==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-APR-12 4ARU . COMPND 2 MOLECULE: HISTIDINE ACID PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HAFNIA ALVEI; . AUTHOR A.ARIZA,O.V.MOROZ,E.B.BLAGOVA,J.P.TURKENBURG,J.VEVODOVA,S.RO . 405 2 4 2 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17100.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 264 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 24 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 31.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.7 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 1 3 0 0 0 0 0 3 1 0 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 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 0 PARALLEL BRIDGES PER LADDER . 2 1 0 2 0 0 0 2 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 . 1 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 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 A 0 0 95 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 158.3 -6.9 -29.6 -14.5 2 5 A P > - 0 0 44 0, 0.0 3,-2.4 0, 0.0 0, 0.0 -0.239 360.0 -77.5 -62.2 152.5 -6.9 -27.6 -17.8 3 6 A A T 3 S+ 0 0 97 1,-0.3 334,-0.3 333,-0.0 3,-0.1 -0.189 119.0 16.0 -47.6 131.6 -3.7 -26.9 -19.7 4 7 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.3 332,-0.1 2,-0.2 0.317 90.6 133.6 89.6 -16.1 -1.9 -24.1 -18.1 5 8 A F < - 0 0 37 -3,-2.4 2,-0.4 331,-0.2 -1,-0.3 -0.532 36.1-164.4 -72.0 142.5 -3.7 -24.1 -14.8 6 9 A Q E -A 335 0A 118 329,-2.8 329,-2.2 -2,-0.2 2,-0.7 -0.991 19.1-133.8-129.7 132.4 -1.6 -23.9 -11.7 7 10 A L E +A 334 0A 12 61,-0.5 327,-0.2 -2,-0.4 3,-0.1 -0.759 26.3 176.2 -84.4 112.9 -2.6 -24.7 -8.1 8 11 A E E - 0 0 68 325,-2.8 2,-0.3 -2,-0.7 -1,-0.2 0.809 58.0 -26.5 -91.4 -35.2 -1.3 -21.8 -6.0 9 12 A R E -A 333 0A 63 324,-1.2 324,-2.9 266,-0.1 2,-0.3 -0.972 51.5-136.4-173.3 167.7 -2.7 -22.8 -2.5 10 13 A V E -Ab 332 293A 0 282,-2.7 284,-2.0 -2,-0.3 2,-0.4 -0.958 0.9-160.3-134.1 147.2 -5.3 -24.6 -0.6 11 14 A V E -Ab 331 294A 2 320,-2.6 320,-3.2 -2,-0.3 2,-0.5 -0.995 15.5-164.9-128.0 122.9 -7.5 -24.0 2.4 12 15 A I E -Ab 330 295A 0 282,-3.1 284,-3.1 -2,-0.4 2,-0.7 -0.944 10.1-166.7-113.8 120.7 -9.0 -27.1 4.1 13 16 A L E -Ab 329 296A 1 316,-2.9 316,-2.4 -2,-0.5 2,-0.4 -0.935 26.0-177.0-107.4 103.6 -11.9 -26.8 6.6 14 17 A S E -Ab 328 297A 2 282,-3.0 284,-3.0 -2,-0.7 314,-0.3 -0.850 27.4-131.0-107.4 139.9 -11.9 -30.3 8.1 15 18 A R E - b 0 298A 0 312,-2.8 284,-0.3 -2,-0.4 311,-0.2 -0.568 41.9-102.8 -71.7 149.2 -14.2 -31.9 10.7 16 19 A H - 0 0 3 282,-1.8 310,-2.0 -2,-0.2 311,-0.3 -0.100 44.7 -92.1 -60.4 169.1 -12.2 -33.7 13.4 17 20 A G - 0 0 2 74,-0.5 -1,-0.1 308,-0.3 34,-0.1 -0.008 63.1 -44.9 -77.8-176.6 -11.9 -37.4 13.4 18 21 A V + 0 0 2 32,-0.2 29,-2.1 307,-0.1 2,-0.3 -0.323 67.9 176.9 -54.9 126.3 -13.8 -40.2 14.9 19 22 A R B -H 46 0B 27 27,-0.3 27,-0.3 -3,-0.1 3,-0.1 -0.882 33.9-101.1-128.5 160.8 -14.7 -39.4 18.5 20 23 A A - 0 0 0 25,-2.2 24,-0.2 22,-0.4 22,-0.1 -0.342 66.1 -70.6 -66.0 159.9 -16.6 -40.8 21.4 21 24 A P - 0 0 3 0, 0.0 23,-1.2 0, 0.0 24,-0.2 -0.266 39.3-132.3 -51.5 142.3 -20.1 -39.3 22.0 22 25 A T S S- 0 0 74 1,-0.3 2,-0.3 21,-0.2 -2,-0.1 0.869 86.6 -4.8 -68.4 -38.1 -19.8 -35.7 23.3 23 26 A K - 0 0 142 21,-0.0 2,-0.5 2,-0.0 -1,-0.3 -0.990 55.5-148.4-149.5 156.7 -22.4 -36.6 25.9 24 27 A M - 0 0 32 -2,-0.3 2,-0.1 -3,-0.1 19,-0.0 -0.907 29.4-163.9-126.0 99.2 -24.6 -39.5 26.9 25 28 A T > - 0 0 45 -2,-0.5 4,-1.9 1,-0.1 5,-0.1 -0.364 32.1-111.2 -81.3 168.7 -27.7 -38.1 28.5 26 29 A Q H > S+ 0 0 121 1,-0.2 4,-3.0 2,-0.2 5,-0.1 0.883 119.6 54.7 -68.9 -34.4 -30.2 -39.9 30.6 27 30 A T H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.920 105.6 52.8 -62.2 -44.4 -32.8 -39.6 27.8 28 31 A M H 4 S+ 0 0 6 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.883 113.5 43.5 -58.9 -39.5 -30.3 -41.3 25.4 29 32 A R H >< S+ 0 0 97 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.956 112.9 52.7 -65.8 -45.8 -29.9 -44.2 27.8 30 33 A D H 3< S+ 0 0 32 -4,-3.0 146,-2.7 1,-0.3 147,-0.3 0.625 93.2 69.5 -70.8 -20.9 -33.7 -44.4 28.5 31 34 A V T 3< S+ 0 0 0 -4,-1.5 -1,-0.3 144,-0.2 143,-0.2 0.433 103.3 45.7 -84.2 4.2 -34.9 -44.6 24.9 32 35 A T < - 0 0 2 -3,-1.3 138,-0.1 2,-0.2 139,-0.1 -0.999 65.8-147.0-139.6 140.6 -33.4 -48.1 24.5 33 36 A P S S+ 0 0 42 0, 0.0 137,-0.1 0, 0.0 2,-0.1 0.616 81.5 89.0 -72.0 -13.5 -33.5 -51.2 26.8 34 37 A H S S- 0 0 57 135,-0.5 2,-0.5 1,-0.1 -2,-0.2 -0.339 84.4-111.9 -84.4 164.4 -30.0 -52.0 25.4 35 38 A Q - 0 0 151 -2,-0.1 195,-0.1 3,-0.0 3,-0.1 -0.883 26.8-121.5 -99.0 130.3 -26.8 -50.8 26.9 36 39 A W - 0 0 17 -2,-0.5 2,-0.0 -4,-0.1 -7,-0.0 -0.447 36.6-108.0 -64.8 138.1 -24.7 -48.3 25.0 37 40 A P - 0 0 43 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.341 31.3-111.4 -71.6 147.1 -21.2 -49.7 24.4 38 41 A E - 0 0 163 -3,-0.1 -3,-0.0 -18,-0.0 -18,-0.0 -0.630 27.7-139.6 -78.2 133.4 -18.3 -48.2 26.3 39 42 A W - 0 0 24 -2,-0.4 4,-0.1 2,-0.2 -1,-0.0 -0.523 15.9-122.9 -87.5 158.6 -15.8 -46.1 24.3 40 43 A P S S+ 0 0 91 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.360 90.1 43.5 -90.4 11.3 -12.0 -46.4 24.9 41 44 A V S S- 0 0 37 4,-0.1 -2,-0.2 1,-0.0 3,-0.1 -0.910 100.0 -72.4-143.2 166.5 -11.6 -42.7 25.6 42 45 A K > - 0 0 133 -2,-0.3 3,-2.5 1,-0.2 -22,-0.4 -0.205 67.9 -80.0 -54.2 147.4 -13.3 -39.9 27.5 43 46 A L T 3 S+ 0 0 78 1,-0.3 -21,-0.2 -4,-0.1 -1,-0.2 -0.222 118.5 16.7 -52.2 136.0 -16.5 -38.6 26.1 44 47 A G T 3 S+ 0 0 4 -23,-1.2 47,-0.3 1,-0.3 -1,-0.3 0.310 96.3 124.1 79.9 -7.6 -15.9 -36.2 23.3 45 48 A Y < - 0 0 89 -3,-2.5 -25,-2.2 -24,-0.2 -1,-0.3 -0.552 66.9-113.8 -82.1 149.1 -12.3 -37.2 22.8 46 49 A I B -H 19 0B 1 -27,-0.3 -27,-0.3 -2,-0.2 -4,-0.1 -0.511 36.9-128.0 -67.2 142.8 -10.9 -38.4 19.4 47 50 A T > - 0 0 0 -29,-2.1 4,-2.5 -2,-0.2 5,-0.2 -0.605 19.7-108.9 -89.1 161.7 -9.9 -42.1 19.6 48 51 A P H > S+ 0 0 85 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.902 124.3 52.2 -57.7 -35.3 -6.6 -43.5 18.6 49 52 A R H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.910 106.2 53.5 -64.7 -41.7 -8.3 -45.0 15.6 50 53 A G H > S+ 0 0 0 -32,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.893 108.8 49.8 -55.6 -44.5 -9.8 -41.6 14.7 51 54 A E H X S+ 0 0 54 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.932 109.9 50.1 -60.2 -45.4 -6.3 -40.2 14.8 52 55 A H H X S+ 0 0 83 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.936 109.4 51.8 -57.2 -46.8 -5.1 -43.0 12.5 53 56 A L H X S+ 0 0 3 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.867 109.1 49.7 -61.4 -39.2 -8.0 -42.4 10.1 54 57 A I H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.901 107.9 54.0 -64.7 -41.7 -7.1 -38.6 10.0 55 58 A S H X S+ 0 0 28 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.878 103.6 56.2 -60.9 -33.8 -3.5 -39.5 9.2 56 59 A L H X S+ 0 0 31 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.921 108.3 48.1 -63.2 -43.1 -4.7 -41.7 6.3 57 60 A M H X S+ 0 0 3 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.918 108.1 54.8 -58.8 -44.3 -6.4 -38.5 5.0 58 61 A G H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.903 107.5 50.2 -54.7 -45.5 -3.2 -36.5 5.5 59 62 A G H X S+ 0 0 23 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.856 110.4 49.9 -60.6 -39.3 -1.3 -39.1 3.4 60 63 A F H X S+ 0 0 8 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.941 109.7 50.1 -66.0 -46.5 -4.0 -38.8 0.7 61 64 A Y H X S+ 0 0 1 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.901 108.1 54.8 -57.6 -40.6 -3.7 -35.0 0.7 62 65 A R H X S+ 0 0 21 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.952 110.5 44.6 -56.6 -49.1 0.1 -35.4 0.5 63 66 A E H X S+ 0 0 70 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.902 115.5 47.7 -65.1 -41.4 -0.2 -37.5 -2.7 64 67 A R H X S+ 0 0 29 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.943 115.5 43.1 -67.2 -47.3 -2.9 -35.1 -4.2 65 68 A F H <>S+ 0 0 0 -4,-3.0 5,-2.1 1,-0.2 6,-1.0 0.833 112.0 53.4 -75.0 -29.4 -1.0 -31.9 -3.6 66 69 A Q H ><5S+ 0 0 26 -4,-2.3 3,-1.5 -5,-0.3 -1,-0.2 0.903 107.2 52.4 -62.3 -43.7 2.4 -33.4 -4.6 67 70 A Q H 3<5S+ 0 0 134 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.865 109.1 50.2 -62.6 -31.1 0.9 -34.4 -7.9 68 71 A Q T 3<5S- 0 0 53 -4,-1.4 -61,-0.5 -5,-0.1 -1,-0.3 0.319 116.9-113.9 -91.0 6.5 -0.4 -30.8 -8.4 69 72 A G T < 5S+ 0 0 58 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.512 87.5 114.1 79.1 6.0 3.1 -29.4 -7.6 70 73 A L S > - 0 0 95 1,-0.1 3,-1.6 -2,-0.0 4,-0.5 -0.534 39.2-118.8 -64.2 139.9 9.4 -26.4 4.2 79 82 A P G >4 S+ 0 0 83 0, 0.0 3,-1.0 0, 0.0 209,-0.1 0.850 110.2 63.0 -64.1 -26.5 7.6 -25.4 7.4 80 83 A D G 34 S+ 0 0 87 1,-0.2 208,-0.4 207,-0.1 212,-0.1 0.773 95.8 64.5 -58.8 -24.9 6.3 -22.0 6.0 81 84 A A G <4 S+ 0 0 8 -3,-1.6 212,-2.4 210,-0.2 211,-2.4 0.781 100.9 48.5 -72.8 -29.6 4.3 -24.1 3.4 82 85 A V E << +c 293 0A 13 -3,-1.0 2,-0.4 -4,-0.5 212,-0.2 -0.953 60.6 173.5-124.9 130.8 1.9 -25.8 5.9 83 86 A Y E -c 294 0A 9 210,-2.3 212,-2.7 -2,-0.4 2,-0.5 -0.995 11.8-161.5-140.0 132.4 -0.1 -24.3 8.7 84 87 A V E -c 295 0A 2 26,-0.4 28,-2.1 -2,-0.4 2,-0.5 -0.965 4.9-174.5-114.3 127.3 -2.7 -25.8 11.0 85 88 A W E -cd 296 112A 20 210,-2.4 212,-2.1 -2,-0.5 2,-0.3 -0.983 17.3-176.2-113.3 114.5 -5.2 -23.9 13.0 86 89 A A E -cd 297 113A 0 26,-2.5 28,-0.5 -2,-0.5 212,-0.2 -0.862 26.8-112.2-110.3 148.1 -7.2 -26.1 15.3 87 90 A D - 0 0 1 210,-2.4 6,-0.2 -2,-0.3 -1,-0.1 -0.215 42.2 -98.2 -65.4 169.3 -10.1 -25.4 17.6 88 91 A V S S+ 0 0 11 31,-0.1 -1,-0.1 4,-0.1 29,-0.1 0.626 88.1 102.3 -68.6 -22.1 -9.4 -25.7 21.4 89 92 A D S > S- 0 0 47 1,-0.1 4,-2.8 4,-0.0 5,-0.3 -0.226 78.8-120.8 -70.4 154.3 -10.9 -29.2 21.9 90 93 A Q H > S+ 0 0 30 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.925 113.6 55.7 -51.6 -45.4 -8.8 -32.3 22.3 91 94 A R H > S+ 0 0 39 -47,-0.3 4,-1.0 1,-0.2 -74,-0.5 0.868 112.7 39.9 -64.2 -36.7 -10.6 -33.8 19.3 92 95 A T H > S+ 0 0 0 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.894 115.1 50.4 -81.4 -41.6 -9.7 -30.9 17.0 93 96 A R H X S+ 0 0 65 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.936 113.5 46.4 -59.4 -46.2 -6.1 -30.4 18.3 94 97 A K H X S+ 0 0 67 -4,-2.9 4,-2.4 -5,-0.3 -1,-0.2 0.832 108.5 55.9 -70.6 -30.0 -5.4 -34.1 17.9 95 98 A T H X S+ 0 0 0 -4,-1.0 4,-2.5 -5,-0.3 -1,-0.2 0.937 106.9 50.4 -60.5 -47.0 -6.9 -34.1 14.4 96 99 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.920 111.9 47.5 -57.1 -45.5 -4.5 -31.3 13.4 97 100 A E H X S+ 0 0 93 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.903 111.7 50.1 -62.6 -38.1 -1.6 -33.3 14.8 98 101 A A H X S+ 0 0 9 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.861 107.5 54.6 -70.3 -35.2 -2.8 -36.4 13.0 99 102 A F H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 3,-0.3 0.955 109.4 47.0 -60.3 -46.4 -3.1 -34.5 9.7 100 103 A L H X S+ 0 0 12 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.895 109.1 54.9 -63.2 -38.8 0.5 -33.3 10.0 101 104 A A H < S+ 0 0 57 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.840 115.8 38.4 -66.1 -31.6 1.7 -36.9 10.8 102 105 A G H < S+ 0 0 11 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.855 119.2 46.3 -83.3 -40.3 -0.0 -38.2 7.6 103 106 A L H < S+ 0 0 0 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.870 134.8 10.3 -65.8 -38.3 0.9 -35.2 5.4 104 107 A A S >< S- 0 0 2 -4,-2.6 3,-1.9 -5,-0.3 -1,-0.2 -0.604 81.1-153.9-149.3 71.6 4.5 -35.1 6.5 105 108 A P T 3 S+ 0 0 76 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 -0.257 79.2 0.6 -59.9 134.2 5.5 -38.1 8.5 106 109 A Q T 3 S+ 0 0 190 1,-0.3 2,-0.4 -5,-0.1 -30,-0.1 0.741 95.4 134.9 61.3 23.1 8.4 -37.5 10.9 107 110 A a < - 0 0 21 -3,-1.9 2,-1.9 -7,-0.2 -1,-0.3 -0.862 66.2-116.0 -96.8 144.8 8.6 -33.8 9.8 108 111 A D + 0 0 171 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.0 -0.528 63.2 138.4 -89.4 81.6 9.0 -31.5 12.8 109 112 A L - 0 0 35 -2,-1.9 2,-0.3 -5,-0.2 -26,-0.1 -0.901 30.2-167.4-121.5 152.0 5.7 -29.6 12.4 110 113 A A - 0 0 75 -2,-0.3 -26,-0.4 -10,-0.0 2,-0.1 -0.968 19.2-114.5-139.3 153.6 3.3 -28.4 15.1 111 114 A I - 0 0 22 -2,-0.3 2,-0.4 -28,-0.1 -26,-0.2 -0.319 19.7-134.1 -80.4 166.2 -0.2 -27.1 15.1 112 115 A H E +d 85 0A 48 -28,-2.1 -26,-2.5 -2,-0.1 2,-0.3 -0.952 31.2 154.7-116.4 149.8 -1.5 -23.7 16.2 113 116 A H E -d 86 0A 65 -2,-0.4 -26,-0.1 -28,-0.2 2,-0.1 -0.965 50.6 -65.5-162.5 167.0 -4.5 -23.0 18.4 114 117 A Q - 0 0 39 -28,-0.5 5,-0.1 -2,-0.3 7,-0.0 -0.423 44.8-130.0 -59.5 138.3 -5.9 -20.4 20.8 115 118 A Q S S+ 0 0 182 1,-0.1 2,-0.9 -2,-0.1 -1,-0.1 0.887 96.5 57.2 -56.1 -51.2 -3.8 -20.1 23.9 116 119 A N > - 0 0 71 1,-0.1 3,-0.8 4,-0.1 -1,-0.1 -0.776 62.7-179.6 -86.8 104.0 -6.6 -20.4 26.3 117 120 A T T 3 S+ 0 0 44 -2,-0.9 -1,-0.1 1,-0.2 4,-0.1 0.519 73.2 70.8 -82.0 -2.7 -8.3 -23.7 25.6 118 121 A Q T 3 S+ 0 0 170 2,-0.1 2,-0.3 -29,-0.0 -1,-0.2 0.281 96.1 59.0 -92.8 -0.6 -10.9 -23.3 28.4 119 122 A Q S < S- 0 0 124 -3,-0.8 -31,-0.1 -5,-0.1 10,-0.1 -0.948 97.2 -90.2-127.0 152.9 -12.7 -20.5 26.4 120 123 A A - 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0 0 69 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.865 20.2-141.8 -92.8 123.7 -32.3 -12.3 17.7 136 139 A K H > S+ 0 0 71 -2,-0.6 4,-2.2 1,-0.2 5,-0.2 0.878 99.6 49.9 -57.3 -44.9 -34.5 -15.1 19.1 137 140 A S H > S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.912 111.0 50.8 -63.2 -37.5 -37.6 -14.2 17.0 138 141 A Q H > S+ 0 0 96 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.873 107.6 53.1 -67.5 -37.2 -35.5 -14.2 13.9 139 142 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.946 109.1 48.4 -58.3 -51.6 -34.0 -17.6 14.6 140 143 A H H X S+ 0 0 77 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.948 115.6 44.7 -57.4 -44.6 -37.5 -19.1 15.0 141 144 A A H X S+ 0 0 62 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.907 112.9 50.5 -68.5 -39.0 -38.6 -17.5 11.7 142 145 A A H X S+ 0 0 17 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.895 110.2 48.9 -68.1 -39.9 -35.5 -18.5 9.8 143 146 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.925 111.0 50.7 -66.3 -41.1 -35.6 -22.1 10.9 144 147 A E H X>S+ 0 0 90 -4,-2.1 4,-2.3 -5,-0.3 5,-0.8 0.923 110.1 50.8 -61.9 -40.6 -39.3 -22.3 9.9 145 148 A K H <5S+ 0 0 176 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.916 110.5 48.2 -61.4 -44.5 -38.4 -20.8 6.5 146 149 A Q H <5S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.909 114.7 45.6 -63.8 -42.2 -35.6 -23.4 6.0 147 150 A A H <5S- 0 0 4 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.805 98.7-139.4 -71.5 -29.0 -37.9 -26.3 7.0 148 151 A G T <5S+ 0 0 64 -4,-2.3 -3,-0.2 -5,-0.2 -4,-0.1 0.538 77.9 56.7 80.4 7.4 -40.8 -24.9 4.7 149 152 A T S - 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