==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOHYDROLASE 29-FEB-96 1FKX . COMPND 2 MOLECULE: ADENOSINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR D.K.WILSON,F.A.QUIOCHO . 348 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13468.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 267 76.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 12.6 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 . 19 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 38.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.9 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 2 1 2 2 1 1 1 2 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 2 1 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 1 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 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 0 154 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 79.7 -9.1 32.3 14.0 2 5 A P - 0 0 55 0, 0.0 2,-4.4 0, 0.0 303,-0.1 -0.157 360.0-122.7-100.0 45.1 -6.6 32.0 17.0 3 6 A A S S+ 0 0 16 1,-0.1 2,-0.3 2,-0.1 299,-0.0 -0.078 102.7 25.0 54.5 -58.7 -8.6 33.7 19.8 4 7 A F - 0 0 1 -2,-4.4 2,-1.7 2,-0.1 -1,-0.1 -0.719 67.5-179.7-136.9 86.7 -5.7 36.2 20.4 5 8 A N + 0 0 131 -2,-0.3 -2,-0.1 3,-0.0 86,-0.1 -0.335 55.8 92.0 -82.6 54.1 -3.6 36.6 17.3 6 9 A K S S- 0 0 57 -2,-1.7 342,-0.1 1,-0.1 -2,-0.1 -0.957 89.6 -65.7-142.5 159.2 -1.3 39.1 19.0 7 10 A P - 0 0 20 0, 0.0 2,-0.3 0, 0.0 85,-0.2 0.007 55.5-166.6 -44.7 144.0 2.0 38.8 21.0 8 11 A K E -a 92 0A 13 83,-1.1 85,-2.7 -3,-0.0 86,-1.1 -0.905 18.8-140.6-135.5 167.0 1.8 36.9 24.3 9 12 A V E -a 94 0A 2 -2,-0.3 2,-0.6 83,-0.2 280,-0.3 -0.998 14.7-158.9-129.6 123.4 3.8 36.3 27.4 10 13 A E E +a 95 0A 0 84,-2.5 86,-2.1 -2,-0.4 3,-0.1 -0.931 19.2 166.6-111.9 123.8 3.9 32.9 29.0 11 14 A L E + 0 0 0 -2,-0.6 2,-0.4 84,-0.2 -1,-0.1 0.621 65.0 52.7-106.9 -13.5 4.9 32.6 32.7 12 15 A H E + 0 0 0 246,-0.1 280,-2.4 277,-0.1 2,-0.3 -0.739 65.5 116.0-135.6 89.9 3.9 29.1 33.6 13 16 A V E -ab 97 292A 0 83,-0.7 85,-2.1 -2,-0.4 2,-0.5 -0.982 48.9-133.6-152.7 133.5 5.0 26.1 31.5 14 17 A H E > -a 98 0A 22 278,-3.2 3,-1.5 -2,-0.3 85,-0.2 -0.801 9.6-146.7 -90.7 132.5 7.3 23.0 32.3 15 18 A L G > S+ 0 0 0 83,-3.0 3,-2.2 -2,-0.5 84,-0.1 0.938 101.3 50.8 -62.3 -49.8 10.0 22.1 29.8 16 19 A D G 3 S+ 0 0 11 82,-0.3 -1,-0.3 1,-0.3 3,-0.2 0.421 108.6 57.5 -69.8 3.9 9.7 18.4 30.4 17 20 A G G < S+ 0 0 0 -3,-1.5 278,-2.1 275,-0.2 279,-0.6 0.186 102.7 53.4-116.2 13.6 6.0 18.8 29.9 18 21 A A S < S+ 0 0 3 -3,-2.2 2,-0.3 276,-0.2 -1,-0.2 -0.361 72.2 134.7-146.9 55.6 6.3 20.3 26.4 19 22 A I - 0 0 8 -3,-0.2 60,-0.0 64,-0.0 -3,-0.0 -0.711 59.5-106.5-104.6 152.9 8.3 17.9 24.3 20 23 A K >> - 0 0 77 -2,-0.3 4,-2.1 1,-0.1 3,-0.7 -0.673 19.1-134.1 -78.3 134.8 7.4 16.8 20.8 21 24 A P H 3> S+ 0 0 9 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.864 107.9 60.5 -57.4 -28.8 6.1 13.2 20.7 22 25 A E H 3> S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.847 104.0 46.0 -64.8 -41.1 8.5 12.9 17.7 23 26 A T H <> S+ 0 0 0 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.916 111.9 52.7 -69.8 -39.2 11.6 13.7 19.8 24 27 A I H X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.940 111.4 46.8 -58.8 -48.3 10.4 11.3 22.5 25 28 A L H >X S+ 0 0 28 -4,-2.7 4,-1.8 1,-0.2 3,-0.5 0.946 109.3 55.6 -61.1 -44.3 10.0 8.6 19.9 26 29 A Y H 3X S+ 0 0 97 -4,-2.2 4,-2.2 1,-0.3 -2,-0.2 0.909 110.3 42.0 -59.1 -47.0 13.5 9.4 18.4 27 30 A F H 3X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 6,-0.3 0.703 106.1 64.0 -76.5 -17.2 15.4 9.0 21.6 28 31 A G H S+ 0 0 2 -4,-1.3 5,-2.2 -3,-0.5 4,-1.0 0.989 111.9 35.7 -66.0 -53.5 13.5 5.9 22.6 29 32 A K H ><5S+ 0 0 158 -4,-1.8 3,-1.0 1,-0.2 -2,-0.2 0.962 116.1 55.6 -61.0 -52.0 14.8 4.0 19.6 30 33 A K H 3<5S+ 0 0 106 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.791 119.2 30.9 -53.0 -37.1 18.2 5.7 19.7 31 34 A R H 3<5S- 0 0 80 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.439 106.5-119.4-104.0 -2.4 18.9 4.6 23.3 32 35 A G T <<5 + 0 0 68 -4,-1.0 2,-0.4 -3,-1.0 -3,-0.2 0.886 62.1 149.0 67.2 35.5 16.9 1.4 23.3 33 36 A I < - 0 0 50 -5,-2.2 -1,-0.3 -6,-0.3 2,-0.2 -0.861 48.3-112.0-104.4 139.4 14.6 2.6 26.0 34 37 A A - 0 0 91 -2,-0.4 34,-0.1 -3,-0.1 -5,-0.0 -0.513 29.6-171.5 -77.2 133.9 11.0 1.4 26.1 35 38 A L - 0 0 29 -2,-0.2 30,-0.1 -10,-0.0 29,-0.1 -0.781 35.9-115.5-115.0 163.1 8.1 3.6 25.3 36 39 A P S S+ 0 0 51 0, 0.0 2,-0.3 0, 0.0 29,-0.1 0.386 98.6 15.8 -80.3 4.5 4.4 2.7 25.8 37 40 A A - 0 0 10 9,-0.0 -2,-0.0 7,-0.0 3,-0.0 -0.942 58.7-144.1-169.3 153.8 3.9 3.1 22.0 38 41 A D S S+ 0 0 117 -2,-0.3 2,-0.4 -3,-0.0 3,-0.1 0.094 81.5 72.8-115.7 24.9 5.9 3.3 18.7 39 42 A T S > S- 0 0 70 1,-0.1 4,-2.6 -14,-0.0 5,-0.2 -0.998 78.8-131.7-137.7 132.2 3.7 5.7 16.9 40 43 A V H > S+ 0 0 23 -2,-0.4 4,-2.4 1,-0.2 5,-0.1 0.899 107.5 54.1 -54.7 -37.2 3.5 9.4 17.7 41 44 A E H > S+ 0 0 113 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.960 113.4 37.0 -62.6 -57.6 -0.3 9.1 17.6 42 45 A E H > S+ 0 0 93 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.804 113.3 59.3 -68.7 -22.8 -0.7 6.3 20.1 43 46 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 3,-0.4 0.935 103.7 52.7 -67.2 -37.4 2.1 7.8 22.1 44 47 A R H X S+ 0 0 95 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.764 109.3 49.8 -65.2 -28.4 -0.1 10.9 22.3 45 48 A N H < S+ 0 0 77 -4,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.726 112.1 44.6 -84.2 -25.9 -2.9 8.8 23.6 46 49 A I H < S+ 0 0 42 -4,-1.5 -2,-0.2 -3,-0.4 -3,-0.2 0.931 125.6 33.0 -80.0 -48.7 -0.9 7.0 26.3 47 50 A I H < S+ 0 0 2 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.945 108.1 79.3 -71.2 -49.6 0.8 10.2 27.5 48 51 A G S < S- 0 0 5 -4,-1.6 2,-0.4 -5,-0.4 249,-0.2 0.011 76.2-125.3 -58.5 162.3 -2.1 12.6 26.8 49 52 A M - 0 0 7 247,-1.3 -1,-0.1 1,-0.1 -3,-0.1 -0.951 21.4-178.9-115.0 134.9 -5.1 13.1 29.0 50 53 A D S S+ 0 0 109 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.913 70.9 7.2 -94.0 -60.7 -8.7 12.8 27.8 51 54 A K S S- 0 0 132 1,-0.1 -1,-0.3 214,-0.1 214,-0.1 -0.756 106.5 -57.6-118.4 169.9 -10.9 13.5 30.7 52 55 A P + 0 0 53 0, 0.0 214,-0.2 0, 0.0 213,-0.2 -0.149 54.1 170.3 -52.2 133.2 -10.0 14.8 34.2 53 56 A L - 0 0 80 212,-2.5 2,-0.3 1,-0.1 213,-0.1 0.301 36.7 -98.1-108.9-119.4 -7.5 12.6 36.2 54 57 A S > - 0 0 52 1,-0.1 4,-2.5 -2,-0.0 5,-0.2 -0.861 33.7 -92.0-155.3-178.7 -6.0 13.9 39.4 55 58 A L H > S+ 0 0 5 -2,-0.3 4,-3.2 2,-0.2 5,-0.2 0.983 128.5 41.3 -70.4 -53.9 -2.7 15.6 40.3 56 59 A P H > S+ 0 0 57 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.802 115.8 54.5 -61.6 -27.0 -0.9 12.3 41.2 57 60 A G H > S+ 0 0 17 2,-0.2 4,-0.6 1,-0.1 3,-0.4 0.944 111.8 41.3 -70.8 -47.2 -2.6 10.9 38.1 58 61 A F H >< S+ 0 0 9 -4,-2.5 3,-1.5 1,-0.2 4,-0.5 0.940 110.0 58.3 -65.0 -45.8 -1.3 13.6 35.8 59 62 A L H >< S+ 0 0 50 -4,-3.2 3,-0.7 1,-0.3 4,-0.3 0.757 98.4 62.9 -56.6 -26.9 2.2 13.5 37.5 60 63 A A H >< S+ 0 0 45 -4,-0.9 3,-1.8 -3,-0.4 4,-0.5 0.795 84.2 73.8 -69.4 -31.7 2.4 9.8 36.5 61 64 A K T XX S+ 0 0 33 -3,-1.5 3,-1.1 -4,-0.6 4,-0.5 0.793 84.3 68.1 -55.8 -26.3 2.3 10.5 32.8 62 65 A F H X> S+ 0 0 20 -3,-0.7 4,-3.0 -4,-0.5 3,-1.3 0.856 86.8 69.1 -64.0 -28.9 5.9 11.7 33.0 63 66 A D H <4 S+ 0 0 97 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.795 87.6 65.2 -58.0 -33.6 7.0 8.2 33.8 64 67 A Y H <4 S+ 0 0 102 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.865 123.3 8.1 -59.6 -33.2 6.1 7.1 30.3 65 68 A Y H XX S+ 0 0 0 -3,-1.3 3,-1.5 -4,-0.5 4,-0.7 0.632 98.6 87.7-127.7 -21.2 8.8 9.3 28.8 66 69 A M H >X S+ 0 0 1 -4,-3.0 4,-2.1 1,-0.2 3,-1.5 0.911 85.5 63.9 -52.8 -39.8 11.2 11.0 31.2 67 70 A P H 34 S+ 0 0 34 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.771 97.6 58.9 -55.0 -25.4 13.7 8.1 31.2 68 71 A V H <4 S+ 0 0 2 -3,-1.5 -2,-0.2 1,-0.1 7,-0.1 0.794 114.4 32.7 -74.1 -31.3 14.2 8.7 27.5 69 72 A I H X< S+ 0 0 0 -3,-1.5 3,-1.7 -4,-0.7 7,-0.3 0.909 95.6 95.9 -90.4 -53.6 15.5 12.3 27.9 70 73 A A T 3< S+ 0 0 0 -4,-2.1 35,-0.2 1,-0.3 34,-0.1 0.018 91.6 15.4 -44.1 136.4 17.3 12.1 31.3 71 74 A G T 3 S+ 0 0 12 33,-2.8 2,-0.5 1,-0.1 -1,-0.3 0.524 98.0 108.6 76.8 5.6 21.0 11.5 31.2 72 75 A C X> - 0 0 26 -3,-1.7 4,-2.4 32,-0.2 3,-0.9 -0.870 49.5-165.0-121.4 102.8 21.4 12.4 27.5 73 76 A R H 3> S+ 0 0 86 -2,-0.5 4,-2.7 1,-0.3 5,-0.3 0.908 92.4 52.4 -44.5 -55.8 23.2 15.7 26.7 74 77 A E H 3> S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.849 112.9 47.3 -52.1 -36.4 22.0 15.7 23.1 75 78 A A H <> S+ 0 0 0 -3,-0.9 4,-2.5 -6,-0.2 5,-0.3 0.931 110.7 47.7 -73.7 -48.3 18.4 15.2 24.3 76 79 A I H X S+ 0 0 0 -4,-2.4 4,-1.3 -7,-0.3 -2,-0.2 0.919 115.2 46.9 -61.5 -42.9 18.4 17.8 27.0 77 80 A K H X S+ 0 0 52 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.928 112.8 49.9 -65.0 -42.4 19.9 20.4 24.7 78 81 A R H X S+ 0 0 72 -4,-1.8 4,-3.0 -5,-0.3 5,-0.2 0.900 106.4 51.8 -65.9 -42.9 17.5 19.5 21.8 79 82 A I H X S+ 0 0 4 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.877 110.2 52.3 -63.8 -31.2 14.2 19.7 23.8 80 83 A A H >X S+ 0 0 0 -4,-1.3 4,-1.5 -5,-0.3 3,-0.7 0.964 111.6 44.1 -68.1 -51.2 15.3 23.2 25.0 81 84 A Y H 3X S+ 0 0 79 -4,-2.1 4,-1.6 1,-0.3 3,-0.4 0.956 114.2 51.4 -58.6 -46.9 16.0 24.4 21.4 82 85 A E H 3X S+ 0 0 20 -4,-3.0 4,-1.8 1,-0.2 -1,-0.3 0.707 102.6 60.0 -64.5 -21.2 12.7 22.9 20.2 83 86 A F H <>S+ 0 0 0 -4,-2.5 5,-1.7 2,-0.2 3,-0.5 0.884 107.6 57.8 -65.9 -36.3 6.6 29.1 21.6 88 91 A A H ><5S+ 0 0 28 -4,-3.0 3,-1.5 1,-0.3 -1,-0.2 0.924 106.4 50.1 -59.5 -45.5 7.8 31.2 18.7 89 92 A K H 3<5S+ 0 0 162 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.754 103.7 58.9 -65.6 -25.6 5.1 29.7 16.5 90 93 A E T <<5S- 0 0 35 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.505 119.5-109.9 -81.7 -2.4 2.4 30.3 19.1 91 94 A G T < 5 + 0 0 29 -3,-1.5 -83,-1.1 -4,-0.4 2,-0.5 0.895 66.8 150.1 76.1 38.2 3.2 34.0 18.9 92 95 A V E < -a 8 0A 2 -5,-1.7 -1,-0.3 -85,-0.2 -83,-0.2 -0.912 24.9-177.0-103.1 128.0 4.8 34.2 22.4 93 96 A V E S+ 0 0 17 -85,-2.7 51,-2.3 -2,-0.5 2,-0.3 0.622 72.8 28.6 -99.7 -19.9 7.5 36.9 22.6 94 97 A Y E +ac 9 144A 1 -86,-1.1 -84,-2.5 49,-0.2 2,-0.3 -0.986 68.4 170.8-141.7 135.4 8.6 36.2 26.2 95 98 A V E -ac 10 145A 0 49,-1.7 51,-3.0 -2,-0.3 2,-0.5 -0.999 25.3-151.2-144.0 150.6 8.5 33.0 28.2 96 99 A E E - c 0 146A 0 -86,-2.1 -83,-0.7 -2,-0.3 2,-0.4 -0.983 21.5-163.8-120.2 113.7 9.7 31.6 31.4 97 100 A V E -ac 13 147A 1 49,-2.7 51,-2.6 -2,-0.5 2,-0.3 -0.822 5.1-162.9 -96.0 144.7 10.3 27.8 31.2 98 101 A R E +ac 14 148A 0 -85,-2.1 -83,-3.0 -2,-0.4 -82,-0.3 -0.906 18.8 147.6-127.9 153.5 10.6 25.8 34.4 99 102 A Y E - c 0 149A 2 49,-1.5 51,-2.4 -2,-0.3 79,-0.1 -0.957 46.9-101.0-168.5 167.0 12.0 22.3 35.1 100 103 A S - 0 0 0 -2,-0.3 4,-0.1 49,-0.2 51,-0.1 -0.930 21.3-157.9-101.2 124.7 13.8 20.3 37.7 101 104 A P S >> S+ 0 0 0 0, 0.0 3,-1.3 0, 0.0 4,-0.6 0.893 91.1 55.8 -67.6 -36.2 17.5 19.9 37.0 102 105 A H G >4 S+ 0 0 1 1,-0.3 3,-1.5 2,-0.2 22,-0.0 0.917 97.4 59.8 -63.1 -45.7 17.7 16.8 39.1 103 106 A L G 34 S+ 0 0 30 1,-0.3 -1,-0.3 9,-0.1 -33,-0.2 0.432 110.4 44.9 -63.9 -2.2 15.0 14.8 37.4 104 107 A L G <4 S+ 0 0 1 -3,-1.3 -33,-2.8 -4,-0.1 -1,-0.3 0.486 99.3 87.2-116.6 -9.3 17.0 15.1 34.2 105 108 A A << - 0 0 0 -3,-1.5 17,-0.2 -4,-0.6 3,-0.1 -0.252 49.5-167.7 -84.8 174.0 20.5 14.2 35.6 106 109 A N + 0 0 12 15,-3.1 13,-2.2 1,-0.2 2,-0.3 0.148 69.4 56.2-147.3 18.1 22.2 10.9 36.2 107 110 A S S S+ 0 0 9 14,-0.8 -1,-0.2 11,-0.2 3,-0.1 -0.972 105.9 15.7-151.3 146.0 25.2 11.7 38.4 108 111 A K S S+ 0 0 150 -2,-0.3 2,-0.4 1,-0.2 14,-0.0 0.775 95.4 117.5 58.9 28.3 25.4 13.4 41.7 109 112 A V - 0 0 14 13,-0.0 -1,-0.2 4,-0.0 3,-0.2 -0.973 54.2-140.4-125.2 143.2 21.7 12.9 42.3 110 113 A D S S+ 0 0 129 -2,-0.4 2,-0.1 1,-0.4 47,-0.0 -0.930 87.6 31.6-153.8 121.3 20.2 10.9 45.1 111 114 A P S S- 0 0 61 0, 0.0 -1,-0.4 0, 0.0 0, 0.0 0.505 100.4-122.0 -74.6 150.1 17.8 9.1 44.8 112 115 A M > - 0 0 51 -3,-0.2 3,-1.1 -2,-0.1 -2,-0.1 -0.368 27.5-128.5 -62.9 112.6 18.6 8.3 41.2 113 116 A P G > S+ 0 0 12 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 -0.278 81.9 3.6 -63.6 146.3 15.6 9.3 39.1 114 117 A W G 3 S- 0 0 60 1,-0.2 -2,-0.1 2,-0.0 -11,-0.0 0.621 118.2 -75.7 57.3 20.9 14.2 6.7 36.7 115 118 A N G < S+ 0 0 161 -3,-1.1 -1,-0.2 1,-0.1 2,-0.1 0.950 80.8 170.5 56.4 47.4 16.4 3.8 37.7 116 119 A Q < - 0 0 33 -3,-1.1 2,-0.4 -4,-0.1 -1,-0.1 -0.439 33.6-121.1 -83.8 168.8 19.3 5.3 35.8 117 120 A T - 0 0 125 -2,-0.1 -1,-0.0 1,-0.1 0, 0.0 -0.901 47.4 -80.4-112.0 134.3 22.9 4.1 35.9 118 121 A E + 0 0 135 -2,-0.4 -11,-0.2 1,-0.1 2,-0.2 0.021 64.5 158.0 -33.3 128.3 25.6 6.5 37.0 119 122 A G - 0 0 29 -13,-2.2 -11,-0.1 2,-0.1 -1,-0.1 -0.427 52.2 -96.7-133.0-149.1 26.7 8.8 34.2 120 123 A D S S+ 0 0 102 -49,-0.2 2,-1.3 -2,-0.2 -13,-0.1 0.262 82.4 109.2-122.8 2.9 28.3 12.2 33.8 121 124 A V - 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0 0 12 -5,-1.4 2,-0.3 -6,-0.2 -1,-0.2 -0.569 48.1-153.4-114.4 175.3 -3.1 21.5 24.4 300 303 A T >> - 0 0 64 -2,-0.2 4,-1.1 -3,-0.1 3,-0.6 -0.852 42.8 -97.6-140.9 161.5 -1.6 24.6 22.9 301 304 A L H 3> S+ 0 0 2 -2,-0.3 4,-1.5 1,-0.2 3,-0.3 0.892 127.4 56.9 -51.7 -36.8 -1.5 28.2 24.2 302 305 A D H 3> S+ 0 0 45 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.872 93.4 67.9 -62.8 -35.5 -4.4 28.8 22.0 303 306 A T H <> S+ 0 0 42 -3,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.942 104.1 43.8 -47.9 -51.8 -6.4 26.0 23.7 304 307 A D H X S+ 0 0 0 -4,-1.1 4,-2.4 -3,-0.3 -1,-0.2 0.884 114.5 48.1 -64.6 -39.6 -6.5 28.1 26.9 305 308 A Y H X S+ 0 0 1 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.973 111.9 50.1 -65.6 -47.7 -7.4 31.4 25.0 306 309 A Q H X S+ 0 0 38 -4,-3.5 4,-2.4 1,-0.2 5,-0.3 0.831 111.0 51.4 -57.2 -34.1 -10.1 29.6 23.1 307 310 A M H X S+ 0 0 18 -4,-1.8 4,-2.0 -5,-0.3 6,-0.2 0.939 111.5 43.0 -70.9 -50.8 -11.4 28.2 26.4 308 311 A T H < S+ 0 0 0 -4,-2.4 6,-2.4 1,-0.2 -2,-0.2 0.781 116.4 51.8 -67.3 -27.3 -11.7 31.5 28.3 309 312 A K H < S+ 0 0 87 -4,-2.3 4,-0.4 4,-0.2 -2,-0.2 0.979 115.1 37.1 -71.7 -58.8 -13.1 33.1 25.2 310 313 A K H < S+ 0 0 134 -4,-2.4 2,-0.2 -5,-0.2 -2,-0.2 0.978 130.9 24.5 -57.3 -63.0 -15.9 30.6 24.5 311 314 A D S >< S+ 0 0 88 -4,-2.0 3,-0.6 -5,-0.3 2,-0.1 -0.544 126.2 29.5 -96.5 166.3 -16.8 29.9 28.1 312 315 A M T 3 S- 0 0 38 1,-0.2 -1,-0.2 -2,-0.2 -3,-0.1 0.257 106.0-114.0 69.7 -19.4 -16.1 32.5 30.8 313 316 A G T 3 + 0 0 44 -4,-0.4 -4,-0.2 -6,-0.2 -1,-0.2 0.887 47.0 176.8 58.3 51.9 -16.5 35.2 28.2 314 317 A F < - 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0 0 6 -5,-0.3 5,-0.0 1,-0.1 -186,-0.0 -0.512 67.2-100.5 -88.3 147.9 13.0 40.2 34.0 333 336 A P > - 0 0 45 0, 0.0 4,-2.7 0, 0.0 3,-0.4 -0.386 42.7-103.4 -63.0 154.1 15.4 42.9 35.1 334 337 A E H > S+ 0 0 111 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.914 119.4 50.5 -46.1 -55.9 13.9 46.4 35.0 335 338 A E H > S+ 0 0 109 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.878 115.6 42.8 -55.6 -36.6 15.6 47.4 31.7 336 339 A E H > S+ 0 0 49 -3,-0.4 4,-1.7 2,-0.2 -1,-0.3 0.833 111.6 53.9 -78.4 -31.3 14.5 44.3 30.0 337 340 A K H X S+ 0 0 37 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.895 108.2 50.3 -67.2 -40.8 11.0 44.4 31.5 338 341 A K H X S+ 0 0 110 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.946 107.6 54.1 -59.2 -51.3 10.6 48.0 30.1 339 342 A E H X S+ 0 0 95 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.878 109.8 47.9 -51.6 -39.7 11.8 46.8 26.7 340 343 A L H X S+ 0 0 14 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.960 109.8 51.2 -66.9 -50.2 9.0 44.1 26.8 341 344 A L H X S+ 0 0 39 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.879 109.3 51.8 -54.3 -40.2 6.3 46.6 27.9 342 345 A E H X S+ 0 0 122 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.975 110.4 47.8 -59.9 -56.3 7.2 48.9 25.0 343 346 A R H X S+ 0 0 83 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.908 113.3 46.6 -53.3 -50.6 7.0 46.1 22.5 344 347 A L H X S+ 0 0 0 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.975 111.8 50.2 -60.9 -50.4 3.6 44.8 23.7 345 348 A Y H < S+ 0 0 153 -4,-2.5 3,-0.2 -5,-0.2 -1,-0.2 0.878 110.7 51.9 -54.8 -36.2 2.1 48.3 23.8 346 349 A R H < S+ 0 0 159 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.959 114.2 40.5 -65.0 -52.0 3.4 48.9 20.3 347 350 A E H < 0 0 72 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.486 360.0 360.0 -75.7 -7.1 1.8 45.7 18.9 348 351 A Y < 0 0 49 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.514 360.0 360.0 -96.0 360.0 -1.3 46.2 20.9