==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 13-JAN-10 3LDY . COMPND 2 MOLECULE: RESTRICTION ENDONUCLEASE PACI; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS ALCALIGENES; . AUTHOR B.W.SHEN,D.HEITER,S.-H.CHAN,S.-Y.XU,G.WILSON,B.L.STODDARD . 142 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8408.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 82 57.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 3 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 0 172 0, 0.0 2,-0.3 0, 0.0 11,-0.2 0.000 360.0 360.0 360.0 124.0 32.6 33.3 62.5 2 2 A T E -A 11 0A 92 9,-2.4 9,-3.2 7,-0.1 2,-0.4 -0.928 360.0 -95.9-141.5 173.2 32.1 37.1 62.6 3 3 A Q E -A 10 0A 114 -2,-0.3 7,-0.2 7,-0.2 6,-0.1 -0.712 20.8-132.3-101.3 133.7 28.9 39.2 63.0 4 4 A C > - 0 0 0 5,-2.3 4,-1.8 -2,-0.4 19,-0.1 -0.659 14.0-143.2 -79.8 125.6 26.7 40.7 60.4 5 5 A P T 4 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 18,-0.1 0.630 96.5 43.5 -65.0 -9.8 26.0 44.4 61.3 6 6 A R T 4 S+ 0 0 123 16,-0.1 17,-0.1 3,-0.1 -3,-0.0 0.898 128.3 18.0-101.4 -63.1 22.5 43.9 60.0 7 7 A C T 4 S- 0 0 30 2,-0.1 3,-0.1 1,-0.0 16,-0.0 0.568 91.8-138.3 -84.0 -8.7 20.9 40.6 61.2 8 8 A Q < + 0 0 120 -4,-1.8 2,-0.1 1,-0.2 -1,-0.0 0.559 49.8 150.2 56.7 15.5 23.6 40.4 63.9 9 9 A R - 0 0 69 -6,-0.1 -5,-2.3 1,-0.1 2,-0.7 -0.407 52.7-118.0 -70.8 150.8 24.0 36.7 63.2 10 10 A N E +A 3 0A 104 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.840 48.7 173.6 -91.1 112.9 27.3 35.0 63.8 11 11 A L E -A 2 0A 9 -9,-3.2 -9,-2.4 -2,-0.7 2,-0.1 -0.813 34.2-109.1-130.0 151.1 28.5 33.7 60.5 12 12 A A > - 0 0 49 -2,-0.3 3,-2.5 -11,-0.2 4,-0.3 -0.389 43.6-103.7 -69.9 154.5 31.3 32.0 58.6 13 13 A A G > S+ 0 0 86 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.755 118.6 67.8 -47.0 -31.7 33.3 34.0 56.0 14 14 A D G 3 S+ 0 0 72 1,-0.3 -1,-0.3 11,-0.0 -2,-0.0 0.524 90.9 61.1 -75.2 -4.2 31.4 32.2 53.2 15 15 A E G < S+ 0 0 1 -3,-2.5 10,-3.3 2,-0.1 11,-0.3 0.435 100.3 72.4 -92.6 -6.0 28.2 34.0 54.2 16 16 A F S < S- 0 0 33 -3,-1.4 8,-0.1 -4,-0.3 2,-0.1 -0.658 85.6-108.3-107.2 164.8 29.9 37.3 53.5 17 17 A Y - 0 0 42 6,-0.4 -2,-0.1 4,-0.3 -1,-0.1 -0.431 14.8-133.9 -86.3 163.8 30.9 39.0 50.2 18 18 A A S S+ 0 0 90 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.0 0.707 85.3 60.2 -92.3 -24.3 34.5 39.5 48.9 19 19 A G S S- 0 0 54 66,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.090 112.1 -63.3 -85.9-154.6 34.1 43.1 47.9 20 20 A S S S+ 0 0 125 2,-0.0 2,-0.2 -2,-0.0 -1,-0.0 0.437 91.1 111.4 -82.2 -2.1 33.3 46.2 50.0 21 21 A S - 0 0 46 1,-0.1 -4,-0.3 2,-0.0 0, 0.0 -0.555 47.6-164.6 -73.5 139.3 29.8 45.3 51.1 22 22 A K + 0 0 175 -2,-0.2 -1,-0.1 -6,-0.1 -16,-0.1 0.744 57.6 87.5 -96.5 -27.8 29.6 44.6 54.9 23 23 A M S S- 0 0 32 -19,-0.1 -6,-0.4 1,-0.1 -19,-0.0 -0.361 82.5-101.0 -75.0 155.0 26.2 42.9 55.3 24 24 A C > - 0 0 0 -8,-0.1 4,-2.9 1,-0.1 -8,-0.2 -0.168 31.1-104.7 -70.0 166.9 25.8 39.1 54.8 25 25 A K H > S+ 0 0 11 -10,-3.3 4,-2.6 1,-0.2 5,-0.2 0.852 121.0 52.3 -61.7 -37.6 24.4 37.3 51.7 26 26 A G H > S+ 0 0 0 -11,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.934 111.8 45.4 -62.6 -49.6 21.1 36.6 53.4 27 27 A C H > S+ 0 0 2 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.942 115.7 46.5 -59.1 -48.9 20.6 40.2 54.4 28 28 A M H X S+ 0 0 39 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.892 113.2 48.3 -62.3 -42.3 21.7 41.4 50.9 29 29 A T H X S+ 0 0 12 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.886 111.8 50.9 -66.7 -38.5 19.4 38.9 49.2 30 30 A W H X S+ 0 0 42 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.927 110.5 47.9 -62.6 -47.1 16.5 40.0 51.5 31 31 A Q H X S+ 0 0 84 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.927 114.2 47.6 -58.8 -46.7 17.1 43.7 50.7 32 32 A N H X S+ 0 0 73 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.914 110.0 52.7 -55.4 -46.8 17.2 42.9 46.9 33 33 A L H X S+ 0 0 5 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.910 112.7 43.9 -58.1 -46.4 14.0 40.7 47.2 34 34 A S H X S+ 0 0 42 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.883 116.1 46.2 -68.7 -43.1 12.1 43.5 48.9 35 35 A Y H X S+ 0 0 152 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.926 116.1 46.1 -64.9 -45.6 13.3 46.3 46.5 36 36 A N H X S+ 0 0 55 -4,-3.1 4,-2.4 -5,-0.2 6,-0.2 0.899 111.3 51.6 -63.2 -43.7 12.7 44.1 43.4 37 37 A A H X>S+ 0 0 5 -4,-2.5 5,-2.4 -5,-0.2 4,-1.0 0.943 112.2 46.2 -59.8 -49.8 9.2 43.0 44.6 38 38 A N H ><5S+ 0 0 138 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.952 115.5 46.1 -55.1 -51.9 8.2 46.6 45.2 39 39 A K H 3<5S+ 0 0 120 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.832 118.9 40.5 -61.9 -36.6 9.6 47.7 41.8 40 40 A E H 3<5S- 0 0 107 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.467 110.2-116.4 -95.4 -2.1 8.0 44.9 39.8 41 41 A G T <<5 + 0 0 68 -4,-1.0 2,-0.4 -3,-0.8 -3,-0.2 0.829 62.7 149.9 65.7 34.8 4.7 44.9 41.6 42 42 A H < - 0 0 47 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.810 46.0-121.1 -94.8 142.8 5.2 41.4 43.1 43 43 A A - 0 0 66 -2,-0.4 57,-2.9 2,-0.0 2,-0.3 -0.367 21.6-156.4 -70.4 157.5 3.6 40.4 46.4 44 44 A N B +b 100 0B 52 55,-0.2 57,-0.2 1,-0.1 -10,-0.0 -0.851 22.6 168.9-141.2 105.0 5.9 39.2 49.2 45 45 A T + 0 0 99 55,-2.6 56,-0.2 -2,-0.3 -1,-0.1 0.555 51.1 104.3 -92.3 -10.0 4.7 37.0 52.0 46 46 A F - 0 0 10 54,-0.4 2,-0.3 4,-0.1 3,-0.1 -0.413 59.0-151.2 -59.0 142.0 8.2 36.2 53.5 47 47 A T > - 0 0 85 1,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.744 33.0-106.5 -97.9 167.0 9.2 38.0 56.6 48 48 A K H > S+ 0 0 61 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.939 120.2 52.2 -57.0 -45.9 12.9 38.6 57.1 49 49 A A H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.907 112.2 42.1 -58.5 -51.4 13.0 35.8 59.8 50 50 A T H > S+ 0 0 59 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.887 114.9 53.3 -65.8 -34.7 11.3 33.1 57.7 51 51 A F H X S+ 0 0 0 -4,-2.6 4,-3.3 2,-0.2 -2,-0.2 0.955 108.0 48.9 -62.4 -48.3 13.4 34.2 54.7 52 52 A L H X S+ 0 0 23 -4,-3.0 4,-1.3 1,-0.2 -1,-0.2 0.859 113.0 47.1 -61.2 -37.6 16.7 33.8 56.6 53 53 A A H < S+ 0 0 82 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.872 114.8 48.1 -70.9 -35.9 15.7 30.4 57.8 54 54 A W H < S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.910 109.6 51.2 -64.6 -47.1 14.7 29.5 54.3 55 55 A Y H < S+ 0 0 5 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.760 88.7 177.6 -66.7 -27.6 17.9 30.8 52.7 56 56 A G < - 0 0 29 -4,-1.3 2,-0.3 -5,-0.2 -1,-0.2 -0.183 37.9 -33.3 62.9-144.2 20.0 28.8 55.1 57 57 A L >> - 0 0 87 -4,-0.1 3,-2.1 1,-0.1 4,-0.7 -0.856 53.3-109.8-123.0 154.0 23.8 28.8 54.8 58 58 A S G >4 S+ 0 0 10 -2,-0.3 3,-1.0 1,-0.3 12,-0.5 0.777 112.2 51.6 -49.5 -45.2 26.2 29.2 51.9 59 59 A A G 34 S+ 0 0 68 1,-0.2 -1,-0.3 11,-0.1 12,-0.0 0.650 110.4 51.2 -72.3 -13.5 27.7 25.6 51.9 60 60 A Q G <4 S+ 0 0 153 -3,-2.1 2,-0.4 9,-0.1 -1,-0.2 0.550 88.1 103.2 -96.5 -11.4 24.2 24.1 51.9 61 61 A R << + 0 0 7 -3,-1.0 9,-1.7 -4,-0.7 2,-0.3 -0.604 39.1 161.0 -82.7 129.0 22.9 26.1 48.9 62 62 A H B -C 69 0C 88 -2,-0.4 7,-0.2 7,-0.2 45,-0.1 -0.989 48.2 -96.4-141.8 141.7 22.6 24.6 45.4 63 63 A C > - 0 0 4 5,-2.3 4,-1.4 -2,-0.3 45,-0.2 -0.345 28.5-139.8 -52.5 129.4 20.6 25.7 42.4 64 64 A G T 4 S+ 0 0 37 43,-3.1 -1,-0.1 1,-0.1 44,-0.1 0.480 98.5 42.3 -78.7 -2.3 17.3 23.7 42.4 65 65 A Y T 4 S+ 0 0 13 42,-0.2 68,-0.2 64,-0.1 -1,-0.1 0.810 129.9 15.9 -98.7 -57.1 17.5 23.4 38.6 66 66 A C T 4 S- 0 0 4 2,-0.1 -2,-0.1 66,-0.1 70,-0.1 0.578 90.8-128.0 -99.9 -11.7 21.2 22.6 37.7 67 67 A G < + 0 0 40 -4,-1.4 -3,-0.1 1,-0.2 2,-0.0 0.420 50.4 156.2 79.4 0.3 22.5 21.5 41.1 68 68 A I - 0 0 3 -6,-0.1 -5,-2.3 1,-0.1 -1,-0.2 -0.370 41.6-124.5 -62.3 135.3 25.5 23.9 41.1 69 69 A S B > -C 62 0C 24 73,-1.1 4,-2.3 -7,-0.2 -7,-0.2 -0.348 23.2-110.1 -71.6 159.6 26.8 24.7 44.6 70 70 A E H > S+ 0 0 2 -9,-1.7 4,-2.2 -12,-0.5 5,-0.1 0.866 121.5 49.4 -58.3 -39.0 27.0 28.4 45.6 71 71 A A H > S+ 0 0 73 -10,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 109.6 52.3 -68.1 -40.1 30.9 28.1 45.5 72 72 A G H 4 S+ 0 0 7 2,-0.2 -2,-0.2 1,-0.2 4,-0.2 0.906 110.9 46.9 -59.3 -42.3 30.7 26.5 42.1 73 73 A F H >< S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.2 5,-0.5 0.906 108.6 54.6 -68.8 -41.6 28.6 29.3 40.7 74 74 A T H >< S+ 0 0 32 -4,-2.2 3,-1.8 1,-0.3 -1,-0.2 0.893 101.0 61.6 -52.7 -41.5 30.9 31.9 42.3 75 75 A S T 3< S+ 0 0 57 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.518 91.6 66.3 -68.6 -7.6 33.7 30.2 40.4 76 76 A L T < S- 0 0 28 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.559 97.1-139.4 -86.4 -9.8 32.0 31.1 37.0 77 77 A H < + 0 0 126 -3,-1.8 2,-0.2 -4,-0.3 -3,-0.1 0.920 33.2 175.7 48.6 54.6 32.5 34.8 37.7 78 78 A R - 0 0 116 -5,-0.5 8,-3.1 8,-0.4 2,-0.4 -0.566 21.3-135.1 -81.5 151.9 29.2 35.9 36.4 79 79 A T B -D 85 0D 82 6,-0.2 6,-0.2 -2,-0.2 -1,-0.0 -0.898 6.3-134.3-113.1 140.7 28.3 39.6 36.7 80 80 A N > - 0 0 56 4,-2.5 3,-1.1 -2,-0.4 6,-0.0 -0.236 47.5 -83.7 -76.7 175.9 25.0 41.1 37.9 81 81 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.666 132.7 48.8 -62.2 -10.1 23.5 44.1 36.0 82 82 A R T 3 S- 0 0 196 2,-0.1 -3,-0.0 0, 0.0 0, 0.0 0.561 121.1-121.9 -84.0 -15.0 25.7 46.6 37.8 83 83 A G < + 0 0 44 -3,-1.1 2,-0.2 1,-0.2 -4,-0.0 0.323 62.5 138.2-109.8 107.8 27.9 44.5 36.9 84 84 A Y - 0 0 161 1,-0.1 -4,-2.5 0, 0.0 2,-0.2 -0.628 64.5 -75.9 -98.6 163.3 29.8 43.1 39.9 85 85 A H B -D 79 0D 64 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.432 46.8-127.5 -66.4 125.4 30.8 39.5 40.5 86 86 A I + 0 0 20 -8,-3.1 -8,-0.4 -2,-0.2 -9,-0.2 -0.617 33.4 170.1 -82.9 128.4 27.9 37.3 41.6 87 87 A Q + 0 0 28 -2,-0.4 2,-0.3 -10,-0.1 -13,-0.2 0.302 53.2 44.6-126.5 3.4 28.6 35.4 44.8 88 88 A C S S- 0 0 16 -15,-0.1 2,-0.3 -14,-0.1 22,-0.3 -0.942 76.8-106.2-146.8 164.3 25.3 33.8 45.9 89 89 A L - 0 0 0 -2,-0.3 20,-0.2 20,-0.1 2,-0.1 -0.698 36.9-152.8 -89.5 147.5 22.3 31.9 44.6 90 90 A G E -E 108 0E 23 18,-2.1 18,-2.8 -2,-0.3 2,-0.4 -0.331 19.6 -89.2-109.6-168.5 19.0 33.8 44.3 91 91 A V E -E 107 0E 15 16,-0.2 2,-0.5 -2,-0.1 16,-0.2 -0.901 25.4-152.1-112.9 135.3 15.3 33.0 44.4 92 92 A D E -E 106 0E 3 14,-3.5 14,-1.3 -2,-0.4 2,-1.3 -0.899 17.9-135.7 -98.6 129.5 13.2 32.0 41.4 93 93 A R E -E 105 0E 44 -2,-0.5 12,-0.2 1,-0.2 5,-0.1 -0.770 26.3-157.0 -77.9 93.6 9.4 32.8 41.6 94 94 A S S S+ 0 0 25 10,-2.6 2,-0.9 -2,-1.3 28,-0.2 0.879 84.9 48.7 -55.8 -48.7 8.8 29.3 40.2 95 95 A D S > S- 0 0 79 9,-0.3 3,-1.8 4,-0.2 -1,-0.1 -0.839 85.9-155.2 -78.5 108.9 5.3 30.3 38.9 96 96 A S T 3 S+ 0 0 29 -2,-0.9 -1,-0.1 1,-0.3 -2,-0.1 0.586 88.7 60.3 -69.8 -11.0 6.5 33.5 37.1 97 97 A F T 3 S+ 0 0 194 2,-0.1 -1,-0.3 -55,-0.0 2,-0.2 0.600 99.8 68.2 -85.6 -15.2 3.0 35.0 37.4 98 98 A E S < S- 0 0 120 -3,-1.8 3,-0.1 1,-0.2 -5,-0.0 -0.634 78.7-122.9-102.7 166.0 3.1 34.8 41.2 99 99 A G - 0 0 7 -2,-0.2 2,-0.5 1,-0.1 -55,-0.2 0.163 47.1 -50.7 -89.4-157.2 5.2 36.8 43.7 100 100 A Y B S+b 44 0B 26 -57,-2.9 -55,-2.6 -67,-0.1 -54,-0.4 -0.746 70.9 131.9 -87.1 124.5 7.6 35.9 46.5 101 101 A S > - 0 0 24 -2,-0.5 4,-2.3 -57,-0.2 3,-0.1 -0.958 66.9-105.8-162.7 155.9 6.3 33.3 49.1 102 102 A P T 4 S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.919 122.7 49.5 -55.2 -44.0 7.7 30.1 50.8 103 103 A Q T 4 S+ 0 0 174 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 0.833 119.2 36.6 -64.1 -35.7 5.3 28.1 48.5 104 104 A N T 4 S+ 0 0 15 -3,-0.1 -10,-2.6 -10,-0.1 -9,-0.3 0.622 96.8 97.4 -93.8 -15.7 6.4 29.9 45.3 105 105 A A E < +E 93 0E 14 -4,-2.3 2,-0.3 -12,-0.2 -12,-0.2 -0.503 42.1 173.4 -80.0 145.3 10.2 30.4 46.0 106 106 A R E -E 92 0E 68 -14,-1.3 -14,-3.5 -2,-0.2 2,-0.4 -0.979 36.0-112.7-145.7 138.3 12.9 28.1 44.7 107 107 A L E +E 91 0E 29 -2,-0.3 -43,-3.1 -16,-0.2 2,-0.3 -0.622 46.5 168.1 -72.3 126.5 16.6 28.5 45.0 108 108 A A E -E 90 0E 0 -18,-2.8 -18,-2.1 -2,-0.4 2,-0.1 -0.999 36.3-118.8-141.6 146.5 18.2 29.1 41.6 109 109 A C > - 0 0 0 -2,-0.3 4,-2.5 -20,-0.2 5,-0.2 -0.421 37.9-111.0 -70.0 155.3 21.5 30.3 40.1 110 110 A F H > S+ 0 0 61 -22,-0.3 4,-1.8 1,-0.2 5,-0.2 0.763 117.2 57.5 -63.0 -24.7 21.3 33.5 38.0 111 111 A I H > S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.969 112.2 38.2 -68.1 -50.9 22.1 31.5 34.9 112 112 A C H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.874 113.7 57.5 -67.3 -36.2 19.1 29.2 35.3 113 113 A N H X S+ 0 0 36 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.904 111.0 41.1 -61.6 -46.7 16.9 32.0 36.6 114 114 A R H < S+ 0 0 135 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.859 113.5 54.1 -67.6 -37.3 17.4 34.1 33.4 115 115 A I H < S+ 0 0 69 -4,-2.2 -2,-0.2 1,-0.2 4,-0.2 0.970 111.9 43.8 -59.5 -48.8 17.1 31.0 31.1 116 116 A K H >X S+ 0 0 0 -4,-2.7 3,-2.1 -5,-0.2 4,-1.8 0.885 84.8 151.1 -60.8 -42.4 13.8 30.1 32.7 117 117 A S T 3< S- 0 0 57 -4,-1.8 -1,-0.1 1,-0.3 -2,-0.1 -0.091 80.7 -49.8 44.0-135.6 12.8 33.8 32.5 118 118 A N T 34 S+ 0 0 120 -4,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.027 129.8 81.7-109.3 27.7 9.0 33.8 32.1 119 119 A I T <4 S+ 0 0 114 -3,-2.1 2,-0.3 -4,-0.2 -2,-0.2 0.901 83.5 48.2 -96.9 -52.4 9.1 31.3 29.3 120 120 A F S < S- 0 0 73 -4,-1.8 -24,-0.2 -5,-0.2 -1,-0.1 -0.697 74.6-126.1 -98.6 144.4 9.4 27.8 30.9 121 121 A S > - 0 0 53 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.427 37.2-103.2 -74.1 161.9 7.4 26.3 33.8 122 122 A A H > S+ 0 0 21 1,-0.2 4,-1.9 -28,-0.2 5,-0.1 0.890 123.6 49.2 -56.2 -42.6 9.4 24.9 36.7 123 123 A S H > S+ 0 0 87 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.880 111.4 48.1 -67.9 -35.6 8.9 21.3 35.5 124 124 A E H > S+ 0 0 111 1,-0.2 4,-1.8 2,-0.2 3,-0.4 0.904 112.4 51.5 -64.0 -40.6 10.1 22.2 32.0 125 125 A M H X S+ 0 0 0 -4,-3.1 4,-3.4 1,-0.2 -2,-0.2 0.832 98.4 64.3 -68.0 -30.5 13.0 24.0 33.7 126 126 A D H X S+ 0 0 57 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.2 0.921 106.0 45.7 -55.1 -42.2 13.8 20.8 35.7 127 127 A V H X S+ 0 0 99 -4,-1.1 4,-1.1 -3,-0.4 -2,-0.2 0.901 112.7 48.4 -69.9 -43.4 14.6 19.1 32.4 128 128 A L H >X S+ 0 0 55 -4,-1.8 4,-2.5 1,-0.2 3,-0.5 0.918 107.3 59.8 -57.4 -42.6 16.7 22.1 31.1 129 129 A G H 3X S+ 0 0 0 -4,-3.4 4,-2.6 1,-0.3 -2,-0.2 0.875 99.6 53.6 -54.6 -42.6 18.4 22.1 34.5 130 130 A E H 3X S+ 0 0 124 -4,-1.4 4,-1.1 2,-0.2 -1,-0.3 0.854 109.8 48.6 -62.9 -34.9 19.7 18.5 34.0 131 131 A A H S+ 0 0 18 -4,-2.1 5,-2.3 2,-0.2 4,-0.3 0.937 113.8 51.8 -59.1 -49.8 29.0 22.2 34.5 137 137 A H H ><5S+ 0 0 153 -4,-3.4 3,-1.0 1,-0.3 -1,-0.2 0.878 111.3 49.1 -54.4 -41.9 29.9 18.5 35.0 138 138 A G H 3<5S+ 0 0 66 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.843 107.0 54.2 -66.5 -35.4 31.9 18.6 31.7 139 139 A R T 3<5S- 0 0 175 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.433 121.3-107.8 -77.7 3.4 33.7 21.8 32.8 140 140 A G T < 5S+ 0 0 70 -3,-1.0 2,-0.4 -4,-0.3 -3,-0.2 0.842 76.5 135.4 69.3 39.2 34.9 20.1 36.0 141 141 A I < 0 0 37 -5,-2.3 -1,-0.2 -8,-0.1 -2,-0.1 -0.960 360.0 360.0-127.9 133.0 32.5 22.1 38.2 142 142 A A 0 0 96 -2,-0.4 -73,-1.1 -74,-0.1 -1,-0.1 0.536 360.0 360.0-120.4 360.0 30.1 20.9 41.1