==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 28-JUL-11 3ZW9 . COMPND 2 MOLECULE: PEROXISOMAL BIFUNCTIONAL ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR P.KASARAGOD,W.SCHMITZ,J.K.HILTUNEN,R.K.WIERENGA . 1442 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 60985.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1042 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 118 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.1 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 . 73 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 170 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 548 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 2.1 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 4 4 6 3 5 5 3 2 6 8 2 2 0 2 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 7 10 3 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 . 7 5 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 4 0 2 0 2 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 -2 A G 0 0 83 0, 0.0 2,-0.9 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 98.4 -60.4 9.3 -136.3 2 -1 A S + 0 0 84 1,-0.2 5,-0.4 3,-0.0 3,-0.0 0.013 360.0 62.9 58.9 -24.5 -63.6 7.2 -136.9 3 0 A H S S+ 0 0 120 -2,-0.9 3,-0.4 3,-0.1 -1,-0.2 0.407 73.8 84.1-110.2 -0.1 -62.4 4.4 -134.6 4 1 A M S S+ 0 0 52 1,-0.3 16,-2.9 15,-0.1 2,-0.3 0.809 111.6 20.7 -77.0 -29.0 -62.2 6.1 -131.2 5 2 A A E S-A 19 0A 6 14,-0.2 -1,-0.3 25,-0.1 2,-0.3 -0.844 95.2-147.8-130.9 99.4 -65.9 5.4 -130.7 6 3 A E E -A 18 0A 52 12,-2.8 12,-2.1 -3,-0.4 2,-0.7 -0.502 2.0-145.5 -77.9 125.5 -66.7 2.6 -133.1 7 4 A Y E +A 17 0A 73 -5,-0.4 2,-0.4 -2,-0.3 10,-0.2 -0.834 28.3 175.3 -91.6 113.1 -70.2 2.6 -134.6 8 5 A L E -A 16 0A 60 8,-2.1 8,-3.5 -2,-0.7 2,-0.8 -0.967 26.8-139.3-127.8 130.4 -71.1 -1.1 -134.9 9 6 A R E -A 15 0A 117 -2,-0.4 6,-0.2 6,-0.2 4,-0.0 -0.798 28.4-164.8 -97.3 106.2 -74.5 -2.6 -136.1 10 7 A L - 0 0 22 4,-0.8 3,-0.4 -2,-0.8 4,-0.2 -0.170 24.1 -86.5 -82.8 172.8 -75.5 -5.6 -134.0 11 8 A P S > S+ 0 0 90 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.324 103.7 38.7 -66.1 161.1 -78.1 -8.5 -134.3 12 9 A H T 3 S- 0 0 123 1,-0.2 3,-0.1 -2,-0.0 37,-0.1 0.773 131.0 -65.7 67.5 32.3 -81.7 -8.0 -133.1 13 10 A S T 3 S+ 0 0 42 -3,-0.4 36,-3.7 1,-0.2 37,-0.8 0.634 101.8 129.1 68.6 18.4 -82.1 -4.4 -134.3 14 11 A L E < - b 0 50A 0 -3,-0.9 -4,-0.8 34,-0.2 2,-0.3 -0.565 42.5-154.1 -99.0 163.0 -79.5 -3.1 -131.8 15 12 A A E -Ab 9 51A 1 35,-1.2 37,-3.3 -6,-0.2 2,-0.4 -0.964 6.7-142.8-135.2 154.2 -76.4 -0.8 -132.3 16 13 A M E -Ab 8 52A 10 -8,-3.5 -8,-2.1 -2,-0.3 2,-0.5 -0.913 10.3-166.1-117.0 140.6 -73.2 -0.5 -130.4 17 14 A I E -Ab 7 53A 1 35,-2.6 37,-1.9 -2,-0.4 2,-0.6 -0.983 21.8-169.7-115.5 113.7 -71.0 2.5 -129.6 18 15 A R E -Ab 6 54A 90 -12,-2.1 -12,-2.8 -2,-0.5 2,-0.3 -0.934 13.7-138.9-111.9 119.1 -67.7 1.1 -128.5 19 16 A L E +Ab 5 55A 2 35,-2.5 37,-2.8 -2,-0.6 2,-0.3 -0.533 22.6 175.1 -75.7 130.4 -65.1 3.3 -126.9 20 17 A C + 0 0 40 -16,-2.9 37,-0.1 -2,-0.3 4,-0.0 -0.763 24.3 134.1-140.6 89.5 -61.4 2.8 -127.8 21 18 A N >> - 0 0 18 -2,-0.3 4,-1.7 35,-0.1 5,-0.7 -0.774 61.2-104.7-132.5 88.7 -59.0 5.3 -126.4 22 19 A P T 45S+ 0 0 84 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 -0.215 85.6 15.7 -60.9 143.6 -56.1 3.1 -125.1 23 20 A P T 45S- 0 0 111 0, 0.0 -2,-0.0 0, 0.0 36,-0.0 -0.944 140.9 -1.4 -88.1 -30.2 -55.1 2.2 -122.4 24 21 A V T 45S- 0 0 59 -3,-0.2 38,-1.4 -2,-0.1 39,-0.2 0.142 91.9-111.8-114.3 19.0 -58.1 2.9 -120.2 25 22 A N T <5 - 0 0 1 -4,-1.7 38,-0.2 36,-0.2 3,-0.1 0.790 46.2-174.2 63.4 30.3 -60.6 4.4 -122.7 26 23 A A < - 0 0 8 -5,-0.7 2,-0.4 35,-0.2 38,-0.2 -0.182 29.3-105.6 -54.8 148.4 -60.5 7.9 -121.2 27 24 A V B +f 64 0B 12 36,-2.3 38,-1.8 4,-0.1 -1,-0.1 -0.655 45.3 172.4 -85.0 131.5 -63.0 10.3 -122.6 28 25 A S > - 0 0 16 -2,-0.4 4,-2.7 36,-0.2 3,-0.3 -0.926 51.3 -94.6-135.2 157.5 -61.5 13.0 -124.9 29 26 A P H > S+ 0 0 106 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.857 129.1 48.8 -42.0 -40.3 -63.0 15.7 -127.1 30 27 A T H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.929 107.9 51.8 -69.6 -44.7 -62.6 13.2 -130.0 31 28 A V H > S+ 0 0 3 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.916 114.4 45.9 -56.6 -41.2 -64.3 10.3 -128.0 32 29 A I H X S+ 0 0 14 -4,-2.7 4,-2.8 2,-0.2 3,-0.3 0.983 110.0 51.2 -62.1 -56.9 -67.1 12.8 -127.3 33 30 A R H X S+ 0 0 143 -4,-3.2 4,-1.9 1,-0.3 -1,-0.2 0.836 115.3 45.1 -52.6 -33.9 -67.4 14.0 -130.9 34 31 A E H X S+ 0 0 12 -4,-2.3 4,-2.0 2,-0.2 -1,-0.3 0.829 107.1 53.9 -84.4 -34.0 -67.6 10.4 -132.0 35 32 A V H X S+ 0 0 2 -4,-2.1 4,-1.4 -3,-0.3 -2,-0.2 0.943 112.1 50.0 -60.5 -45.4 -70.1 9.1 -129.4 36 33 A R H >X S+ 0 0 74 -4,-2.8 4,-2.2 1,-0.2 3,-0.8 0.940 106.8 53.5 -52.1 -53.7 -72.2 12.0 -130.7 37 34 A N H 3X S+ 0 0 61 -4,-1.9 4,-1.6 1,-0.3 -1,-0.2 0.842 108.2 50.5 -51.8 -41.8 -71.7 10.9 -134.3 38 35 A G H 3X S+ 0 0 3 -4,-2.0 4,-1.8 2,-0.2 -1,-0.3 0.802 109.2 50.8 -69.0 -30.3 -72.9 7.4 -133.5 39 36 A L H - 0 0 49 -3,-0.3 3,-2.2 1,-0.1 -1,-0.1 -0.859 60.1-165.9-114.6 97.3 -82.0 4.9 -138.7 46 43 A H T 3 S+ 0 0 163 -2,-0.7 -1,-0.1 1,-0.3 -2,-0.1 0.573 84.6 66.9 -60.9 -10.3 -85.5 3.5 -137.9 47 44 A T T 3 S+ 0 0 54 -3,-0.0 2,-0.6 2,-0.0 -1,-0.3 0.659 83.6 83.5 -83.6 -17.5 -84.1 -0.1 -137.9 48 45 A V < + 0 0 1 -3,-2.2 -34,-0.2 -6,-0.2 3,-0.1 -0.795 51.1 169.3 -86.4 120.6 -82.0 0.6 -134.8 49 46 A K + 0 0 90 -36,-3.7 2,-0.3 -2,-0.6 -35,-0.2 0.778 62.2 12.1-108.0 -34.9 -84.2 0.2 -131.7 50 47 A A E -b 14 0A 0 -37,-0.8 -35,-1.2 40,-0.2 2,-0.4 -0.887 66.0-137.5-131.3 171.3 -81.8 0.3 -128.8 51 48 A I E -bc 15 92A 1 40,-2.3 42,-2.6 -2,-0.3 2,-0.5 -0.998 5.8-156.2-130.7 132.3 -78.1 1.3 -128.3 52 49 A V E -bc 16 93A 0 -37,-3.3 -35,-2.6 -2,-0.4 2,-0.5 -0.936 8.3-164.5-105.1 126.0 -75.4 -0.5 -126.3 53 50 A I E +bc 17 94A 1 40,-3.1 42,-2.8 -2,-0.5 2,-0.3 -0.948 27.2 137.6-108.3 123.4 -72.4 1.6 -125.1 54 51 A C E -b 18 0A 3 -37,-1.9 -35,-2.5 -2,-0.5 2,-0.3 -0.856 42.3-110.0-144.7-178.6 -69.3 -0.2 -123.9 55 52 A G E -b 19 0A 13 40,-0.5 3,-0.4 -2,-0.3 -35,-0.2 -0.881 23.8-119.5-119.3 159.4 -65.5 -0.1 -124.1 56 53 A A S > S+ 0 0 14 -37,-2.8 3,-1.2 -2,-0.3 -35,-0.1 -0.323 85.7 31.0 -84.9 168.6 -62.9 -2.2 -125.8 57 54 A N T 3 S- 0 0 128 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 0.808 129.6 -59.1 51.4 37.6 -60.0 -4.1 -124.2 58 55 A G T 3 S+ 0 0 38 -3,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.673 111.4 92.2 74.9 23.5 -61.8 -4.8 -120.9 59 56 A N < - 0 0 37 -3,-1.2 39,-0.2 39,-0.2 -1,-0.1 -0.990 53.1-157.0-142.8 143.4 -62.6 -1.4 -119.6 60 57 A F S S- 0 0 0 37,-1.3 2,-0.3 39,-0.9 40,-0.2 0.971 72.3 -43.5 -74.0 -73.7 -65.6 0.9 -119.9 61 58 A C B -g 100 0C 0 38,-2.3 40,-2.6 36,-0.1 -36,-0.2 -0.884 37.3-157.1-168.8 129.1 -64.1 4.3 -119.2 62 59 A A - 0 0 32 -38,-1.4 2,-0.3 1,-0.3 -36,-0.1 0.480 59.5 -89.0 -96.5 -4.9 -61.6 5.6 -116.6 63 60 A G S S- 0 0 6 -38,-0.2 -36,-2.3 -39,-0.2 -1,-0.3 -0.787 70.2 -24.0 134.6-169.6 -62.6 9.2 -116.7 64 61 A A B S-f 27 0B 34 -2,-0.3 2,-0.3 -38,-0.2 -36,-0.2 -0.363 90.6 -76.7 -68.0 155.6 -61.6 12.3 -118.7 65 62 A D > - 0 0 46 -38,-1.8 4,-0.5 1,-0.2 -1,-0.1 -0.404 35.9-142.3 -67.4 121.9 -58.1 12.1 -120.1 66 63 A I T 4 S+ 0 0 57 -2,-0.3 3,-0.3 1,-0.2 -1,-0.2 0.722 99.3 49.9 -55.8 -23.4 -55.6 12.6 -117.4 67 64 A H T 4 S+ 0 0 133 1,-0.2 -1,-0.2 3,-0.0 -3,-0.0 0.989 96.3 63.7 -79.5 -68.7 -53.4 14.6 -119.9 68 65 A G T 4 S+ 0 0 45 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.464 78.3 119.0 -27.9 -14.9 -56.0 17.0 -121.4 69 66 A F < + 0 0 31 -4,-0.5 2,-0.2 -3,-0.3 6,-0.0 -0.514 34.0 143.9 -64.3 121.2 -56.3 18.5 -117.8 70 67 A S - 0 0 38 3,-3.1 -2,-0.0 -2,-0.3 -1,-0.0 -0.675 66.6 -84.6-141.2-171.6 -55.3 22.2 -117.7 71 68 A A S S+ 0 0 58 -2,-0.2 -2,-0.0 1,-0.2 196,-0.0 0.735 132.8 21.2 -73.2 -22.5 -56.4 25.4 -115.9 72 69 A F S S+ 0 0 156 191,-0.1 -1,-0.2 3,-0.0 191,-0.1 0.250 112.9 109.2-132.3 2.7 -59.1 25.8 -118.5 73 70 A T + 0 0 48 189,-0.2 -3,-3.1 1,-0.0 2,-0.2 -0.917 50.8 34.7-131.5 160.0 -59.4 22.3 -119.9 74 71 A P S S- 0 0 37 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.776 80.5-178.4 -77.4 171.8 -61.0 19.8 -120.0 75 72 A G - 0 0 38 -2,-0.2 2,-2.3 -6,-0.0 60,-0.0 -0.912 36.5 -58.8-153.4 126.5 -64.5 21.3 -120.1 76 73 A L S > S+ 0 0 52 -2,-0.3 4,-1.3 1,-0.2 3,-0.2 0.045 85.8 104.2 70.1 -20.9 -68.1 20.9 -120.1 77 74 A A H > S+ 0 0 39 -2,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.901 80.8 54.7 -63.5 -42.6 -68.7 18.9 -123.4 78 75 A L H > S+ 0 0 19 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.787 103.7 53.5 -64.2 -32.5 -69.3 15.7 -121.5 79 76 A G H > S+ 0 0 0 55,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.900 107.8 52.3 -70.5 -37.7 -72.0 17.1 -119.3 80 77 A S H X S+ 0 0 51 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.893 110.7 46.9 -62.7 -40.6 -73.7 18.2 -122.4 81 78 A L H X S+ 0 0 2 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.932 105.3 59.2 -67.8 -48.9 -73.4 14.6 -123.9 82 79 A V H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.875 109.6 44.3 -43.5 -46.4 -74.7 13.1 -120.7 83 80 A D H X S+ 0 0 7 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.907 109.6 54.8 -72.5 -41.3 -77.9 15.1 -121.1 84 81 A E H < S+ 0 0 65 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.878 108.3 50.5 -53.8 -41.2 -78.2 14.4 -124.8 85 82 A I H >< S+ 0 0 0 -4,-2.6 3,-1.3 1,-0.2 -2,-0.2 0.925 109.0 50.8 -66.7 -44.6 -78.0 10.7 -124.0 86 83 A Q H 3< S+ 0 0 0 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.916 109.9 50.0 -56.7 -42.9 -80.8 11.0 -121.4 87 84 A R T 3< S+ 0 0 127 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.431 86.3 128.2 -77.9 1.0 -83.0 12.8 -123.8 88 85 A Y < - 0 0 25 -3,-1.3 4,-0.1 -4,-0.2 -3,-0.1 -0.202 58.7-139.3 -62.0 154.8 -82.5 10.1 -126.4 89 86 A Q S S+ 0 0 148 2,-0.1 -1,-0.1 106,-0.0 106,-0.1 0.372 84.1 53.4-102.1 -5.3 -85.5 8.5 -128.0 90 87 A K S S- 0 0 37 105,-0.0 -40,-0.2 -39,-0.0 2,-0.1 -0.923 101.2 -89.8-121.1 152.9 -84.3 4.9 -128.1 91 88 A P - 0 0 6 0, 0.0 -40,-2.3 0, 0.0 2,-0.4 -0.395 37.7-158.0 -60.0 137.4 -83.1 3.1 -125.0 92 89 A V E -c 51 0A 0 -42,-0.2 20,-2.2 -4,-0.1 21,-2.0 -0.985 8.2-169.9-119.9 129.4 -79.3 3.3 -124.2 93 90 A L E -cd 52 113A 0 -42,-2.6 -40,-3.1 -2,-0.4 2,-0.5 -0.966 13.0-142.7-124.2 135.3 -77.6 0.7 -122.1 94 91 A A E -cd 53 114A 0 19,-2.7 21,-2.8 -2,-0.4 2,-0.6 -0.852 6.5-158.6 -98.8 126.4 -74.1 0.8 -120.7 95 92 A A E - d 0 115A 1 -42,-2.8 2,-0.8 -2,-0.5 -40,-0.5 -0.934 14.0-159.6-104.7 113.4 -72.1 -2.4 -120.5 96 93 A I E + d 0 116A 0 19,-3.0 21,-2.4 -2,-0.6 2,-0.4 -0.814 17.7 170.7-108.1 102.1 -69.4 -2.0 -117.9 97 94 A Q - 0 0 50 -2,-0.8 -37,-1.3 19,-0.2 2,-0.8 -0.887 67.5 -22.8 -98.7 135.0 -66.4 -4.3 -118.0 98 95 A G S S+ 0 0 17 -2,-0.4 23,-2.4 -39,-0.2 2,-0.4 -0.534 119.3 15.5 76.0-106.5 -63.5 -3.4 -115.7 99 96 A V E + h 0 121C 15 -2,-0.8 -38,-2.3 21,-0.2 -39,-0.9 -0.835 41.3 175.3-122.0 136.9 -63.6 0.2 -114.7 100 97 A A E +gh 61 122C 0 21,-2.3 23,-1.4 -2,-0.4 2,-0.4 -0.808 28.8 166.0-133.4 92.3 -66.2 3.1 -114.9 101 98 A L E > - h 0 123C 13 -40,-2.6 3,-2.6 -2,-0.3 23,-0.2 -0.885 47.6 -39.1-124.8 142.9 -64.7 6.1 -113.2 102 99 A G T 3> S+ 0 0 3 21,-2.3 4,-3.1 -2,-0.4 5,-0.2 -0.258 136.4 13.0 53.0-122.3 -65.5 9.8 -113.0 103 100 A G H 3> S+ 0 0 3 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.775 129.8 60.3 -50.6 -32.1 -66.6 11.0 -116.4 104 101 A G H <> S+ 0 0 0 -3,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.979 109.5 39.4 -57.2 -58.3 -66.9 7.3 -117.2 105 102 A L H > S+ 0 0 4 18,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.894 114.2 55.9 -55.8 -42.0 -69.4 6.8 -114.5 106 103 A E H X S+ 0 0 5 -4,-3.1 4,-0.8 1,-0.3 -1,-0.2 0.915 106.0 49.8 -60.4 -43.1 -71.0 10.1 -115.4 107 104 A L H < S+ 0 0 6 -4,-2.6 4,-0.5 -5,-0.2 -1,-0.3 0.807 110.0 52.8 -59.6 -34.2 -71.5 8.9 -118.9 108 105 A A H >< S+ 0 0 0 -4,-1.5 3,-1.6 1,-0.2 -2,-0.2 0.911 103.4 54.7 -71.1 -44.3 -73.0 5.7 -117.5 109 106 A L H 3< S+ 0 0 0 -4,-2.6 91,-0.3 1,-0.3 -1,-0.2 0.681 99.6 64.1 -60.5 -18.9 -75.5 7.7 -115.4 110 107 A G T 3< S+ 0 0 0 -4,-0.8 -1,-0.3 -3,-0.2 -2,-0.2 0.744 91.6 85.4 -73.3 -24.3 -76.5 9.4 -118.7 111 108 A C S < S- 0 0 0 -3,-1.6 89,-0.3 -4,-0.5 -18,-0.2 -0.205 79.6-132.5 -76.5 168.1 -77.7 6.0 -119.9 112 109 A H S S+ 0 0 0 -20,-2.2 2,-0.4 1,-0.3 -19,-0.2 0.848 90.8 27.1 -90.4 -38.5 -81.1 4.5 -119.3 113 110 A Y E -d 93 0A 18 -21,-2.0 -19,-2.7 2,-0.0 2,-0.5 -0.963 66.3-160.6-125.7 141.8 -79.9 1.1 -118.2 114 111 A R E +d 94 0A 7 -2,-0.4 58,-3.1 -21,-0.2 59,-1.3 -0.920 11.1 175.4-125.3 111.0 -76.6 0.0 -116.7 115 112 A I E +de 95 173A 0 -21,-2.8 -19,-3.0 -2,-0.5 2,-0.3 -0.931 11.1 178.9-111.0 136.4 -75.3 -3.6 -116.7 116 113 A A E -de 96 174A 0 57,-1.9 59,-2.0 -2,-0.4 -19,-0.2 -0.942 30.3-107.9-136.1 153.0 -71.8 -4.5 -115.3 117 114 A N E > - 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0 0 10 -4,-1.6 4,-1.9 -5,-0.4 -1,-0.3 -0.093 40.6 -76.9 88.9 164.1 -79.9 9.9 -101.9 147 144 A V H > S+ 0 0 2 59,-0.3 4,-2.9 2,-0.2 5,-0.3 0.971 122.2 52.6 -65.9 -55.9 -78.0 12.9 -100.5 148 145 A P H > S+ 0 0 67 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.896 113.8 43.9 -55.2 -43.7 -76.1 11.3 -97.6 149 146 A V H > S+ 0 0 48 -4,-0.4 4,-3.0 2,-0.2 5,-0.2 0.964 114.0 50.7 -62.4 -49.6 -74.6 8.5 -99.7 150 147 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.889 108.2 52.8 -52.2 -44.4 -73.8 10.9 -102.6 151 148 A L H X S+ 0 0 11 -4,-2.9 4,-1.9 2,-0.2 5,-0.3 0.897 112.5 45.8 -58.0 -42.6 -72.0 13.3 -100.2 152 149 A D H X S+ 0 0 57 -4,-1.8 4,-2.0 -5,-0.3 5,-0.4 0.955 114.4 45.8 -66.9 -52.7 -70.0 10.3 -99.0 153 150 A L H X S+ 0 0 11 -4,-3.0 4,-1.8 1,-0.2 -29,-0.3 0.880 118.3 41.1 -57.0 -42.8 -69.1 9.0 -102.4 154 151 A I H < S+ 0 0 0 -4,-2.6 -27,-0.4 -5,-0.2 -1,-0.2 0.806 116.1 46.4 -84.2 -31.7 -68.2 12.3 -104.0 155 152 A T H < S+ 0 0 13 -4,-1.9 -2,-0.2 -5,-0.3 -3,-0.2 0.916 121.5 37.6 -74.9 -44.3 -66.2 13.9 -101.1 156 153 A S H < S- 0 0 34 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.865 91.8-143.5 -72.0 -41.1 -64.2 10.7 -100.4 157 154 A G < + 0 0 7 -4,-1.8 -3,-0.1 -5,-0.4 -4,-0.1 0.639 40.7 165.8 80.6 18.1 -63.7 9.6 -104.1 158 155 A K - 0 0 97 -5,-0.3 -34,-0.6 -6,-0.3 2,-0.3 -0.164 32.1-121.3 -71.0 157.9 -64.1 6.0 -103.0 159 156 A Y E -I 123 0C 89 -36,-0.2 2,-0.3 -34,-0.0 -36,-0.2 -0.694 19.2-153.4-100.3 155.0 -64.6 3.0 -105.4 160 157 A L E -I 122 0C 11 -38,-2.4 -38,-2.1 -2,-0.3 2,-0.1 -0.927 14.4-123.7-128.8 146.3 -67.5 0.5 -105.4 161 158 A S E > -I 121 0C 19 -2,-0.3 4,-2.4 -40,-0.2 5,-0.2 -0.468 37.4-102.0 -79.7 161.4 -67.7 -3.0 -106.5 162 159 A A H > S+ 0 0 0 -42,-1.4 4,-2.1 -44,-0.5 5,-0.2 0.918 124.9 49.0 -45.1 -48.1 -70.4 -4.1 -109.0 163 160 A D H > S+ 0 0 60 -45,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.854 108.0 51.6 -68.7 -39.0 -72.4 -5.5 -106.2 164 161 A E H > S+ 0 0 34 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.910 113.1 46.8 -58.5 -44.3 -72.1 -2.4 -104.0 165 162 A A H X>S+ 0 0 0 -4,-2.4 6,-1.0 2,-0.2 5,-1.0 0.863 111.0 50.0 -69.1 -37.9 -73.3 -0.3 -106.8 166 163 A L H ><5S+ 0 0 60 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.881 109.5 51.4 -67.6 -41.6 -76.2 -2.5 -107.8 167 164 A R H 3<5S+ 0 0 157 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.778 111.1 51.2 -64.4 -26.2 -77.4 -2.6 -104.3 168 165 A L H 3<5S- 0 0 64 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.597 116.8-109.2 -90.5 -12.5 -77.2 1.2 -104.3 169 166 A G T <<5S+ 0 0 34 -4,-0.8 -3,-0.2 -3,-0.7 -4,-0.1 0.032 93.3 107.9 107.2 -25.3 -79.3 1.7 -107.5 170 167 A I S - 0 0 79 1,-0.1 4,-1.6 -61,-0.1 -1,-0.2 -0.462 48.7-148.5 -58.5 128.0 -69.6 -11.0 -120.4 179 176 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.846 95.1 54.8 -70.5 -32.3 -71.6 -7.8 -119.6 180 177 A V H > S+ 0 0 29 2,-0.2 4,-1.0 1,-0.2 5,-0.1 0.927 108.6 46.6 -65.8 -48.2 -72.0 -6.9 -123.2 181 178 A E H >> S+ 0 0 96 1,-0.2 4,-1.5 2,-0.2 3,-0.8 0.934 114.9 48.4 -56.2 -49.3 -73.6 -10.2 -124.1 182 179 A E H 3X S+ 0 0 36 -4,-1.6 4,-1.7 1,-0.3 -2,-0.2 0.856 106.5 56.3 -59.9 -39.9 -75.8 -9.9 -121.0 183 180 A A H 3X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -1,-0.3 0.678 103.3 56.1 -70.0 -19.7 -76.8 -6.3 -122.0 184 181 A I H X S+ 0 0 24 -4,-1.7 3,-1.5 1,-0.2 4,-0.6 0.900 101.0 61.0 -68.8 -43.5 -81.6 -7.2 -121.4 187 184 A A H >X S+ 0 0 0 -4,-1.4 4,-0.8 1,-0.3 3,-0.6 0.783 98.3 59.4 -58.1 -27.4 -82.1 -4.9 -124.3 188 185 A Q H 3< S+ 0 0 75 -4,-0.9 -1,-0.3 -3,-0.3 4,-0.2 0.755 104.0 49.4 -73.9 -26.6 -84.7 -7.3 -125.7 189 186 A K H << S+ 0 0 146 -3,-1.5 -1,-0.2 -4,-0.5 -2,-0.2 0.492 120.8 33.0 -93.4 -0.5 -86.9 -7.1 -122.6 190 187 A I H << S+ 0 0 10 -4,-0.6 -2,-0.2 -3,-0.6 -1,-0.2 0.356 83.8 108.4-126.6 -1.5 -87.0 -3.3 -122.4 191 188 A I S < S+ 0 0 28 -4,-0.8 -3,-0.1 1,-0.2 -2,-0.1 0.782 91.9 28.1 -57.0 -33.0 -86.9 -2.4 -126.0 192 189 A D S S+ 0 0 139 -4,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.675 96.7 108.1-104.4 -17.8 -90.5 -1.3 -126.3 193 190 A K S S- 0 0 135 1,-0.1 2,-0.2 -3,-0.1 -3,-0.1 -0.038 84.0 -88.5 -46.5 153.4 -90.9 -0.2 -122.6 194 191 A P - 0 0 99 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.550 27.4-148.6 -74.5 144.2 -91.1 3.6 -122.0 195 192 A I S > S+ 0 0 23 -2,-0.2 3,-2.7 1,-0.2 4,-0.1 0.838 77.4 83.2 -78.4 -38.6 -87.8 5.5 -121.6 196 193 A E G > S+ 0 0 91 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.701 84.8 54.2 -43.0 -43.3 -89.0 8.3 -119.2 197 194 A P G 3 S+ 0 0 77 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.621 108.4 54.6 -71.0 -5.4 -88.9 6.5 -115.9 198 195 A R G < S+ 0 0 59 -3,-2.7 2,-0.9 -112,-0.1 -2,-0.2 0.235 80.7 100.3-109.6 10.7 -85.2 5.7 -116.7 199 196 A R X - 0 0 27 -3,-1.4 3,-1.3 1,-0.2 4,-0.3 -0.838 58.5-162.9 -97.8 97.1 -84.2 9.4 -117.3 200 197 A I G > S+ 0 0 9 -2,-0.9 3,-2.0 -91,-0.3 -1,-0.2 0.782 79.5 66.0 -56.2 -32.4 -82.5 10.3 -114.1 201 198 A F G 3 S+ 0 0 23 1,-0.3 -1,-0.3 -91,-0.1 46,-0.2 0.850 98.0 54.1 -65.9 -31.5 -82.7 14.1 -114.6 202 199 A N G < S+ 0 0 78 -3,-1.3 -1,-0.3 -6,-0.2 -2,-0.2 0.481 89.2 95.4 -78.1 -3.2 -86.4 14.1 -114.3 203 200 A K S < S- 0 0 93 -3,-2.0 -59,-0.0 -4,-0.3 -60,-0.0 -0.760 75.7-130.7 -86.3 126.7 -86.3 12.2 -110.9 204 201 A P - 0 0 108 0, 0.0 39,-0.1 0, 0.0 -2,-0.1 -0.320 29.0 -97.9 -71.2 163.3 -86.4 14.5 -108.0 205 202 A V - 0 0 21 37,-0.3 -62,-0.2 38,-0.1 -61,-0.0 -0.646 45.3-101.8 -76.1 131.3 -83.8 14.2 -105.2 206 203 A P - 0 0 65 0, 0.0 -59,-0.3 0, 0.0 2,-0.1 -0.330 43.8-136.6 -47.1 127.9 -85.2 12.2 -102.2 207 204 A S - 0 0 105 -61,-0.1 3,-0.1 -60,-0.0 -60,-0.0 -0.403 17.7-164.6 -81.1 168.0 -86.1 14.7 -99.5 208 205 A L > - 0 0 69 -2,-0.1 3,-1.4 1,-0.1 4,-0.2 -0.966 25.7-132.4-152.0 140.9 -85.4 14.4 -95.8 209 206 A P T 3 S+ 0 0 140 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.831 109.8 45.5 -66.3 -29.0 -86.8 16.3 -92.9 210 207 A N T >> S+ 0 0 89 1,-0.2 4,-2.1 2,-0.1 3,-1.4 0.239 76.9 122.3 -94.6 13.1 -83.3 17.0 -91.4 211 208 A M H <> + 0 0 16 -3,-1.4 4,-2.1 1,-0.3 5,-0.2 0.841 66.9 56.4 -43.7 -52.3 -81.7 18.0 -94.8 212 209 A D H 3> S+ 0 0 146 -3,-0.3 4,-1.3 1,-0.2 -1,-0.3 0.861 113.5 43.1 -51.3 -37.3 -80.5 21.5 -93.7 213 210 A S H <> S+ 0 0 64 -3,-1.4 4,-2.6 2,-0.2 -1,-0.2 0.882 104.6 62.1 -79.9 -40.4 -78.6 19.9 -90.9 214 211 A V H X S+ 0 0 17 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.880 107.3 47.2 -48.1 -44.9 -77.3 17.0 -93.1 215 212 A F H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.925 111.0 49.1 -66.4 -43.7 -75.5 19.6 -95.2 216 213 A A H X S+ 0 0 60 -4,-1.3 4,-2.4 -5,-0.2 -2,-0.2 0.861 111.5 50.6 -64.0 -34.2 -74.1 21.5 -92.2 217 214 A E H X S+ 0 0 140 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.892 110.5 49.2 -68.9 -42.1 -72.8 18.3 -90.7 218 215 A A H X S+ 0 0 16 -4,-1.9 4,-2.8 -5,-0.2 -2,-0.2 0.908 110.8 50.0 -60.2 -49.1 -71.1 17.3 -94.0 219 216 A I H X S+ 0 0 9 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.944 112.2 47.6 -54.8 -51.5 -69.5 20.8 -94.2 220 217 A A H X S+ 0 0 60 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.866 112.3 51.0 -57.4 -36.8 -68.2 20.4 -90.7 221 218 A K H X S+ 0 0 101 -4,-1.9 4,-3.3 2,-0.2 3,-0.4 0.947 110.8 46.5 -67.8 -51.7 -67.0 16.9 -91.5 222 219 A V H X S+ 0 0 6 -4,-2.8 4,-2.3 1,-0.2 7,-0.2 0.855 110.5 53.7 -56.5 -41.3 -65.1 18.0 -94.6 223 220 A R H < S+ 0 0 139 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.810 116.5 39.2 -66.5 -28.7 -63.5 20.9 -92.7 224 221 A K H < S+ 0 0 177 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.918 120.6 41.4 -86.1 -51.7 -62.3 18.5 -90.0 225 222 A Q H < S+ 0 0 100 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.937 130.7 25.1 -61.3 -48.6 -61.2 15.6 -92.2 226 223 A Y S >< S- 0 0 74 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.2 -0.629 84.0-156.2-121.8 72.0 -59.6 17.8 -95.0 227 224 A P T 3 S- 0 0 88 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.219 73.4 -10.0 -62.1 127.3 -58.5 21.1 -93.4 228 225 A G T 3 S+ 0 0 61 1,-0.2 2,-0.7 -5,-0.1 -5,-0.1 0.474 93.7 131.7 69.2 2.8 -58.3 23.9 -96.0 229 226 A V <> - 0 0 29 -3,-1.9 4,-0.8 -7,-0.2 -1,-0.2 -0.816 44.4-155.4 -91.8 123.3 -58.6 21.8 -99.0 230 227 A L H > S+ 0 0 51 -2,-0.7 4,-3.0 1,-0.2 5,-0.3 0.815 74.9 64.0 -60.0 -46.1 -61.2 23.3 -101.4 231 228 A A H > S+ 0 0 2 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.900 99.4 49.3 -63.0 -46.3 -62.6 20.4 -103.5 232 229 A P H > S+ 0 0 4 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.934 115.9 45.4 -63.1 -37.8 -64.3 18.3 -100.9 233 230 A E H X S+ 0 0 47 -4,-0.8 4,-2.1 2,-0.2 3,-0.3 0.956 113.3 48.5 -63.3 -47.6 -66.1 21.4 -99.5 234 231 A T H X S+ 0 0 13 -4,-3.0 4,-2.4 1,-0.3 -1,-0.2 0.879 105.5 60.7 -61.7 -33.8 -67.0 22.6 -102.9 235 232 A C H X S+ 0 0 0 -4,-3.1 4,-2.0 -5,-0.3 -1,-0.3 0.905 104.0 49.8 -55.8 -43.3 -68.2 19.0 -103.6 236 233 A V H X S+ 0 0 1 -4,-1.6 4,-2.1 -3,-0.3 -2,-0.2 0.947 110.2 48.9 -62.7 -45.6 -70.7 19.5 -100.8 237 234 A R H X S+ 0 0 96 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.884 108.8 53.8 -63.7 -34.1 -71.9 22.8 -102.1 238 235 A S H X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.922 109.9 45.7 -68.6 -41.5 -72.4 21.4 -105.6 239 236 A I H >X S+ 0 0 0 -4,-2.0 3,-0.8 1,-0.2 4,-0.5 0.846 107.5 62.2 -67.3 -31.6 -74.6 18.5 -104.3 240 237 A Q H >X S+ 0 0 29 -4,-2.1 3,-2.1 1,-0.3 4,-1.7 0.933 94.2 59.5 -58.6 -47.2 -76.4 21.1 -102.3 241 238 A A H 3X S+ 0 0 6 -4,-2.0 4,-0.8 1,-0.3 -1,-0.3 0.793 95.6 64.9 -49.0 -32.8 -77.5 22.9 -105.4 242 239 A S H << S+ 0 0 2 -3,-0.8 -37,-0.3 -4,-0.7 -1,-0.3 0.719 106.9 40.3 -69.9 -23.5 -79.3 19.8 -106.5 243 240 A V H << S+ 0 0 61 -3,-2.1 -2,-0.2 -4,-0.5 -1,-0.2 0.905 112.4 55.8 -83.6 -50.2 -81.7 20.0 -103.5 244 241 A K H < S+ 0 0 133 -4,-1.7 -2,-0.2 6,-0.0 -3,-0.1 0.479 114.5 15.9 -52.7 -17.8 -82.1 23.9 -103.7 245 242 A H S < S- 0 0 74 -4,-0.8 5,-0.1 2,-0.0 -1,-0.0 -0.998 83.1 -80.5-159.9 155.8 -83.3 24.1 -107.4 246 243 A P >> - 0 0 71 0, 0.0 4,-2.5 0, 0.0 3,-0.7 -0.148 57.8 -96.9 -57.7 164.4 -84.7 22.3 -110.6 247 244 A Y H 3> S+ 0 0 8 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.826 120.1 56.8 -63.7 -37.4 -82.2 20.5 -112.7 248 245 A E H 3> S+ 0 0 126 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.862 114.9 39.4 -61.5 -36.9 -81.6 23.2 -115.3 249 246 A V H <> S+ 0 0 68 -3,-0.7 4,-1.1 2,-0.2 3,-0.4 0.891 113.4 55.3 -78.7 -39.9 -80.6 25.6 -112.5 250 247 A G H >X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 3,-0.7 0.909 103.7 53.3 -60.2 -46.6 -78.7 22.9 -110.6 251 248 A I H 3X S+ 0 0 17 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.803 104.2 57.0 -61.7 -27.0 -76.5 21.9 -113.5 252 249 A K H 3X S+ 0 0 117 -4,-0.6 4,-1.9 -3,-0.4 -1,-0.2 0.823 106.1 50.5 -73.5 -29.5 -75.4 25.6 -114.0 253 250 A E H < S+ 0 0 126 -4,-1.5 3,-0.8 1,-0.2 4,-0.3 0.982 115.0 40.8 -60.2 -55.3 -63.8 27.4 -110.2 261 258 A L H >< S+ 0 0 0 -4,-2.8 3,-2.3 1,-0.2 6,-0.4 0.905 107.4 63.2 -56.3 -45.7 -62.0 24.3 -109.0 262 259 A R H 3< S+ 0 0 30 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.800 107.3 43.3 -55.0 -31.8 -60.5 23.6 -112.4 263 260 A A T << S+ 0 0 65 -4,-1.4 -1,-0.3 -3,-0.8 -2,-0.2 0.354 90.7 112.8-100.1 5.2 -58.5 26.8 -112.3 264 261 A S S <> S- 0 0 20 -3,-2.3 4,-1.5 -4,-0.3 5,-0.1 -0.387 72.4-125.0 -79.2 155.1 -57.3 26.6 -108.7 265 262 A G H > S+ 0 0 53 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.911 112.5 59.1 -57.8 -42.3 -53.7 26.1 -107.5 266 263 A Q H > S+ 0 0 34 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.866 101.6 52.0 -60.8 -38.2 -54.9 23.2 -105.5 267 264 A A H > S+ 0 0 1 -6,-0.4 4,-2.1 -137,-0.2 -1,-0.3 0.912 111.7 48.8 -62.6 -37.3 -56.2 21.4 -108.6 268 265 A K H X S+ 0 0 142 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.935 114.0 45.5 -67.6 -43.9 -52.7 22.0 -110.1 269 266 A A H X S+ 0 0 1 -4,-3.3 4,-2.6 392,-0.3 -2,-0.2 0.918 112.5 48.8 -65.2 -45.6 -51.0 20.6 -107.0 270 267 A L H X S+ 0 0 12 -4,-2.9 4,-1.8 2,-0.2 -1,-0.2 0.921 112.4 48.4 -66.4 -39.2 -53.2 17.6 -106.6 271 268 A Q H X S+ 0 0 23 -4,-2.1 4,-1.8 -142,-0.3 -1,-0.2 0.933 110.2 53.3 -65.8 -40.1 -52.8 16.7 -110.2 272 269 A Y H X S+ 0 0 31 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.923 102.7 57.1 -53.1 -47.1 -49.0 17.2 -109.8 273 270 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.907 104.9 53.7 -56.6 -41.8 -49.0 14.8 -106.8 274 271 A F H X S+ 0 0 66 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.928 111.1 43.0 -56.8 -48.6 -50.4 12.2 -109.2 275 272 A F H X S+ 0 0 104 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.885 111.5 55.9 -67.3 -37.4 -47.7 12.6 -111.8 276 273 A A H >X S+ 0 0 0 -4,-3.1 3,-0.6 1,-0.2 4,-0.6 0.959 105.8 52.8 -54.2 -50.0 -45.1 12.7 -109.0 277 274 A E H >< S+ 0 0 15 -4,-2.7 3,-1.2 1,-0.3 4,-0.4 0.879 106.9 49.5 -61.4 -40.6 -46.3 9.4 -107.8 278 275 A K H >X S+ 0 0 114 -4,-1.6 3,-1.2 1,-0.2 4,-0.6 0.811 103.5 61.9 -65.8 -27.3 -46.0 7.6 -111.2 279 276 A S H << S+ 0 0 11 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.675 84.5 76.0 -77.6 -7.2 -42.6 8.9 -111.6 280 277 A A T << S+ 0 0 0 -3,-1.2 194,-0.4 -4,-0.6 -1,-0.2 0.773 90.0 60.1 -72.9 -23.1 -41.4 7.0 -108.5 281 278 A N T <4 S+ 0 0 67 -3,-1.2 2,-2.1 -4,-0.4 -1,-0.2 0.906 85.1 77.3 -62.3 -49.9 -41.5 3.9 -110.7 282 279 A K S < S+ 0 0 92 -4,-0.6 2,-0.2 -3,-0.2 -1,-0.2 -0.478 73.9 166.5 -67.5 83.4 -39.0 5.2 -113.2 283 280 A W + 0 0 14 -2,-2.1 8,-2.1 190,-0.0 2,-0.3 -0.657 12.9 163.6-102.0 156.4 -36.0 4.5 -110.9 284 281 A S E -J 290 0D 50 -2,-0.2 6,-0.2 190,-0.2 359,-0.2 -0.951 26.5-134.5-156.2 166.6 -32.3 4.5 -111.7 285 282 A T E >> -J 289 0D 22 4,-1.8 3,-2.0 -2,-0.3 4,-1.0 -0.999 30.7-111.3-124.7 126.4 -29.1 4.5 -109.9 286 283 A P T 34 S+ 0 0 79 0, 0.0 -2,-0.0 0, 0.0 357,-0.0 -0.443 112.9 55.8 -38.4 119.6 -26.1 6.7 -110.8 287 284 A S T 34 S- 0 0 120 -2,-0.1 -3,-0.0 1,-0.0 0, 0.0 0.240 129.6 -83.4 107.3 -5.8 -23.8 3.9 -112.0 288 285 A G T <4 S+ 0 0 65 -3,-2.0 2,-0.3 1,-0.3 -1,-0.0 0.590 76.3 140.5 98.5 17.7 -26.4 2.6 -114.5 289 286 A A E < -J 285 0D 12 -4,-1.0 -4,-1.8 4,-0.1 2,-0.3 -0.713 32.1-174.5 -84.0 144.7 -29.1 0.4 -113.0 290 287 A S E > -J 284 0D 17 -2,-0.3 4,-2.7 -6,-0.2 3,-0.4 -1.000 45.0-130.1-144.6 144.6 -32.5 1.1 -114.5 291 288 A W T 4 S+ 0 0 108 -8,-2.1 -7,-0.1 -2,-0.3 -1,-0.1 0.739 113.2 60.9 -51.8 -25.8 -36.2 0.3 -114.3 292 289 A K T 4 S+ 0 0 159 -9,-0.3 -1,-0.2 1,-0.1 -8,-0.1 0.887 114.8 27.8 -70.2 -46.5 -35.8 -0.2 -118.1 293 290 A T T 4 S+ 0 0 106 -3,-0.4 -2,-0.2 2,-0.0 -1,-0.1 0.877 105.7 81.1 -85.0 -45.6 -33.2 -2.9 -117.9 294 291 A A < - 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0 0 108 0, 0.0 39,-0.1 0, 0.0 -1,-0.1 -0.304 29.0 -98.7 -71.7 165.5 -68.0 0.3 -18.7 927 202 B V - 0 0 18 37,-0.3 -62,-0.2 1,-0.1 -61,-0.0 -0.702 46.7-100.2 -80.4 124.0 -66.2 0.4 -22.0 928 203 B P - 0 0 62 0, 0.0 -59,-0.3 0, 0.0 2,-0.1 -0.148 44.3-132.0 -35.3 127.9 -68.6 0.3 -25.0 929 204 B S - 0 0 106 -61,-0.1 -60,-0.0 -60,-0.0 36,-0.0 -0.417 22.1-170.9 -86.4 165.9 -68.6 -3.3 -26.3 930 205 B L > - 0 0 73 -2,-0.1 3,-1.3 1,-0.1 4,-0.2 -0.948 26.2-135.0-154.5 142.8 -68.3 -4.4 -29.9 931 206 B P T 3 S+ 0 0 136 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.792 108.0 47.7 -74.2 -26.7 -68.8 -7.9 -31.5 932 207 B N T >> S+ 0 0 88 1,-0.2 4,-2.2 2,-0.1 3,-0.7 0.094 77.4 124.2 -92.2 20.3 -65.6 -7.7 -33.6 933 208 B M H <> + 0 0 18 -3,-1.3 4,-1.9 1,-0.3 5,-0.2 0.894 66.8 53.6 -54.0 -53.5 -63.5 -6.5 -30.6 934 209 B D H 3> S+ 0 0 148 -3,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.848 113.9 44.3 -47.8 -41.0 -60.8 -9.2 -30.7 935 210 B S H <> S+ 0 0 63 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.875 104.7 62.4 -74.6 -38.6 -60.2 -8.4 -34.4 936 211 B V H X S+ 0 0 17 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.879 106.1 47.3 -54.1 -41.6 -60.2 -4.5 -33.8 937 212 B F H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.940 111.3 49.2 -65.1 -44.4 -57.2 -4.9 -31.6 938 213 B A H X S+ 0 0 63 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.798 111.4 50.6 -66.3 -28.6 -55.3 -7.2 -34.0 939 214 B E H X S+ 0 0 139 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.879 110.4 49.4 -74.7 -40.6 -56.0 -4.7 -36.8 940 215 B A H X S+ 0 0 16 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.890 110.7 50.5 -62.7 -46.2 -54.7 -1.9 -34.6 941 216 B I H X S+ 0 0 11 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.935 112.3 45.8 -54.6 -52.4 -51.6 -3.9 -33.9 942 217 B A H X S+ 0 0 60 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.835 112.4 52.8 -63.3 -30.5 -50.9 -4.6 -37.6 943 218 B K H X S+ 0 0 99 -4,-1.7 4,-3.5 2,-0.2 3,-0.3 0.933 111.3 44.8 -71.1 -47.4 -51.6 -0.9 -38.4 944 219 B V H X S+ 0 0 6 -4,-2.5 4,-2.3 1,-0.2 7,-0.2 0.864 110.7 53.6 -62.5 -41.4 -49.1 0.3 -35.8 945 220 B R H < S+ 0 0 140 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.766 117.0 40.1 -67.3 -23.4 -46.5 -2.3 -36.9 946 221 B K H < S+ 0 0 176 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.887 119.7 41.0 -93.3 -50.7 -46.9 -0.9 -40.5 947 222 B Q H < S+ 0 0 101 -4,-3.5 -3,-0.2 1,-0.2 -2,-0.2 0.968 130.9 26.2 -57.5 -52.4 -47.2 2.8 -39.8 948 223 B Y S >< S- 0 0 72 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.2 -0.592 82.0-160.8-119.2 71.1 -44.4 2.8 -37.1 949 224 B P T 3 S- 0 0 88 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.203 74.3 -3.8 -58.1 133.3 -42.0 -0.1 -37.7 950 225 B G T 3 S+ 0 0 62 1,-0.2 2,-0.6 -5,-0.2 -5,-0.1 0.470 95.6 126.7 68.5 3.8 -39.9 -1.0 -34.7 951 226 B V <> - 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