==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-JUN-06 2HJ3 . COMPND 2 MOLECULE: SULFHYDRYL OXIDASE ERV1P; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR E.VITU,D.FASS . 201 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 145 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 6 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 59.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 0 0 0 0 0 0 2 0 0 0 2 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 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 8 A P 0 0 118 0, 0.0 200,-0.0 0, 0.0 201,-0.0 0.000 360.0 360.0 360.0 153.0 18.4 -40.2 -8.6 2 9 A V - 0 0 36 200,-0.1 2,-0.1 4,-0.0 200,-0.0 0.930 360.0-152.5 52.2 98.9 16.3 -39.5 -5.5 3 10 A T > - 0 0 69 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.348 35.5 -90.8 -90.8 175.3 12.9 -41.3 -5.8 4 11 A K H > S+ 0 0 98 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.862 130.4 50.6 -53.3 -36.6 9.6 -40.3 -4.2 5 12 A E H > S+ 0 0 101 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.883 106.6 50.9 -71.7 -40.7 10.7 -42.4 -1.2 6 13 A D H > S+ 0 0 66 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.894 111.9 49.1 -64.0 -39.4 14.1 -40.8 -0.8 7 14 A L H X S+ 0 0 5 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.959 111.4 49.6 -63.1 -51.2 12.5 -37.4 -0.8 8 15 A G H X S+ 0 0 10 -4,-2.1 4,-2.9 -5,-0.2 5,-0.2 0.914 111.6 47.3 -53.8 -49.9 9.9 -38.4 1.7 9 16 A R H X S+ 0 0 146 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.872 113.9 47.8 -61.8 -40.1 12.5 -39.9 4.1 10 17 A A H X S+ 0 0 11 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.949 114.5 45.6 -66.0 -49.5 14.8 -36.9 3.9 11 18 A T H X S+ 0 0 5 -4,-3.0 4,-3.6 2,-0.2 5,-0.2 0.921 110.9 51.3 -62.1 -46.1 11.9 -34.4 4.4 12 19 A W H X S+ 0 0 45 -4,-2.9 4,-3.6 -5,-0.2 5,-0.5 0.938 109.5 51.9 -57.9 -44.1 10.4 -36.3 7.4 13 20 A T H X S+ 0 0 30 -4,-1.9 4,-2.0 -5,-0.2 5,-0.2 0.926 113.6 44.2 -56.1 -46.1 13.8 -36.4 9.0 14 21 A F H X S+ 0 0 3 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.954 117.7 44.2 -64.0 -51.3 14.1 -32.6 8.5 15 22 A L H X S+ 0 0 4 -4,-3.6 4,-2.4 2,-0.2 5,-0.2 0.959 117.6 42.0 -61.5 -53.5 10.5 -32.0 9.7 16 23 A H H X S+ 0 0 9 -4,-3.6 4,-1.4 1,-0.2 -1,-0.2 0.880 115.1 51.0 -64.2 -35.5 10.5 -34.3 12.7 17 24 A T H X S+ 0 0 11 -4,-2.0 4,-1.0 -5,-0.5 -1,-0.2 0.908 110.4 51.4 -66.5 -37.2 14.0 -33.2 13.7 18 25 A L H >X S+ 0 0 4 -4,-2.3 4,-1.0 1,-0.2 3,-0.6 0.908 109.2 48.2 -63.8 -42.8 12.7 -29.6 13.4 19 26 A A H 3< S+ 0 0 2 -4,-2.4 53,-0.3 1,-0.2 -1,-0.2 0.742 105.6 60.0 -70.4 -21.6 9.7 -30.3 15.7 20 27 A A H 3< S+ 0 0 20 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.779 110.7 40.7 -74.8 -26.1 12.1 -32.0 18.2 21 28 A Q H << S+ 0 0 100 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.551 85.1 122.1 -95.6 -14.4 13.9 -28.6 18.5 22 29 A Y S < S- 0 0 11 -4,-1.0 46,-0.1 46,-0.1 50,-0.1 -0.218 71.7-103.5 -50.4 135.9 10.8 -26.4 18.5 23 30 A P - 0 0 38 0, 0.0 45,-0.6 0, 0.0 -1,-0.1 -0.252 10.9-130.5 -67.6 152.3 10.8 -24.4 21.7 24 31 A E S S+ 0 0 127 1,-0.3 44,-0.1 43,-0.2 45,-0.1 0.944 111.0 26.4 -62.4 -47.9 8.5 -25.1 24.7 25 32 A K S S- 0 0 188 42,-0.1 -1,-0.3 43,-0.1 42,-0.1 -0.817 92.9-163.6-117.7 85.5 7.5 -21.5 24.7 26 33 A P - 0 0 28 0, 0.0 2,-0.1 0, 0.0 -4,-0.0 -0.334 17.4-115.8 -71.0 152.1 7.9 -20.3 21.1 27 34 A T > - 0 0 79 1,-0.1 4,-1.9 -2,-0.0 5,-0.2 -0.297 33.4-100.6 -78.6 170.4 8.0 -16.7 20.1 28 35 A R H > S+ 0 0 232 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.849 123.8 48.1 -61.5 -34.3 5.4 -15.1 17.9 29 36 A Q H > S+ 0 0 94 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.909 107.2 52.9 -75.1 -42.7 7.7 -15.4 14.9 30 37 A Q H > S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.886 111.1 49.1 -59.4 -36.5 8.8 -19.0 15.5 31 38 A K H X S+ 0 0 83 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.934 112.4 48.3 -67.0 -45.0 5.1 -19.9 15.5 32 39 A K H X S+ 0 0 146 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.881 110.7 49.7 -62.9 -41.9 4.5 -17.9 12.3 33 40 A D H X S+ 0 0 3 -4,-3.0 4,-3.1 2,-0.2 -1,-0.2 0.917 108.1 53.2 -66.3 -42.5 7.4 -19.5 10.5 34 41 A V H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.920 113.2 43.4 -58.2 -45.7 6.4 -23.0 11.4 35 42 A K H X S+ 0 0 86 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.898 114.4 49.5 -68.1 -39.4 2.9 -22.4 10.0 36 43 A E H X S+ 0 0 57 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.887 107.2 56.6 -66.2 -37.2 4.3 -20.6 6.9 37 44 A L H X S+ 0 0 2 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.913 107.5 47.4 -60.0 -44.2 6.7 -23.5 6.4 38 45 A M H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.901 112.0 50.0 -65.9 -40.1 3.8 -26.0 6.3 39 46 A T H X S+ 0 0 43 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.932 110.4 50.1 -62.6 -46.3 1.8 -23.8 3.9 40 47 A I H >X S+ 0 0 1 -4,-2.9 4,-3.4 1,-0.2 3,-1.2 0.941 110.6 49.9 -58.1 -47.0 4.8 -23.5 1.6 41 48 A L H 3X S+ 0 0 7 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.869 101.5 62.7 -59.5 -37.3 5.3 -27.3 1.6 42 49 A S H 3< S+ 0 0 9 -4,-2.1 13,-0.3 1,-0.2 -1,-0.3 0.761 118.6 27.6 -61.1 -23.2 1.6 -27.8 0.8 43 50 A R H << S+ 0 0 80 -3,-1.2 -2,-0.2 -4,-0.9 -1,-0.2 0.790 129.4 38.1-102.8 -39.9 2.3 -25.9 -2.5 44 51 A M H < + 0 0 25 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.588 69.0 129.7 -92.8 -15.6 6.0 -26.7 -3.1 45 52 A Y < - 0 0 33 -4,-2.3 2,-1.0 -5,-0.3 6,-0.3 -0.227 64.5-124.3 -48.0 121.3 6.7 -30.3 -2.1 46 53 A P S S+ 0 0 16 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.117 90.7 77.1 -56.2 15.8 8.5 -31.8 -5.1 47 54 A a S > S- 0 0 17 -2,-1.0 4,-2.4 1,-0.2 5,-0.2 -0.925 73.7-147.2-133.2 107.3 6.1 -34.8 -5.6 48 55 A R H > S+ 0 0 214 -2,-0.4 4,-1.5 1,-0.2 3,-0.4 0.865 93.9 34.8 -35.1 -72.3 2.8 -33.7 -7.3 49 56 A E H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.900 115.5 57.4 -57.0 -44.2 0.3 -36.1 -5.6 50 57 A a H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.877 106.1 50.5 -54.8 -40.7 2.1 -36.0 -2.3 51 58 A A H X S+ 0 0 8 -4,-2.4 4,-1.8 -3,-0.4 -1,-0.2 0.842 108.1 52.1 -68.3 -34.6 1.7 -32.2 -2.2 52 59 A D H X S+ 0 0 91 -4,-1.5 4,-2.2 -3,-0.3 -2,-0.2 0.930 110.8 47.5 -67.2 -44.9 -2.0 -32.4 -3.0 53 60 A H H X S+ 0 0 86 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.907 111.1 50.5 -61.9 -43.6 -2.6 -34.8 -0.1 54 61 A F H X S+ 0 0 18 -4,-2.1 4,-2.9 -5,-0.2 -1,-0.2 0.885 108.4 54.1 -61.7 -38.4 -0.5 -32.7 2.3 55 62 A K H X S+ 0 0 73 -4,-1.8 4,-2.3 -13,-0.3 -2,-0.2 0.934 111.0 45.1 -60.8 -47.7 -2.6 -29.7 1.2 56 63 A E H X S+ 0 0 119 -4,-2.2 4,-2.1 2,-0.2 5,-0.3 0.966 114.2 48.0 -59.7 -55.5 -5.8 -31.6 2.0 57 64 A I H X S+ 0 0 15 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.892 112.4 50.0 -53.1 -42.9 -4.5 -32.8 5.4 58 65 A L H < S+ 0 0 23 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.886 107.4 55.0 -65.4 -38.9 -3.3 -29.3 6.2 59 66 A R H < S+ 0 0 196 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.966 118.6 31.8 -57.7 -56.0 -6.8 -27.9 5.3 60 67 A S H < S+ 0 0 85 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.645 129.2 38.9 -78.5 -18.0 -8.6 -30.1 7.7 61 68 A N S < S- 0 0 78 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.1 -0.582 80.6-160.7-133.5 73.0 -5.8 -30.3 10.3 62 69 A P - 0 0 80 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.137 37.1 -85.2 -54.4 147.4 -4.1 -27.0 10.7 63 70 A A - 0 0 18 -28,-0.1 2,-0.9 1,-0.1 8,-0.1 -0.266 32.8-142.9 -56.5 133.1 -0.6 -27.0 12.2 64 71 A Q + 0 0 99 6,-0.3 3,-0.3 1,-0.1 10,-0.2 -0.845 35.0 158.3-100.0 98.0 -0.6 -26.9 16.0 65 72 A A + 0 0 2 -2,-0.9 -1,-0.1 1,-0.2 -31,-0.1 0.178 33.5 112.8-108.3 18.0 2.4 -24.7 16.8 66 73 A G S S- 0 0 30 1,-0.1 2,-0.3 -41,-0.1 -1,-0.2 0.751 90.4 -20.1 -61.5 -25.4 1.6 -23.6 20.3 67 74 A S S > S- 0 0 21 -3,-0.3 4,-2.3 -42,-0.1 5,-0.3 -0.976 75.5 -82.2-169.8 174.4 4.5 -25.5 21.7 68 75 A Q H > S+ 0 0 28 -45,-0.6 4,-2.5 -2,-0.3 5,-0.2 0.888 123.9 49.3 -56.9 -42.6 7.0 -28.3 21.2 69 76 A E H > S+ 0 0 126 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.919 111.9 46.4 -66.8 -44.1 4.6 -31.0 22.3 70 77 A E H > S+ 0 0 82 2,-0.2 4,-2.6 1,-0.2 -6,-0.3 0.883 116.2 45.3 -66.5 -38.4 1.7 -29.8 20.0 71 78 A F H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.931 113.2 49.1 -71.4 -45.9 3.9 -29.4 17.0 72 79 A S H X S+ 0 0 5 -4,-2.5 4,-1.5 -53,-0.3 -2,-0.2 0.935 117.1 42.5 -56.8 -49.6 5.7 -32.8 17.5 73 80 A Q H >X S+ 0 0 44 -4,-2.3 4,-2.5 -5,-0.2 3,-0.5 0.966 113.3 51.0 -62.6 -54.6 2.4 -34.6 17.9 74 81 A W H 3X S+ 0 0 16 -4,-2.6 4,-2.5 1,-0.3 -2,-0.2 0.909 110.3 49.5 -49.8 -48.5 0.7 -32.8 15.1 75 82 A L H 3X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.3 0.835 110.7 51.2 -62.4 -32.3 3.5 -33.6 12.7 76 83 A b H S+ 0 0 21 -4,-2.6 5,-2.8 1,-0.2 3,-0.5 0.930 111.5 47.7 -53.2 -49.5 1.3 -43.9 6.4 84 91 A R H ><5S+ 0 0 153 -4,-3.4 3,-1.8 1,-0.2 -1,-0.2 0.920 108.1 53.6 -59.4 -46.6 -2.3 -45.1 6.6 85 92 A S H 3<5S+ 0 0 92 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.791 112.9 45.8 -60.8 -25.5 -3.1 -44.1 3.1 86 93 A L T 3<5S- 0 0 110 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.310 116.1-111.4 -99.4 5.7 -0.1 -46.1 1.9 87 94 A G T < 5S+ 0 0 72 -3,-1.8 2,-0.2 1,-0.2 -3,-0.2 0.884 71.6 138.7 66.5 37.9 -0.8 -49.2 4.0 88 95 A K < - 0 0 125 -5,-2.8 -1,-0.2 -8,-0.2 -2,-0.1 -0.710 62.0 -78.4-110.4 164.1 2.2 -48.6 6.2 89 96 A L - 0 0 166 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.1 -0.222 43.4-127.7 -58.3 150.1 2.6 -49.0 10.0 90 97 A V - 0 0 67 -7,-0.1 -1,-0.1 -3,-0.1 -10,-0.1 -0.927 22.1-132.2-106.9 123.5 1.1 -46.2 12.1 91 98 A F - 0 0 66 -2,-0.5 2,-0.9 -15,-0.2 -11,-0.1 -0.517 16.9-117.2 -78.8 136.6 3.6 -44.7 14.7 92 99 A P > - 0 0 50 0, 0.0 3,-2.6 0, 0.0 4,-0.2 -0.636 22.1-150.2 -76.3 106.6 2.5 -44.2 18.3 93 100 A b T 3 S+ 0 0 10 -2,-0.9 4,-0.2 1,-0.3 3,-0.2 0.381 88.2 73.7 -61.9 6.3 2.8 -40.4 18.7 94 101 A E T 3 S+ 0 0 175 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.596 97.8 49.5 -92.0 -13.2 3.6 -40.7 22.4 95 102 A R S X> S+ 0 0 167 -3,-2.6 4,-2.0 1,-0.1 3,-1.5 0.337 75.5 104.5-104.1 2.5 7.0 -41.9 21.4 96 103 A V H 3> S+ 0 0 5 1,-0.3 4,-3.1 2,-0.2 3,-0.3 0.918 82.5 51.9 -51.1 -46.1 7.9 -39.2 18.8 97 104 A D H 34 S+ 0 0 83 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.726 109.2 51.0 -62.9 -21.3 10.3 -37.6 21.4 98 105 A A H <4 S+ 0 0 90 -3,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.804 115.5 41.3 -83.8 -31.1 11.9 -41.0 21.8 99 106 A R H < S+ 0 0 102 -4,-2.0 2,-0.5 -3,-0.3 5,-0.3 0.788 124.6 35.7 -84.4 -31.7 12.3 -41.4 18.0 100 107 A W < 0 0 28 -4,-3.1 -1,-0.3 -5,-0.3 -87,-0.0 -0.920 360.0 360.0-128.3 107.0 13.4 -37.8 17.4 101 108 A G 0 0 75 -2,-0.5 -81,-0.2 -3,-0.2 3,-0.1 -0.439 360.0 360.0 -96.8 360.0 15.5 -36.0 20.1 102 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 103 8 B P 0 0 142 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 63.3 19.3 -40.4 17.2 104 9 B V - 0 0 46 -5,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.384 360.0-143.5 -65.2 135.3 19.6 -38.1 14.1 105 10 B T >> - 0 0 60 -2,-0.1 4,-2.8 1,-0.1 3,-1.0 -0.643 26.5-105.8-102.4 158.8 23.0 -36.5 13.8 106 11 B K H 3> S+ 0 0 100 1,-0.3 4,-1.9 -2,-0.2 43,-0.1 0.808 124.4 50.0 -45.0 -36.0 24.0 -33.0 12.6 107 12 B E H 3> S+ 0 0 99 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.812 108.5 48.7 -77.8 -33.6 25.2 -34.8 9.4 108 13 B D H <> S+ 0 0 62 -3,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.836 111.0 52.7 -74.4 -33.6 22.0 -36.8 8.8 109 14 B L H X S+ 0 0 8 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.964 110.5 47.5 -64.5 -49.5 20.1 -33.5 9.3 110 15 B G H X S+ 0 0 12 -4,-1.9 4,-2.8 -5,-0.2 5,-0.3 0.922 112.5 47.5 -57.2 -49.4 22.2 -31.8 6.7 111 16 B R H X S+ 0 0 139 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.906 112.8 49.4 -60.3 -42.6 22.0 -34.6 4.1 112 17 B A H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.953 113.0 47.7 -61.7 -47.8 18.2 -34.8 4.5 113 18 B T H X S+ 0 0 6 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.934 111.3 47.6 -60.9 -50.6 17.9 -31.1 4.1 114 19 B W H X S+ 0 0 42 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.878 110.2 54.4 -59.5 -37.4 20.1 -30.7 1.0 115 20 B T H X S+ 0 0 27 -4,-2.1 4,-1.5 -5,-0.3 -1,-0.2 0.921 112.9 43.5 -62.2 -41.2 18.2 -33.7 -0.6 116 21 B F H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.976 117.6 44.1 -66.1 -56.2 14.9 -31.8 0.1 117 22 B L H X S+ 0 0 5 -4,-3.2 4,-3.1 1,-0.2 5,-0.2 0.946 115.5 46.0 -53.6 -57.3 16.2 -28.4 -1.1 118 23 B H H X S+ 0 0 9 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.827 113.6 48.9 -59.5 -34.2 18.0 -29.6 -4.2 119 24 B T H X S+ 0 0 15 -4,-1.5 4,-1.2 -5,-0.4 -1,-0.2 0.906 111.4 50.6 -72.3 -38.9 15.1 -31.8 -5.2 120 25 B L H >X S+ 0 0 5 -4,-2.7 4,-0.7 1,-0.2 3,-0.6 0.932 111.4 48.0 -61.5 -43.8 12.8 -28.8 -4.7 121 26 B A H 3< S+ 0 0 2 -4,-3.1 53,-0.3 1,-0.2 -1,-0.2 0.743 108.1 55.7 -70.0 -21.4 15.1 -26.7 -6.8 122 27 B A H 3< S+ 0 0 23 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.722 112.5 41.9 -81.0 -21.6 15.1 -29.4 -9.5 123 28 B Q H << S+ 0 0 111 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.429 84.0 120.4-102.9 -3.7 11.3 -29.3 -9.7 124 29 B Y S < S- 0 0 11 -4,-0.7 46,-0.1 -5,-0.1 50,-0.1 -0.327 72.3-103.3 -58.9 142.7 11.0 -25.5 -9.6 125 30 B P - 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