==== 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 17-JUL-06 2HOW . COMPND 2 MOLECULE: 356AA LONG HYPOTHETICAL DIPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR J.JEYAKANTHAN,S.YOKOYAMA,Y.SHIRO,K.YUTANI,RIKEN STRUCTURAL . 712 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30374.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 527 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 16.4 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 47 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 0 0 3 3 0 0 3 1 1 1 2 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 2 0 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 PARALLEL BRIDGES PER LADDER . 12 4 1 12 0 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 2 4 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 0 164 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -43.4 56.4 11.9 43.0 2 2 A R H > + 0 0 61 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.896 360.0 48.6 -50.9 -53.2 52.7 10.9 43.0 3 3 A L H > S+ 0 0 9 26,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.933 113.0 50.4 -56.1 -44.3 51.4 13.7 40.7 4 4 A E H > S+ 0 0 100 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.878 110.1 48.0 -61.6 -42.6 54.2 12.8 38.3 5 5 A K H X S+ 0 0 105 -4,-2.5 4,-3.3 2,-0.2 5,-0.2 0.959 111.5 52.4 -61.7 -48.8 53.4 9.1 38.3 6 6 A F H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 -2,-0.2 0.893 108.5 49.7 -51.5 -47.0 49.8 10.0 37.8 7 7 A I H X S+ 0 0 19 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.901 111.9 48.5 -62.0 -40.8 50.7 12.2 34.7 8 8 A H H X S+ 0 0 131 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.976 112.9 47.2 -62.4 -53.8 52.8 9.3 33.3 9 9 A L H X S+ 0 0 14 -4,-3.3 4,-2.3 1,-0.2 6,-0.2 0.895 105.6 61.0 -54.5 -43.2 49.9 6.9 33.8 10 10 A L H <>S+ 0 0 0 -4,-2.9 5,-1.3 -5,-0.2 4,-0.4 0.948 109.2 40.9 -48.5 -57.7 47.5 9.3 32.3 11 11 A G H ><5S+ 0 0 39 -4,-1.8 3,-1.4 1,-0.2 -1,-0.2 0.895 111.4 54.9 -59.7 -45.6 49.3 9.3 29.0 12 12 A E H 3<5S+ 0 0 121 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.873 108.1 50.7 -57.1 -39.0 50.0 5.6 28.9 13 13 A R T 3<5S- 0 0 111 -4,-2.3 -1,-0.3 -3,-0.2 -2,-0.2 0.470 120.8-101.4 -82.6 -2.8 46.3 4.8 29.4 14 14 A G T < 5S+ 0 0 43 -3,-1.4 81,-0.2 -4,-0.4 -3,-0.2 0.248 74.7 133.0 106.3 -14.0 45.0 7.0 26.6 15 15 A F < - 0 0 27 -5,-1.3 -1,-0.3 -6,-0.2 81,-0.2 -0.413 45.9-154.1 -78.2 146.6 43.7 10.1 28.4 16 16 A D S S- 0 0 66 79,-2.6 32,-2.5 1,-0.2 33,-0.3 0.702 70.6 -40.4 -88.8 -23.8 44.5 13.7 27.5 17 17 A G E -Ab 47 96A 0 78,-1.2 80,-1.6 30,-0.3 2,-0.3 -0.970 53.3-116.5-178.3-170.2 44.0 15.1 31.0 18 18 A A E -Ab 46 97A 0 28,-2.6 28,-2.8 -2,-0.3 2,-0.5 -0.992 5.1-149.0-153.2 149.2 42.0 15.1 34.2 19 19 A L E -Ab 45 98A 1 78,-2.8 80,-1.6 -2,-0.3 2,-0.6 -0.983 21.4-170.2-123.0 116.9 39.8 17.4 36.3 20 20 A I E -A 44 0A 0 24,-2.5 24,-1.8 -2,-0.5 3,-0.1 -0.916 6.3-163.6-121.1 113.4 40.0 16.8 40.0 21 21 A S - 0 0 3 -2,-0.6 5,-0.3 22,-0.2 22,-0.2 -0.388 46.7 -65.0 -82.5 166.3 37.7 18.4 42.5 22 22 A P S S+ 0 0 24 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.047 85.7 82.9 -51.7 147.7 38.5 18.4 46.3 23 23 A G S > S- 0 0 36 9,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.942 93.3 -41.8 148.1-169.4 38.6 15.1 48.2 24 24 A T H > S+ 0 0 28 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.879 130.8 52.7 -58.9 -40.2 40.9 12.2 49.0 25 25 A N H > S+ 0 0 8 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.890 109.3 47.9 -65.6 -40.5 42.2 12.0 45.4 26 26 A L H > S+ 0 0 0 -5,-0.3 4,-2.6 2,-0.2 6,-0.6 0.926 114.4 48.0 -64.4 -43.9 43.1 15.6 45.3 27 27 A Y H X S+ 0 0 74 -4,-2.3 4,-3.0 4,-0.2 -2,-0.2 0.925 108.7 53.8 -60.5 -47.3 44.9 15.2 48.7 28 28 A Y H < S+ 0 0 13 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.887 116.5 38.0 -53.7 -44.9 46.7 12.1 47.6 29 29 A L H < S+ 0 0 11 -4,-1.8 -26,-0.5 -5,-0.2 -1,-0.2 0.841 138.0 8.0 -79.1 -35.6 48.1 13.8 44.6 30 30 A T H < S- 0 0 28 -4,-2.6 -3,-0.2 2,-0.2 -2,-0.2 0.494 85.6-117.4-131.2 -3.9 48.9 17.2 46.0 31 31 A G < + 0 0 48 -4,-3.0 2,-0.3 -5,-0.4 -4,-0.2 0.508 66.2 144.9 76.4 2.3 48.4 17.4 49.8 32 32 A L + 0 0 11 -6,-0.6 2,-0.4 -5,-0.1 -9,-0.3 -0.593 24.2 177.6 -79.3 135.1 45.7 20.0 49.2 33 33 A R - 0 0 132 30,-0.3 2,-0.6 -2,-0.3 -9,-0.0 -0.982 8.1-167.6-137.9 119.9 42.7 20.0 51.5 34 34 A L > - 0 0 16 -2,-0.4 3,-0.6 8,-0.0 2,-0.3 -0.947 20.4-131.0-114.4 119.5 39.9 22.5 51.2 35 35 A H T 3 S- 0 0 35 -2,-0.6 -2,-0.0 1,-0.2 522,-0.0 -0.496 74.8 -23.1 -73.4 131.5 37.4 22.8 54.0 36 36 A E T 3 + 0 0 93 -2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.859 69.2 172.8 33.2 68.2 33.7 22.8 53.1 37 37 A V X + 0 0 16 -3,-0.6 3,-1.5 1,-0.2 -1,-0.1 0.869 15.1 167.5 -68.0 -36.7 34.1 24.0 49.5 38 38 A G T 3 - 0 0 50 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 -0.357 65.9 -8.9 61.9-129.7 30.4 23.4 48.9 39 39 A E T 3 S+ 0 0 101 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.3 0.700 103.9 111.0 -74.6 -22.0 29.2 24.9 45.6 40 40 A R S < S- 0 0 60 -3,-1.5 34,-0.0 1,-0.1 -3,-0.0 -0.411 76.3-115.5 -65.4 115.4 32.4 26.9 44.9 41 41 A L + 0 0 3 -2,-0.4 2,-0.4 15,-0.1 -1,-0.1 -0.235 41.3 170.5 -52.5 121.8 34.2 25.5 41.9 42 42 A A + 0 0 0 14,-0.2 2,-0.4 -3,-0.0 14,-0.2 -0.928 10.4 165.6-138.4 109.0 37.6 24.1 42.9 43 43 A I E - C 0 55A 0 12,-2.4 12,-3.8 -2,-0.4 2,-0.7 -0.984 33.7-153.2-138.0 138.9 39.5 22.1 40.3 44 44 A L E -AC 20 54A 0 -24,-1.8 -24,-2.5 -2,-0.4 2,-0.4 -0.932 24.3-158.8-103.0 114.4 43.0 20.8 39.6 45 45 A A E -AC 19 53A 0 8,-3.3 8,-1.8 -2,-0.7 2,-0.4 -0.808 11.6-175.7 -96.2 134.0 43.4 20.5 35.8 46 46 A V E -AC 18 52A 0 -28,-2.8 -28,-2.6 -2,-0.4 2,-0.3 -0.993 10.6-158.0-136.0 133.0 46.0 18.1 34.6 47 47 A S E > -A 17 0A 2 4,-2.1 3,-1.0 -2,-0.4 -30,-0.3 -0.693 29.9-121.2-102.8 158.7 47.2 17.4 31.1 48 48 A A T 3 S+ 0 0 23 -32,-2.5 -37,-0.2 -2,-0.3 -31,-0.1 0.627 108.4 70.4 -71.6 -11.0 49.0 14.2 29.9 49 49 A E T 3 S- 0 0 171 -33,-0.3 -1,-0.2 40,-0.2 3,-0.1 0.719 119.0 -99.7 -78.8 -24.0 51.8 16.6 28.9 50 50 A G S < S+ 0 0 30 -3,-1.0 -2,-0.1 1,-0.5 2,-0.1 0.177 83.6 120.6 125.6 -17.3 53.0 17.5 32.4 51 51 A D + 0 0 91 38,-0.2 -4,-2.1 -44,-0.1 -1,-0.5 -0.398 34.2 170.3 -76.3 154.2 51.3 20.8 32.8 52 52 A Y E -C 46 0A 61 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.933 13.4-174.8-167.5 145.2 48.8 21.4 35.7 53 53 A R E -C 45 0A 67 -8,-1.8 -8,-3.3 -2,-0.3 2,-0.6 -0.995 17.2-139.8-144.8 146.2 46.9 24.2 37.4 54 54 A F E -Cd 44 69A 0 14,-2.2 16,-2.2 -2,-0.3 2,-0.6 -0.919 10.9-161.2-113.7 114.9 44.6 24.5 40.3 55 55 A L E +Cd 43 70A 0 -12,-3.8 -12,-2.4 -2,-0.6 16,-0.2 -0.823 26.0 157.0 -94.5 122.9 41.5 26.8 40.2 56 56 A A E - d 0 71A 0 14,-2.1 16,-1.8 -2,-0.6 -14,-0.2 -0.968 46.4 -94.3-142.2 156.5 40.2 27.7 43.6 57 57 A P E > - d 0 72A 0 0, 0.0 3,-2.3 0, 0.0 16,-0.2 -0.490 42.2-111.5 -72.9 144.6 38.1 30.4 45.1 58 58 A S G > S+ 0 0 18 14,-3.2 3,-2.5 1,-0.3 4,-0.2 0.744 109.1 78.3 -43.0 -33.0 40.1 33.3 46.6 59 59 A L G 3 S+ 0 0 41 1,-0.3 3,-0.3 13,-0.3 -1,-0.3 0.740 93.8 49.0 -49.4 -31.3 39.0 32.2 50.2 60 60 A Y G X> S+ 0 0 22 -3,-2.3 4,-1.2 1,-0.2 3,-1.0 0.313 74.0 119.8 -94.5 5.4 41.6 29.4 50.1 61 61 A E T <4 S+ 0 0 100 -3,-2.5 3,-0.4 1,-0.3 -1,-0.2 0.806 82.1 36.4 -40.8 -47.5 44.5 31.6 49.0 62 62 A N T >4 S+ 0 0 154 -3,-0.3 3,-0.9 -4,-0.2 -1,-0.3 0.722 110.2 62.2 -83.4 -20.3 46.6 30.9 52.0 63 63 A V T <4 S+ 0 0 78 -3,-1.0 -30,-0.3 1,-0.2 -1,-0.2 0.643 96.5 62.2 -77.6 -13.2 45.5 27.3 52.4 64 64 A V T >< S- 0 0 1 -4,-1.2 3,-2.5 -3,-0.4 -1,-0.2 0.194 83.6-165.0 -98.2 17.8 47.0 26.5 49.0 65 65 A N T < - 0 0 139 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 -0.015 65.6 -28.2 37.7-121.4 50.6 27.3 49.9 66 66 A N T 3 S+ 0 0 150 2,-0.1 -1,-0.3 -4,-0.0 3,-0.1 0.116 93.2 142.6-110.2 19.9 52.7 27.7 46.8 67 67 A F < - 0 0 37 -3,-2.5 2,-0.9 1,-0.1 -3,-0.1 -0.374 68.6 -97.4 -65.0 136.7 50.7 25.4 44.6 68 68 A P S S+ 0 0 56 0, 0.0 -14,-2.2 0, 0.0 2,-0.3 -0.352 70.7 158.0 -55.3 97.8 50.4 26.5 41.0 69 69 A A E -d 54 0A 25 -2,-0.9 2,-0.4 -16,-0.2 -14,-0.2 -0.926 43.4-154.0-134.6 156.9 47.0 28.2 41.3 70 70 A T E -d 55 0A 26 -16,-2.2 -14,-2.1 -2,-0.3 2,-0.4 -0.984 24.9-148.9-121.1 130.3 44.6 30.7 39.9 71 71 A F E -d 56 0A 44 -2,-0.4 2,-0.3 -16,-0.2 -16,-0.1 -0.841 7.0-160.0-108.1 142.0 42.1 32.3 42.3 72 72 A W E -d 57 0A 15 -16,-1.8 -14,-3.2 -2,-0.4 2,-0.4 -0.896 12.3-135.1-117.8 149.1 38.6 33.5 41.5 73 73 A H > - 0 0 100 -2,-0.3 3,-1.8 -16,-0.2 2,-0.0 -0.826 33.5 -93.7-107.0 141.4 36.5 35.9 43.4 74 74 A D T 3 S+ 0 0 60 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 -0.288 115.7 46.4 -49.5 116.9 32.8 35.6 44.3 75 75 A G T 3 S+ 0 0 62 1,-0.6 -1,-0.3 587,-0.0 2,-0.2 0.265 94.3 89.8 128.0 -8.6 31.2 37.5 41.5 76 76 A E S < S- 0 0 97 -3,-1.8 -1,-0.6 3,-0.0 3,-0.1 -0.606 83.8-105.5-109.6 171.7 33.1 36.1 38.5 77 77 A N >> - 0 0 93 -2,-0.2 4,-1.3 1,-0.2 3,-1.2 -0.855 28.8-170.0-100.0 100.7 32.3 33.1 36.3 78 78 A P H 3> S+ 0 0 13 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.769 85.6 63.3 -61.6 -23.9 34.8 30.5 37.5 79 79 A Y H 3> S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.836 99.2 53.7 -69.1 -30.4 33.8 28.3 34.6 80 80 A A H <> S+ 0 0 44 -3,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.884 109.0 48.0 -70.3 -38.4 35.1 31.1 32.3 81 81 A K H X S+ 0 0 46 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.922 107.2 55.6 -67.8 -42.3 38.5 31.0 34.1 82 82 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.876 103.0 58.5 -56.4 -36.7 38.6 27.2 33.8 83 83 A R H X S+ 0 0 108 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.968 105.4 46.9 -56.8 -55.8 38.2 27.7 30.1 84 84 A E H X S+ 0 0 125 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.888 113.0 51.3 -51.3 -44.9 41.3 29.8 29.8 85 85 A I H X S+ 0 0 4 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.897 110.1 47.1 -61.1 -45.6 43.2 27.2 31.9 86 86 A L H X>S+ 0 0 2 -4,-2.8 5,-2.4 1,-0.2 4,-0.8 0.900 110.2 55.2 -64.5 -39.5 42.1 24.3 29.8 87 87 A E H <5S+ 0 0 120 -4,-2.7 3,-0.5 1,-0.2 -2,-0.2 0.912 110.7 43.1 -59.0 -46.8 43.1 26.3 26.7 88 88 A E H <5S+ 0 0 101 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.759 114.4 49.8 -73.2 -25.4 46.6 26.9 27.8 89 89 A L H <5S- 0 0 12 -4,-1.6 -40,-0.2 -5,-0.2 -1,-0.2 0.512 113.5-119.6 -88.7 -6.7 47.1 23.3 29.1 90 90 A G T <5S+ 0 0 59 -4,-0.8 -3,-0.2 -3,-0.5 -4,-0.1 0.682 81.5 113.4 77.8 19.1 45.8 22.1 25.8 91 91 A I < + 0 0 4 -5,-2.4 -4,-0.2 -6,-0.2 -3,-0.1 -0.355 20.6 121.5-120.7 55.4 42.8 20.2 27.2 92 92 A S S S+ 0 0 50 -6,-0.2 23,-0.6 -5,-0.2 2,-0.3 0.041 88.4 11.0 -99.6 24.8 39.8 22.0 25.9 93 93 A K E S+ e 0 115A 142 21,-0.2 23,-0.2 -7,-0.1 2,-0.2 -0.877 92.1 72.1 176.4 162.0 38.6 18.8 24.3 94 94 A G E S- e 0 116A 14 21,-1.8 23,-1.4 -2,-0.3 2,-0.7 -0.690 87.8 -27.8 116.6-169.6 39.6 15.1 24.4 95 95 A R E - 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0 0 6 181,-2.6 2,-0.1 -2,-0.8 -3,-0.1 -0.535 8.1-137.0 -75.8 137.3 50.6 2.1 50.0 133 133 A D > - 0 0 67 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.401 35.1 -89.7 -86.7 170.5 54.1 3.4 50.6 134 134 A K H > S+ 0 0 169 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.820 124.9 47.6 -49.2 -42.7 55.9 3.1 53.9 135 135 A E H >> S+ 0 0 105 2,-0.2 4,-2.6 1,-0.2 3,-1.1 0.984 108.2 53.5 -66.1 -54.2 54.7 6.4 55.3 136 136 A E H 3> S+ 0 0 7 1,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.887 109.5 51.1 -45.7 -42.8 51.1 5.7 54.4 137 137 A V H 3X S+ 0 0 14 -4,-2.2 4,-2.5 2,-0.2 -1,-0.3 0.848 107.2 52.4 -64.7 -34.6 51.4 2.4 56.3 138 138 A K H < S+ 0 0 92 -4,-2.7 3,-1.8 1,-0.2 4,-0.3 0.900 104.1 55.6 -66.9 -42.5 38.8 1.9 76.9 154 154 A I H >< S+ 0 0 0 -4,-2.7 3,-1.9 1,-0.3 -1,-0.2 0.877 95.8 66.7 -59.4 -38.1 35.3 0.6 76.1 155 155 A L T 3< S+ 0 0 48 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.499 97.7 56.1 -63.3 -1.1 35.9 -2.5 78.2 156 156 A T T < S+ 0 0 96 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.2 0.513 86.3 96.1-109.0 -5.7 36.0 -0.3 81.3 157 157 A W S < S- 0 0 61 -3,-1.9 2,-1.1 -4,-0.3 -3,-0.0 -0.442 81.8-113.5 -83.0 158.2 32.6 1.5 80.9 158 158 A D + 0 0 123 1,-0.2 -1,-0.1 -2,-0.1 -3,-0.1 -0.794 37.8 177.7 -92.2 96.7 29.4 0.4 82.7 159 159 A L > + 0 0 4 -2,-1.1 3,-1.8 197,-0.1 47,-0.3 0.656 38.7 113.8 -76.7 -17.6 27.4 -0.8 79.6 160 160 A I T 3 S+ 0 0 71 1,-0.3 47,-0.2 45,-0.1 3,-0.1 -0.363 89.7 4.8 -60.2 126.3 24.3 -2.0 81.5 161 161 A G T 3 S+ 0 0 31 45,-3.1 2,-0.3 1,-0.3 -1,-0.3 0.355 96.2 135.1 83.6 -5.1 21.3 0.2 80.7 162 162 A M < - 0 0 27 -3,-1.8 44,-2.1 44,-0.3 -1,-0.3 -0.561 56.3-120.6 -81.1 135.8 23.1 2.3 78.1 163 163 A K B > -G 205 0C 54 -2,-0.3 4,-2.3 42,-0.2 3,-0.5 -0.498 16.6-124.7 -74.9 144.4 21.4 3.0 74.8 164 164 A E H > S+ 0 0 0 40,-1.9 4,-2.5 1,-0.3 5,-0.2 0.915 115.5 51.9 -50.2 -47.6 23.1 1.9 71.7 165 165 A R H > S+ 0 0 113 37,-2.6 4,-1.4 1,-0.2 -1,-0.3 0.823 108.3 51.6 -60.0 -34.2 23.0 5.4 70.4 166 166 A E H > S+ 0 0 70 -3,-0.5 4,-1.8 36,-0.3 -1,-0.2 0.856 109.9 47.8 -73.7 -36.0 24.6 6.6 73.7 167 167 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.950 109.7 51.2 -69.2 -49.8 27.5 4.2 73.5 168 168 A A H X S+ 0 0 8 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.898 108.9 54.6 -53.0 -39.3 28.2 5.0 69.8 169 169 A L H X S+ 0 0 67 -4,-1.4 4,-2.2 -5,-0.2 -1,-0.2 0.927 108.2 47.0 -61.6 -45.1 28.3 8.6 71.0 170 170 A K H X S+ 0 0 101 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.864 112.6 49.9 -64.3 -37.1 30.9 7.9 73.7 171 171 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.961 108.7 53.2 -65.7 -48.0 33.0 6.0 71.2 172 172 A E H X S+ 0 0 16 -4,-3.1 4,-2.2 -5,-0.2 -2,-0.2 0.920 111.6 44.9 -52.1 -49.7 32.7 8.9 68.7 173 173 A L H X S+ 0 0 49 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.912 111.6 51.3 -64.7 -40.9 34.0 11.4 71.3 174 174 A L H X S+ 0 0 20 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.912 112.0 48.3 -63.2 -38.4 36.8 9.2 72.5 175 175 A I H X S+ 0 0 1 -4,-2.8 4,-1.2 1,-0.2 6,-0.5 0.868 112.2 48.7 -67.3 -36.7 37.9 8.7 68.9 176 176 A R H < S+ 0 0 70 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.743 111.9 49.7 -75.7 -22.0 37.7 12.5 68.3 177 177 A E H < S+ 0 0 150 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.891 116.7 41.0 -79.2 -42.4 39.7 13.1 71.5 178 178 A L H < S+ 0 0 57 -4,-2.2 2,-0.2 -5,-0.2 -2,-0.2 0.556 123.2 11.9 -84.7 -12.8 42.4 10.6 70.5 179 179 A S S < S- 0 0 13 -4,-1.2 41,-0.2 -5,-0.1 3,-0.1 -0.741 92.3 -74.2-146.5-164.5 42.8 11.3 66.8 180 180 A D S S- 0 0 100 39,-2.0 2,-0.2 1,-0.3 40,-0.1 0.560 95.2 -65.1 -78.8 -8.6 42.0 13.6 63.9 181 181 A G - 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