==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-09 3L24 . COMPND 2 MOLECULE: XAA-PRO DIPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ALTEROMONAS SP.; . AUTHOR N.K.VYAS,A.NICHITENKO,V.K.RASTOGI,S.S.SHAH,F.A.QUIOCHO . 1259 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57486.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 898 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.2 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 . 116 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 154 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 371 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.6 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 6 1 2 7 2 0 1 2 3 0 0 0 0 3 3 0 0 0 0 2 1 0 3 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 0 3 3 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 . 14 1 10 6 3 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 6 0 3 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 0 239 0, 0.0 2,-0.6 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 150.5 -6.3 24.4 34.1 2 2 A N > - 0 0 84 1,-0.2 4,-2.4 2,-0.0 5,-0.2 -0.939 360.0-158.5-115.0 111.0 -4.4 25.8 31.1 3 3 A K H > S+ 0 0 132 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.898 99.0 50.0 -51.9 -45.0 -0.7 26.4 31.5 4 4 A L H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.933 108.9 52.9 -60.5 -45.5 -0.8 28.9 28.6 5 5 A A H > S+ 0 0 20 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.875 109.7 47.5 -59.2 -40.2 -3.7 30.6 30.3 6 6 A V H >X S+ 0 0 87 -4,-2.4 4,-0.9 1,-0.2 3,-0.5 0.934 112.6 48.0 -70.0 -42.2 -1.8 31.0 33.5 7 7 A L H 3X S+ 0 0 39 -4,-2.5 4,-1.7 1,-0.2 156,-0.5 0.859 103.9 64.0 -64.0 -33.2 1.4 32.3 31.8 8 8 A Y H 3X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.844 91.3 62.9 -60.1 -37.3 -0.8 34.7 29.8 9 9 A A H S+ 0 0 19 -4,-2.4 5,-3.3 1,-0.2 -1,-0.2 0.817 112.8 48.7 -67.8 -25.8 3.4 56.8 28.1 24 24 A E H ><5S+ 0 0 143 -4,-1.4 3,-1.1 -5,-0.3 -2,-0.2 0.926 109.0 51.0 -74.8 -45.4 4.8 58.5 31.2 25 25 A R H 3<5S+ 0 0 57 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.755 122.3 34.3 -62.6 -23.5 8.2 59.0 29.6 26 26 A E T 3<5S- 0 0 56 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.260 108.7-120.9-114.4 8.7 6.4 60.5 26.6 27 27 A N T < 5 + 0 0 116 -3,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.942 58.5 152.1 48.9 59.5 3.5 62.2 28.4 28 28 A L < - 0 0 14 -5,-3.3 -1,-0.2 1,-0.1 98,-0.2 -0.802 52.0-140.4-116.2 160.1 0.8 60.3 26.5 29 29 A D S S- 0 0 85 96,-2.0 2,-0.3 1,-0.3 97,-0.2 0.697 77.2 -48.2 -88.0 -23.5 -2.7 59.3 27.5 30 30 A G E -a 126 0A 0 95,-1.0 97,-2.0 -7,-0.1 2,-0.4 -0.987 52.9 -95.4 174.2-176.5 -2.3 55.9 25.9 31 31 A V E -aB 127 72A 0 41,-3.2 41,-2.7 -2,-0.3 2,-0.5 -0.993 22.2-154.9-131.8 134.8 -1.3 53.8 23.0 32 32 A V E -aB 128 71A 0 95,-3.1 97,-3.6 -2,-0.4 2,-0.6 -0.947 6.1-163.0-114.7 118.8 -3.5 52.5 20.2 33 33 A F E -aB 129 70A 0 37,-2.7 37,-2.8 -2,-0.5 2,-0.6 -0.899 4.8-158.8-105.3 121.6 -2.5 49.3 18.2 34 34 A H E - B 0 69A 0 95,-2.2 97,-0.3 -2,-0.6 35,-0.2 -0.886 11.6-150.3-103.6 118.6 -4.3 48.7 14.9 35 35 A S - 0 0 0 33,-3.1 18,-2.1 -2,-0.6 2,-0.3 0.799 46.5-127.6 -58.1 -29.4 -4.2 45.1 13.7 36 36 A G - 0 0 5 32,-0.4 31,-3.0 16,-0.2 2,-0.3 -0.798 17.8 -88.0 118.7-162.8 -4.3 46.4 10.1 37 37 A Q - 0 0 51 -2,-0.3 14,-0.4 29,-0.2 2,-0.3 -0.927 35.8 -93.7-145.5 169.7 -6.4 45.8 7.0 38 38 A A - 0 0 37 -2,-0.3 2,-0.5 12,-0.1 12,-0.1 -0.705 39.8-130.2 -87.1 139.5 -6.5 43.5 4.0 39 39 A K - 0 0 93 9,-0.4 9,-3.1 -2,-0.3 2,-0.3 -0.806 16.9-137.5 -94.0 130.5 -4.7 44.9 0.9 40 40 A R B -F 47 0B 139 -2,-0.5 7,-0.3 7,-0.3 2,-0.1 -0.678 21.3-114.2 -88.3 138.1 -6.7 44.9 -2.4 41 41 A Q > - 0 0 68 5,-3.1 3,-2.2 -2,-0.3 5,-0.2 -0.467 46.8 -85.5 -71.6 141.5 -5.0 43.8 -5.6 42 42 A F T 3 S- 0 0 174 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.193 106.9 -9.0 -50.6 127.9 -4.6 46.6 -8.2 43 43 A L T 3 S+ 0 0 149 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.602 119.8 100.0 58.4 13.9 -7.7 46.9 -10.4 44 44 A D S < S- 0 0 71 -3,-2.2 -1,-0.2 2,-0.2 -4,-0.0 -0.679 74.4-134.5-122.3 175.5 -9.1 43.7 -8.9 45 45 A D S S+ 0 0 121 -2,-0.2 2,-0.3 -3,-0.1 -3,-0.1 0.074 78.9 96.5-115.9 21.1 -11.6 42.7 -6.3 46 46 A M - 0 0 103 -5,-0.2 -5,-3.1 -4,-0.1 2,-0.3 -0.717 63.7-141.3-105.2 160.7 -9.2 40.1 -4.7 47 47 A Y B -F 40 0B 130 -7,-0.3 -7,-0.3 -2,-0.3 3,-0.1 -0.879 15.8-112.4-125.0 154.7 -7.0 40.8 -1.7 48 48 A Y - 0 0 136 -9,-3.1 -9,-0.4 -2,-0.3 3,-0.1 -0.491 57.5 -82.1 -75.2 153.6 -3.5 39.8 -0.7 49 49 A P - 0 0 65 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.303 56.2-102.2 -59.1 143.0 -3.5 37.5 2.3 50 50 A F - 0 0 42 -12,-0.1 2,-0.4 14,-0.1 -12,-0.1 -0.447 34.8-169.8 -70.8 136.9 -3.8 39.4 5.6 51 51 A K - 0 0 127 -14,-0.4 -14,-0.2 -2,-0.2 13,-0.1 -0.964 20.6-131.7-130.1 112.0 -0.7 40.0 7.7 52 52 A V - 0 0 17 11,-0.6 -16,-0.2 -2,-0.4 -17,-0.1 -0.254 27.1 -99.2 -65.9 147.0 -1.3 41.3 11.2 53 53 A N >> - 0 0 26 -18,-2.1 4,-1.9 1,-0.2 3,-1.9 -0.518 30.6-140.6 -61.5 121.3 0.6 44.3 12.6 54 54 A P H 3> S+ 0 0 38 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.902 101.8 59.6 -53.7 -40.5 3.3 42.6 14.8 55 55 A Q H 34 S+ 0 0 6 1,-0.2 4,-0.1 2,-0.2 -20,-0.1 0.660 107.4 47.0 -63.0 -17.8 2.8 45.4 17.4 56 56 A F H X> S+ 0 0 0 -3,-1.9 3,-1.5 -22,-0.2 4,-0.7 0.872 110.0 48.3 -91.9 -44.6 -0.8 44.3 17.7 57 57 A K H 3< S+ 0 0 30 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.1 0.617 91.9 81.8 -72.0 -8.4 -0.4 40.5 18.0 58 58 A A T 3< S+ 0 0 7 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.1 0.811 96.9 44.8 -62.4 -27.1 2.3 41.2 20.6 59 59 A W T <4 S- 0 0 2 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.816 126.8 -2.6 -86.2 -36.5 -0.7 41.5 23.0 60 60 A L S < S- 0 0 2 -4,-0.7 2,-1.6 2,-0.1 -1,-0.2 -0.990 72.5 -99.9-156.2 157.3 -2.9 38.6 22.1 61 61 A P S S+ 0 0 25 0, 0.0 2,-0.7 0, 0.0 189,-0.1 -0.249 74.2 121.5 -79.3 51.7 -3.1 35.6 19.6 62 62 A V + 0 0 8 -2,-1.6 -2,-0.1 188,-0.1 3,-0.1 -0.905 24.3 147.2-111.8 97.7 -5.6 37.2 17.2 63 63 A I + 0 0 52 -2,-0.7 -11,-0.6 1,-0.1 -1,-0.1 0.385 59.1 54.8-117.2 4.4 -3.6 37.2 13.9 64 64 A D S S+ 0 0 131 -13,-0.1 -1,-0.1 2,-0.1 -14,-0.1 0.040 86.0 92.8-123.9 24.3 -6.2 36.7 11.1 65 65 A N - 0 0 21 -3,-0.1 3,-0.4 -30,-0.0 18,-0.1 -0.919 53.8-163.8-129.4 109.1 -8.5 39.6 11.9 66 66 A P S S+ 0 0 20 0, 0.0 17,-0.3 0, 0.0 -29,-0.2 -0.224 71.1 41.9 -77.3 173.8 -8.2 43.0 10.3 67 67 A H S S+ 0 0 30 -31,-3.0 2,-0.4 1,-0.2 -30,-0.1 0.774 80.1 138.6 59.9 30.6 -9.9 46.2 11.7 68 68 A C - 0 0 0 -3,-0.4 -33,-3.1 -32,-0.2 2,-0.4 -0.883 33.2-163.4-108.9 140.0 -9.1 45.3 15.3 69 69 A W E -BC 34 81A 5 12,-2.2 12,-3.4 -2,-0.4 2,-0.5 -0.974 12.2-164.5-130.2 136.2 -7.9 47.9 17.7 70 70 A I E -BC 33 80A 0 -37,-2.8 -37,-2.7 -2,-0.4 2,-0.5 -0.961 8.0-171.6-114.0 126.2 -6.2 47.8 21.1 71 71 A V E +BC 32 79A 17 8,-1.9 8,-2.9 -2,-0.5 2,-0.3 -0.979 19.4 161.4-120.8 121.0 -6.3 51.0 23.3 72 72 A A E +B 31 0A 4 -41,-2.7 -41,-3.2 -2,-0.5 5,-0.1 -0.960 36.5 177.5-140.8 156.5 -4.1 50.9 26.4 73 73 A N - 0 0 34 3,-0.4 -50,-0.1 -2,-0.3 -1,-0.1 0.337 54.6-114.9-132.0 -5.4 -2.5 53.0 29.0 74 74 A G S S+ 0 0 1 2,-0.4 -54,-0.2 -55,-0.1 -55,-0.1 0.247 103.8 57.8 90.6 -16.6 -1.0 50.2 31.2 75 75 A T S S+ 0 0 96 -56,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.743 97.0 58.9-110.7 -47.9 -3.0 50.8 34.4 76 76 A D S S- 0 0 97 1,-0.1 -3,-0.4 -60,-0.1 -2,-0.4 -0.343 106.5 -81.1 -77.5 163.1 -6.6 50.5 33.2 77 77 A K - 0 0 121 1,-0.1 -1,-0.1 -5,-0.1 27,-0.1 -0.471 55.4-109.0 -65.5 126.1 -7.9 47.3 31.5 78 78 A P - 0 0 1 0, 0.0 27,-2.5 0, 0.0 2,-0.3 -0.293 31.3-130.8 -59.0 139.1 -6.8 47.4 27.9 79 79 A K E -Cd 71 105A 47 -8,-2.9 -8,-1.9 25,-0.2 2,-0.5 -0.704 17.7-162.8 -92.5 143.4 -9.7 47.9 25.4 80 80 A L E -Cd 70 106A 0 25,-2.5 27,-2.4 -2,-0.3 2,-0.9 -0.938 9.3-162.9-131.4 110.7 -10.1 45.6 22.4 81 81 A I E -Cd 69 107A 0 -12,-3.4 -12,-2.2 -2,-0.5 2,-0.6 -0.846 22.5-162.3 -90.2 109.8 -12.3 46.6 19.5 82 82 A F E - d 0 108A 21 25,-2.8 27,-2.3 -2,-0.9 2,-0.4 -0.886 14.4-132.1-105.3 113.7 -12.8 43.2 17.9 83 83 A Y E + d 0 109A 45 -2,-0.6 27,-0.2 -17,-0.3 -15,-0.1 -0.460 38.7 157.5 -66.2 117.0 -13.9 43.1 14.3 84 84 A R - 0 0 48 25,-3.3 -1,-0.1 -2,-0.4 -2,-0.1 -0.660 18.9-170.5-143.5 79.9 -16.8 40.6 14.0 85 85 A P - 0 0 31 0, 0.0 2,-0.4 0, 0.0 26,-0.1 -0.230 10.6-142.9 -68.5 162.3 -18.9 41.4 11.0 86 86 A V + 0 0 88 24,-0.4 2,-0.2 6,-0.1 5,-0.1 -0.997 40.4 117.0-132.8 133.6 -22.2 39.7 10.4 87 87 A D - 0 0 61 -2,-0.4 3,-0.5 3,-0.4 5,-0.1 -0.821 68.7-104.3 174.5 149.9 -23.6 38.5 7.1 88 88 A F S S+ 0 0 179 -2,-0.2 4,-0.0 1,-0.2 -1,-0.0 0.650 109.7 71.8 -61.7 -15.3 -24.6 35.3 5.3 89 89 A W S S+ 0 0 190 2,-0.0 2,-0.3 1,-0.0 -1,-0.2 0.951 97.9 38.1 -67.9 -53.4 -21.4 35.5 3.2 90 90 A H S S- 0 0 131 -3,-0.5 2,-0.5 1,-0.0 -3,-0.4 -0.746 91.4-101.2-105.9 151.4 -18.8 34.7 5.8 91 91 A K - 0 0 206 -2,-0.3 -3,-0.1 -5,-0.1 -2,-0.0 -0.538 36.1-139.6 -69.9 118.6 -18.8 32.2 8.7 92 92 A V - 0 0 60 -2,-0.5 2,-0.1 -5,-0.1 3,-0.1 -0.705 15.3-150.1 -85.0 115.5 -19.5 34.1 11.9 93 93 A P - 0 0 74 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.387 29.2 -91.4 -79.0 161.5 -17.4 32.8 14.8 94 94 A D - 0 0 127 1,-0.1 3,-0.1 -2,-0.1 0, 0.0 -0.206 56.7 -82.1 -65.3 164.0 -18.6 33.0 18.4 95 95 A E - 0 0 119 1,-0.2 -1,-0.1 -3,-0.1 -11,-0.0 -0.418 69.9 -71.7 -66.2 146.4 -17.7 36.1 20.4 96 96 A P + 0 0 27 0, 0.0 -1,-0.2 0, 0.0 10,-0.1 -0.132 67.8 158.1 -41.7 118.6 -14.1 35.9 21.9 97 97 A N + 0 0 122 -3,-0.1 2,-0.2 4,-0.0 -2,-0.1 0.086 30.1 108.0-137.2 23.6 -14.5 33.3 24.7 98 98 A E S >> S- 0 0 110 1,-0.0 3,-1.4 -93,-0.0 4,-0.6 -0.482 86.9 -86.5 -96.7 173.8 -10.9 32.0 25.2 99 99 A Y G >4 S+ 0 0 40 1,-0.3 3,-0.7 2,-0.2 4,-0.3 0.803 125.0 54.1 -49.3 -38.2 -8.6 32.6 28.2 100 100 A W G >4 S+ 0 0 8 1,-0.2 3,-1.6 2,-0.2 4,-0.3 0.789 90.6 74.9 -72.8 -24.0 -7.2 35.9 26.8 101 101 A A G X4 S+ 0 0 11 -3,-1.4 3,-1.5 1,-0.3 -1,-0.2 0.847 87.3 63.2 -55.2 -34.8 -10.7 37.4 26.2 102 102 A D G << S+ 0 0 123 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.736 92.7 63.1 -63.7 -24.1 -11.0 38.1 30.0 103 103 A Y G < S+ 0 0 71 -3,-1.6 2,-0.3 -4,-0.3 -1,-0.3 0.503 99.1 63.3 -82.8 -0.4 -8.0 40.4 30.0 104 104 A F S < S- 0 0 5 -3,-1.5 2,-1.1 -4,-0.3 -25,-0.2 -0.884 78.4-125.6-125.7 155.9 -9.6 43.0 27.7 105 105 A D E -d 79 0A 78 -27,-2.5 -25,-2.5 -2,-0.3 2,-0.5 -0.851 46.0-151.9 -94.6 97.8 -12.6 45.3 27.8 106 106 A I E -d 80 0A 44 -2,-1.1 2,-0.4 -27,-0.2 -25,-0.2 -0.665 23.3-179.4 -86.5 121.5 -14.1 44.0 24.5 107 107 A E E -d 81 0A 60 -27,-2.4 -25,-2.8 -2,-0.5 2,-0.3 -0.945 25.9-131.7-112.0 133.6 -16.2 46.1 22.1 108 108 A L E -d 82 0A 63 -2,-0.4 2,-0.5 -27,-0.2 -25,-0.2 -0.699 13.8-154.7 -89.9 139.7 -17.5 44.3 19.0 109 109 A L E +d 83 0A 1 -27,-2.3 -25,-3.3 -2,-0.3 6,-0.1 -0.962 15.4 177.8-115.9 120.6 -17.1 46.0 15.6 110 110 A V S S+ 0 0 64 -2,-0.5 -24,-0.4 1,-0.3 -1,-0.1 0.676 74.6 27.0 -94.0 -22.3 -19.6 45.1 12.8 111 111 A K S > S- 0 0 106 -26,-0.1 3,-1.9 1,-0.1 -1,-0.3 -0.994 74.5-129.8-142.4 135.9 -18.3 47.5 10.1 112 112 A P G > S+ 0 0 47 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.826 106.3 55.8 -52.0 -39.2 -14.8 49.0 9.7 113 113 A D G 3 S+ 0 0 121 1,-0.2 3,-0.2 2,-0.1 0, 0.0 0.282 93.4 71.6 -82.7 14.3 -16.0 52.6 9.4 114 114 A Q G < + 0 0 55 -3,-1.9 -1,-0.2 1,-0.1 4,-0.2 0.101 69.2 95.3-111.7 21.2 -17.8 52.4 12.7 115 115 A V X> + 0 0 6 -3,-0.9 3,-1.1 1,-0.2 4,-0.8 0.701 63.1 76.4 -85.4 -21.0 -14.7 52.4 14.9 116 116 A E G >4 S+ 0 0 110 1,-0.3 3,-0.8 -3,-0.2 -1,-0.2 0.894 93.1 51.1 -58.6 -42.8 -14.5 56.1 15.6 117 117 A K G 34 S+ 0 0 160 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.650 108.8 53.2 -71.0 -13.4 -17.3 56.1 18.2 118 118 A L G <4 S+ 0 0 44 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.2 0.573 97.9 78.2 -96.0 -10.9 -15.6 53.2 20.1 119 119 A L S << S- 0 0 13 -3,-0.8 4,-0.1 -4,-0.8 -48,-0.0 -0.326 101.0 -62.4 -90.6 174.5 -12.2 54.9 20.4 120 120 A P - 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0 0 50 -17,-0.4 -15,-2.8 -19,-0.3 2,-0.6 -0.712 66.9-165.1 -85.1 101.9 1.1 61.0 16.7 144 144 A M B -e 128 0A 41 -2,-1.1 3,-0.2 1,-0.2 -15,-0.2 -0.805 63.5 -39.5 -93.9 117.0 1.9 58.5 14.0 145 145 A N S S- 0 0 48 -17,-3.1 -1,-0.2 -2,-0.6 -16,-0.1 0.848 77.5-145.0 34.8 53.9 4.2 55.6 15.1 146 146 A P >> - 0 0 26 0, 0.0 4,-2.1 0, 0.0 3,-1.1 -0.248 8.0-130.6 -51.0 124.6 6.2 58.0 17.3 147 147 A E H 3> S+ 0 0 124 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.848 103.4 55.3 -45.5 -49.6 9.8 56.7 17.1 148 148 A P H 3> S+ 0 0 54 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.859 110.8 45.8 -58.7 -31.6 10.5 56.7 20.8 149 149 A V H <> S+ 0 0 0 -3,-1.1 4,-2.0 2,-0.2 5,-0.3 0.900 112.9 49.7 -76.4 -39.6 7.4 54.5 21.4 150 150 A M H X S+ 0 0 36 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.955 111.5 48.7 -60.9 -50.9 8.3 52.1 18.6 151 151 A N H X S+ 0 0 24 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.855 109.0 54.7 -58.0 -38.0 11.9 51.8 19.9 152 152 A F H X S+ 0 0 0 -4,-1.4 4,-2.1 -5,-0.3 -1,-0.2 0.956 112.7 38.9 -62.6 -55.4 10.7 51.1 23.5 153 153 A Y H X S+ 0 0 8 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.917 116.9 52.4 -63.0 -42.2 8.4 48.2 22.7 154 154 A H H >X S+ 0 0 46 -4,-2.7 4,-0.7 -5,-0.3 3,-0.6 0.948 107.3 51.8 -60.5 -46.7 10.9 46.9 20.1 155 155 A Y H >< S+ 0 0 20 -4,-2.9 3,-1.1 1,-0.3 192,-0.2 0.924 112.9 44.9 -54.4 -48.5 13.7 46.9 22.7 156 156 A H H >< S+ 0 0 13 -4,-2.1 3,-1.6 1,-0.2 -1,-0.3 0.705 95.1 76.7 -72.0 -17.3 11.6 45.0 25.2 157 157 A R H << S+ 0 0 7 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.787 83.2 68.7 -62.0 -25.4 10.4 42.5 22.6 158 158 A A T << S+ 0 0 0 -3,-1.1 2,-0.8 -4,-0.7 205,-0.3 0.782 89.8 69.3 -64.8 -24.4 13.9 41.0 22.9 159 159 A Y S < S- 0 0 41 -3,-1.6 2,-0.3 -4,-0.2 203,-0.2 -0.841 82.8-148.6-101.1 103.5 12.9 39.8 26.4 160 160 A K - 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