==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER EF-HAND PROTEIN 17-SEP-98 3PSR . COMPND 2 MOLECULE: PSORIASIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.E.BRODERSEN,J.NYBORG,M.KJELDGAARD . 192 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10360.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 143 74.5 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 . 4 2.1 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 . 1 0.5 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 . 10 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 52.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 2 0 0 0 2 0 2 0 0 0 1 1 0 1 1 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 . 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 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 1 A S 0 0 161 0, 0.0 2,-0.3 0, 0.0 137,-0.1 0.000 360.0 360.0 360.0 153.4 30.7 21.3 20.1 2 2 A N - 0 0 50 1,-0.1 134,-0.1 135,-0.1 133,-0.0 -0.735 360.0-107.4 -99.5 146.3 26.9 21.2 20.1 3 3 A T > - 0 0 31 -2,-0.3 4,-2.6 132,-0.2 5,-0.2 -0.052 34.1-103.9 -62.2 168.4 24.6 24.0 19.1 4 4 A Q H > S+ 0 0 119 2,-0.2 4,-3.8 1,-0.2 5,-0.2 0.951 123.1 55.0 -59.2 -45.6 22.5 25.9 21.6 5 5 A A H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.941 109.9 44.4 -52.1 -54.0 19.4 23.9 20.5 6 6 A E H > S+ 0 0 0 129,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.932 114.6 50.2 -56.1 -46.4 21.2 20.6 21.2 7 7 A R H X S+ 0 0 134 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.937 107.6 54.5 -57.3 -44.3 22.5 22.0 24.5 8 8 A S H X S+ 0 0 19 -4,-3.8 4,-1.0 1,-0.2 -1,-0.2 0.891 109.3 46.7 -59.8 -40.0 19.0 23.1 25.4 9 9 A I H >X S+ 0 0 16 -4,-2.1 4,-1.4 -5,-0.2 3,-0.5 0.918 109.7 52.2 -69.8 -45.2 17.5 19.7 24.9 10 10 A I H 3X S+ 0 0 50 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.887 102.5 63.1 -57.1 -37.0 20.3 17.9 26.8 11 11 A G H 3X S+ 0 0 31 -4,-2.4 4,-3.5 -5,-0.2 -1,-0.2 0.895 99.5 52.1 -52.6 -43.0 19.5 20.4 29.6 12 12 A M H X S+ 0 0 12 -4,-3.5 3,-1.4 1,-0.2 4,-0.7 0.940 110.0 51.7 -54.6 -49.2 17.0 18.5 34.7 16 16 A F H >X S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.3 4,-0.6 0.936 107.4 51.7 -50.3 -53.5 15.1 15.2 34.6 17 17 A H H 3< S+ 0 0 61 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.535 97.7 68.8 -68.1 -7.7 18.0 13.3 36.0 18 18 A K H << S+ 0 0 162 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.753 111.5 30.3 -78.4 -23.4 18.2 15.8 38.9 19 19 A Y H << S+ 0 0 32 -3,-1.9 8,-0.4 -4,-0.7 -2,-0.2 0.422 93.9 110.4-118.8 5.3 14.9 14.5 40.3 20 20 A T < - 0 0 32 -4,-0.6 6,-0.2 6,-0.1 2,-0.1 -0.419 56.0-134.6 -82.4 161.7 14.7 10.9 39.3 21 21 A R > - 0 0 133 4,-2.7 3,-2.1 -2,-0.1 4,-0.1 -0.238 48.7 -74.2 -92.8-173.1 14.9 7.9 41.7 22 22 A R T 3 S+ 0 0 260 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.841 131.1 59.8 -54.5 -34.2 16.9 4.7 41.1 23 23 A D T 3 S- 0 0 58 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.347 115.5-110.9 -81.5 8.2 14.4 3.6 38.5 24 24 A D S < S+ 0 0 33 -3,-2.1 2,-0.3 1,-0.3 47,-0.3 0.758 86.2 112.6 67.6 22.7 14.9 6.7 36.3 25 25 A K - 0 0 69 45,-0.1 -4,-2.7 -4,-0.1 2,-0.5 -0.909 65.5-126.6-125.6 154.1 11.4 7.8 37.3 26 26 A I B -A 69 0A 0 43,-2.5 43,-2.1 -2,-0.3 -6,-0.1 -0.876 19.0-141.6-106.0 126.5 10.2 10.8 39.3 27 27 A D > - 0 0 26 -2,-0.5 4,-2.6 -8,-0.4 5,-0.2 -0.316 30.5-100.4 -80.7 170.3 7.9 10.3 42.3 28 28 A K H > S+ 0 0 73 39,-0.5 4,-2.4 1,-0.2 5,-0.2 0.937 117.8 46.3 -61.5 -53.8 5.1 12.8 43.1 29 29 A P H > S+ 0 0 82 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.878 115.9 49.0 -60.9 -32.0 6.7 15.0 45.9 30 30 A S H > S+ 0 0 22 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.898 108.5 53.1 -69.9 -39.6 9.8 15.2 43.8 31 31 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.905 110.0 47.8 -61.4 -39.3 7.8 16.2 40.7 32 32 A L H X S+ 0 0 39 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.901 111.6 50.7 -66.7 -41.9 6.1 18.9 42.7 33 33 A T H X S+ 0 0 61 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 0.922 108.6 52.2 -57.3 -48.2 9.5 20.1 43.9 34 34 A M H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 5,-0.3 0.921 110.6 47.9 -54.2 -48.9 10.8 20.1 40.4 35 35 A M H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.936 112.8 47.3 -56.7 -53.3 7.9 22.3 39.2 36 36 A K H < S+ 0 0 134 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.879 116.7 43.7 -59.4 -42.7 8.3 24.8 42.1 37 37 A E H < S+ 0 0 118 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.765 125.0 29.4 -76.6 -30.5 12.0 25.1 41.6 38 38 A N H < S+ 0 0 26 -4,-2.0 65,-0.6 -5,-0.2 62,-0.2 0.692 126.0 33.3-112.3 -19.7 12.1 25.3 37.8 39 39 A F X + 0 0 0 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.1 -0.307 65.8 138.3-129.8 55.6 8.9 26.9 36.6 40 40 A P H > S+ 0 0 49 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.883 74.8 50.4 -70.1 -36.3 7.9 29.4 39.4 41 41 A N H > S+ 0 0 50 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.940 109.1 52.4 -68.2 -38.9 6.8 32.2 37.0 42 42 A F H > S+ 0 0 8 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.935 113.0 45.5 -57.0 -44.3 4.6 29.8 35.1 43 43 A L H X S+ 0 0 18 -4,-1.9 4,-2.8 1,-0.2 3,-0.5 0.939 106.8 55.9 -68.6 -46.9 3.0 28.7 38.4 44 44 A S H X S+ 0 0 55 -4,-2.9 4,-2.2 1,-0.3 -1,-0.2 0.840 105.9 55.6 -53.4 -33.2 2.5 32.2 39.7 45 45 A A H X S+ 0 0 20 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.3 0.893 108.5 45.5 -67.0 -41.6 0.6 32.9 36.5 46 46 A a H <>S+ 0 0 0 -4,-1.4 5,-4.3 -3,-0.5 -2,-0.2 0.914 113.8 48.5 -69.8 -41.6 -1.8 30.0 37.1 47 47 A D H ><5S+ 0 0 83 -4,-2.8 3,-1.2 3,-0.3 -2,-0.2 0.889 109.9 52.0 -66.2 -36.5 -2.4 30.9 40.7 48 48 A K H 3<5S+ 0 0 176 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.847 107.2 52.8 -66.2 -30.8 -3.0 34.5 39.7 49 49 A K T 3<5S- 0 0 113 -4,-1.4 -1,-0.3 2,-0.2 -2,-0.2 0.453 129.2-105.7 -78.6 -1.5 -5.5 33.2 37.2 50 50 A G T < 5S+ 0 0 67 -3,-1.2 2,-0.5 1,-0.2 -3,-0.3 0.654 82.9 126.3 87.0 18.2 -7.0 31.4 40.2 51 51 A T < - 0 0 46 -5,-4.3 2,-1.1 -6,-0.2 -1,-0.2 -0.928 49.4-156.8-116.7 123.7 -5.6 28.0 39.2 52 52 A N > - 0 0 82 -2,-0.5 3,-1.4 1,-0.2 4,-0.4 -0.774 12.4-176.7 -99.9 91.8 -3.4 25.8 41.3 53 53 A Y G >> S+ 0 0 47 -2,-1.1 4,-1.5 1,-0.3 3,-0.9 0.767 75.8 62.8 -51.4 -37.2 -1.7 23.7 38.7 54 54 A L G 34 S+ 0 0 20 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.725 83.6 78.2 -71.4 -20.5 0.1 21.5 41.2 55 55 A A G <4 S+ 0 0 67 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.845 118.3 3.0 -58.1 -34.8 -3.1 20.1 42.7 56 56 A D T <> S+ 0 0 60 -3,-0.9 4,-2.2 -4,-0.4 3,-0.3 0.548 95.6 104.9-133.2 -6.9 -3.6 17.6 39.9 57 57 A V H X S+ 0 0 6 -4,-1.5 4,-2.7 1,-0.3 5,-0.2 0.862 86.7 50.2 -47.7 -47.9 -0.7 17.8 37.5 58 58 A F H > S+ 0 0 10 -4,-0.5 4,-2.2 1,-0.2 -1,-0.3 0.933 111.2 49.0 -56.4 -47.7 0.8 14.6 38.8 59 59 A E H 4 S+ 0 0 97 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.807 114.3 45.9 -63.2 -33.7 -2.6 12.8 38.4 60 60 A K H < S+ 0 0 132 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.807 115.9 43.9 -80.7 -30.5 -3.0 14.1 34.9 61 61 A K H < S+ 0 0 26 -4,-2.7 2,-2.3 -5,-0.2 3,-0.2 0.715 89.8 83.5 -92.4 -17.0 0.5 13.3 33.7 62 62 A D >< + 0 0 13 -4,-2.2 3,-2.0 -5,-0.2 -1,-0.2 -0.473 58.2 169.5 -80.2 70.7 0.8 9.8 35.2 63 63 A K T 3 S+ 0 0 169 -2,-2.3 -1,-0.2 1,-0.3 6,-0.1 0.763 73.5 43.5 -57.4 -31.5 -1.0 8.4 32.2 64 64 A N T 3 S- 0 0 87 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.321 103.8-129.6-101.6 11.1 -0.3 4.8 33.1 65 65 A E < + 0 0 155 -3,-2.0 -2,-0.1 1,-0.1 -3,-0.1 0.836 63.7 135.7 49.3 43.9 -1.1 5.3 36.8 66 66 A D S S- 0 0 44 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.303 74.9-116.4-100.2 12.7 2.1 3.7 38.1 67 67 A K S S+ 0 0 157 1,-0.2 -39,-0.5 -5,-0.2 2,-0.3 0.637 87.0 96.4 61.1 20.3 2.4 6.5 40.6 68 68 A K S S- 0 0 53 -41,-0.1 2,-0.6 -40,-0.1 -2,-0.4 -0.956 70.8-134.0-133.7 151.7 5.6 7.5 38.8 69 69 A I B -A 26 0A 2 -43,-2.1 -43,-2.5 -2,-0.3 -7,-0.1 -0.926 27.0-168.0-105.2 109.4 6.5 10.0 36.1 70 70 A D > - 0 0 38 -2,-0.6 4,-2.7 -45,-0.2 5,-0.1 -0.271 40.1 -91.3 -86.1 179.2 8.8 8.5 33.4 71 71 A F H > S+ 0 0 13 -47,-0.3 4,-3.1 1,-0.2 5,-0.1 0.890 125.4 49.4 -62.3 -40.2 10.6 10.4 30.7 72 72 A S H > S+ 0 0 71 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.948 113.0 45.3 -65.9 -46.7 7.8 10.2 28.1 73 73 A E H > S+ 0 0 13 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.925 113.9 53.0 -60.5 -38.8 5.2 11.4 30.7 74 74 A F H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.910 104.5 54.0 -56.9 -48.9 7.8 14.0 31.5 75 75 A L H X S+ 0 0 39 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.910 107.6 51.1 -55.7 -42.9 8.1 15.1 27.9 76 76 A S H X S+ 0 0 44 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.937 106.2 54.2 -62.4 -44.5 4.3 15.6 27.8 77 77 A L H X S+ 0 0 1 -4,-2.1 4,-1.6 1,-0.2 3,-0.2 0.942 110.3 45.6 -53.1 -50.4 4.4 17.8 30.9 78 78 A L H X S+ 0 0 12 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.881 108.1 61.0 -62.0 -32.9 7.0 20.1 29.3 79 79 A G H X S+ 0 0 17 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.901 102.5 49.0 -59.2 -43.4 4.9 20.0 26.2 80 80 A D H X S+ 0 0 61 -4,-2.2 4,-1.8 -3,-0.2 -1,-0.2 0.880 113.1 48.2 -65.6 -35.7 1.9 21.5 27.9 81 81 A I H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.960 110.9 47.9 -71.2 -49.2 4.1 24.3 29.4 82 82 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.943 110.9 55.1 -50.2 -50.5 5.8 25.1 26.1 83 83 A T H X S+ 0 0 47 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.875 103.9 52.4 -53.3 -43.0 2.4 25.2 24.6 84 84 A D H X S+ 0 0 15 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.956 109.6 49.2 -64.6 -42.8 1.1 27.7 27.0 85 85 A Y H X S+ 0 0 29 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.891 108.1 55.6 -60.4 -35.9 4.0 30.0 26.4 86 86 A H H >X S+ 0 0 26 -4,-2.3 4,-0.6 1,-0.2 3,-0.5 0.973 106.8 47.5 -61.4 -53.4 3.3 29.7 22.6 87 87 A K H ><>S+ 0 0 112 -4,-2.3 3,-1.1 1,-0.3 5,-1.0 0.869 109.1 57.6 -55.0 -35.2 -0.3 30.8 22.9 88 88 A Q H ><5S+ 0 0 60 -4,-2.0 3,-2.2 1,-0.3 -1,-0.3 0.917 98.2 58.7 -59.0 -44.3 1.0 33.6 25.0 89 89 A S H <<5S+ 0 0 64 -4,-1.9 -1,-0.3 -3,-0.5 -2,-0.2 0.568 103.5 53.2 -67.7 -10.1 3.3 34.8 22.2 90 90 A H T <<5S- 0 0 99 -3,-1.1 -1,-0.3 -4,-0.6 2,-0.2 0.024 133.4 -90.7-109.9 25.3 0.2 35.2 20.0 91 91 A G T < 5S+ 0 0 67 -3,-2.2 -3,-0.2 1,-0.3 -2,-0.1 -0.281 82.9 135.1 102.9 -45.7 -1.4 37.4 22.6 92 92 A A < - 0 0 44 -5,-1.0 -1,-0.3 -2,-0.2 3,-0.1 0.282 60.0 -97.1 -38.2 157.4 -3.3 34.7 24.7 93 93 A A - 0 0 62 1,-0.1 -1,-0.1 2,-0.1 -5,-0.1 -0.573 39.6 -99.8 -85.4 144.0 -3.2 34.8 28.5 94 94 A P S S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -9,-0.1 -0.222 107.3 26.1 -53.8 151.8 -0.8 32.7 30.5 95 95 A a 0 0 12 -14,-0.1 -2,-0.1 1,-0.1 -14,-0.0 0.980 360.0 360.0 50.3 79.5 -2.5 29.5 31.9 96 96 A S 0 0 87 -4,-0.0 -12,-0.1 0, 0.0 -1,-0.1 -0.013 360.0 360.0-153.2 360.0 -5.2 29.3 29.2 97 !* 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 98 1 B S 0 0 147 0, 0.0 2,-0.4 0, 0.0 -57,-0.2 0.000 360.0 360.0 360.0 157.6 12.9 36.6 36.8 99 2 B N - 0 0 69 -59,-0.1 -60,-0.1 -58,-0.1 2,-0.0 -0.803 360.0-132.6-105.6 134.7 13.2 33.5 34.6 100 3 B T > - 0 0 30 -2,-0.4 4,-2.5 -62,-0.2 5,-0.3 -0.325 32.2-105.3 -72.8 163.3 14.8 30.2 35.6 101 4 B Q H > S+ 0 0 149 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.906 123.9 53.8 -49.3 -43.0 17.2 28.4 33.3 102 5 B A H > S+ 0 0 5 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.941 108.8 44.7 -62.0 -50.6 14.3 26.0 32.7 103 6 B E H > S+ 0 0 0 -65,-0.6 4,-2.7 1,-0.2 3,-0.4 0.953 113.4 49.4 -62.9 -48.2 11.8 28.7 31.6 104 7 B R H X S+ 0 0 119 -4,-2.5 4,-3.0 1,-0.3 -1,-0.2 0.919 107.3 56.5 -56.9 -41.9 14.2 30.5 29.4 105 8 B S H X S+ 0 0 24 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.3 0.890 109.3 46.5 -57.8 -38.8 15.2 27.3 27.7 106 9 B I H X S+ 0 0 1 -4,-1.7 4,-1.6 -3,-0.4 3,-0.3 0.936 110.6 50.7 -69.1 -47.4 11.5 26.7 26.9 107 10 B I H X S+ 0 0 47 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.913 106.5 58.0 -56.2 -39.8 11.0 30.3 25.6 108 11 B G H X S+ 0 0 28 -4,-3.0 4,-3.3 -5,-0.2 -1,-0.2 0.901 100.8 54.8 -56.8 -42.2 14.1 29.7 23.4 109 12 B M H X S+ 0 0 37 -4,-1.4 4,-2.4 -3,-0.3 -1,-0.2 0.897 109.3 48.3 -59.3 -37.9 12.4 26.7 21.8 110 13 B I H X S+ 0 0 6 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.887 111.1 50.0 -70.2 -37.9 9.5 28.9 20.9 111 14 B D H X S+ 0 0 102 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.951 110.0 50.0 -63.7 -48.3 11.9 31.5 19.5 112 15 B M H >X S+ 0 0 23 -4,-3.3 3,-0.9 1,-0.2 4,-0.5 0.922 108.9 55.0 -53.7 -45.6 13.7 28.9 17.5 113 16 B F H >< S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.956 106.0 48.0 -51.8 -58.8 10.3 27.8 16.2 114 17 B H H >< S+ 0 0 54 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.643 94.4 77.7 -64.2 -13.3 9.2 31.2 14.9 115 18 B K H << S+ 0 0 138 -4,-1.0 -1,-0.3 -3,-0.9 3,-0.3 0.795 102.1 38.5 -65.6 -25.3 12.5 31.7 13.2 116 19 B Y T << S+ 0 0 15 -3,-2.0 8,-0.4 -4,-0.5 -1,-0.3 0.203 93.7 84.9-111.3 14.4 11.3 29.4 10.4 117 20 B T S X S- 0 0 5 -3,-1.2 3,-1.8 1,-0.3 5,-0.5 0.506 74.1-153.0 -94.4 -1.8 7.7 30.4 10.1 118 21 B R T 3 - 0 0 191 -3,-0.3 -1,-0.3 1,-0.3 5,-0.0 -0.448 69.5 -30.6 56.9-138.3 8.3 33.3 7.8 119 22 B R T 3 S+ 0 0 252 -3,-0.1 -1,-0.3 -2,-0.1 2,-0.1 0.496 130.1 61.6 -90.6 -2.3 5.4 35.7 8.4 120 23 B D S < S- 0 0 78 -3,-1.8 -3,-0.1 2,-0.2 0, 0.0 -0.328 92.5 -98.6-112.0-158.6 2.8 33.1 9.4 121 24 B D S S+ 0 0 71 -2,-0.1 47,-0.4 2,-0.0 2,-0.3 0.047 89.4 66.5-110.0 23.9 2.5 30.5 12.2 122 25 B K S S- 0 0 55 -5,-0.5 2,-0.5 45,-0.1 -2,-0.2 -0.973 70.3-121.8-146.1 159.2 3.7 27.3 10.5 123 26 B I B -B 166 0B 0 43,-2.0 43,-2.5 -2,-0.3 -6,-0.1 -0.870 19.2-146.1-109.2 128.2 6.8 25.7 9.0 124 27 B D > - 0 0 41 -2,-0.5 4,-2.2 -8,-0.4 5,-0.2 -0.348 33.7-100.0 -78.4 169.2 7.0 24.5 5.4 125 28 B K H > S+ 0 0 74 39,-0.4 4,-2.5 1,-0.2 5,-0.2 0.942 120.4 45.5 -57.0 -53.7 9.1 21.5 4.4 126 29 B P H > S+ 0 0 81 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.902 113.5 51.6 -63.4 -34.6 12.2 23.3 3.1 127 30 B S H > S+ 0 0 25 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.888 109.5 50.1 -65.5 -37.0 12.1 25.6 6.1 128 31 B L H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.931 108.6 50.8 -67.3 -44.5 12.0 22.6 8.5 129 32 B L H X S+ 0 0 40 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.896 111.9 49.3 -58.5 -39.9 14.9 20.9 6.8 130 33 B T H X S+ 0 0 59 -4,-2.0 4,-2.6 -5,-0.2 5,-0.3 0.945 108.7 51.6 -62.7 -50.2 16.8 24.1 7.1 131 34 B M H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 5,-0.3 0.907 110.8 50.1 -50.9 -44.8 15.9 24.4 10.8 132 35 B M H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.904 111.1 47.1 -61.5 -46.1 17.1 20.8 11.3 133 36 B K H < S+ 0 0 126 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.908 116.2 43.5 -68.0 -41.7 20.5 21.4 9.6 134 37 B E H < S+ 0 0 103 -4,-2.6 -1,-0.2 1,-0.1 -2,-0.2 0.764 126.6 28.8 -72.2 -30.5 21.2 24.6 11.4 135 38 B N H < S+ 0 0 21 -4,-1.7 -129,-0.6 -5,-0.3 -2,-0.2 0.655 126.1 35.7-114.3 -18.8 20.1 23.5 14.9 136 39 B F X + 0 0 2 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.1 -0.271 66.2 136.6-129.5 53.8 20.7 19.7 15.0 137 40 B P H > S+ 0 0 47 0, 0.0 4,-3.4 0, 0.0 5,-0.2 0.896 75.5 47.2 -69.9 -38.4 23.9 19.1 13.0 138 41 B N H > S+ 0 0 55 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.944 111.2 50.0 -70.3 -43.2 25.4 16.6 15.4 139 42 B F H > S+ 0 0 5 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 114.4 49.2 -57.6 -37.2 22.2 14.6 15.8 140 43 B L H X S+ 0 0 13 -4,-1.9 4,-2.7 2,-0.2 3,-0.3 0.971 111.1 45.3 -65.7 -54.7 22.2 14.6 12.0 141 44 B S H X S+ 0 0 63 -4,-3.4 4,-3.4 1,-0.3 5,-0.2 0.922 110.1 56.2 -56.6 -43.9 25.8 13.5 11.5 142 45 B A H X S+ 0 0 21 -4,-3.2 4,-1.3 1,-0.2 -1,-0.3 0.896 109.3 47.7 -52.4 -42.0 25.3 10.9 14.2 143 46 B b H <>S+ 0 0 0 -4,-1.7 5,-3.1 -3,-0.3 4,-0.5 0.936 111.4 48.4 -64.6 -47.0 22.4 9.6 12.1 144 47 B D H ><5S+ 0 0 81 -4,-2.7 3,-2.1 1,-0.2 -2,-0.2 0.937 106.3 57.4 -64.3 -40.2 24.4 9.7 8.9 145 48 B K H 3<5S+ 0 0 189 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.874 105.4 50.4 -57.2 -36.6 27.3 7.8 10.5 146 49 B K T 3<5S- 0 0 117 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.551 127.7-105.4 -77.1 -6.2 24.9 5.0 11.4 147 50 B G T < 5S+ 0 0 66 -3,-2.1 2,-0.5 -4,-0.5 -3,-0.2 0.648 82.3 125.4 90.4 19.6 23.9 5.1 7.7 148 51 B T < - 0 0 51 -5,-3.1 2,-1.0 -6,-0.2 -1,-0.3 -0.937 48.2-156.6-115.1 123.8 20.5 6.8 8.4 149 52 B N > - 0 0 83 -2,-0.5 3,-1.5 1,-0.2 4,-0.3 -0.796 9.8-173.1 -98.5 96.6 19.5 10.1 6.7 150 53 B Y G >> S+ 0 0 31 -2,-1.0 3,-1.2 1,-0.3 4,-1.1 0.824 78.1 64.6 -52.4 -39.4 16.9 11.4 9.1 151 54 B L G 34 S+ 0 0 30 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.728 79.4 85.9 -64.4 -22.8 15.9 14.3 6.7 152 55 B A G <4 S- 0 0 63 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.817 115.5 -3.2 -50.7 -39.3 14.6 11.8 4.2 153 56 B D T <> S+ 0 0 68 -3,-1.2 4,-4.0 -4,-0.3 5,-0.3 0.364 95.1 111.8-142.8 8.0 11.1 11.6 5.7 154 57 B V H X S+ 0 0 1 -4,-1.1 4,-2.1 2,-0.2 5,-0.2 0.907 84.9 48.0 -48.2 -51.6 11.1 13.6 8.9 155 58 B F H > S+ 0 0 2 -4,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.949 115.1 45.2 -57.4 -49.0 8.7 16.1 7.3 156 59 B E H 4 S+ 0 0 77 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.916 112.4 51.6 -63.7 -44.0 6.4 13.4 6.1 157 60 B K H < S+ 0 0 113 -4,-4.0 -1,-0.2 1,-0.2 -2,-0.2 0.834 116.7 39.7 -57.9 -34.7 6.6 11.5 9.4 158 61 B K H < S+ 0 0 31 -4,-2.1 2,-2.5 -5,-0.3 3,-0.2 0.651 86.8 87.9-100.6 -15.2 5.7 14.6 11.4 159 62 B D >< + 0 0 9 -4,-2.0 3,-3.1 1,-0.2 5,-0.2 -0.380 56.1 172.0 -80.8 66.8 3.0 16.3 9.3 160 63 B K T 3 S+ 0 0 190 -2,-2.5 -1,-0.2 1,-0.3 6,-0.1 0.789 74.6 42.6 -48.1 -38.8 0.4 14.2 11.1 161 64 B N T 3 S- 0 0 86 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.291 104.0-130.7 -98.1 13.6 -2.5 16.1 9.5 162 65 B E < + 0 0 157 -3,-3.1 -2,-0.1 1,-0.2 4,-0.1 0.750 64.3 136.2 48.2 32.9 -0.9 16.1 6.1 163 66 B D S S- 0 0 59 2,-0.4 -1,-0.2 1,-0.0 3,-0.1 0.417 74.2-119.4 -86.8 8.9 -1.5 19.9 5.6 164 67 B K S S+ 0 0 119 -5,-0.2 -39,-0.4 1,-0.2 2,-0.3 0.830 85.5 90.8 55.2 39.9 2.1 19.9 4.4 165 68 B K S S- 0 0 49 -41,-0.1 2,-0.7 -10,-0.1 -2,-0.4 -0.961 74.2-127.9-150.3 152.4 3.1 22.3 7.1 166 69 B I B -B 123 0B 1 -43,-2.5 -43,-2.0 -2,-0.3 2,-0.1 -0.910 25.6-164.3-107.5 108.3 4.4 21.7 10.6 167 70 B D > - 0 0 36 -2,-0.7 4,-2.4 -45,-0.2 3,-0.4 -0.358 41.7 -89.1 -83.1 172.0 2.4 23.6 13.3 168 71 B F H > S+ 0 0 11 -47,-0.4 4,-2.5 1,-0.3 5,-0.2 0.826 127.1 52.0 -52.6 -36.8 3.8 24.1 16.8 169 72 B S H > S+ 0 0 74 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.931 109.0 48.0 -68.2 -43.8 2.3 20.9 18.1 170 73 B E H > S+ 0 0 12 -3,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.907 111.1 54.7 -62.0 -37.4 3.8 18.8 15.3 171 74 B F H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.943 103.2 52.9 -57.1 -54.7 7.1 20.6 16.1 172 75 B L H X S+ 0 0 30 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.876 107.7 53.5 -53.4 -36.9 7.0 19.6 19.8 173 76 B S H X S+ 0 0 54 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.942 106.7 51.3 -64.8 -42.9 6.6 16.0 18.7 174 77 B L H X S+ 0 0 1 -4,-1.9 4,-1.7 1,-0.2 3,-0.3 0.972 110.6 47.5 -54.0 -54.7 9.7 16.3 16.5 175 78 B L H X S+ 0 0 11 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.811 106.6 60.4 -60.3 -27.3 11.7 17.7 19.4 176 79 B G H X S+ 0 0 14 -4,-1.7 4,-3.3 -5,-0.3 5,-0.3 0.966 101.7 51.2 -62.5 -49.0 10.3 14.8 21.5 177 80 B D H X S+ 0 0 57 -4,-2.2 4,-1.5 -3,-0.3 -2,-0.2 0.888 114.8 44.4 -55.7 -38.0 11.8 12.3 19.2 178 81 B I H >X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 3,-0.5 0.982 112.2 49.4 -70.2 -54.9 15.2 14.0 19.5 179 82 B A H 3X S+ 0 0 11 -4,-3.2 4,-2.3 1,-0.3 -2,-0.2 0.898 110.8 53.4 -47.5 -45.6 14.9 14.5 23.3 180 83 B T H 3X S+ 0 0 49 -4,-3.3 4,-1.9 -5,-0.3 -1,-0.3 0.893 106.6 51.3 -60.9 -38.2 14.1 10.9 23.5 181 84 B D H < S+ 0 0 25 -4,-2.3 3,-0.6 -5,-0.3 4,-0.5 0.979 106.7 46.0 -59.5 -51.6 17.7 10.4 26.8 184 87 B K H >< S+ 0 0 119 -4,-1.9 3,-1.8 1,-0.3 5,-0.4 0.864 105.5 60.0 -58.7 -38.5 18.7 7.0 25.8 185 88 B Q H >< S+ 0 0 53 -4,-2.0 3,-2.1 1,-0.3 -1,-0.3 0.885 98.0 59.9 -57.8 -37.4 22.3 8.1 25.0 186 89 B S T << S+ 0 0 58 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.2 0.636 102.0 53.8 -63.8 -17.2 22.5 9.1 28.7 187 90 B H T < S- 0 0 108 -3,-1.8 2,-0.5 -4,-0.5 -1,-0.3 0.109 131.2 -95.2-104.2 21.3 21.9 5.5 29.5 188 91 B G S < S+ 0 0 66 -3,-2.1 -3,-0.1 1,-0.3 -4,-0.1 -0.538 81.9 128.7 108.5 -62.8 24.8 4.4 27.2 189 92 B A - 0 0 54 -2,-0.5 -1,-0.3 -5,-0.4 -2,-0.1 0.440 61.9 -92.4 -29.5 159.2 23.1 3.6 23.9 190 93 B A - 0 0 64 1,-0.1 -1,-0.1 2,-0.1 -5,-0.1 -0.490 41.2 -95.6 -87.5 149.4 24.2 5.1 20.6 191 94 B P S S+ 0 0 48 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.176 102.1 21.7 -57.0 153.8 22.9 8.3 18.9 192 95 B b 0 0 7 -14,-0.1 -2,-0.1 1,-0.1 -44,-0.1 0.962 360.0 360.0 48.2 76.8 20.2 7.9 16.3 193 96 B S 0 0 105 -3,-0.0 -1,-0.1 -4,-0.0 -12,-0.1 -0.109 360.0 360.0-137.8 360.0 18.7 4.5 17.2