.6 -0.756 9.6-165.9 -91.9 133.1 25.8 23.0 30.5 73 79 A A E -bc 7 108A 0 -67,-2.8 -65,-2.4 -2,-0.4 36,-0.2 -0.920 21.2-166.4-116.3 99.1 22.9 22.3 32.8 74 80 A T - 0 0 0 34,-2.2 47,-0.1 -2,-0.6 36,-0.1 -0.785 13.1-153.4-100.8 118.8 24.3 23.2 36.2 75 81 A P - 0 0 4 0, 0.0 7,-1.2 0, 0.0 2,-0.5 -0.460 18.5-135.7 -76.3 158.1 22.7 22.2 39.5 76 82 A E E +F 81 0B 25 34,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.977 26.2 173.2-120.1 122.1 23.6 24.5 42.5 77 83 A Y E > S-F 80 0B 107 3,-2.1 3,-1.3 -2,-0.5 0, 0.0 -0.996 70.3 -6.6-126.2 133.4 24.5 23.0 45.8 78 84 A N T 3 S- 0 0 162 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.889 128.4 -55.1 50.3 48.4 25.8 25.1 48.7 79 85 A Y T 3 S+ 0 0 156 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.641 123.6 60.4 62.9 21.5 26.1 28.3 46.7 80 86 A S E < S-F 77 0B 34 -3,-1.3 -3,-2.1 43,-0.0 40,-0.3 -0.886 95.9 -46.4-155.9-175.1 28.3 26.9 44.0 81 87 A M E -F 76 0B 24 39,-0.3 -5,-0.2 -2,-0.3 2,-0.1 -0.280 66.1 -96.2 -60.3 147.2 28.6 24.2 41.2 82 88 A A > - 0 0 0 -7,-1.2 4,-2.2 1,-0.1 3,-0.3 -0.432 31.2-129.6 -62.7 134.7 27.5 20.7 42.0 83 89 A G H > S+ 0 0 49 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.860 106.2 58.8 -56.1 -37.5 30.7 18.8 42.9 84 90 A V H > S+ 0 0 57 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 107.9 44.9 -59.6 -44.8 29.8 16.0 40.5 85 91 A L H > S+ 0 0 0 -77,-0.5 4,-2.2 -3,-0.3 -2,-0.2 0.937 113.7 49.1 -65.3 -46.2 29.7 18.4 37.5 86 92 A K H X S+ 0 0 65 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.908 109.6 53.3 -60.0 -41.0 32.9 20.1 38.6 87 93 A N H X S+ 0 0 20 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.893 107.9 49.9 -61.1 -41.2 34.6 16.7 39.0 88 94 A A H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.913 112.7 47.1 -64.2 -42.5 33.6 15.7 35.4 89 95 A I H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.906 108.4 56.1 -64.6 -41.4 35.0 19.0 34.1 90 96 A D H < S+ 0 0 49 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.915 110.6 44.7 -57.7 -44.0 38.2 18.4 36.1 91 97 A W H >< S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.953 115.4 45.0 -65.1 -51.5 38.7 15.0 34.4 92 98 A A H 3< S+ 0 0 0 -4,-2.4 8,-0.2 1,-0.2 -1,-0.2 0.726 105.9 63.5 -66.8 -21.2 37.9 16.2 30.9 93 99 A S T 3< S+ 0 0 27 -4,-2.0 5,-0.3 -5,-0.2 -1,-0.2 0.457 79.4 111.5 -82.9 -4.0 40.1 19.3 31.3 94 100 A R < - 0 0 71 -3,-1.3 -3,-0.0 -4,-0.3 -4,-0.0 -0.278 69.2 -58.6 -72.3 156.5 43.3 17.4 31.8 95 101 A P S S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.318 92.5 72.1 -65.0 159.5 46.2 17.4 29.3 96 102 A P S S- 0 0 87 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.489 123.0 -42.0 -87.4 155.9 46.8 16.7 26.5 97 103 A E S S- 0 0 181 1,-0.2 -3,-0.1 -2,-0.1 -4,-0.0 0.810 74.9-135.2 29.5 65.7 45.0 19.4 24.5 98 104 A Q > - 0 0 32 -5,-0.3 3,-1.3 1,-0.1 -1,-0.2 -0.187 9.6-130.8 -49.6 129.9 41.9 19.5 26.7 99 105 A P T 3 S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.537 94.7 75.1 -63.4 -13.8 38.8 19.5 24.3 100 106 A F T > + 0 0 0 -8,-0.2 3,-2.2 2,-0.1 -2,-0.1 0.785 69.1 122.9 -69.8 -25.3 36.9 22.3 25.8 101 107 A S T < S- 0 0 69 -3,-1.3 31,-0.2 1,-0.3 32,-0.2 -0.077 83.2 -4.5 -45.2 121.3 39.3 24.8 24.3 102 108 A G T 3 S+ 0 0 39 30,-2.3 -1,-0.3 29,-0.3 31,-0.2 0.391 92.5 144.8 77.3 -0.8 37.7 27.4 22.1 103 109 A K < - 0 0 36 -3,-2.2 31,-2.7 29,-0.1 -1,-0.2 -0.470 46.5-133.4 -75.7 135.5 34.2 26.0 22.3 104 110 A P E + d 0 134A 53 0, 0.0 -34,-1.9 0, 0.0 2,-0.3 -0.554 36.9 178.3 -79.9 154.8 31.2 28.3 22.2 105 111 A A E -cd 70 135A 0 29,-2.1 31,-2.1 -36,-0.2 2,-0.3 -0.974 29.7-144.8-154.5 167.0 28.7 27.4 24.9 106 112 A A E -c 71 0A 0 -36,-2.1 -34,-2.4 -2,-0.3 2,-0.4 -0.966 16.9-152.0-132.6 147.9 25.4 28.2 26.7 107 113 A I E +c 72 0A 1 -2,-0.3 34,-0.6 -36,-0.2 2,-0.3 -0.970 20.9 160.8-123.8 137.0 24.7 27.7 30.4 108 114 A L E -ce 73 141A 0 -36,-2.5 -34,-2.2 -2,-0.4 2,-0.3 -0.928 9.4-178.5-144.9 166.9 21.3 27.0 32.0 109 115 A G E - e 0 142A 0 32,-1.0 34,-2.9 -2,-0.3 2,-0.4 -0.976 15.5-151.2-167.8 155.8 20.1 25.6 35.3 110 116 A A E + e 0 143A 3 -2,-0.3 2,-0.3 32,-0.2 -34,-0.3 -0.991 19.4 167.0-134.3 140.8 17.2 24.6 37.4 111 117 A S - 0 0 27 32,-2.8 35,-2.6 -2,-0.4 5,-0.1 -0.984 43.6-130.8-149.5 155.6 16.8 24.6 41.2 112 118 A A S S+ 0 0 51 -2,-0.3 33,-0.3 33,-0.3 -1,-0.1 0.732 87.6 95.7 -76.6 -20.9 14.0 24.3 43.7 113 119 A G S > S- 0 0 30 -37,-0.1 3,-1.3 31,-0.1 32,-1.0 -0.167 91.1-107.4 -70.7 162.0 15.7 27.3 45.3 114 120 A R T 3 S+ 0 0 202 1,-0.2 30,-0.1 30,-0.2 -1,-0.1 0.802 113.5 49.7 -57.2 -37.3 14.8 31.0 44.8 115 121 A F T > S- 0 0 94 28,-0.1 3,-2.3 29,-0.1 -1,-0.2 0.340 95.1-135.5 -93.8 11.2 17.8 31.9 42.7 116 122 A G T < S- 0 0 0 -3,-1.3 27,-0.4 1,-0.3 -7,-0.1 0.739 70.1 -49.5 40.4 44.9 17.5 29.1 40.1 117 123 A T T 3> S+ 0 0 2 25,-0.2 4,-2.3 -41,-0.1 3,-0.3 0.438 94.5 138.9 77.8 9.6 21.3 28.2 40.1 118 124 A A H <> S+ 0 0 18 -3,-2.3 4,-1.8 1,-0.2 5,-0.2 0.883 71.3 49.9 -48.3 -49.0 22.5 31.8 39.6 119 125 A R H > S+ 0 0 75 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.905 110.4 49.5 -60.6 -42.8 25.4 31.3 42.0 120 126 A A H > S+ 0 0 0 -40,-0.3 4,-2.6 -3,-0.3 -39,-0.3 0.890 107.9 56.2 -63.5 -38.1 26.6 28.1 40.4 121 127 A Q H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.907 106.8 46.3 -63.2 -43.3 26.5 29.7 36.9 122 128 A Y H X S+ 0 0 113 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.850 112.9 50.3 -71.0 -30.6 28.8 32.6 37.8 123 129 A H H >X S+ 0 0 90 -4,-1.6 4,-1.7 -5,-0.2 3,-0.6 0.921 110.6 50.2 -69.3 -43.0 31.3 30.2 39.5 124 130 A L H 3X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.901 103.9 59.2 -60.5 -40.4 31.1 28.0 36.4 125 131 A R H 3X S+ 0 0 41 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.828 104.1 51.0 -59.3 -30.8 31.8 31.1 34.2 126 132 A Q H XX S+ 0 0 151 -4,-1.0 4,-0.9 -3,-0.6 3,-0.9 0.921 109.2 50.1 -71.5 -43.0 35.1 31.6 36.1 127 133 A T H 3X S+ 0 0 32 -4,-1.7 4,-1.3 1,-0.2 3,-0.5 0.894 103.4 61.3 -59.4 -39.6 36.1 28.0 35.5 128 134 A L H 3X>S+ 0 0 1 -4,-2.6 5,-2.4 1,-0.2 4,-0.7 0.762 92.8 66.1 -61.0 -25.4 35.3 28.5 31.8 129 135 A V H X<5S+ 0 0 112 -3,-0.9 3,-1.1 -4,-0.7 -1,-0.2 0.955 102.6 45.0 -61.8 -48.8 38.0 31.1 31.5 130 136 A F H 3<5S+ 0 0 186 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.849 114.1 49.5 -64.6 -32.5 40.7 28.7 32.2 131 137 A L H 3<5S- 0 0 5 -4,-1.3 -29,-0.3 2,-0.1 -1,-0.3 0.547 109.6-126.4 -81.0 -7.8 39.2 26.2 29.8 132 138 A D T <<5 + 0 0 76 -3,-1.1 -30,-2.3 -4,-0.7 2,-0.3 0.893 54.1 155.0 59.8 44.7 38.9 28.9 27.1 133 139 A V < - 0 0 6 -5,-2.4 -1,-0.2 -32,-0.2 -32,-0.1 -0.770 38.0-142.0 -98.1 146.5 35.2 28.3 26.6 134 140 A H E -d 104 0A 108 -31,-2.7 -29,-2.1 -2,-0.3 2,-0.2 -0.829 21.4-169.0-114.8 93.8 33.1 31.2 25.3 135 141 A P E -d 105 0A 31 0, 0.0 -29,-0.2 0, 0.0 2,-0.0 -0.475 26.9-106.2 -82.8 151.1 29.7 31.2 26.9 136 142 A L - 0 0 37 -31,-2.1 -29,-0.2 -2,-0.2 32,-0.0 -0.376 19.2-157.6 -66.4 153.0 26.7 33.3 25.8 137 143 A N + 0 0 115 1,-0.3 -1,-0.1 -31,-0.1 -31,-0.0 0.649 64.0 82.5-101.7 -27.9 25.9 36.3 28.1 138 144 A K S S+ 0 0 162 1,-0.1 -1,-0.3 30,-0.1 2,-0.1 -1.000 81.4 19.9-144.8 141.8 22.3 36.5 27.0 139 145 A P S S- 0 0 23 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.658 74.0-156.1 -82.5 172.1 19.8 35.3 27.5 140 146 A E - 0 0 63 -2,-0.1 2,-0.5 -34,-0.1 -32,-0.1 -0.866 1.1-153.5-108.4 146.2 20.3 33.7 30.9 141 147 A V E +e 108 0A 1 -34,-0.6 -32,-1.0 -2,-0.4 2,-0.4 -0.943 24.5 159.1-125.9 107.7 18.2 30.8 32.0 142 148 A M E -e 109 0A 51 -2,-0.5 2,-0.8 -34,-0.2 -32,-0.2 -0.899 21.4-162.2-130.3 97.9 17.8 30.3 35.8 143 149 A I E -e 110 0A 10 -34,-2.9 -32,-2.8 -2,-0.4 3,-0.4 -0.745 12.3-172.0 -87.2 111.0 14.7 28.2 36.6 144 150 A S + 0 0 55 -2,-0.8 -30,-0.2 1,-0.2 -32,-0.2 -0.573 66.1 25.3 -98.2 165.0 13.7 28.7 40.2 145 151 A S S > S+ 0 0 56 -32,-1.0 3,-2.4 -33,-0.3 -33,-0.3 0.896 74.8 175.1 47.5 43.7 11.1 26.7 42.1 146 152 A A G >> + 0 0 0 -35,-2.6 3,-1.3 -3,-0.4 4,-1.0 0.678 62.8 77.7 -53.9 -22.5 11.8 24.0 39.6 147 153 A Q G 34 S+ 0 0 92 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.746 102.2 39.9 -62.0 -20.8 9.5 21.6 41.4 148 154 A N G <4 S+ 0 0 117 -3,-2.4 -1,-0.3 -4,-0.1 -2,-0.2 0.375 102.1 72.3-106.8 1.0 6.6 23.5 39.8 149 155 A A T <4 S+ 0 0 7 -3,-1.3 8,-3.4 -4,-0.3 9,-0.7 0.725 97.7 47.4 -87.7 -24.7 8.3 23.9 36.4 150 156 A F B < -G 156 0C 22 -4,-1.0 6,-0.2 6,-0.2 3,-0.1 -0.871 60.4-167.6-120.8 154.7 7.9 20.2 35.4 151 157 A D - 0 0 59 4,-1.0 -1,-0.1 1,-0.4 -2,-0.1 0.129 62.0 -10.4-107.3-138.2 5.1 17.7 35.4 152 158 A A S > S- 0 0 74 2,-0.1 2,-1.2 1,-0.1 3,-1.2 -0.355 129.4 -14.7 -63.8 143.9 5.3 13.9 34.8 153 159 A Q T 3 S- 0 0 193 1,-0.2 -135,-0.1 -3,-0.1 -1,-0.1 -0.447 125.7 -48.6 63.0 -94.4 8.7 12.8 33.6 154 160 A G T 3 S+ 0 0 8 -2,-1.2 -1,-0.2 -136,-0.1 -132,-0.2 0.208 77.4 145.8-166.2 36.3 10.2 16.1 32.5 155 161 A R < - 0 0 161 -3,-1.2 -4,-1.0 1,-0.1 2,-0.5 -0.527 48.8-118.0 -79.4 147.7 8.1 18.4 30.4 156 162 A L B -G 150 0C 10 -2,-0.2 -6,-0.2 -6,-0.2 -7,-0.1 -0.757 27.4-179.8 -89.6 125.4 8.4 22.1 30.9 157 163 A L + 0 0 101 -8,-3.4 2,-1.1 -2,-0.5 -1,-0.2 0.593 65.6 87.3 -94.3 -17.1 5.3 23.9 32.0 158 164 A D > - 0 0 57 -9,-0.7 4,-1.9 1,-0.2 5,-0.1 -0.737 55.4-176.7 -88.1 98.8 7.1 27.2 32.0 159 165 A D H > S+ 0 0 90 -2,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.793 82.6 60.5 -65.9 -28.9 6.8 28.6 28.5 160 166 A K H > S+ 0 0 130 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 106.5 46.9 -62.8 -44.6 8.9 31.6 29.4 161 167 A A H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.903 110.4 52.5 -62.9 -42.3 11.7 29.2 30.2 162 168 A R H X S+ 0 0 96 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.889 109.5 50.1 -61.5 -39.4 11.1 27.3 27.0 163 169 A E H X S+ 0 0 110 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.923 111.0 47.4 -65.1 -46.5 11.4 30.5 25.0 164 170 A L H X S+ 0 0 41 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.896 112.0 49.9 -62.8 -42.0 14.6 31.6 26.6 165 171 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.910 109.2 52.7 -62.9 -40.1 16.2 28.1 26.1 166 172 A Q H X S+ 0 0 85 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.875 108.1 52.7 -61.8 -36.5 15.0 28.4 22.5 167 173 A Q H X S+ 0 0 86 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.887 106.1 51.2 -67.1 -42.3 16.8 31.8 22.3 168 174 A Q H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.928 110.8 48.5 -61.1 -46.7 20.2 30.4 23.6 169 175 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.866 110.3 51.2 -62.7 -37.0 20.1 27.6 21.0 170 176 A Q H X S+ 0 0 89 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.816 110.6 51.1 -69.4 -28.2 19.3 30.2 18.3 171 177 A A H < S+ 0 0 28 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.904 107.4 50.6 -74.3 -43.3 22.3 32.2 19.6 172 178 A L H < S+ 0 0 18 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.886 107.5 55.2 -60.7 -39.7 24.7 29.3 19.5 173 179 A Q H < 0 0 68 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.941 360.0 360.0 -57.9 -48.2 23.7 28.6 15.9 174 180 A L < 0 0 179 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.965 360.0 360.0 -64.3 360.0 24.5 32.2 15.0