==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-FEB-05 1WXY . COMPND 2 MOLECULE: ADENOSINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR T.KINOSHITA . 349 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14333.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 279 79.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 28 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 3.7 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 2 0 2 1 1 1 2 0 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 2 3 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 4 A T 0 0 170 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 32.4 81.0 60.6 24.7 2 5 A P - 0 0 72 0, 0.0 3,-0.3 0, 0.0 301,-0.1 -0.435 360.0-144.7 -76.1 127.7 79.1 58.1 27.2 3 6 A A S S+ 0 0 18 299,-0.3 2,-0.3 1,-0.2 300,-0.0 0.793 90.3 15.0 -61.9 -25.6 81.1 57.1 30.3 4 7 A F - 0 0 4 2,-0.1 2,-1.2 315,-0.0 -1,-0.2 -0.818 66.8-170.0-152.2 97.9 79.6 53.6 30.4 5 8 A D + 0 0 135 -3,-0.3 86,-0.1 -2,-0.3 -2,-0.0 -0.389 54.1 99.5 -92.1 54.4 77.8 52.3 27.3 6 9 A K S S- 0 0 55 -2,-1.2 -2,-0.1 1,-0.0 342,-0.1 -0.888 86.8 -70.7-128.1 162.0 76.4 49.2 28.8 7 10 A P - 0 0 32 0, 0.0 2,-0.3 0, 0.0 85,-0.2 -0.319 56.7-165.3 -56.4 145.9 73.0 48.4 30.1 8 11 A K E -a 92 0A 12 83,-2.1 85,-2.9 315,-0.0 86,-1.0 -0.873 16.0-147.1-126.3 159.7 72.2 50.2 33.4 9 12 A V E -a 94 0A 0 -2,-0.3 2,-0.4 83,-0.2 280,-0.4 -0.951 11.2-163.3-125.3 149.6 69.8 50.0 36.3 10 13 A E E +a 95 0A 0 84,-2.4 86,-2.4 -2,-0.3 3,-0.1 -0.997 18.3 169.9-142.6 130.5 68.5 52.9 38.3 11 14 A L + 0 0 0 -2,-0.4 2,-0.2 84,-0.2 279,-0.1 0.375 68.6 58.3-117.6 -8.6 66.8 52.7 41.7 12 15 A H + 0 0 0 277,-0.2 280,-1.9 246,-0.1 2,-0.3 -0.727 65.3 115.0-136.6 87.3 66.7 56.5 42.8 13 16 A V B -j 292 0B 0 83,-0.4 85,-2.4 -2,-0.2 2,-0.7 -0.992 50.2-132.7-157.7 137.0 64.9 58.9 40.5 14 17 A H B > -b 98 0A 17 278,-3.3 3,-1.8 -2,-0.3 85,-0.2 -0.809 3.6-149.2-103.1 118.0 61.8 61.0 40.9 15 18 A L G > S+ 0 0 0 83,-2.0 3,-2.5 -2,-0.7 -1,-0.1 0.903 100.1 54.2 -32.4 -58.4 59.1 61.3 38.4 16 19 A D G 3 S+ 0 0 10 82,-0.3 -1,-0.3 1,-0.3 3,-0.2 0.595 111.2 45.3 -64.8 -14.1 58.2 64.9 39.4 17 20 A G G < S+ 0 0 0 -3,-1.8 278,-2.4 275,-0.2 280,-0.3 0.080 105.6 65.9-111.8 27.2 61.8 65.9 38.9 18 21 A A < + 0 0 1 -3,-2.5 2,-0.4 276,-0.2 -1,-0.1 -0.467 67.4 123.4-134.7 55.9 62.0 64.1 35.5 19 22 A I - 0 0 2 -3,-0.2 3,-0.1 63,-0.0 60,-0.0 -0.948 63.3-115.5-110.7 140.9 59.7 66.0 33.3 20 23 A K >> - 0 0 69 -2,-0.4 4,-2.1 1,-0.1 3,-0.7 -0.601 18.6-127.2 -67.4 132.1 60.8 67.5 30.0 21 24 A P H 3>>S+ 0 0 13 0, 0.0 4,-2.1 0, 0.0 5,-0.5 0.951 110.0 60.8 -40.6 -58.2 60.6 71.2 29.9 22 25 A E H 3>5S+ 0 0 95 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.877 106.8 45.0 -32.5 -51.2 58.6 70.8 26.7 23 26 A T H <>5S+ 0 0 1 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.935 112.6 48.2 -74.0 -35.5 55.9 68.9 28.5 24 27 A I H >X5S+ 0 0 0 -4,-2.1 4,-2.5 -3,-0.3 3,-0.6 1.000 114.8 46.7 -59.1 -62.3 55.7 71.2 31.5 25 28 A L H 3X5S+ 0 0 15 -4,-2.1 4,-1.5 1,-0.3 -1,-0.2 0.764 107.5 60.9 -51.6 -23.8 55.5 74.2 29.3 26 29 A Y H 3XS+ 0 0 10 -4,-2.5 5,-1.3 -5,-0.2 4,-0.9 0.933 111.4 33.7 -42.3 -55.6 51.1 75.5 31.0 29 32 A K H ><5S+ 0 0 168 -4,-1.5 3,-1.2 2,-0.2 -2,-0.2 0.980 111.3 61.1 -62.2 -56.9 49.5 76.6 27.7 30 33 A R H 3<5S+ 0 0 150 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.690 124.3 17.6 -50.8 -20.6 47.0 73.8 27.4 31 34 A R H 3<5S- 0 0 98 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.243 104.8-101.1-139.9 16.8 45.4 75.1 30.7 32 35 A G T <<5 + 0 0 68 -3,-1.2 2,-1.1 -4,-0.9 -3,-0.2 0.726 63.2 143.6 78.4 20.9 46.3 78.6 31.7 33 36 A I < - 0 0 42 -5,-1.3 2,-1.3 -6,-0.4 -1,-0.2 -0.658 49.1-132.3 -97.6 95.8 49.0 78.2 34.4 34 37 A A - 0 0 108 -2,-1.1 -1,-0.0 2,-0.1 -5,-0.0 -0.179 26.9-171.4 -69.9 96.4 51.4 81.0 33.9 35 38 A L - 0 0 25 -2,-1.3 2,-0.9 2,-0.1 29,-0.0 -0.087 37.6 -99.7 -59.3 161.1 55.1 79.7 34.0 36 39 A P S S+ 0 0 42 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.231 96.6 7.8 -86.0 48.8 58.3 81.9 34.0 37 40 A A - 0 0 19 -2,-0.9 -2,-0.1 1,-0.1 0, 0.0 -0.776 59.4-132.2 152.9 160.1 59.1 81.6 30.3 38 41 A D S S+ 0 0 126 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 0.588 78.3 63.2-126.7 -4.8 57.8 80.3 27.0 39 42 A T S >> S- 0 0 80 1,-0.1 3,-1.9 0, 0.0 4,-1.5 -0.950 79.6-121.3-115.6 139.6 60.4 78.3 25.2 40 43 A P H 3> S+ 0 0 39 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.843 104.9 60.5 -40.7 -53.1 61.8 75.1 26.5 41 44 A E H 3> S+ 0 0 148 1,-0.2 4,-0.6 2,-0.2 0, 0.0 0.781 106.6 45.4 -45.5 -37.5 65.4 76.1 26.6 42 45 A E H <> S+ 0 0 84 -3,-1.9 4,-3.1 2,-0.2 -1,-0.2 0.911 108.9 56.3 -84.6 -30.7 64.9 78.9 29.0 43 46 A L H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.984 105.1 52.1 -46.4 -60.5 62.6 76.8 31.3 44 47 A Q H < S+ 0 0 41 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.813 112.8 47.9 -52.3 -22.2 65.5 74.4 31.6 45 48 A N H >< S+ 0 0 95 -4,-0.6 3,-0.7 -5,-0.3 -2,-0.2 0.930 119.3 34.3 -81.3 -42.3 67.5 77.3 32.6 46 49 A I H 3< S+ 0 0 53 -4,-3.1 2,-1.2 1,-0.2 -3,-0.2 0.989 121.8 46.8 -66.6 -63.7 65.1 78.9 35.2 47 50 A I T 3< S+ 0 0 1 -4,-1.7 -1,-0.2 -5,-0.2 2,-0.2 -0.021 111.7 68.4 -70.5 34.6 63.8 75.6 36.5 48 51 A G < - 0 0 9 -2,-1.2 2,-0.4 -3,-0.7 249,-0.2 -0.791 66.7-136.9-147.7 178.0 67.4 74.2 36.7 49 52 A M + 0 0 5 247,-0.9 216,-0.1 -2,-0.2 -3,-0.0 -0.964 28.0 170.5-148.6 154.9 70.6 74.6 38.6 50 53 A D S S+ 0 0 111 -2,-0.4 -1,-0.1 1,-0.3 247,-0.0 0.490 74.2 47.7-149.0 12.5 74.4 74.8 38.7 51 54 A K S S- 0 0 130 214,-0.2 -1,-0.3 215,-0.0 2,-0.1 -0.974 99.1 -80.4-127.9 146.6 75.4 75.9 42.2 52 55 A P - 0 0 36 0, 0.0 2,-0.2 0, 0.0 214,-0.2 -0.165 55.4-152.4 -26.9 104.8 74.4 74.6 45.5 53 56 A L - 0 0 49 212,-1.2 2,-0.2 -2,-0.1 -4,-0.0 -0.555 17.1-103.3 -80.9 165.0 71.1 76.2 46.2 54 57 A T > - 0 0 75 -2,-0.2 4,-2.7 1,-0.1 5,-0.1 -0.516 35.5-113.7 -59.9 150.4 69.5 77.0 49.4 55 58 A L H > S+ 0 0 77 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.897 118.1 50.5 -53.6 -51.8 66.7 74.7 50.5 56 59 A P H > S+ 0 0 79 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.967 110.9 50.0 -47.1 -55.2 64.0 77.4 50.1 57 60 A D H > S+ 0 0 92 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.951 112.6 48.9 -52.8 -50.1 65.4 78.1 46.5 58 61 A F H X S+ 0 0 40 -4,-2.7 4,-1.0 2,-0.2 3,-0.4 0.954 110.9 46.7 -52.5 -57.0 65.2 74.4 45.7 59 62 A L H >X S+ 0 0 79 -4,-3.0 4,-1.5 1,-0.2 3,-0.8 0.970 105.2 62.1 -56.2 -43.2 61.7 73.8 46.9 60 63 A A H 3X S+ 0 0 41 -4,-3.0 4,-1.5 -5,-0.3 -1,-0.2 0.895 91.4 65.5 -53.8 -29.3 60.5 76.8 45.1 61 64 A K H >X S+ 0 0 16 -4,-1.5 3,-1.4 -3,-0.4 4,-1.2 0.975 98.9 53.3 -53.6 -45.6 61.5 75.3 41.9 62 65 A F H X S+ 0 0 1 -4,-1.2 3,-1.9 1,-0.2 4,-0.9 0.805 102.7 78.6 -65.1 -38.0 56.4 73.7 37.4 66 69 A M H >X S+ 0 0 0 -4,-1.6 4,-3.3 -5,-0.3 3,-1.1 0.805 87.4 56.7 -51.5 -43.1 54.3 71.4 39.4 67 70 A P H 34 S+ 0 0 24 0, 0.0 -1,-0.3 0, 0.0 5,-0.1 0.675 98.1 63.6 -70.7 -15.8 50.9 73.1 39.0 68 71 A A H <4 S+ 0 0 0 -3,-1.9 -2,-0.2 -4,-0.4 4,-0.1 0.946 119.4 24.4 -59.7 -42.8 51.2 72.8 35.2 69 72 A I H X< S+ 0 0 0 -3,-1.1 3,-0.6 -4,-0.9 7,-0.3 0.854 104.7 85.9 -90.3 -33.9 51.2 69.0 35.6 70 73 A A T 3< S+ 0 0 0 -4,-3.3 2,-0.5 1,-0.2 35,-0.2 -0.354 95.7 21.1 -64.8 144.9 49.5 68.4 38.8 71 74 A G T 3 S+ 0 0 6 33,-2.1 2,-1.5 1,-0.1 -1,-0.2 -0.095 97.4 108.1 87.5 -37.4 45.6 68.1 38.7 72 75 A C X> - 0 0 23 -3,-0.6 4,-2.0 -2,-0.5 3,-1.0 -0.550 59.6-156.9 -75.9 91.1 45.8 67.4 35.0 73 76 A R H 3> S+ 0 0 89 -2,-1.5 4,-1.5 1,-0.2 5,-0.2 0.762 88.8 42.4 -24.7 -51.6 44.9 63.8 34.6 74 77 A D H 3> S+ 0 0 75 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.839 107.1 59.3 -82.2 -22.1 46.6 63.3 31.2 75 78 A A H <> S+ 0 0 0 -3,-1.0 4,-3.1 2,-0.2 5,-0.3 0.891 104.6 55.6 -63.9 -35.7 49.8 65.2 32.0 76 79 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 -7,-0.3 3,-0.2 0.987 111.2 38.4 -51.8 -68.9 50.2 62.7 34.8 77 80 A K H X S+ 0 0 61 -4,-1.5 4,-2.3 1,-0.2 5,-0.2 0.856 118.0 56.3 -55.4 -28.7 50.1 59.6 32.6 78 81 A R H X S+ 0 0 73 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.940 102.3 48.1 -75.9 -38.9 52.0 61.5 30.2 79 82 A I H X S+ 0 0 1 -4,-3.1 4,-2.6 -3,-0.2 -1,-0.2 0.943 111.9 54.5 -65.0 -36.9 54.9 62.4 32.3 80 83 A A H X S+ 0 0 0 -4,-2.7 4,-1.3 -5,-0.3 -1,-0.2 0.943 109.9 45.3 -57.4 -39.5 55.0 58.9 33.2 81 84 A Y H X S+ 0 0 68 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.922 112.9 49.7 -69.4 -40.1 55.2 57.8 29.5 82 85 A E H X S+ 0 0 27 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.916 103.8 62.1 -62.4 -39.3 57.8 60.3 28.7 83 86 A F H X S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.888 101.4 51.4 -48.2 -47.2 59.8 59.1 31.7 84 87 A V H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.2 5,-0.3 0.956 109.8 47.5 -68.0 -46.0 60.2 55.6 30.3 85 88 A E H X S+ 0 0 57 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.943 105.4 59.9 -56.8 -38.5 61.4 56.7 27.0 86 89 A M H X S+ 0 0 50 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.923 108.2 47.6 -55.6 -40.4 63.9 59.1 28.8 87 90 A K H X>S+ 0 0 2 -4,-1.8 5,-1.7 2,-0.2 4,-0.9 0.898 104.7 55.3 -70.9 -42.3 65.4 56.0 30.4 88 91 A A H ><5S+ 0 0 37 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.978 107.1 54.4 -57.2 -40.7 65.6 53.9 27.2 89 92 A K H 3<5S+ 0 0 165 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.861 104.3 54.8 -63.3 -27.9 67.6 56.7 25.9 90 93 A D H 3<5S- 0 0 34 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.691 117.1-110.8 -68.7 -13.1 69.8 56.4 29.0 91 94 A G T <<5 + 0 0 31 -3,-1.8 -83,-2.1 -4,-0.9 2,-0.5 0.590 65.5 151.2 91.3 6.1 70.6 52.7 28.4 92 95 A V E < -a 8 0A 4 -5,-1.7 -1,-0.2 -85,-0.2 -83,-0.2 -0.605 28.4-178.8 -80.7 119.1 68.6 51.5 31.5 93 96 A V E S+ 0 0 35 -85,-2.9 51,-3.3 -2,-0.5 2,-0.3 0.773 78.4 26.5 -87.5 -20.3 67.1 48.1 31.3 94 97 A Y E +ac 9 144A 0 -86,-1.0 -84,-2.4 49,-0.2 2,-0.4 -0.982 66.0 167.0-150.6 128.1 65.5 48.5 34.8 95 98 A V E -ac 10 145A 0 49,-2.2 51,-2.5 -2,-0.3 2,-0.6 -0.995 22.1-154.1-133.5 132.2 64.4 51.5 36.7 96 99 A E E - c 0 146A 0 -86,-2.4 -83,-0.4 -2,-0.4 2,-0.3 -0.989 23.0-161.1-107.8 130.3 62.3 52.0 39.7 97 100 A V E - c 0 147A 0 49,-2.4 51,-1.6 -2,-0.6 2,-0.3 -0.873 3.6-155.7-106.9 144.5 60.8 55.4 39.6 98 101 A R E +bc 14 148A 0 -85,-2.4 -83,-2.0 -2,-0.3 -82,-0.3 -0.914 21.0 140.5-132.2 152.9 59.4 57.4 42.6 99 102 A Y E - c 0 149A 0 49,-1.8 51,-2.8 -2,-0.3 3,-0.1 -0.993 45.9 -95.2-174.2 168.5 56.9 60.0 43.4 100 103 A S > - 0 0 3 -2,-0.3 3,-0.5 1,-0.2 4,-0.3 -0.837 18.3-156.6-108.0 116.8 54.3 61.2 45.7 101 104 A P G > S+ 0 0 0 0, 0.0 3,-2.7 0, 0.0 4,-0.5 0.979 92.9 56.5 -44.1 -70.8 50.8 60.4 44.9 102 105 A H G > S+ 0 0 0 1,-0.3 3,-1.9 2,-0.2 49,-0.0 0.756 98.0 60.0 -23.5 -50.9 49.5 63.3 46.9 103 106 A L G < S+ 0 0 20 -3,-0.5 -1,-0.3 1,-0.3 -33,-0.1 0.402 104.9 47.5 -86.3 9.5 51.5 66.0 45.2 104 107 A L G < S+ 0 0 0 -3,-2.7 -33,-2.1 -4,-0.3 -1,-0.3 0.281 101.4 94.2-112.0 5.5 50.0 65.4 41.7 105 108 A A < + 0 0 0 -3,-1.9 17,-0.2 -4,-0.5 3,-0.1 -0.598 43.9 176.4 -92.6 155.0 46.5 65.4 43.3 106 109 A N + 0 0 16 15,-2.5 2,-0.3 -2,-0.3 3,-0.2 0.499 65.1 63.0-128.5 -0.1 44.1 68.1 43.7 107 110 A S S S+ 0 0 11 14,-2.5 -1,-0.1 1,-0.2 13,-0.1 -0.949 104.3 9.2-120.1 146.2 41.1 66.3 45.3 108 111 A K S S+ 0 0 160 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.924 95.2 117.7 55.5 40.3 40.8 64.5 48.7 109 112 A V - 0 0 9 -3,-0.2 -1,-0.2 13,-0.1 49,-0.0 -0.865 60.3-131.2-141.2 107.6 44.1 65.7 49.8 110 113 A E S S+ 0 0 162 -2,-0.3 2,-0.0 1,-0.3 -3,-0.0 -0.907 95.9 27.0-108.9 123.8 44.5 68.0 52.9 111 114 A P S S- 0 0 66 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 0.371 98.0-123.3 -91.5 153.1 46.1 70.1 52.3 112 115 A I > - 0 0 53 1,-0.1 3,-0.9 -6,-0.1 -6,-0.1 -0.194 37.9-116.5 -54.9 119.8 45.8 70.8 48.5 113 116 A P G > S+ 0 0 5 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.008 78.8 2.3 -59.8 152.1 49.2 70.7 47.0 114 117 A W G 3 S- 0 0 49 1,-0.3 -2,-0.1 -48,-0.0 -44,-0.0 0.665 119.2 -68.1 60.1 12.4 51.0 73.5 45.2 115 118 A N G < S+ 0 0 162 -3,-0.9 -1,-0.3 1,-0.2 -3,-0.1 0.520 91.5 151.4 76.9 2.0 48.4 76.2 45.8 116 119 A Q < - 0 0 30 -3,-2.2 -1,-0.2 1,-0.1 2,-0.2 -0.110 47.0-113.1 -51.6 154.0 45.9 74.5 43.4 117 120 A A - 0 0 82 1,-0.2 -1,-0.1 -10,-0.0 0, 0.0 -0.577 46.6 -79.6 -81.0 162.9 42.2 74.7 43.7 118 121 A E + 0 0 137 -2,-0.2 2,-0.4 1,-0.1 -11,-0.2 0.613 63.0 128.2 -45.7-162.3 40.1 71.7 44.6 119 122 A G - 0 0 37 1,-0.1 -1,-0.1 -3,-0.1 -11,-0.1 -0.876 54.7 -50.9 172.6-157.8 39.1 68.9 42.3 120 123 A D S S+ 0 0 94 -2,-0.4 2,-0.6 -49,-0.1 -1,-0.1 0.419 86.5 86.3-129.7 -13.5 38.5 65.7 40.7 121 124 A L - 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0 0 2 -3,-1.6 -3,-0.1 -4,-0.4 7,-0.0 -0.146 68.8-127.3 -68.2 165.4 66.1 45.7 43.7 331 334 A F S S+ 0 0 6 -124,-0.1 -124,-0.2 6,-0.0 -1,-0.1 0.046 70.2 122.4 -99.9 20.3 62.6 45.4 45.0 332 335 A L S S- 0 0 3 -5,-0.2 5,-0.1 1,-0.1 -186,-0.0 -0.560 75.2 -91.7 -74.1 144.7 61.7 43.1 42.2 333 336 A P > - 0 0 44 0, 0.0 4,-1.5 0, 0.0 5,-0.1 -0.122 43.1-106.2 -45.1 159.2 60.4 39.6 43.0 334 337 A E H > S+ 0 0 124 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.912 117.0 53.2 -74.2 -36.1 63.1 37.0 43.3 335 338 A D H > S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.955 116.7 40.3 -51.3 -49.5 62.3 35.2 40.0 336 339 A E H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.745 107.5 63.9 -72.2 -19.4 62.5 38.5 38.1 337 340 A K H X S+ 0 0 35 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.955 104.4 44.8 -74.4 -36.1 65.4 39.6 40.1 338 341 A K H X S+ 0 0 123 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.888 108.1 57.8 -77.0 -26.8 67.5 36.9 38.8 339 342 A E H X S+ 0 0 107 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.951 106.9 48.7 -59.1 -47.3 66.4 37.4 35.3 340 343 A L H X S+ 0 0 14 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.978 109.9 54.2 -50.2 -53.2 67.6 41.0 35.5 341 344 A L H X S+ 0 0 17 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.889 107.0 48.5 -55.3 -37.1 70.8 39.7 36.8 342 345 A D H X S+ 0 0 81 -4,-2.6 4,-3.2 2,-0.2 5,-0.3 0.938 108.3 53.4 -75.8 -33.4 71.3 37.3 33.9 343 346 A L H X S+ 0 0 87 -4,-2.2 4,-3.0 -5,-0.2 5,-0.3 0.995 110.0 49.7 -51.7 -55.3 70.6 40.0 31.4 344 347 A L H X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.883 111.6 48.8 -55.4 -39.1 73.3 42.1 33.2 345 348 A Y H X S+ 0 0 68 -4,-2.6 4,-0.8 -5,-0.3 -1,-0.2 0.918 110.8 47.6 -65.8 -42.6 75.8 39.2 33.1 346 349 A K H >< S+ 0 0 150 -4,-3.2 3,-0.8 1,-0.2 -2,-0.2 0.940 115.5 46.4 -66.5 -34.6 75.3 38.4 29.5 347 350 A A H 3< S+ 0 0 35 -4,-3.0 -2,-0.2 -5,-0.3 -1,-0.2 0.775 107.6 59.5 -74.2 -21.3 75.6 42.0 28.6 348 351 A Y H 3< 0 0 1 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.526 360.0 360.0 -84.1 -12.0 78.6 42.5 30.8 349 352 A R << 0 0 219 -3,-0.8 -3,-0.0 -4,-0.8 -4,-0.0 -0.560 360.0 360.0-108.8 360.0 80.9 40.1 29.3