==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JUL-10 2XJE . COMPND 2 MOLECULE: CYTOSOLIC PURINE 5'-NUCLEOTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.WALLDEN,P.NORDLUND . 465 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22241.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 326 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 30 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.4 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 2 0 1 1 2 2 1 1 3 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 PARALLEL BRIDGES PER LADDER . 2 5 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 1 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 3 A T 0 0 126 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.5 -7.5 37.1 33.4 2 4 A S >> - 0 0 18 58,-0.2 4,-2.0 1,-0.1 3,-0.8 -0.667 360.0-109.8-101.9 159.0 -5.9 34.3 35.4 3 5 A W H 3> S+ 0 0 22 -2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.758 121.6 59.6 -54.3 -26.6 -3.0 34.4 37.8 4 6 A S H 3> S+ 0 0 0 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.808 102.7 51.1 -75.0 -29.1 -1.0 32.5 35.1 5 7 A D H <> S+ 0 0 66 -3,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.954 112.1 46.8 -66.3 -54.5 -1.6 35.5 32.7 6 8 A R H X S+ 0 0 90 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.925 116.9 44.5 -45.4 -53.0 -0.3 37.9 35.4 7 9 A L H X S+ 0 0 22 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.871 112.5 50.5 -65.6 -40.5 2.6 35.6 36.0 8 10 A Q H X S+ 0 0 27 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.805 106.6 56.1 -69.0 -28.9 3.3 35.1 32.3 9 11 A N H < S+ 0 0 101 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.815 109.2 44.6 -74.0 -31.6 3.3 38.9 31.7 10 12 A A H < S+ 0 0 23 -4,-1.3 3,-0.5 -5,-0.2 -1,-0.2 0.656 112.9 54.1 -80.0 -19.8 6.0 39.5 34.3 11 13 A A H < S+ 0 0 7 -4,-0.9 217,-0.8 1,-0.2 -2,-0.2 0.684 96.4 64.7 -84.1 -25.7 7.8 36.5 32.7 12 14 A D S < S+ 0 0 110 -4,-1.2 -1,-0.2 215,-0.1 -2,-0.1 0.014 92.7 93.1 -83.8 25.0 7.6 38.1 29.2 13 15 A M S S- 0 0 76 -3,-0.5 216,-0.2 -5,-0.1 2,-0.2 -0.954 73.8-126.3-125.7 139.9 9.9 40.8 30.7 14 16 A P - 0 0 107 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.549 34.5-102.4 -83.4 152.1 13.7 41.2 30.7 15 17 A A - 0 0 37 -2,-0.2 2,-0.7 2,-0.0 7,-0.0 -0.593 24.7-160.2 -76.2 119.4 15.7 41.8 33.9 16 18 A N - 0 0 95 -2,-0.5 -1,-0.0 1,-0.1 0, 0.0 -0.923 9.2-172.2 -95.5 111.3 16.8 45.4 34.5 17 19 A M + 0 0 71 -2,-0.7 2,-0.3 4,-0.1 -1,-0.1 0.123 36.9 128.7-102.3 18.6 19.6 44.9 37.0 18 20 A D > - 0 0 97 1,-0.1 4,-3.0 4,-0.0 3,-0.2 -0.624 64.6-130.6 -68.3 128.8 20.2 48.5 37.9 19 21 A K H > S+ 0 0 170 -2,-0.3 4,-1.0 1,-0.2 -1,-0.1 0.610 107.3 51.5 -61.6 -14.3 20.1 48.7 41.7 20 22 A H H > S+ 0 0 154 2,-0.2 4,-1.5 3,-0.1 -1,-0.2 0.839 111.4 43.2 -90.1 -41.8 17.7 51.7 41.4 21 23 A A H > S+ 0 0 22 2,-0.2 4,-3.0 -3,-0.2 -2,-0.2 0.893 112.1 57.2 -65.2 -41.1 15.2 50.0 39.0 22 24 A L H X S+ 0 0 17 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.949 109.8 41.9 -54.2 -56.9 15.4 46.8 41.2 23 25 A K H < S+ 0 0 102 -4,-1.0 4,-0.2 1,-0.2 -1,-0.2 0.854 115.0 52.2 -58.2 -38.8 14.4 48.5 44.4 24 26 A K H >< S+ 0 0 164 -4,-1.5 3,-1.5 1,-0.2 4,-0.4 0.945 107.4 52.9 -62.6 -48.0 11.7 50.4 42.5 25 27 A Y H >< S+ 0 0 40 -4,-3.0 3,-1.4 1,-0.3 6,-0.4 0.841 103.0 55.8 -53.8 -44.2 10.3 47.2 41.0 26 28 A R T 3< S+ 0 0 29 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.447 88.3 78.9 -77.6 0.1 9.9 45.4 44.4 27 29 A R T < S+ 0 0 167 -3,-1.5 2,-0.3 -4,-0.2 -1,-0.3 0.757 76.4 90.1 -74.1 -26.6 7.7 48.3 45.6 28 30 A E S X S- 0 0 88 -3,-1.4 3,-1.3 -4,-0.4 4,-0.3 -0.562 84.5-130.1 -75.3 135.6 4.9 46.8 43.6 29 31 A A G > S+ 0 0 29 -2,-0.3 3,-1.2 1,-0.3 -1,-0.1 0.858 106.5 56.6 -47.5 -40.4 2.8 44.3 45.6 30 32 A Y G 3 S+ 0 0 74 1,-0.3 411,-0.3 410,-0.1 -1,-0.3 0.756 109.9 40.7 -70.9 -30.0 3.2 41.8 42.7 31 33 A H G < S+ 0 0 21 -3,-1.3 -1,-0.3 -6,-0.4 2,-0.2 0.117 96.4 111.0-106.5 17.3 7.0 41.7 42.7 32 34 A R < - 0 0 121 -3,-1.2 2,-0.5 -4,-0.3 409,-0.4 -0.607 61.5-138.7 -96.7 148.2 7.3 41.7 46.4 33 35 A V - 0 0 4 -2,-0.2 2,-0.3 412,-0.2 407,-0.2 -0.935 25.1-141.4 -97.9 131.1 8.5 39.1 48.8 34 36 A F E -A 439 0A 34 405,-3.1 405,-1.6 -2,-0.5 2,-0.5 -0.736 9.9-138.7 -98.1 142.0 6.3 38.9 52.0 35 37 A V E +A 438 0A 41 -2,-0.3 403,-0.2 403,-0.2 3,-0.1 -0.900 32.9 161.1-110.3 125.4 7.9 38.3 55.5 36 38 A N S S+ 0 0 37 401,-2.9 2,-0.3 -2,-0.5 402,-0.2 0.745 82.2 13.6-101.6 -40.8 6.4 36.1 58.2 37 39 A R S S- 0 0 81 400,-1.6 -1,-0.4 399,-0.1 418,-0.1 -0.994 95.3 -92.2-136.5 146.9 9.7 35.8 60.2 38 40 A S - 0 0 51 -2,-0.3 2,-0.4 419,-0.2 418,-0.2 -0.185 43.5-174.0 -56.8 138.3 12.9 37.7 59.8 39 41 A L E -J 455 0B 0 416,-2.2 416,-2.9 398,-0.0 2,-0.8 -0.952 19.1-150.1-142.0 120.2 15.4 36.2 57.5 40 42 A A E > -J 454 0B 32 -2,-0.4 3,-1.6 414,-0.2 4,-0.5 -0.791 10.9-153.7 -86.1 111.7 18.9 37.3 56.9 41 43 A M G > S+ 0 0 19 412,-3.0 3,-1.0 -2,-0.8 -1,-0.2 0.811 88.7 65.8 -59.7 -27.8 19.6 36.4 53.3 42 44 A E G 3 S+ 0 0 124 411,-0.3 -1,-0.3 410,-0.3 410,-0.1 0.678 92.2 60.3 -70.3 -13.2 23.4 36.2 54.0 43 45 A K G < S+ 0 0 143 -3,-1.6 2,-0.4 299,-0.0 -1,-0.2 0.701 82.3 99.0 -83.2 -19.1 23.0 33.2 56.4 44 46 A I < + 0 0 6 -3,-1.0 300,-0.2 -4,-0.5 299,-0.1 -0.574 39.6 168.9 -71.7 120.7 21.5 31.0 53.6 45 47 A K + 0 0 97 298,-2.5 197,-3.1 -2,-0.4 2,-0.4 0.548 65.8 42.1-108.6 -15.3 24.2 28.8 52.1 46 48 A C E -bc 242 344A 1 297,-2.1 299,-3.2 195,-0.2 2,-0.6 -0.992 61.0-159.7-140.7 126.6 21.8 26.5 50.0 47 49 A F E -bc 243 345A 6 195,-3.4 197,-2.6 -2,-0.4 2,-0.4 -0.922 19.0-162.9-106.8 126.8 18.8 27.4 47.9 48 50 A G E -bc 244 346A 0 297,-3.5 299,-2.8 -2,-0.6 2,-0.3 -0.906 4.7-164.9-118.7 146.0 16.6 24.5 47.4 49 51 A F E -bc 245 347A 0 195,-2.0 197,-3.4 -2,-0.4 2,-0.3 -0.918 17.1-157.6-132.9 146.5 13.9 24.1 44.8 50 52 A N > - 0 0 9 297,-1.1 5,-0.5 -2,-0.3 197,-0.2 -0.795 17.3-148.5-108.2 164.0 11.0 22.0 43.9 51 53 A M T >>> + 0 0 0 -2,-0.3 5,-2.8 3,-0.2 3,-2.1 0.919 66.6 76.1 -99.6 -64.3 9.8 21.8 40.3 52 54 A D B 345S-k 56 0C 13 1,-0.3 297,-0.2 2,-0.2 5,-0.2 -0.413 120.1 -5.1 -64.1 121.2 6.1 21.4 39.8 53 55 A Y T 345S+ 0 0 1 3,-3.1 -1,-0.3 -2,-0.3 4,-0.2 0.564 135.6 62.3 67.3 15.0 4.2 24.6 40.4 54 56 A T T <45S+ 0 0 1 -3,-2.1 389,-0.3 2,-0.3 3,-0.2 0.562 123.2 5.5-121.9 -69.3 7.5 26.2 41.6 55 57 A L T < - 0 0 34 164,-3.1 4,-2.5 -2,-0.1 5,-0.4 -0.376 44.1 -98.8 -60.7 141.3 -0.9 27.7 32.8 60 62 A S T 4 S- 0 0 6 1,-0.2 -58,-0.2 2,-0.2 -55,-0.1 -0.882 89.6 -3.6-122.1 141.8 -4.4 28.3 34.0 61 63 A P T > S+ 0 0 49 0, 0.0 4,-3.3 0, 0.0 -1,-0.2 -0.977 124.2 69.4 -81.7 5.3 -7.2 27.3 33.3 62 64 A E H > S+ 0 0 76 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.849 104.0 38.0 -52.0 -54.2 -5.6 25.2 30.5 63 65 A Y H X S+ 0 0 9 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.890 118.9 48.4 -69.8 -41.8 -3.6 22.6 32.6 64 66 A E H > S+ 0 0 2 -5,-0.4 4,-3.1 2,-0.2 5,-0.2 0.952 112.9 49.9 -60.2 -49.3 -6.4 22.3 35.2 65 67 A S H X S+ 0 0 41 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.942 111.6 47.8 -56.9 -46.8 -8.9 21.9 32.4 66 68 A L H X S+ 0 0 18 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.945 112.7 48.5 -54.8 -50.6 -6.7 19.2 30.8 67 69 A G H X S+ 0 0 6 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.911 112.5 48.8 -61.9 -41.3 -6.3 17.4 34.1 68 70 A F H X S+ 0 0 3 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.881 107.6 55.0 -57.5 -44.9 -10.0 17.5 34.7 69 71 A E H X S+ 0 0 106 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.928 111.0 44.1 -61.5 -45.4 -10.9 16.2 31.2 70 72 A L H X S+ 0 0 11 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.720 110.0 53.4 -70.3 -33.5 -8.7 13.1 31.6 71 73 A T H X S+ 0 0 4 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.916 109.9 49.3 -67.6 -47.3 -9.9 12.2 35.2 72 74 A V H X S+ 0 0 5 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.955 111.9 49.9 -49.6 -50.6 -13.5 12.3 33.9 73 75 A E H X S+ 0 0 95 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.835 111.6 48.1 -65.6 -33.7 -12.3 10.0 31.0 74 76 A R H X S+ 0 0 77 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.892 113.0 47.4 -70.3 -39.8 -10.7 7.7 33.5 75 77 A L H <>S+ 0 0 0 -4,-2.9 5,-2.8 1,-0.2 4,-0.2 0.882 113.6 47.7 -67.3 -34.5 -13.8 7.6 35.7 76 78 A V H ><5S+ 0 0 19 -4,-2.7 3,-0.9 3,-0.2 -1,-0.2 0.873 109.0 54.5 -75.5 -34.2 -16.0 7.0 32.7 77 79 A S H 3<5S+ 0 0 84 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.849 109.1 48.1 -69.2 -36.9 -13.7 4.3 31.4 78 80 A I T 3<5S- 0 0 83 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.429 136.7 -74.7 -82.0 3.3 -14.0 2.4 34.7 79 81 A G T < 5S+ 0 0 62 -3,-0.9 -3,-0.2 1,-0.3 -2,-0.1 0.354 81.2 136.1 130.3 -14.1 -17.8 2.7 34.9 80 82 A Y < - 0 0 19 -5,-2.8 -1,-0.3 -6,-0.2 2,-0.0 -0.374 67.2 -86.4 -68.0 153.9 -19.0 6.1 35.8 81 83 A P > - 0 0 24 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.299 30.4-117.4 -70.5 146.6 -22.0 7.2 33.7 82 84 A Q G > S+ 0 0 133 1,-0.3 3,-1.6 2,-0.2 4,-0.2 0.626 102.9 81.9 -55.4 -19.9 -21.4 8.9 30.3 83 85 A E G > S+ 0 0 80 1,-0.3 3,-2.5 2,-0.2 -1,-0.3 0.823 77.9 71.2 -52.2 -36.3 -23.1 12.1 31.5 84 86 A L G X S+ 0 0 0 -3,-1.9 3,-1.9 1,-0.3 -1,-0.3 0.761 81.8 72.3 -50.2 -33.2 -19.8 13.1 33.1 85 87 A L G < S+ 0 0 89 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.642 91.1 59.3 -58.0 -14.9 -18.4 13.6 29.6 86 88 A S G < S+ 0 0 98 -3,-2.5 -1,-0.3 -4,-0.2 2,-0.2 0.500 82.1 100.4 -97.7 -2.9 -20.6 16.8 29.5 87 89 A F < - 0 0 38 -3,-1.9 2,-0.3 -4,-0.2 75,-0.0 -0.540 53.1-171.1 -68.1 145.9 -18.9 18.4 32.5 88 90 A A - 0 0 69 -2,-0.2 2,-0.2 -20,-0.0 -2,-0.0 -0.965 32.1 -93.9-137.7 149.2 -16.3 21.0 31.6 89 91 A Y - 0 0 29 -2,-0.3 2,-0.5 -24,-0.1 -24,-0.1 -0.433 32.5-162.3 -68.7 134.8 -13.9 22.7 34.1 90 92 A D > - 0 0 61 -2,-0.2 3,-1.0 1,-0.1 -1,-0.0 -0.967 7.4-167.1-121.0 111.7 -14.9 26.1 35.6 91 93 A S T 3 S+ 0 0 63 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.628 82.3 69.3 -77.5 -12.6 -12.1 28.0 37.1 92 94 A T T 3 S+ 0 0 77 1,-0.1 322,-2.1 321,-0.1 323,-0.4 0.659 97.7 51.8 -79.0 -17.2 -14.5 30.4 38.9 93 95 A F S < S+ 0 0 5 -3,-1.0 322,-0.8 320,-0.2 -2,-0.2 0.975 90.0 71.3 -82.3 -65.2 -15.7 27.7 41.4 94 96 A P - 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S 0 188G 63 3,-2.8 3,-1.6 -2,-0.4 2,-0.4 -0.799 66.7 -65.5-130.2 90.2 -29.1 3.2 42.7 186 188 A G T 3 S- 0 0 41 -2,-0.3 -1,-0.1 1,-0.3 -9,-0.1 -0.555 118.1 -14.2 65.5-121.2 -31.2 0.1 43.0 187 189 A D T 3 S+ 0 0 170 -2,-0.4 2,-0.5 -3,-0.1 -1,-0.3 0.243 120.0 93.3 -99.0 12.1 -29.1 -2.4 45.0 188 190 A L E < -S 185 0G 127 -3,-1.6 -3,-2.8 2,-0.0 2,-0.6 -0.909 58.3-161.5-106.3 128.9 -25.9 -0.5 44.6 189 191 A F E -S 184 0G 107 -2,-0.5 2,-0.7 -5,-0.2 -5,-0.2 -0.951 3.0-168.6-113.9 117.1 -24.9 2.0 47.2 190 192 A M E -S 183 0G 35 -7,-3.0 -7,-3.6 -2,-0.6 2,-0.1 -0.901 10.5-159.9-103.1 109.6 -22.3 4.7 46.4 191 193 A S E > -S 182 0G 31 -2,-0.7 4,-2.3 -9,-0.3 -9,-0.3 -0.486 27.8-120.3 -81.0 156.9 -21.0 6.5 49.4 192 194 A Y H > S+ 0 0 2 -11,-2.3 4,-2.4 -89,-0.3 -89,-0.1 0.789 115.9 59.1 -60.7 -32.7 -19.4 9.9 49.1 193 195 A R H > S+ 0 0 98 -12,-0.5 4,-1.9 -91,-0.3 -1,-0.2 0.891 108.8 41.4 -64.1 -42.7 -16.3 8.2 50.7 194 196 A S H > S+ 0 0 45 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.893 114.8 51.5 -75.8 -40.1 -16.1 5.7 47.9 195 197 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.910 109.8 50.9 -55.7 -45.7 -16.8 8.3 45.2 196 198 A F H X S+ 0 0 7 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.931 111.5 47.0 -60.8 -47.1 -14.1 10.5 46.7 197 199 A Q H X S+ 0 0 65 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.908 109.2 53.4 -60.4 -45.7 -11.6 7.6 46.6 198 200 A D H X S+ 0 0 52 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.901 112.5 45.5 -53.7 -46.6 -12.5 6.7 43.0 199 201 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.819 113.3 49.9 -62.6 -33.4 -11.8 10.4 42.1 200 202 A R H X S+ 0 0 27 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.918 112.3 46.1 -81.1 -45.2 -8.6 10.4 44.0 201 203 A D H X S+ 0 0 85 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.848 111.8 53.4 -56.4 -44.7 -7.4 7.2 42.4 202 204 A A H X S+ 0 0 4 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.890 109.2 46.7 -64.5 -42.8 -8.4 8.6 39.0 203 205 A V H X S+ 0 0 8 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.928 114.9 47.6 -60.7 -45.7 -6.4 11.8 39.4 204 206 A D H X S+ 0 0 64 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.927 111.2 51.6 -62.4 -44.0 -3.4 9.8 40.6 205 207 A W H X>S+ 0 0 75 -4,-2.6 4,-3.7 2,-0.2 5,-1.6 0.872 108.6 50.3 -59.8 -43.3 -3.9 7.4 37.7 206 208 A V H <5S+ 0 0 1 -4,-2.4 6,-1.1 3,-0.2 7,-0.5 0.885 113.6 46.2 -62.7 -40.7 -3.9 10.3 35.2 207 209 A H H <5S+ 0 0 31 -4,-2.1 -2,-0.2 -5,-0.2 6,-0.2 0.917 129.6 22.5 -67.6 -41.8 -0.7 11.7 36.7 208 210 A Y H <5S+ 0 0 163 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.807 138.3 15.3-101.2 -32.8 1.0 8.2 36.8 209 211 A K T <5S+ 0 0 168 -4,-3.7 -3,-0.2 -5,-0.2 -4,-0.1 0.429 112.8 67.7-126.1 -7.8 -0.5 5.8 34.2 210 212 A G S S+ 0 0 29 1,-0.2 4,-3.1 2,-0.1 5,-0.3 0.192 84.5 107.0-117.5 14.0 -1.6 10.7 29.5 212 214 A L H > S+ 0 0 0 -6,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.916 89.4 44.6 -55.7 -46.2 -1.5 14.0 31.3 213 215 A K H > S+ 0 0 38 -7,-0.5 4,-2.2 -3,-0.3 -1,-0.2 0.935 114.9 46.2 -66.7 -47.2 2.4 14.0 31.2 214 216 A E H > S+ 0 0 137 -4,-0.3 4,-0.5 1,-0.2 -2,-0.2 0.955 116.5 46.3 -59.7 -50.0 2.6 13.0 27.5 215 217 A K H >< S+ 0 0 69 -4,-3.1 3,-0.7 1,-0.2 4,-0.4 0.874 112.1 51.1 -58.7 -40.2 -0.1 15.6 26.6 216 218 A T H >< S+ 0 0 0 -4,-2.3 3,-1.1 -5,-0.3 7,-0.3 0.939 110.7 47.2 -64.4 -44.9 1.6 18.3 28.7 217 219 A V H 3< S+ 0 0 33 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.483 103.4 61.9 -79.6 -3.6 5.0 17.9 27.2 218 220 A E T << S+ 0 0 135 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.480 118.3 27.9-103.9 -5.4 3.8 17.8 23.6 219 221 A N S <> S+ 0 0 70 -3,-1.1 4,-1.3 -4,-0.4 3,-0.4 -0.507 73.2 158.6-147.0 74.4 2.5 21.3 23.9 220 222 A L H > S+ 0 0 16 -3,-0.4 4,-3.7 1,-0.2 -2,-0.1 0.839 70.5 58.1 -71.6 -35.5 4.7 22.9 26.5 221 223 A E H 4 S+ 0 0 119 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.783 107.7 49.4 -65.5 -30.7 4.0 26.5 25.5 222 224 A K H 4 S+ 0 0 95 -3,-0.4 -1,-0.2 -6,-0.1 -2,-0.2 0.853 124.0 28.2 -73.0 -38.0 0.3 26.0 26.0 223 225 A Y H < S+ 0 0 24 -4,-1.3 -164,-3.1 -7,-0.3 2,-0.4 0.723 111.7 59.7-104.0 -24.9 0.8 24.4 29.5 224 226 A V B < -L 58 0D 0 -4,-3.7 2,-0.4 -166,-0.3 -166,-0.2 -0.903 68.8-131.8-118.1 136.8 4.0 25.8 31.1 225 227 A V - 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