==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-SEP-94 2ALR . COMPND 2 MOLECULE: ALDEHYDE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR O.EL-KABBANI . 312 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13644.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 15 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 0 0 0 3 0 2 2 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 2 1 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 PARALLEL BRIDGES PER LADDER . 2 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 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 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 A 0 0 83 0, 0.0 39,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -53.3 6.1 12.7 46.3 2 2 A A - 0 0 28 37,-0.5 2,-0.2 14,-0.1 261,-0.1 -0.366 360.0-132.8 -82.5 158.0 5.9 12.5 42.5 3 3 A S - 0 0 59 -2,-0.1 12,-3.4 1,-0.1 13,-0.3 -0.629 30.8-134.6 -97.3 162.6 4.1 14.7 40.0 4 4 A C E -A 14 0A 64 10,-0.3 2,-0.3 -2,-0.2 8,-0.1 -0.568 4.0-129.4-116.8-179.0 2.1 12.9 37.3 5 5 A V E -A 13 0A 14 8,-2.2 8,-2.3 -2,-0.2 2,-0.5 -0.819 27.6-118.3-119.3 164.5 1.4 13.0 33.6 6 6 A L E -A 12 0A 87 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.941 25.7-153.3-108.5 123.5 -2.0 13.0 32.0 7 7 A L > - 0 0 6 4,-2.9 3,-2.0 -2,-0.5 197,-0.1 -0.588 33.7-104.0 -91.9 158.6 -2.8 10.0 29.8 8 8 A H T 3 S+ 0 0 101 195,-0.3 -1,-0.1 1,-0.3 170,-0.1 0.484 121.2 65.6 -58.4 -2.0 -5.3 10.2 26.9 9 9 A T T 3 S- 0 0 63 2,-0.2 -1,-0.3 171,-0.0 3,-0.1 0.821 119.1-109.9 -85.3 -36.4 -7.7 8.4 29.2 10 10 A G S < S+ 0 0 52 -3,-2.0 2,-0.2 1,-0.4 -2,-0.1 0.167 76.3 138.0 118.6 -1.9 -7.8 11.3 31.6 11 11 A Q - 0 0 30 96,-0.1 -4,-2.9 -5,-0.1 2,-0.5 -0.433 50.9-134.1 -74.5 141.3 -5.8 9.2 34.1 12 12 A K E -A 6 0A 136 -6,-0.2 -6,-0.2 -2,-0.2 -1,-0.0 -0.839 20.3-170.6 -98.7 129.4 -2.9 10.7 36.1 13 13 A M E -A 5 0A 2 -8,-2.3 -8,-2.2 -2,-0.5 29,-0.1 -0.979 23.1-123.7-124.9 117.4 0.2 8.7 36.2 14 14 A P E -A 4 0A 13 0, 0.0 -10,-0.3 0, 0.0 26,-0.0 -0.268 16.7-127.1 -58.0 148.5 3.0 9.7 38.6 15 15 A L S S+ 0 0 9 -12,-3.4 233,-3.0 232,-0.1 2,-0.4 0.683 94.6 52.6 -68.5 -23.5 6.4 10.2 36.9 16 16 A I B +b 248 0B 1 -13,-0.3 25,-0.4 231,-0.2 2,-0.3 -0.926 64.3 165.2-117.8 141.2 8.1 7.8 39.4 17 17 A G - 0 0 0 231,-1.3 2,-0.5 -2,-0.4 26,-0.2 -0.952 40.0-101.0-149.9 157.3 7.0 4.3 40.1 18 18 A L E -c 43 0B 3 24,-2.6 26,-2.8 -2,-0.3 2,-0.4 -0.735 30.9-144.2 -84.9 126.1 8.6 1.3 41.8 19 19 A G E -cd 44 251B 2 231,-2.2 233,-0.9 -2,-0.5 26,-0.1 -0.758 17.6-177.2 -90.3 137.1 10.0 -1.3 39.4 20 20 A T > + 0 0 1 24,-1.2 3,-2.0 -2,-0.4 -1,-0.1 0.285 42.1 127.8-110.4 2.6 9.6 -4.9 40.6 21 21 A W T 3 S+ 0 0 66 1,-0.3 -1,-0.1 23,-0.2 25,-0.0 0.741 87.1 9.8 -25.9 -63.7 11.5 -6.2 37.6 22 22 A K T 3 S+ 0 0 164 -3,-0.1 -1,-0.3 2,-0.1 2,-0.3 0.158 91.3 141.6-113.6 19.8 14.0 -8.4 39.5 23 23 A S < - 0 0 9 -3,-2.0 -3,-0.1 1,-0.1 230,-0.0 -0.420 52.5-123.5 -67.5 123.9 12.6 -8.2 43.0 24 24 A E > - 0 0 92 -2,-0.3 4,-3.0 1,-0.1 -1,-0.1 -0.369 18.4-123.7 -63.2 141.6 12.8 -11.5 44.9 25 25 A P H > S+ 0 0 57 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.865 113.0 50.6 -55.4 -33.0 9.4 -12.7 46.1 26 26 A G H 4 S+ 0 0 74 1,-0.2 4,-0.4 2,-0.1 3,-0.2 0.902 117.0 36.4 -70.3 -45.9 10.9 -12.7 49.7 27 27 A Q H > S+ 0 0 93 1,-0.2 4,-1.3 2,-0.1 3,-0.3 0.776 100.4 81.1 -79.6 -29.3 12.3 -9.1 49.6 28 28 A V H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 3,-0.4 0.856 85.2 52.5 -45.9 -54.8 9.5 -7.6 47.5 29 29 A K H X S+ 0 0 44 -4,-0.7 4,-2.3 1,-0.2 5,-0.3 0.932 107.0 52.3 -52.9 -50.1 6.8 -7.0 50.2 30 30 A A H > S+ 0 0 63 -4,-0.4 4,-1.6 -3,-0.3 -1,-0.2 0.869 110.6 51.5 -53.7 -35.5 9.1 -5.1 52.4 31 31 A A H X S+ 0 0 4 -4,-1.3 4,-2.2 -3,-0.4 5,-0.3 0.923 107.3 50.8 -67.3 -47.8 9.8 -3.0 49.4 32 32 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.919 112.5 45.8 -57.1 -49.5 6.2 -2.3 48.6 33 33 A K H X S+ 0 0 43 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.850 112.2 50.0 -63.8 -39.7 5.3 -1.1 52.1 34 34 A Y H X S+ 0 0 73 -4,-1.6 4,-2.4 -5,-0.3 3,-0.2 0.980 111.9 46.7 -62.6 -57.8 8.4 1.1 52.5 35 35 A A H X>S+ 0 0 0 -4,-2.2 5,-2.6 1,-0.2 4,-0.5 0.802 109.2 57.0 -52.2 -36.5 7.8 2.9 49.2 36 36 A L H ><5S+ 0 0 13 -4,-1.7 3,-1.2 -5,-0.3 -1,-0.2 0.954 108.5 46.0 -63.0 -47.9 4.2 3.2 50.1 37 37 A S H 3<5S+ 0 0 103 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.899 109.1 56.7 -59.5 -43.9 5.2 5.1 53.3 38 38 A V H 3<5S- 0 0 34 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.513 127.6 -86.9 -72.2 -4.4 7.6 7.2 51.4 39 39 A G T <<5S+ 0 0 16 -3,-1.2 -37,-0.5 -4,-0.5 -3,-0.2 0.424 75.2 145.1 116.9 -5.0 5.1 8.7 48.9 40 40 A Y < + 0 0 1 -5,-2.6 -1,-0.3 -6,-0.1 -23,-0.1 -0.449 14.4 167.4 -70.3 138.2 5.1 6.1 46.0 41 41 A R + 0 0 80 -25,-0.4 34,-2.7 -2,-0.2 2,-0.4 0.033 58.1 71.3-137.4 20.4 1.7 5.7 44.3 42 42 A H E - e 0 75B 1 32,-0.2 -24,-2.6 -29,-0.1 2,-0.4 -0.955 52.6-179.4-146.2 122.2 2.8 3.8 41.3 43 43 A I E -ce 18 76B 1 32,-2.3 34,-2.3 -2,-0.4 2,-0.6 -0.992 14.1-152.4-125.7 129.8 4.0 0.2 41.1 44 44 A D E +ce 19 77B 3 -26,-2.8 -24,-1.2 -2,-0.4 2,-0.2 -0.918 25.8 169.8-103.2 120.4 5.1 -1.5 37.9 45 45 A C - 0 0 0 32,-2.3 2,-0.3 -2,-0.6 -24,-0.1 -0.692 18.6-163.8-122.4 175.8 4.6 -5.3 37.9 46 46 A A >> - 0 0 0 -2,-0.2 3,-1.7 32,-0.2 4,-0.6 -0.918 27.8-131.7-162.9 132.3 4.8 -8.3 35.5 47 47 A A G >4 S+ 0 0 42 32,-0.9 3,-0.8 -2,-0.3 5,-0.2 0.831 108.8 59.2 -53.8 -32.1 3.5 -11.9 35.6 48 48 A I G 34 S+ 0 0 46 1,-0.2 -1,-0.3 31,-0.2 32,-0.0 0.716 88.1 69.9 -72.1 -20.6 7.0 -13.0 34.5 49 49 A Y G <4 S- 0 0 44 -3,-1.7 -1,-0.2 1,-0.1 -2,-0.2 0.790 96.9-143.3 -67.4 -20.9 8.7 -11.5 37.5 50 50 A G S << S+ 0 0 46 -3,-0.8 -3,-0.1 -4,-0.6 -2,-0.1 0.829 72.9 96.7 62.8 38.1 7.0 -14.2 39.4 51 51 A N >> + 0 0 0 -5,-0.5 4,-2.5 -27,-0.1 3,-0.7 0.243 36.9 114.2-135.5 8.1 6.3 -12.1 42.5 52 52 A E H 3> S+ 0 0 5 1,-0.2 4,-2.3 -6,-0.2 5,-0.1 0.837 76.1 53.8 -50.9 -41.8 2.8 -10.9 42.0 53 53 A P H 3> S+ 0 0 41 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.838 109.3 48.1 -64.4 -36.7 1.3 -12.8 45.0 54 54 A E H X> S+ 0 0 49 -3,-0.7 4,-1.8 2,-0.2 3,-0.7 0.941 113.5 47.6 -67.9 -46.7 3.9 -11.4 47.4 55 55 A I H 3X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.855 108.5 56.8 -59.5 -35.7 3.1 -8.0 46.0 56 56 A G H 3X S+ 0 0 0 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.773 106.2 49.2 -66.2 -29.3 -0.6 -8.9 46.4 57 57 A E H X S+ 0 0 0 -4,-1.8 3,-1.3 2,-0.2 4,-1.1 0.952 113.3 46.6 -64.5 -51.5 1.7 -6.3 50.7 59 59 A L H >X S+ 0 0 7 -4,-2.3 4,-3.1 1,-0.3 3,-0.8 0.886 105.5 62.0 -55.9 -41.2 -1.0 -4.4 48.9 60 60 A K H 3< S+ 0 0 111 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.748 103.8 50.4 -58.4 -24.9 -3.5 -6.4 50.9 61 61 A E H << S+ 0 0 112 -3,-1.3 7,-0.3 -4,-0.7 -1,-0.3 0.771 125.1 19.9 -88.2 -24.0 -2.0 -4.8 54.0 62 62 A D H << S+ 0 0 20 -4,-1.1 7,-2.9 -3,-0.8 2,-0.4 0.618 103.3 75.5-123.1 -12.9 -2.1 -1.2 52.9 63 63 A V B < S+k 69 0C 17 -4,-3.1 3,-0.1 -5,-0.2 5,-0.1 -0.832 79.2 12.7-108.4 147.6 -4.5 -0.4 50.1 64 64 A G S > S+ 0 0 17 5,-1.4 3,-0.6 -2,-0.4 -4,-0.0 -0.751 98.5 16.1 110.6-153.2 -8.3 -0.2 50.2 65 65 A P T 3 S- 0 0 130 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.804 132.8 -3.2 -26.2 -87.3 -11.2 0.1 52.8 66 66 A G T 3 S+ 0 0 81 -3,-0.1 2,-0.1 3,-0.0 -2,-0.1 0.114 109.9 118.8-106.1 21.0 -9.8 1.1 56.1 67 67 A K S < S- 0 0 70 -3,-0.6 -3,-0.1 2,-0.1 -5,-0.1 -0.257 77.9-101.2 -85.3 170.0 -6.2 1.0 54.9 68 68 A A S S+ 0 0 92 -7,-0.3 -5,-0.2 1,-0.2 -6,-0.1 0.930 106.2 31.2 -52.7 -58.8 -3.4 3.6 54.6 69 69 A V B S-k 63 0C 3 -7,-2.9 -5,-1.4 2,-0.0 2,-0.3 -0.938 81.7-129.6-115.7 133.5 -3.7 4.2 50.9 70 70 A P > - 0 0 36 0, 0.0 3,-2.7 0, 0.0 4,-0.4 -0.585 19.2-123.7 -80.2 135.6 -7.0 4.0 49.0 71 71 A R G > S+ 0 0 30 1,-0.3 3,-1.7 -2,-0.3 -8,-0.0 0.823 110.1 61.8 -43.9 -43.5 -7.1 2.0 45.8 72 72 A E G 3 S+ 0 0 147 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.727 101.5 55.0 -60.6 -21.0 -8.3 5.0 43.8 73 73 A E G < S+ 0 0 115 -3,-2.7 2,-0.4 2,-0.0 -1,-0.3 0.441 95.6 79.6 -92.2 -6.0 -5.0 6.7 44.7 74 74 A L < - 0 0 4 -3,-1.7 2,-0.6 -4,-0.4 -32,-0.2 -0.849 63.4-150.1-111.2 142.8 -2.7 4.0 43.4 75 75 A F E -e 42 0B 8 -34,-2.7 -32,-2.3 -2,-0.4 2,-0.5 -0.963 18.7-172.7-111.3 116.1 -1.6 3.3 39.8 76 76 A V E -e 43 0B 0 -2,-0.6 31,-2.1 -34,-0.2 32,-1.7 -0.957 1.7-169.8-116.4 126.2 -0.9 -0.4 39.2 77 77 A T E +ef 44 108B 1 -34,-2.3 -32,-2.3 -2,-0.5 2,-0.2 -0.887 8.9 168.5-116.1 149.2 0.6 -1.8 36.0 78 78 A S E - f 0 109B 0 30,-1.8 32,-2.7 -2,-0.4 2,-0.4 -0.864 19.6-133.3-144.6 172.6 1.0 -5.4 34.8 79 79 A K E - f 0 110B 1 -2,-0.2 -32,-0.9 30,-0.2 2,-0.4 -0.995 13.8-123.3-143.2 143.0 1.9 -7.1 31.6 80 80 A L E - f 0 111B 1 30,-2.7 32,-1.8 -2,-0.4 33,-0.4 -0.649 39.3-130.8 -77.6 126.5 0.8 -10.0 29.4 81 81 A W > - 0 0 26 -2,-0.4 3,-1.4 31,-0.1 -1,-0.1 -0.278 20.1-103.4 -77.6 166.4 3.6 -12.5 28.9 82 82 A N G > S+ 0 0 1 1,-0.3 35,-1.3 41,-0.1 3,-0.6 0.744 116.5 56.5 -59.1 -35.6 4.9 -14.0 25.6 83 83 A T G 3 S+ 0 0 6 1,-0.2 37,-1.2 33,-0.2 -1,-0.3 0.426 100.0 65.0 -78.8 -1.5 3.2 -17.4 26.0 84 84 A K G < + 0 0 31 -3,-1.4 -1,-0.2 1,-0.1 -2,-0.1 -0.149 61.6 112.0-116.7 41.0 -0.1 -15.7 26.4 85 85 A H < + 0 0 2 -3,-0.6 -1,-0.1 32,-0.3 -2,-0.1 0.551 45.0 109.5 -88.3 -11.9 -0.6 -14.1 22.9 86 86 A H S >> S- 0 0 50 -3,-0.2 3,-2.7 1,-0.1 4,-1.5 -0.520 75.0-130.4 -69.9 129.1 -3.5 -16.3 21.9 87 87 A P H 3> S+ 0 0 58 0, 0.0 4,-0.6 0, 0.0 3,-0.4 0.856 110.4 54.0 -44.7 -43.3 -6.7 -14.4 21.8 88 88 A E H 34 S+ 0 0 143 1,-0.2 -2,-0.1 2,-0.1 -3,-0.0 0.630 110.3 47.4 -67.7 -18.3 -8.2 -17.2 23.9 89 89 A D H <> S+ 0 0 26 -3,-2.7 4,-1.7 2,-0.1 -1,-0.2 0.668 89.1 81.7 -99.7 -18.7 -5.5 -16.9 26.5 90 90 A V H X S+ 0 0 0 -4,-1.5 4,-1.7 -3,-0.4 5,-0.2 0.942 92.9 45.6 -51.3 -57.7 -5.4 -13.1 27.0 91 91 A E H X S+ 0 0 59 -4,-0.6 4,-2.4 1,-0.2 3,-0.4 0.954 113.2 46.4 -56.3 -55.8 -8.3 -12.9 29.4 92 92 A P H > S+ 0 0 72 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.816 108.9 57.4 -59.9 -29.2 -7.5 -15.8 31.7 93 93 A A H X S+ 0 0 21 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.927 109.6 44.7 -66.2 -41.0 -3.9 -14.6 31.9 94 94 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 -3,-0.4 -1,-0.2 0.889 110.4 53.7 -66.7 -45.1 -5.1 -11.2 33.2 95 95 A R H X S+ 0 0 123 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.834 106.7 53.0 -60.6 -34.8 -7.5 -12.8 35.6 96 96 A K H X S+ 0 0 128 -4,-1.7 4,-2.5 -5,-0.2 -1,-0.2 0.906 110.6 47.4 -66.1 -42.0 -4.7 -14.8 37.0 97 97 A T H X S+ 0 0 5 -4,-1.5 4,-2.8 1,-0.2 -2,-0.2 0.871 110.5 51.9 -65.8 -41.1 -2.7 -11.6 37.5 98 98 A L H X>S+ 0 0 13 -4,-2.6 5,-2.1 2,-0.2 4,-0.6 0.889 110.9 47.8 -64.6 -39.8 -5.6 -9.9 39.2 99 99 A A H ><5S+ 0 0 61 -4,-2.0 3,-0.6 3,-0.2 -2,-0.2 0.965 114.0 46.7 -63.7 -53.1 -6.1 -12.9 41.6 100 100 A D H 3<5S+ 0 0 40 -4,-2.5 -44,-0.2 1,-0.3 -2,-0.2 0.929 118.7 39.5 -53.2 -54.3 -2.4 -12.9 42.4 101 101 A L H 3<5S- 0 0 1 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.2 0.537 106.9-133.9 -73.7 -8.9 -2.2 -9.1 42.9 102 102 A Q T <<5 + 0 0 98 -3,-0.6 2,-0.3 -4,-0.6 -3,-0.2 0.863 56.2 138.3 53.5 46.4 -5.6 -9.4 44.6 103 103 A L < - 0 0 23 -5,-2.1 -1,-0.2 -6,-0.2 3,-0.1 -0.780 58.5-139.8-116.0 162.5 -7.1 -6.4 42.7 104 104 A E S S- 0 0 171 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.540 87.3 -5.1 -92.9 -14.8 -10.5 -5.8 41.0 105 105 A Y - 0 0 47 -7,-0.1 -1,-0.3 50,-0.0 2,-0.3 -0.957 66.3-120.7-169.9 161.5 -8.8 -4.0 38.0 106 106 A L E - g 0 155B 0 48,-2.0 50,-1.7 -2,-0.3 3,-0.2 -0.763 9.8-147.8-108.2 155.8 -5.5 -2.8 36.7 107 107 A D E S+ 0 0 10 -31,-2.1 50,-0.8 1,-0.3 2,-0.4 0.820 87.1 16.8 -89.4 -41.2 -4.7 0.8 35.7 108 108 A L E -fg 77 157B 1 -32,-1.7 -30,-1.8 48,-0.2 2,-0.5 -0.996 64.9-171.0-136.8 130.9 -2.4 -0.0 32.9 109 109 A Y E -fg 78 158B 2 48,-2.4 50,-2.8 -2,-0.4 2,-0.3 -0.973 12.4-167.2-123.7 117.1 -1.9 -3.3 31.1 110 110 A L E -fg 79 159B 0 -32,-2.7 -30,-2.7 -2,-0.5 2,-0.9 -0.753 27.3-125.4-108.2 154.7 0.9 -3.8 28.7 111 111 A M E -fg 80 160B 0 48,-1.8 50,-1.6 -2,-0.3 -30,-0.1 -0.841 28.3-148.2 -92.8 108.6 1.8 -6.3 26.0 112 112 A H S S+ 0 0 17 -32,-1.8 -1,-0.2 -2,-0.9 -31,-0.1 0.852 72.0 1.5 -46.8 -48.5 5.2 -7.3 27.2 113 113 A W - 0 0 21 -33,-0.4 49,-0.1 2,-0.1 50,-0.1 -0.977 64.2-128.1-141.7 154.7 6.7 -8.1 23.8 114 114 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 25,-0.2 0.833 92.7 62.7 -73.6 -28.8 5.4 -7.9 20.3 115 115 A Y S S- 0 0 1 191,-0.2 2,-0.3 23,-0.1 21,-0.1 -0.673 78.8-131.2 -99.9 154.0 6.4 -11.5 19.5 116 116 A A E -L 135 0D 1 19,-0.6 19,-1.9 21,-0.3 2,-0.3 -0.707 1.7-139.0-111.2 156.9 5.2 -14.6 21.1 117 117 A F E -L 134 0D 2 -35,-1.3 -32,-0.3 17,-0.3 17,-0.3 -0.661 58.1 -63.3-100.4 156.8 6.5 -17.8 22.6 118 118 A E - 0 0 93 15,-3.1 17,-0.2 -2,-0.3 -1,-0.1 -0.169 67.2 -94.5 -48.6 125.8 4.8 -21.1 22.0 119 119 A R S S+ 0 0 107 15,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.168 82.9 71.2 -43.5 118.5 1.3 -21.2 23.4 120 120 A G S S- 0 0 22 -37,-1.2 -3,-0.1 -3,-0.1 -37,-0.1 -0.975 86.0 -72.5 160.5-173.8 1.3 -22.7 26.9 121 121 A D S S+ 0 0 142 -2,-0.3 -1,-0.1 3,-0.0 -38,-0.1 0.759 92.6 88.6 -89.6 -26.2 2.2 -22.6 30.6 122 122 A N - 0 0 94 1,-0.2 -1,-0.0 -3,-0.1 -4,-0.0 -0.672 69.3-149.8 -76.6 111.4 5.9 -23.0 30.6 123 123 A P S S+ 0 0 48 0, 0.0 -1,-0.2 0, 0.0 -41,-0.1 0.658 89.0 39.0 -54.0 -23.3 7.1 -19.4 30.4 124 124 A F S S- 0 0 82 2,-0.1 2,-0.6 -7,-0.0 -3,-0.0 -0.561 74.3-170.6-131.6 72.7 10.3 -20.4 28.5 125 125 A P + 0 0 7 0, 0.0 8,-3.1 0, 0.0 2,-0.3 -0.493 21.0 178.0 -67.3 109.3 9.6 -23.2 26.0 126 126 A K B -M 132 0E 128 -2,-0.6 6,-0.2 6,-0.2 2,-0.2 -0.848 29.9-133.3-119.3 156.4 12.9 -24.4 24.8 127 127 A N > - 0 0 78 4,-3.5 3,-2.3 -2,-0.3 4,-0.2 -0.565 46.7 -94.4 -93.0 163.1 14.4 -27.0 22.6 128 128 A A T 3 S+ 0 0 119 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.624 124.0 63.8 -56.2 -14.5 17.3 -29.1 23.8 129 129 A D T 3 S- 0 0 110 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.333 120.9-106.2 -92.3 7.9 19.8 -26.7 22.2 130 130 A G S < S+ 0 0 29 -3,-2.3 2,-0.2 1,-0.3 -2,-0.2 0.533 78.0 138.1 81.7 6.3 18.6 -24.0 24.5 131 131 A T - 0 0 49 -4,-0.2 -4,-3.5 1,-0.1 -1,-0.3 -0.615 55.4-105.9 -87.6 146.4 16.7 -22.4 21.6 132 132 A I B -M 126 0E 5 -6,-0.2 2,-1.0 -2,-0.2 -6,-0.2 -0.520 12.6-137.1 -78.6 136.1 13.2 -20.9 22.0 133 133 A C - 0 0 25 -8,-3.1 -15,-3.1 -2,-0.3 -1,-0.1 -0.800 37.2-168.2 -90.2 96.0 10.0 -22.5 20.7 134 134 A Y E -L 117 0D 76 -2,-1.0 2,-0.3 -17,-0.3 -17,-0.3 -0.058 11.3-140.7 -78.3-177.9 8.3 -19.4 19.2 135 135 A D E -L 116 0D 56 -19,-1.9 -19,-0.6 -17,-0.2 -17,-0.1 -0.956 11.3-134.5-144.4 156.9 4.7 -18.8 18.0 136 136 A S + 0 0 97 -2,-0.3 -18,-0.0 -21,-0.1 -19,-0.0 0.291 50.3 136.9-100.3 6.9 3.2 -16.9 15.1 137 137 A T - 0 0 14 1,-0.1 -21,-0.3 2,-0.1 2,-0.3 -0.307 53.7-128.2 -55.4 134.3 0.3 -14.9 16.7 138 138 A H >> - 0 0 45 1,-0.1 3,-1.5 -23,-0.1 4,-1.5 -0.664 10.7-127.1 -85.5 142.0 0.3 -11.4 15.3 139 139 A Y H 3> S+ 0 0 12 -2,-0.3 4,-2.3 1,-0.3 -1,-0.1 0.714 110.5 64.3 -60.8 -20.4 0.2 -8.7 17.9 140 140 A K H 3> S+ 0 0 73 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.828 103.2 50.7 -70.3 -28.8 -2.7 -7.2 16.2 141 141 A E H <> S+ 0 0 101 -3,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.914 112.2 42.4 -72.1 -49.5 -4.5 -10.4 17.1 142 142 A T H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.893 109.9 62.5 -66.9 -34.4 -3.6 -10.3 20.8 143 143 A W H X S+ 0 0 1 -4,-2.3 4,-1.8 1,-0.2 3,-0.3 0.935 99.3 50.9 -56.1 -50.7 -4.4 -6.6 20.7 144 144 A K H X S+ 0 0 75 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.858 109.1 53.2 -56.1 -35.3 -8.1 -7.1 19.8 145 145 A A H X S+ 0 0 21 -4,-1.2 4,-0.6 1,-0.2 3,-0.4 0.895 104.6 54.5 -68.0 -38.2 -8.3 -9.6 22.7 146 146 A L H >X S+ 0 0 0 -4,-2.0 3,-1.2 -3,-0.3 4,-1.0 0.875 100.0 61.9 -61.3 -39.2 -6.9 -7.0 25.1 147 147 A E H 3X S+ 0 0 19 -4,-1.8 4,-2.0 1,-0.3 3,-0.5 0.888 93.4 61.9 -57.2 -37.3 -9.6 -4.5 24.0 148 148 A A H 3X S+ 0 0 47 -4,-1.0 4,-2.6 -3,-0.4 -1,-0.3 0.836 99.1 60.4 -57.5 -29.2 -12.3 -6.8 25.3 149 149 A L H S+ 0 0 1 -3,-1.2 5,-2.9 -4,-0.6 4,-0.8 0.873 103.5 45.0 -64.9 -45.3 -10.6 -6.3 28.7 150 150 A V H <5S+ 0 0 42 -4,-1.0 3,-0.2 -3,-0.5 -1,-0.2 0.891 113.9 51.8 -68.9 -36.8 -11.1 -2.6 28.9 151 151 A A H <5S+ 0 0 85 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.949 109.7 48.0 -63.9 -47.1 -14.7 -3.0 27.7 152 152 A K H <5S- 0 0 117 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.707 117.2-119.9 -67.2 -15.6 -15.2 -5.6 30.4 153 153 A G T <5S+ 0 0 45 -4,-0.8 -3,-0.2 -3,-0.2 -2,-0.1 0.808 77.5 123.3 81.9 34.1 -13.7 -3.1 32.8 154 154 A L S - 0 0 4 -2,-0.4 4,-2.1 149,-0.1 5,-0.2 -0.299 32.4 -98.1 -84.4 173.5 9.2 -0.1 17.4 165 165 A S H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.907 124.2 50.5 -57.6 -47.5 7.7 2.8 15.5 166 166 A R H > S+ 0 0 169 147,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.939 110.6 51.9 -55.4 -47.5 6.4 0.7 12.7 167 167 A Q H > S+ 0 0 10 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 106.8 51.8 -55.0 -47.6 4.9 -1.7 15.2 168 168 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.885 111.5 46.8 -57.7 -45.6 3.1 1.1 17.0 169 169 A D H X S+ 0 0 56 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.887 108.1 57.1 -66.6 -39.5 1.5 2.4 13.8 170 170 A D H < S+ 0 0 43 -4,-2.5 4,-0.3 -5,-0.2 -2,-0.2 0.951 110.9 42.1 -57.5 -49.8 0.6 -1.1 12.8 171 171 A I H >X S+ 0 0 1 -4,-2.4 4,-1.9 1,-0.2 3,-1.8 0.925 111.4 57.1 -63.0 -42.8 -1.4 -1.6 16.0 172 172 A L H 3< S+ 0 0 15 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.846 96.9 61.7 -56.3 -39.2 -2.9 1.9 15.7 173 173 A S T 3< S+ 0 0 97 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.628 116.3 31.8 -67.8 -8.6 -4.3 1.3 12.3 174 174 A V T <4 S+ 0 0 51 -3,-1.8 -2,-0.2 -4,-0.3 -1,-0.2 0.596 95.2 113.3-118.0 -23.2 -6.5 -1.5 13.7 175 175 A A < - 0 0 25 -4,-1.9 3,-0.1 1,-0.1 -31,-0.0 -0.178 37.6-178.5 -61.9 142.8 -7.2 -0.3 17.3 176 176 A S S S+ 0 0 103 1,-0.3 2,-0.6 -32,-0.0 -1,-0.1 0.654 89.4 50.3-101.7 -33.7 -10.5 0.8 18.8 177 177 A V S S- 0 0 36 -20,-0.0 -1,-0.3 0, 0.0 -30,-0.1 -0.927 90.9-136.4-107.7 116.5 -8.7 1.5 22.0 178 178 A R - 0 0 121 -2,-0.6 -20,-0.3 -3,-0.1 -6,-0.0 -0.605 26.1-110.3 -75.8 130.3 -5.6 3.6 21.5 179 179 A P - 0 0 1 0, 0.0 -20,-0.2 0, 0.0 -171,-0.1 -0.322 27.0-160.9 -57.3 134.7 -2.6 2.4 23.4 180 180 A A + 0 0 1 -22,-2.9 25,-2.6 1,-0.1 2,-0.3 0.903 64.3 31.2 -85.8 -44.6 -1.8 4.9 26.2 181 181 A V E -hi 159 205B 0 -23,-0.7 -21,-2.3 23,-0.2 2,-0.4 -0.850 53.7-156.6-121.7 155.7 1.8 4.1 27.1 182 182 A L E -hi 160 206B 0 23,-2.4 25,-3.0 -2,-0.3 2,-0.6 -0.997 17.7-160.8-127.0 117.3 5.0 2.8 25.4 183 183 A Q E +hi 161 207B 7 -23,-2.7 -21,-2.0 -2,-0.4 2,-0.3 -0.900 25.8 143.5-105.4 116.7 7.5 1.2 27.8 184 184 A V E - i 0 208B 6 23,-2.3 25,-2.4 -2,-0.6 2,-0.5 -0.871 55.3 -77.3-142.6 177.6 11.1 0.8 26.7 185 185 A E E + i 0 209B 3 -2,-0.3 2,-0.4 23,-0.2 25,-0.2 -0.631 56.8 167.3 -76.2 122.8 14.7 0.9 27.7 186 186 A C + 0 0 0 23,-1.8 27,-0.3 -2,-0.5 5,-0.2 -0.986 10.4 122.5-146.4 133.9 15.7 4.6 28.1 187 187 A H B > S-N 190 0F 0 3,-1.7 3,-1.3 -2,-0.4 25,-0.1 -0.925 73.8 -72.8-169.2 174.9 18.7 6.3 29.6 188 188 A P T 3 S+ 0 0 1 0, 0.0 3,-0.5 0, 0.0 94,-0.1 0.735 130.9 49.6 -57.7 -21.9 21.5 8.7 28.5 189 189 A Y T 3 S+ 0 0 15 1,-0.3 95,-2.6 92,-0.2 93,-1.7 0.670 124.9 30.2 -87.4 -18.3 23.3 6.0 26.4 190 190 A L B < S+N 187 0F 8 -3,-1.3 -3,-1.7 93,-0.2 -1,-0.3 -0.663 74.3 168.6-138.7 71.6 20.0 5.0 24.8 191 191 A A - 0 0 2 -3,-0.5 5,-0.1 -5,-0.2 -1,-0.1 0.635 30.4-147.1 -63.1 -20.7 18.1 8.4 24.8 192 192 A Q > + 0 0 21 1,-0.1 4,-2.0 3,-0.1 5,-0.2 0.832 37.6 157.9 52.5 40.6 15.3 7.1 22.4 193 193 A N H > + 0 0 68 2,-0.2 4,-1.0 1,-0.2 -1,-0.1 0.742 68.3 45.9 -64.3 -33.6 14.9 10.6 20.8 194 194 A E H > S+ 0 0 98 2,-0.2 4,-1.7 1,-0.1 -1,-0.2 0.911 116.5 46.0 -76.1 -43.7 13.3 9.5 17.5 195 195 A L H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.777 109.6 52.3 -68.1 -36.5 10.9 7.1 19.2 196 196 A I H X S+ 0 0 25 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.918 112.2 47.4 -68.2 -41.4 9.8 9.6 21.9 197 197 A A H X S+ 0 0 50 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.865 111.9 49.8 -65.1 -39.0 9.1 12.1 19.3 198 198 A H H X S+ 0 0 31 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.898 110.7 49.2 -65.0 -45.0 7.2 9.4 17.3 199 199 A C H X>S+ 0 0 1 -4,-2.4 5,-3.0 2,-0.2 4,-1.3 0.800 110.1 53.4 -60.3 -36.8 5.2 8.5 20.3 200 200 A Q H <5S+ 0 0 149 -4,-1.7 3,-0.4 2,-0.2 -2,-0.2 0.918 107.1 49.2 -64.5 -50.6 4.5 12.2 20.8 201 201 A A H <5S+ 0 0 87 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.767 116.5 45.9 -61.0 -27.2 3.2 12.6 17.3 202 202 A R H <5S- 0 0 67 -4,-1.2 -2,-0.2 -5,-0.1 -1,-0.2 0.628 115.8-107.2 -94.7 -17.0 1.0 9.5 18.0 203 203 A G T <5S+ 0 0 41 -4,-1.3 2,-0.4 -3,-0.4 -195,-0.3 0.698 71.9 131.0 97.6 21.6 -0.4 10.3 21.5 204 204 A L < - 0 0 8 -5,-3.0 -1,-0.3 -8,-0.1 2,-0.2 -0.853 49.9-136.1-108.2 141.9 1.5 7.8 23.6 205 205 A E E -i 181 0B 62 -25,-2.6 -23,-2.4 -2,-0.4 2,-0.5 -0.649 24.0-127.4 -92.1 152.0 3.3 8.6 26.8 206 206 A V E -i 182 0B 10 39,-0.3 41,-1.9 -2,-0.2 2,-0.5 -0.889 17.8-165.9-109.2 127.8 6.8 7.0 27.3 207 207 A T E -ij 183 247B 2 -25,-3.0 -23,-2.3 -2,-0.5 2,-0.4 -0.931 12.8-146.8-114.3 123.0 7.9 5.0 30.3 208 208 A A E -ij 184 248B 0 39,-3.9 41,-2.0 -2,-0.5 2,-0.3 -0.726 12.2-172.0 -93.6 132.9 11.6 4.3 30.8 209 209 A Y E S+i 185 0B 17 -25,-2.4 -23,-1.8 -2,-0.4 4,-0.1 -0.868 72.5 27.1-116.3 149.4 13.0 1.2 32.3 210 210 A S > + 0 0 16 39,-0.5 3,-1.3 -2,-0.3 -1,-0.2 0.961 69.6 168.6 60.7 52.9 16.7 0.7 33.2 211 211 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 30,-0.1 0.649 73.9 55.5 -68.9 -21.8 17.1 4.5 33.7 212 212 A L T 3 0 0 51 1,-0.3 4,-0.3 -25,-0.1 5,-0.2 0.104 360.0 360.0 -99.7 20.1 20.5 4.0 35.3 213 213 A G < 0 0 39 -3,-1.3 -1,-0.3 -27,-0.3 72,-0.0 0.000 360.0 360.0 35.3 360.0 21.4 2.2 32.1 214 ! 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 0.0 215 226 A V 0 0 106 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 114.7 29.4 2.9 33.7 216 227 A L > + 0 0 5 -4,-0.3 3,-0.8 1,-0.2 6,-0.2 0.797 360.0 55.7 -68.8 -32.5 26.7 5.5 33.2 217 228 A L T 3 S+ 0 0 55 1,-0.3 -1,-0.2 -5,-0.2 2,-0.1 0.793 102.3 59.1 -72.6 -24.5 26.9 6.3 36.9 218 229 A E T 3 S+ 0 0 130 -3,-0.1 -1,-0.3 4,-0.1 -2,-0.1 -0.175 73.9 125.4 -96.1 37.7 30.6 6.9 36.5 219 230 A E X> - 0 0 37 -3,-0.8 4,-2.5 1,-0.1 3,-0.8 -0.874 61.5-136.9 -99.1 126.5 30.4 9.7 33.9 220 231 A P H 3> S+ 0 0 98 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.864 105.8 55.5 -47.2 -42.1 32.2 12.9 34.9 221 232 A V H 3> S+ 0 0 24 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.895 111.9 41.6 -59.1 -43.2 29.2 14.9 33.7 222 233 A V H <> S+ 0 0 0 -3,-0.8 4,-1.6 2,-0.2 -1,-0.2 0.798 114.4 52.5 -74.3 -29.8 26.8 13.0 36.0 223 234 A L H X S+ 0 0 68 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.822 107.4 52.7 -75.1 -29.7 29.3 13.1 38.8 224 235 A A H X S+ 0 0 51 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.932 109.5 47.1 -72.2 -42.3 29.6 16.8 38.5 225 236 A L H X S+ 0 0 7 -4,-1.6 4,-3.1 2,-0.2 6,-0.2 0.881 109.3 55.6 -65.3 -35.9 25.8 17.4 38.7 226 237 A A H X>S+ 0 0 10 -4,-1.6 5,-2.3 2,-0.2 4,-1.0 0.916 112.7 41.5 -59.7 -44.9 25.7 15.1 41.7 227 238 A E H <5S+ 0 0 174 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.855 114.6 53.3 -70.3 -37.9 28.2 17.2 43.5 228 239 A K H <5S+ 0 0 128 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.887 119.8 31.0 -67.4 -38.9 26.5 20.3 42.2 229 240 A Y H <5S- 0 0 40 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.386 104.6-114.2-102.9 3.8 23.1 19.4 43.6 230 241 A G T <5S+ 0 0 69 -4,-1.0 2,-0.3 1,-0.3 -3,-0.2 0.914 78.2 123.6 64.7 41.1 23.9 17.3 46.7 231 242 A R < - 0 0 58 -5,-2.3 -1,-0.3 -6,-0.2 -2,-0.1 -0.811 64.7-101.1-128.8 170.2 22.4 14.3 45.0 232 243 A S > - 0 0 24 -2,-0.3 4,-1.7 -3,-0.1 3,-0.5 -0.520 35.2-110.8 -89.3 159.8 23.4 10.8 43.9 233 244 A P H > S+ 0 0 38 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.834 119.2 54.3 -59.6 -30.9 24.4 9.9 40.4 234 245 A A H > S+ 0 0 18 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.849 103.3 53.9 -72.3 -33.2 21.2 7.9 40.1 235 246 A Q H > S+ 0 0 6 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.839 106.9 54.1 -69.4 -30.3 19.0 10.8 41.1 236 247 A I H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 3,-0.2 0.974 107.1 48.8 -65.5 -51.9 20.6 12.8 38.4 237 248 A L H X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.881 114.6 46.4 -54.7 -39.4 19.8 10.2 35.8 238 249 A L H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 -1,-0.2 0.799 108.5 55.6 -73.3 -31.2 16.2 10.1 37.0 239 250 A R H X S+ 0 0 22 -4,-2.0 4,-3.2 -3,-0.2 5,-0.3 0.898 104.4 54.4 -67.5 -41.0 16.0 14.0 37.0 240 251 A W H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.945 114.4 39.9 -58.5 -47.7 17.0 14.1 33.4 241 252 A Q H <>S+ 0 0 0 -4,-1.4 5,-3.1 -5,-0.2 -2,-0.2 0.968 115.9 49.6 -65.7 -53.2 14.2 11.7 32.5 242 253 A V H ><5S+ 0 0 6 -4,-3.0 3,-2.0 1,-0.2 -2,-0.2 0.914 112.8 47.2 -48.5 -54.6 11.6 13.3 34.8 243 254 A Q H 3<5S+ 0 0 52 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.856 107.0 57.9 -56.8 -40.4 12.4 16.8 33.5 244 255 A R T 3<5S- 0 0 49 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.465 122.4-113.2 -68.5 -3.2 12.2 15.4 30.0 245 256 A K T < 5S+ 0 0 143 -3,-2.0 2,-0.5 1,-0.3 -39,-0.3 0.711 71.0 143.1 73.5 23.6 8.7 14.4 31.0 246 257 A V < - 0 0 4 -5,-3.1 -1,-0.3 -6,-0.2 2,-0.2 -0.850 50.9-127.6 -99.3 125.8 9.7 10.7 30.8 247 258 A I E - j 0 207B 1 -41,-1.9 -39,-3.9 -2,-0.5 2,-0.4 -0.523 26.7-156.5 -71.6 132.9 8.1 8.3 33.3 248 259 A C E -bj 16 208B 0 -233,-3.0 -231,-1.3 -2,-0.2 -39,-0.2 -0.941 18.2-168.8-119.0 139.3 10.7 6.2 35.1 249 260 A I - 0 0 7 -41,-2.0 -39,-0.5 -2,-0.4 2,-0.4 -0.787 14.3-174.9-122.6 81.2 10.3 2.9 36.9 250 261 A P - 0 0 2 0, 0.0 -231,-2.2 0, 0.0 2,-0.4 -0.658 17.9-139.9 -80.4 129.3 13.5 2.3 38.8 251 262 A K B +d 19 0B 72 -2,-0.4 2,-0.3 -233,-0.2 -231,-0.2 -0.770 36.1 147.5 -93.4 131.8 13.6 -1.1 40.5 252 263 A S - 0 0 16 -233,-0.9 -229,-0.1 -2,-0.4 -231,-0.0 -0.981 39.0-167.1-162.2 150.3 15.0 -1.4 43.9 253 264 A I + 0 0 31 -2,-0.3 -1,-0.1 1,-0.0 -221,-0.0 0.208 68.0 95.0-123.5 13.0 14.6 -3.4 47.2 254 265 A T >> - 0 0 46 1,-0.1 4,-2.5 -223,-0.0 3,-1.3 -0.942 66.5-144.6-114.1 110.5 16.7 -1.1 49.4 255 266 A P H 3> S+ 0 0 62 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.722 97.4 56.3 -39.9 -41.3 14.9 1.6 51.4 256 267 A S H 3> S+ 0 0 67 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.886 114.9 37.6 -63.5 -43.3 17.7 4.2 51.1 257 268 A R H <> S+ 0 0 141 -3,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.824 112.5 58.6 -78.3 -33.9 17.6 4.0 47.3 258 269 A I H X S+ 0 0 0 -4,-2.5 4,-0.7 2,-0.2 -2,-0.2 0.930 109.4 45.3 -59.7 -44.8 13.8 3.7 47.3 259 270 A L H >X S+ 0 0 64 -4,-2.6 3,-1.4 -5,-0.2 4,-1.0 0.977 114.5 46.9 -61.0 -56.8 13.7 7.0 49.2 260 271 A Q H 3< S+ 0 0 61 -4,-1.9 3,-0.4 1,-0.3 -1,-0.2 0.829 102.9 64.6 -52.9 -41.5 16.2 8.8 46.9 261 272 A N H 3< S+ 0 0 8 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.713 106.3 41.9 -57.8 -27.4 14.5 7.5 43.8 262 273 A I H << S+ 0 0 3 -3,-1.4 2,-1.6 -4,-0.7 3,-0.3 0.643 95.9 81.5 -95.0 -19.9 11.4 9.5 44.4 263 274 A K < + 0 0 77 -4,-1.0 -1,-0.2 -3,-0.4 -261,-0.0 -0.476 57.8 104.8 -88.1 65.7 13.1 12.6 45.6 264 275 A V + 0 0 0 -2,-1.6 3,-0.2 -3,-0.1 -1,-0.2 0.113 59.9 76.0-127.0 14.8 13.9 14.1 42.1 265 276 A F S S+ 0 0 45 -3,-0.3 2,-0.2 1,-0.1 -2,-0.1 0.685 74.9 72.1-101.7 -21.6 11.3 16.8 42.0 266 277 A D S S+ 0 0 111 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.069 99.2 43.6 -89.8 35.3 12.7 19.5 44.3 267 278 A F - 0 0 19 -3,-0.2 2,-0.3 -2,-0.2 -38,-0.0 -0.968 65.6-151.5-165.7 162.5 15.5 20.6 41.9 268 279 A T - 0 0 84 -2,-0.3 2,-0.2 -25,-0.0 -28,-0.1 -0.999 14.5-126.8-147.6 147.4 16.0 21.4 38.2 269 280 A F - 0 0 7 -2,-0.3 -2,-0.0 -30,-0.1 -44,-0.0 -0.628 28.5-124.9 -89.5 149.7 18.7 21.3 35.7 270 281 A S > - 0 0 46 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.262 33.4 -98.5 -81.3 178.0 19.5 24.3 33.6 271 282 A P H > S+ 0 0 105 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.894 123.1 54.4 -69.7 -33.8 19.5 24.1 29.8 272 283 A E H > S+ 0 0 121 2,-0.2 4,-1.9 1,-0.2 -3,-0.0 0.835 110.7 48.6 -64.7 -32.1 23.3 23.8 29.5 273 284 A E H > S+ 0 0 11 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.930 108.1 50.7 -72.7 -49.4 23.1 20.8 31.8 274 285 A M H X S+ 0 0 29 -4,-2.2 4,-2.4 1,-0.3 -2,-0.2 0.865 111.5 51.3 -56.8 -35.0 20.2 19.1 30.0 275 286 A K H X S+ 0 0 135 -4,-1.9 4,-1.3 -5,-0.2 -1,-0.3 0.962 105.2 56.8 -64.7 -48.4 22.3 19.5 27.0 276 287 A Q H < S+ 0 0 80 -4,-1.9 3,-0.4 1,-0.2 -2,-0.2 0.874 112.2 39.1 -47.8 -48.0 25.2 18.0 28.9 277 288 A L H >< S+ 0 0 1 -4,-2.1 3,-2.0 1,-0.2 -1,-0.2 0.874 110.0 61.4 -69.5 -41.1 23.3 14.8 29.6 278 289 A N H >< S+ 0 0 64 -4,-2.4 3,-0.7 1,-0.3 -1,-0.2 0.678 94.8 65.0 -60.8 -18.6 21.8 14.9 26.1 279 290 A A T 3< S+ 0 0 83 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.610 82.7 77.6 -82.9 -9.5 25.3 14.6 24.7 280 291 A L T < + 0 0 19 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.1 0.518 63.1 128.7 -76.6 -9.2 25.9 11.1 26.1 281 292 A N < + 0 0 57 -3,-0.7 -92,-0.2 -4,-0.2 -91,-0.2 -0.208 16.8 155.9 -57.2 131.3 23.9 9.2 23.5 282 293 A K - 0 0 107 -93,-1.7 -92,-0.2 -94,-0.1 -1,-0.1 0.218 62.6-105.6-139.8 17.0 25.4 6.2 21.8 283 294 A N + 0 0 123 -94,-0.4 2,-0.7 1,-0.2 -93,-0.2 0.927 64.9 164.5 54.7 46.0 22.5 4.0 20.6 284 295 A W + 0 0 129 -95,-2.6 2,-0.5 -96,-0.0 -1,-0.2 -0.798 15.9 177.4-103.9 94.1 23.5 1.6 23.4 285 296 A R + 0 0 67 -2,-0.7 3,-0.1 1,-0.2 -99,-0.0 -0.776 13.0 173.8 -97.7 132.6 21.0 -1.0 24.5 286 297 A Y + 0 0 83 -2,-0.5 2,-1.8 1,-0.2 -1,-0.2 0.768 63.5 83.4-101.2 -31.7 21.8 -3.5 27.1 287 298 A I + 0 0 43 -77,-0.1 -1,-0.2 2,-0.0 -102,-0.1 -0.520 58.9 128.0 -77.9 79.7 18.4 -5.1 27.4 288 299 A V - 0 0 30 -2,-1.8 2,-0.2 -3,-0.1 0, 0.0 -0.988 64.8-113.3-136.0 122.7 18.6 -7.6 24.5 289 300 A P - 0 0 23 0, 0.0 11,-3.5 0, 0.0 12,-0.5 -0.326 45.9-172.3 -56.9 117.0 17.8 -11.3 24.8 290 301 A M E -O 299 0G 57 9,-0.3 2,-0.3 -2,-0.2 7,-0.1 -0.650 17.4-154.4-111.9 171.5 21.1 -13.1 24.2 291 302 A L E -O 298 0G 47 7,-2.1 7,-3.6 -2,-0.2 2,-0.7 -0.987 16.7-131.5-143.2 139.3 22.3 -16.7 23.7 292 303 A T E +O 297 0G 102 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.869 31.1 170.9-100.0 113.9 25.7 -18.2 24.3 293 304 A V E > S-O 296 0G 70 3,-3.0 3,-1.9 -2,-0.7 -2,-0.1 -0.996 71.4 -17.6-124.6 129.6 26.9 -20.2 21.4 294 305 A D T 3 S- 0 0 161 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.710 129.9 -50.9 45.8 34.1 30.5 -21.5 21.3 295 306 A G T 3 S+ 0 0 61 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.642 118.3 107.0 81.7 20.0 31.5 -19.0 24.0 296 307 A K E < -O 293 0G 141 -3,-1.9 -3,-3.0 -5,-0.0 2,-0.6 -0.987 69.6-124.4-131.8 137.2 30.0 -16.0 22.2 297 308 A R E -O 292 0G 177 -2,-0.4 -5,-0.2 -5,-0.2 -7,-0.0 -0.704 33.2-177.3 -85.1 123.7 26.9 -14.0 23.0 298 309 A V E -O 291 0G 63 -7,-3.6 -7,-2.1 -2,-0.6 2,-0.1 -0.920 37.6 -93.8-120.9 146.1 24.5 -13.9 20.0 299 310 A P E -O 290 0G 67 0, 0.0 -9,-0.3 0, 0.0 4,-0.1 -0.368 36.4-151.2 -60.7 130.8 21.2 -12.1 19.7 300 311 A R S S+ 0 0 53 -11,-3.5 -168,-0.2 1,-0.2 3,-0.2 0.835 81.2 22.7 -78.2 -37.7 18.5 -14.6 20.7 301 312 A D S > S+ 0 0 1 -12,-0.5 3,-2.0 1,-0.1 -1,-0.2 0.236 77.7 119.9-119.3 20.1 15.4 -13.6 18.8 302 313 A A T 3 S+ 0 0 36 1,-0.3 -1,-0.1 -3,-0.1 5,-0.1 0.681 73.6 59.2 -54.0 -25.4 16.7 -11.6 15.9 303 314 A G T 3 S+ 0 0 76 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.546 77.7 111.1 -82.5 -12.3 15.1 -14.0 13.4 304 315 A H X - 0 0 16 -3,-2.0 3,-2.4 1,-0.1 -3,-0.0 -0.476 69.6-133.7 -71.0 130.7 11.6 -13.6 14.6 305 316 A P T 3 S+ 0 0 116 0, 0.0 -1,-0.1 0, 0.0 -169,-0.0 0.836 106.9 43.6 -47.3 -43.7 9.3 -11.8 12.1 306 317 A L T 3 S+ 0 0 25 -190,-0.1 -191,-0.2 -192,-0.0 -2,-0.1 0.064 81.8 139.6 -95.0 26.3 7.9 -9.5 14.8 307 318 A Y < - 0 0 18 -3,-2.4 3,-0.5 1,-0.1 4,-0.2 -0.523 40.7-154.2 -69.4 132.6 11.2 -8.8 16.4 308 319 A P S S+ 0 0 4 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.745 74.6 63.9 -84.6 -27.1 11.5 -5.1 17.4 309 320 A F S S+ 0 0 35 1,-0.2 -7,-0.1 -145,-0.1 -146,-0.0 0.054 80.5 75.9 -93.4 32.6 15.2 -4.2 17.4 310 321 A N S S+ 0 0 106 -3,-0.5 -1,-0.2 3,-0.0 -8,-0.0 0.709 81.2 77.3-101.3 -33.1 16.2 -4.6 13.8 311 322 A D S S- 0 0 45 -3,-0.4 -146,-0.0 -4,-0.2 0, 0.0 -0.435 97.5-112.0 -72.1 149.6 14.6 -1.4 12.6 312 323 A P 0 0 120 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.733 360.0 360.0 -57.3 -24.0 16.6 1.8 13.5 313 324 A Y 0 0 97 -119,-0.1 -147,-0.4 -5,-0.1 -149,-0.1 -0.888 360.0 360.0-176.7 360.0 13.8 2.8 16.0