==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-MAY-11 3S3G . COMPND 2 MOLECULE: ALDOSE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.ZHENG,J.CHEN,H.LUO,X.HU . 316 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13728.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.2 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 12 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 26.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 2 1 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 3 2 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 PARALLEL BRIDGES PER LADDER . 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 0 A M 0 0 99 0, 0.0 254,-0.0 0, 0.0 253,-0.0 0.000 360.0 360.0 360.0 140.5 15.8 -12.2 19.2 2 1 A A - 0 0 72 1,-0.1 13,-0.1 2,-0.1 3,-0.0 -0.232 360.0-137.2 -58.6 145.4 15.3 -11.8 15.5 3 2 A S S S+ 0 0 72 11,-0.1 12,-2.9 12,-0.1 13,-0.5 0.717 81.9 35.3 -78.0 -21.6 14.6 -8.2 14.4 4 3 A R E -A 14 0A 114 10,-0.3 2,-0.3 11,-0.1 -2,-0.1 -0.920 64.4-148.9-133.1 155.5 11.8 -9.2 11.9 5 4 A L E -A 13 0A 33 8,-2.4 8,-2.8 -2,-0.3 2,-0.4 -0.901 29.2-104.9-122.2 159.6 9.1 -11.8 11.5 6 5 A L E -A 12 0A 115 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.621 30.5-154.7 -84.8 131.8 7.6 -13.4 8.4 7 6 A L > - 0 0 7 4,-3.0 3,-1.5 -2,-0.4 198,-0.1 -0.558 30.9-106.7 -94.4 174.1 4.2 -12.2 7.2 8 7 A N T 3 S+ 0 0 65 196,-0.3 171,-0.1 1,-0.3 197,-0.1 0.405 116.9 64.4 -86.3 2.7 1.8 -14.3 5.1 9 8 A N T 3 S- 0 0 64 2,-0.2 -1,-0.3 169,-0.1 3,-0.1 0.300 121.2-106.4 -95.2 2.0 2.5 -12.2 2.0 10 9 A G S < S+ 0 0 59 -3,-1.5 2,-0.3 1,-0.3 -2,-0.1 0.458 83.0 119.1 89.5 3.7 6.1 -13.6 2.2 11 10 A A - 0 0 35 144,-0.1 -4,-3.0 95,-0.1 2,-0.4 -0.689 62.2-120.1-104.5 151.4 7.6 -10.3 3.4 12 11 A K E -A 6 0A 115 -2,-0.3 -6,-0.2 -6,-0.2 -8,-0.0 -0.792 21.4-158.3 -94.2 133.8 9.5 -9.6 6.7 13 12 A M E -A 5 0A 2 -8,-2.8 -8,-2.4 -2,-0.4 2,-0.1 -0.950 23.1-118.1-113.1 123.4 8.2 -7.0 9.2 14 13 A P E -A 4 0A 12 0, 0.0 -10,-0.3 0, 0.0 -11,-0.1 -0.411 19.1-142.0 -59.0 130.0 10.5 -5.4 11.8 15 14 A I S S+ 0 0 8 -12,-2.9 245,-3.2 -2,-0.1 2,-0.4 0.660 85.5 56.0 -74.0 -14.5 9.1 -6.3 15.2 16 15 A L B +b 260 0B 3 -13,-0.5 25,-0.5 243,-0.2 26,-0.4 -0.967 68.3 165.0-118.0 133.6 9.9 -2.9 16.6 17 16 A G - 0 0 0 243,-2.3 2,-0.6 -2,-0.4 26,-0.2 -0.909 37.3-105.1-143.0 164.1 8.6 0.3 15.0 18 17 A L E -c 43 0B 1 24,-2.3 26,-2.6 -2,-0.3 245,-0.2 -0.846 30.4-139.0 -94.9 120.7 8.2 4.0 15.8 19 18 A G E -cd 44 263B 4 243,-2.3 245,-0.7 -2,-0.6 26,-0.1 -0.514 16.4-174.6 -73.3 136.1 4.7 5.3 16.6 20 19 A T > + 0 0 0 24,-0.8 3,-1.5 -2,-0.2 2,-0.3 0.342 39.0 122.6-107.2 -1.5 3.6 8.7 15.2 21 20 A W T 3 S+ 0 0 64 1,-0.3 -2,-0.1 23,-0.1 28,-0.0 -0.546 89.8 5.7 -67.1 125.8 0.1 9.4 16.7 22 21 A K T 3 S+ 0 0 50 -2,-0.3 -1,-0.3 1,-0.3 -2,-0.0 0.389 89.3 140.6 83.7 -3.0 0.3 12.8 18.5 23 22 A S < - 0 0 3 -3,-1.5 -1,-0.3 1,-0.1 5,-0.1 -0.632 59.6-118.5 -72.4 116.7 3.8 13.5 17.4 24 23 A P >> - 0 0 47 0, 0.0 3,-2.0 0, 0.0 4,-1.9 -0.284 13.6-123.5 -61.4 141.9 3.6 17.2 16.6 25 24 A P H 3> S+ 0 0 69 0, 0.0 4,-0.5 0, 0.0 -2,-0.1 0.792 111.9 56.1 -58.9 -24.9 4.3 18.1 13.0 26 25 A G H 34 S+ 0 0 74 1,-0.2 4,-0.2 2,-0.1 -3,-0.0 0.603 117.9 31.5 -79.0 -21.6 7.1 20.4 14.1 27 26 A Q H <> S+ 0 0 95 -3,-2.0 4,-2.2 2,-0.1 -1,-0.2 0.548 100.5 77.9-104.5 -9.3 8.9 17.6 16.0 28 27 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.802 87.5 58.1 -80.3 -26.6 8.1 14.4 14.0 29 28 A T H X S+ 0 0 26 -4,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.975 112.1 41.5 -64.7 -52.5 10.6 15.0 11.2 30 29 A E H > S+ 0 0 108 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.904 112.5 56.9 -57.2 -42.4 13.5 15.1 13.7 31 30 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.925 110.4 42.5 -58.9 -46.3 11.9 12.1 15.5 32 31 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.868 112.5 53.3 -69.2 -38.1 11.9 9.9 12.4 33 32 A K H X S+ 0 0 54 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.947 113.0 44.3 -58.6 -47.4 15.4 11.0 11.4 34 33 A V H X S+ 0 0 31 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.925 111.4 53.8 -62.9 -46.3 16.7 10.1 14.8 35 34 A A H <>S+ 0 0 0 -4,-2.6 5,-2.3 -5,-0.3 4,-0.4 0.947 111.4 44.7 -54.7 -50.8 14.8 6.8 14.8 36 35 A I H ><5S+ 0 0 1 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.927 111.6 53.6 -62.3 -41.4 16.3 5.8 11.5 37 36 A D H 3<5S+ 0 0 90 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.836 110.4 47.2 -59.2 -34.8 19.7 6.9 12.6 38 37 A V T 3<5S- 0 0 58 -4,-2.2 -1,-0.2 -3,-0.3 -2,-0.2 0.367 131.6 -86.1 -93.5 6.6 19.5 4.7 15.7 39 38 A G T < 5S+ 0 0 22 -3,-1.3 -3,-0.2 -4,-0.4 2,-0.1 0.300 74.1 144.6 113.0 -7.1 18.2 1.6 13.9 40 39 A Y < + 0 0 1 -5,-2.3 -1,-0.3 -6,-0.2 -23,-0.1 -0.427 15.2 173.7 -62.6 126.9 14.4 1.8 13.5 41 40 A R + 0 0 74 -25,-0.5 33,-3.4 -2,-0.1 2,-0.4 0.416 59.3 64.9-104.8 -3.2 13.3 0.3 10.2 42 41 A H E - e 0 74B 0 -26,-0.4 -24,-2.3 31,-0.2 2,-0.4 -0.977 58.4-171.4-132.0 124.9 9.5 0.4 10.6 43 42 A I E -ce 18 75B 0 31,-1.9 33,-2.7 -2,-0.4 2,-0.6 -0.987 13.4-147.1-122.0 130.0 7.4 3.5 11.0 44 43 A D E +ce 19 76B 4 -26,-2.6 -24,-0.8 -2,-0.4 2,-0.2 -0.861 31.1 163.1 -98.6 122.6 3.7 3.5 11.9 45 44 A C - 0 0 0 31,-2.1 2,-0.3 -2,-0.6 3,-0.1 -0.754 20.1-168.2-131.1 165.9 1.7 6.3 10.3 46 45 A A > > - 0 0 0 -2,-0.2 3,-1.3 31,-0.2 5,-0.5 -0.929 30.0-132.1-155.0 147.6 -1.9 7.4 9.5 47 46 A H G > 5S+ 0 0 33 31,-1.0 3,-1.8 -2,-0.3 5,-0.2 0.874 109.8 61.5 -58.9 -37.0 -3.6 10.0 7.4 48 47 A V G 3 5S+ 0 0 25 1,-0.3 -1,-0.3 30,-0.3 74,-0.1 0.669 90.5 67.3 -70.5 -13.2 -5.8 10.8 10.4 49 48 A Y G < 5S- 0 0 40 -3,-1.3 -1,-0.3 1,-0.1 -27,-0.2 0.638 94.5-144.9 -78.2 -15.4 -2.7 11.8 12.4 50 49 A Q T < 5S+ 0 0 149 -3,-1.8 -3,-0.1 -4,-0.3 -2,-0.1 0.650 76.7 93.6 59.6 17.6 -2.3 14.8 10.0 51 50 A N >< + 0 0 1 -5,-0.5 4,-2.0 2,-0.1 3,-0.4 0.228 42.3 109.4-109.0 4.0 1.5 14.5 10.2 52 51 A E H > S+ 0 0 4 -6,-0.3 4,-2.6 1,-0.2 5,-0.2 0.857 74.6 56.6 -59.5 -34.9 2.3 12.3 7.2 53 52 A N H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.937 110.1 45.1 -58.4 -43.8 3.9 15.0 5.2 54 53 A E H > S+ 0 0 54 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.894 112.2 50.7 -72.4 -36.8 6.5 15.7 7.9 55 54 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.937 109.3 53.5 -60.2 -45.7 7.2 12.0 8.5 56 55 A G H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.876 101.7 57.9 -57.4 -41.6 7.7 11.8 4.7 57 56 A V H X S+ 0 0 61 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.939 108.7 46.8 -55.3 -46.3 10.2 14.6 4.9 58 57 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.947 113.1 46.8 -61.6 -49.6 12.3 12.5 7.3 59 58 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.927 113.3 49.6 -56.2 -45.4 12.0 9.3 5.3 60 59 A Q H X S+ 0 0 82 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.905 109.7 50.3 -65.5 -42.9 13.0 11.0 2.1 61 60 A E H X S+ 0 0 47 -4,-2.4 4,-2.5 -5,-0.3 -1,-0.2 0.928 111.1 49.0 -60.4 -44.2 16.0 12.8 3.6 62 61 A K H <>S+ 0 0 12 -4,-2.5 5,-2.3 2,-0.2 6,-1.1 0.861 113.2 47.3 -66.8 -33.8 17.2 9.5 5.0 63 62 A L H ><5S+ 0 0 35 -4,-2.3 3,-1.6 -5,-0.2 -2,-0.2 0.947 113.0 48.1 -65.3 -50.7 16.8 7.8 1.6 64 63 A R H 3<5S+ 0 0 171 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.871 111.6 50.3 -57.6 -41.1 18.5 10.6 -0.3 65 64 A E T 3<5S- 0 0 83 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.468 110.1-127.0 -75.2 -5.8 21.4 10.6 2.2 66 65 A Q T < 5 + 0 0 173 -3,-1.6 -3,-0.2 2,-0.2 3,-0.1 0.824 68.7 134.8 56.6 36.3 21.7 6.8 1.7 67 66 A V S - 0 0 124 -2,-0.3 3,-1.6 -3,-0.1 4,-0.4 -0.766 28.7-118.5-100.2 148.5 17.6 1.8 1.3 70 69 A R G > S+ 0 0 32 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.860 114.3 58.5 -53.4 -39.1 13.8 1.8 0.6 71 70 A E G 3 S+ 0 0 129 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.697 101.8 55.8 -67.1 -17.9 13.8 -2.0 0.6 72 71 A E G < S+ 0 0 90 -3,-1.6 2,-0.3 2,-0.0 -1,-0.3 0.520 95.6 82.4 -89.7 -8.7 15.1 -1.9 4.2 73 72 A L < - 0 0 2 -3,-1.4 2,-0.5 -4,-0.4 -31,-0.2 -0.699 61.5-158.7 -96.9 146.3 12.3 0.3 5.5 74 73 A F E -e 42 0B 8 -33,-3.4 -31,-1.9 -2,-0.3 2,-0.5 -0.912 15.6-173.4-125.4 108.5 8.8 -1.0 6.4 75 74 A I E -e 43 0B 0 -2,-0.5 31,-1.6 -33,-0.2 32,-1.5 -0.863 1.3-168.2-111.8 124.3 6.4 1.8 6.3 76 75 A V E +ef 44 107B 0 -33,-2.7 -31,-2.1 -2,-0.5 2,-0.3 -0.891 10.0 168.5-114.1 136.4 2.8 1.3 7.5 77 76 A S E - f 0 108B 0 30,-2.3 32,-2.3 -2,-0.4 2,-0.4 -0.841 20.3-132.4-134.5-176.4 -0.2 3.5 7.0 78 77 A K E - f 0 109B 1 -2,-0.3 -31,-1.0 30,-0.2 2,-0.5 -0.996 14.5-122.9-144.3 139.4 -4.0 3.3 7.5 79 78 A L E - f 0 110B 0 30,-2.8 32,-1.9 -2,-0.4 33,-0.4 -0.696 37.4-128.3 -80.4 120.0 -7.2 4.1 5.6 80 79 A W > - 0 0 8 -2,-0.5 3,-1.8 31,-0.1 36,-0.1 -0.277 20.2-108.6 -73.5 158.8 -9.3 6.5 7.6 81 80 A C G > S+ 0 0 0 1,-0.3 35,-2.8 2,-0.2 3,-0.9 0.696 114.8 60.5 -61.5 -25.7 -13.0 5.7 8.3 82 81 A T G 3 S+ 0 0 1 1,-0.2 -1,-0.3 33,-0.2 37,-0.2 0.352 100.1 61.2 -84.4 -1.9 -14.4 8.4 6.0 83 82 A Y G < + 0 0 51 -3,-1.8 -1,-0.2 35,-0.1 -2,-0.2 0.140 65.9 108.7-101.6 7.8 -12.6 6.6 3.1 84 83 A H < + 0 0 2 -3,-0.9 60,-0.1 32,-0.3 5,-0.1 0.772 49.0 104.4 -61.9 -28.4 -14.4 3.2 3.3 85 84 A E S >> S- 0 0 38 1,-0.1 3,-2.1 -3,-0.1 4,-1.0 -0.310 80.7-123.5 -54.1 136.7 -16.4 3.7 0.0 86 85 A K H 3> S+ 0 0 125 1,-0.3 4,-0.5 2,-0.2 3,-0.4 0.818 109.6 54.7 -54.3 -35.8 -14.8 1.7 -2.8 87 86 A G H 34 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.575 109.3 47.6 -76.7 -14.1 -14.4 4.7 -5.0 88 87 A L H <> S+ 0 0 66 -3,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.607 90.1 80.9 -96.5 -12.7 -12.4 6.6 -2.3 89 88 A V H X S+ 0 0 1 -4,-1.0 4,-2.7 -3,-0.4 5,-0.2 0.931 91.4 47.2 -66.4 -50.7 -9.9 4.0 -1.2 90 89 A K H X S+ 0 0 88 -4,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.921 113.9 49.2 -56.8 -45.4 -7.3 4.4 -4.0 91 90 A G H > S+ 0 0 38 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.879 110.1 50.3 -63.4 -40.0 -7.4 8.1 -3.7 92 91 A A H X S+ 0 0 12 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.934 112.7 47.2 -61.6 -46.6 -6.9 7.9 0.1 93 92 A C H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.925 111.9 50.4 -60.4 -43.7 -4.0 5.6 -0.4 94 93 A Q H X S+ 0 0 94 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.844 107.7 52.8 -66.3 -35.2 -2.4 7.8 -3.0 95 94 A K H X S+ 0 0 101 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.933 110.1 48.8 -65.5 -44.1 -2.7 10.9 -0.8 96 95 A T H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.923 111.4 49.8 -59.3 -41.5 -0.9 9.0 1.9 97 96 A L H X>S+ 0 0 11 -4,-2.4 5,-2.4 1,-0.2 4,-0.7 0.918 110.7 49.5 -63.7 -44.2 1.8 7.9 -0.6 98 97 A S H <5S+ 0 0 82 -4,-2.5 3,-0.3 3,-0.2 -1,-0.2 0.898 113.0 46.9 -61.0 -44.4 2.3 11.5 -1.9 99 98 A D H <5S+ 0 0 21 -4,-2.5 -43,-0.2 1,-0.2 -2,-0.2 0.903 115.7 43.7 -65.1 -43.3 2.6 12.8 1.7 100 99 A L H <5S- 0 0 0 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.551 108.7-128.2 -77.1 -8.9 5.1 10.1 2.8 101 100 A K T <5 + 0 0 69 -4,-0.7 2,-0.3 -3,-0.3 -3,-0.2 0.897 64.1 130.3 58.5 46.9 6.9 10.6 -0.6 102 101 A L < - 0 0 18 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.868 59.4-146.3-123.4 155.4 6.8 6.9 -1.3 103 102 A D S S+ 0 0 124 -2,-0.3 2,-0.3 1,-0.2 -6,-0.1 0.524 87.5 13.0 -97.2 -5.4 5.7 4.9 -4.4 104 103 A Y - 0 0 34 -7,-0.1 2,-0.4 3,-0.0 50,-0.2 -0.982 66.4-131.5-157.5 159.2 4.4 2.0 -2.2 105 104 A L B -k 154 0C 0 48,-1.8 50,-2.8 -2,-0.3 51,-0.3 -0.869 11.7-145.1-106.3 145.2 3.5 1.1 1.4 106 105 A D S S+ 0 0 16 -31,-1.6 2,-0.3 -2,-0.4 -30,-0.2 0.817 90.4 11.9 -75.0 -32.1 4.8 -2.1 2.9 107 106 A L E -f 76 0B 0 -32,-1.5 -30,-2.3 48,-0.1 2,-0.4 -0.976 62.0-171.6-146.6 134.9 1.5 -2.4 4.8 108 107 A Y E -fg 77 157B 2 48,-1.7 50,-2.1 -2,-0.3 2,-0.3 -0.995 16.5-165.0-128.5 125.5 -1.8 -0.6 4.6 109 108 A L E -fg 78 158B 0 -32,-2.3 -30,-2.8 -2,-0.4 2,-0.7 -0.840 30.1-118.6-111.3 145.5 -4.4 -1.2 7.2 110 109 A I E -fg 79 159B 0 48,-2.3 50,-1.1 -2,-0.3 -30,-0.1 -0.745 35.2-146.9 -74.1 120.4 -8.1 -0.5 7.5 111 110 A H S S- 0 0 10 -32,-1.9 -1,-0.2 -2,-0.7 -31,-0.1 0.881 71.1 -1.9 -66.7 -43.4 -7.8 1.8 10.5 112 111 A W - 0 0 16 -33,-0.4 -1,-0.2 2,-0.1 49,-0.2 -0.981 67.0-122.7-140.7 149.3 -11.1 0.9 12.2 113 112 A P S S+ 0 0 1 0, 0.0 2,-0.6 0, 0.0 25,-0.1 0.665 88.3 94.7 -64.4 -15.2 -13.9 -1.5 11.1 114 113 A T - 0 0 0 195,-0.1 2,-0.3 23,-0.0 -2,-0.1 -0.704 64.3-154.1 -85.6 118.6 -16.3 1.4 11.3 115 114 A G - 0 0 1 -2,-0.6 19,-1.8 19,-0.3 2,-0.3 -0.734 12.0-161.7 -85.0 142.4 -17.0 3.3 8.1 116 115 A F B -L 133 0D 0 -35,-2.8 -32,-0.3 -2,-0.3 18,-0.1 -0.844 33.7 -81.4-119.5 158.0 -18.1 7.0 8.3 117 116 A K - 0 0 97 15,-2.6 17,-0.1 -2,-0.3 15,-0.1 -0.300 55.5-111.3 -54.3 132.2 -19.9 9.3 5.9 118 117 A P + 0 0 44 0, 0.0 2,-0.3 0, 0.0 -35,-0.1 -0.352 65.9 98.5 -69.7 151.3 -17.3 10.8 3.5 119 118 A G S S- 0 0 43 -37,-0.2 -37,-0.1 1,-0.1 -3,-0.0 -0.952 85.7 -63.2 158.4-172.6 -16.4 14.5 3.7 120 119 A K S S+ 0 0 200 -2,-0.3 2,-0.3 3,-0.0 -1,-0.1 0.877 105.3 85.2 -73.0 -34.9 -13.9 16.9 5.1 121 120 A E - 0 0 134 1,-0.1 -2,-0.0 -3,-0.1 0, 0.0 -0.505 65.3-154.0 -72.8 128.9 -14.6 16.0 8.7 122 121 A F S S+ 0 0 40 -2,-0.3 -1,-0.1 1,-0.3 -41,-0.1 0.778 97.8 31.2 -69.4 -29.5 -12.8 12.9 10.1 123 122 A F S S- 0 0 75 -42,-0.0 -1,-0.3 -41,-0.0 2,-0.2 -0.700 85.1-162.3-127.7 80.8 -15.6 12.4 12.6 124 123 A P - 0 0 9 0, 0.0 8,-2.4 0, 0.0 2,-0.3 -0.452 12.6-161.9 -67.0 132.2 -18.8 13.6 10.9 125 124 A L B -M 131 0E 102 6,-0.2 6,-0.2 -2,-0.2 2,-0.1 -0.858 14.1-130.3-118.0 147.9 -21.5 14.2 13.5 126 125 A D > - 0 0 68 4,-2.3 3,-1.5 -2,-0.3 6,-0.0 -0.244 47.7 -87.3 -78.4 180.0 -25.3 14.6 13.3 127 126 A E T 3 S+ 0 0 207 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.742 131.2 51.2 -62.5 -21.3 -27.0 17.5 15.0 128 127 A S T 3 S- 0 0 107 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.447 121.6-104.1 -97.6 -1.5 -27.2 15.4 18.2 129 128 A G S < S+ 0 0 40 -3,-1.5 2,-0.1 1,-0.3 -2,-0.1 0.392 74.3 131.1 98.8 -3.6 -23.5 14.5 18.2 130 129 A N - 0 0 87 1,-0.1 -4,-2.3 174,-0.0 -1,-0.3 -0.501 64.9-100.6 -78.6 152.8 -23.5 10.9 17.1 131 130 A V B -M 125 0E 12 172,-1.0 -6,-0.2 -6,-0.2 -1,-0.1 -0.546 33.2-126.3 -72.9 136.6 -21.0 9.8 14.3 132 131 A V - 0 0 40 -8,-2.4 -15,-2.6 -2,-0.2 -1,-0.1 -0.755 29.9-140.7 -87.2 116.2 -22.7 9.5 10.9 133 132 A P B -L 116 0D 63 0, 0.0 2,-0.3 0, 0.0 -17,-0.3 -0.233 3.2-127.2 -74.4 162.3 -22.0 6.0 9.4 134 133 A S - 0 0 5 -19,-1.8 -19,-0.3 2,-0.2 -17,-0.1 -0.829 14.2-136.2 -97.2 145.7 -21.2 4.9 5.9 135 134 A D S S+ 0 0 151 -2,-0.3 2,-0.5 2,-0.1 -1,-0.1 0.394 71.7 113.2 -83.7 4.0 -23.4 2.1 4.4 136 135 A T - 0 0 20 -20,-0.1 -21,-0.2 2,-0.0 -2,-0.2 -0.659 63.4-137.3 -76.7 122.7 -20.3 0.4 3.0 137 136 A N >> - 0 0 75 -2,-0.5 4,-1.9 1,-0.1 3,-0.7 -0.415 19.9-108.7 -81.3 157.2 -19.6 -2.9 4.7 138 137 A I H 3> S+ 0 0 10 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.793 114.2 57.4 -51.0 -35.4 -16.2 -4.2 5.9 139 138 A L H 3> S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.884 106.5 46.4 -71.6 -37.2 -16.1 -6.9 3.1 140 139 A D H <> S+ 0 0 93 -3,-0.7 4,-2.3 2,-0.2 -2,-0.2 0.927 111.2 52.3 -69.3 -42.4 -16.4 -4.4 0.2 141 140 A T H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.920 108.3 53.7 -55.5 -41.7 -13.8 -2.1 1.8 142 141 A W H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.946 104.5 52.8 -59.8 -47.2 -11.6 -5.3 2.0 143 142 A A H X S+ 0 0 31 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.907 107.8 52.3 -53.9 -41.5 -12.1 -5.9 -1.8 144 143 A A H X S+ 0 0 8 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.910 108.0 50.9 -61.4 -40.9 -10.9 -2.3 -2.4 145 144 A M H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 3,-0.2 0.942 107.1 53.8 -59.0 -45.8 -7.8 -2.9 -0.3 146 145 A E H X S+ 0 0 13 -4,-2.7 4,-2.3 1,-0.3 3,-0.2 0.912 103.6 56.5 -57.5 -40.7 -7.0 -6.1 -2.3 147 146 A E H X S+ 0 0 118 -4,-2.2 4,-1.2 1,-0.2 -1,-0.3 0.889 100.8 58.1 -57.8 -40.2 -7.2 -4.0 -5.4 148 147 A L H <>S+ 0 0 1 -4,-1.7 5,-1.4 -3,-0.2 6,-1.0 0.894 106.0 49.6 -57.2 -39.9 -4.5 -1.8 -3.9 149 148 A V H ><5S+ 0 0 32 -4,-1.7 3,-1.6 -3,-0.2 -2,-0.2 0.951 109.6 49.7 -60.8 -47.3 -2.3 -4.8 -3.7 150 149 A D H 3<5S+ 0 0 78 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.653 108.2 55.5 -69.1 -12.3 -3.0 -5.8 -7.3 151 150 A E T 3<5S- 0 0 79 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.381 112.3-116.9 -96.1 -1.8 -2.1 -2.2 -8.5 152 151 A G T < 5S+ 0 0 44 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.529 83.5 116.5 80.5 6.2 1.3 -2.2 -6.8 153 152 A L S - 0 0 14 -2,-0.5 4,-2.4 -3,-0.1 3,-0.4 -0.282 35.0 -93.5 -77.5 175.9 -12.6 -8.0 17.1 164 163 A H H > S+ 0 0 33 152,-1.7 4,-2.3 1,-0.3 5,-0.1 0.832 126.0 53.4 -69.4 -27.8 -12.3 -11.7 16.5 165 164 A L H > S+ 0 0 51 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.859 110.1 47.9 -68.7 -37.1 -15.8 -11.9 14.8 166 165 A Q H > S+ 0 0 6 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.886 111.1 49.8 -71.5 -38.6 -14.8 -9.2 12.3 167 166 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.950 111.2 50.8 -59.8 -47.3 -11.5 -10.9 11.6 168 167 A E H X S+ 0 0 75 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.858 105.4 56.4 -57.0 -37.9 -13.6 -14.0 11.1 169 168 A M H < S+ 0 0 90 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.915 109.8 45.1 -64.1 -43.3 -15.8 -12.1 8.7 170 169 A I H >< S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 -2,-0.2 0.953 111.7 50.6 -63.1 -48.9 -12.9 -11.2 6.6 171 170 A L H 3< S+ 0 0 32 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.775 115.1 45.7 -61.6 -25.7 -11.4 -14.7 6.6 172 171 A N T 3< S+ 0 0 114 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.266 81.7 133.2 -95.9 3.9 -14.9 -16.0 5.6 173 172 A K X - 0 0 34 -3,-2.0 3,-1.8 -4,-0.1 2,-0.2 -0.384 66.3-109.7 -59.5 130.4 -15.5 -13.4 2.8 174 173 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.448 103.1 9.3 -59.5 130.3 -16.7 -15.0 -0.4 175 174 A G T 3 S- 0 0 72 1,-0.2 -2,-0.1 -2,-0.2 -3,-0.0 0.670 86.1-176.0 72.7 18.8 -14.0 -14.8 -3.0 176 175 A L < - 0 0 46 -3,-1.8 -1,-0.2 1,-0.1 3,-0.1 -0.235 7.8-177.8 -51.4 128.5 -11.4 -13.6 -0.5 177 176 A K + 0 0 125 1,-0.3 2,-0.4 0, 0.0 -1,-0.1 0.884 65.1 20.4 -98.6 -58.9 -8.2 -12.9 -2.5 178 177 A Y S S- 0 0 78 -22,-0.0 -1,-0.3 -35,-0.0 -32,-0.1 -0.981 74.0-135.9-115.7 130.9 -5.6 -11.8 0.2 179 178 A K - 0 0 105 -2,-0.4 -22,-0.3 -3,-0.1 2,-0.1 -0.451 41.4 -88.8 -70.6 152.6 -5.9 -12.6 3.9 180 179 A P - 0 0 0 0, 0.0 -22,-0.3 0, 0.0 -1,-0.1 -0.464 32.9-158.6 -56.9 132.1 -5.1 -9.8 6.3 181 180 A A S S+ 0 0 1 -24,-2.8 25,-2.1 1,-0.2 2,-0.3 0.749 72.3 17.5 -78.8 -28.8 -1.3 -9.9 7.0 182 181 A V E - i 0 206B 0 -25,-0.4 -23,-2.7 23,-0.2 2,-0.4 -0.989 51.6-158.4-146.9 144.7 -1.7 -8.0 10.3 183 182 A N E -hi 159 207B 0 23,-2.2 25,-1.9 -2,-0.3 2,-0.7 -0.983 20.2-157.5-120.9 115.6 -4.2 -6.9 12.9 184 183 A Q E +hi 160 208B 5 -25,-2.1 -23,-1.8 -2,-0.4 2,-0.3 -0.862 25.9 161.0 -96.9 117.3 -3.0 -3.9 14.9 185 184 A I E - i 0 209B 4 23,-2.4 25,-2.6 -2,-0.7 2,-0.2 -0.892 46.5 -89.3-133.0 160.2 -4.7 -3.7 18.2 186 185 A E E + i 0 210B 1 -2,-0.3 2,-0.3 23,-0.2 25,-0.2 -0.517 54.3 166.9 -67.6 130.7 -4.1 -2.0 21.6 187 186 A C + 0 0 2 23,-2.1 5,-0.2 -2,-0.2 27,-0.2 -0.927 10.2 120.2-152.5 139.0 -2.1 -4.3 23.8 188 187 A H B > S-N 191 0F 4 3,-1.8 3,-1.6 -2,-0.3 25,-0.1 -0.935 75.0 -69.9-178.2 173.5 -0.2 -3.9 27.1 189 188 A P T 3 S+ 0 0 0 0, 0.0 3,-0.3 0, 0.0 60,-0.0 0.756 131.3 51.0 -58.4 -23.2 -0.2 -5.3 30.7 190 189 A Y T 3 S+ 0 0 10 1,-0.3 106,-2.2 103,-0.2 104,-1.5 0.592 122.7 30.5 -88.6 -15.9 -3.6 -3.7 31.4 191 190 A L B < S+N 188 0F 4 -3,-1.6 -3,-1.8 104,-0.2 -1,-0.3 -0.698 71.9 171.5-134.0 100.7 -5.2 -5.0 28.3 192 191 A T - 0 0 0 -3,-0.3 -1,-0.1 -2,-0.2 5,-0.1 0.695 21.4-155.7 -87.6 -22.6 -3.5 -8.4 27.5 193 192 A Q > + 0 0 20 1,-0.1 4,-2.6 3,-0.1 5,-0.3 0.764 28.1 161.4 58.3 34.4 -5.7 -9.6 24.6 194 193 A E H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.895 71.4 45.6 -54.5 -46.0 -5.0 -13.3 25.1 195 194 A K H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.949 116.8 41.3 -64.5 -53.7 -8.1 -14.5 23.1 196 195 A L H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.910 116.7 49.7 -63.7 -43.2 -7.9 -12.2 20.1 197 196 A I H X S+ 0 0 6 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.936 111.0 49.1 -61.1 -47.3 -4.1 -12.6 19.9 198 197 A Q H X S+ 0 0 120 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.927 113.1 48.2 -59.4 -44.4 -4.4 -16.4 20.1 199 198 A Y H X S+ 0 0 34 -4,-2.5 4,-1.5 2,-0.2 6,-0.2 0.972 113.0 45.4 -61.0 -55.9 -7.0 -16.4 17.4 200 199 A C H ><>S+ 0 0 0 -4,-2.8 5,-2.3 1,-0.2 3,-1.0 0.954 114.8 48.0 -53.1 -51.9 -5.2 -14.1 15.0 201 200 A Q H ><5S+ 0 0 67 -4,-2.7 3,-1.4 1,-0.3 -1,-0.2 0.877 106.8 56.8 -60.3 -36.6 -1.9 -16.0 15.4 202 201 A S H 3<5S+ 0 0 68 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.793 108.1 50.1 -64.6 -25.8 -3.6 -19.3 14.9 203 202 A K T <<5S- 0 0 87 -4,-1.5 -1,-0.3 -3,-1.0 -2,-0.2 0.463 121.4-106.4 -91.2 1.7 -4.8 -17.9 11.6 204 203 A G T < 5S+ 0 0 42 -3,-1.4 2,-0.6 -4,-0.5 -196,-0.3 0.616 76.6 137.5 83.5 11.9 -1.3 -16.8 10.5 205 204 A I < - 0 0 1 -5,-2.3 -1,-0.3 -6,-0.2 -23,-0.2 -0.832 50.5-135.7 -92.5 118.9 -2.2 -13.1 11.1 206 205 A V E -i 182 0B 18 -25,-2.1 -23,-2.2 -2,-0.6 2,-0.5 -0.513 16.1-140.7 -73.0 138.0 0.6 -11.2 12.8 207 206 A V E -i 183 0B 0 50,-0.4 52,-2.3 -25,-0.2 2,-0.5 -0.860 8.7-158.7-101.7 133.3 -0.6 -8.9 15.7 208 207 A T E -ij 184 259B 0 -25,-1.9 -23,-2.4 -2,-0.5 2,-0.6 -0.950 14.1-141.5-107.1 131.5 0.9 -5.4 16.2 209 208 A A E -ij 185 260B 0 50,-3.4 52,-1.6 -2,-0.5 -23,-0.2 -0.822 19.3-168.0 -93.1 121.3 0.5 -4.0 19.7 210 209 A Y E +i 186 0B 19 -25,-2.6 -23,-2.1 -2,-0.6 4,-0.1 -0.635 65.8 25.4-103.5 173.4 -0.2 -0.3 20.0 211 210 A S S > S+ 0 0 15 50,-0.3 3,-2.1 -2,-0.2 -1,-0.2 0.876 70.8 164.9 41.0 48.1 -0.1 2.1 23.0 212 211 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.747 72.8 47.9 -67.4 -21.0 2.4 -0.4 24.6 213 212 A L T 3 S- 0 0 24 -25,-0.1 16,-0.5 15,-0.0 15,-0.1 0.356 124.3-101.6 -95.7 2.9 3.3 2.2 27.1 214 213 A G < - 0 0 6 -3,-2.1 4,-0.2 1,-0.2 -3,-0.1 0.647 51.1 -95.9 82.7 15.1 -0.3 3.1 28.0 215 214 A S > - 0 0 8 1,-0.1 3,-2.4 2,-0.1 -1,-0.2 0.875 48.0-174.1 45.6 58.5 -0.3 6.3 25.9 216 215 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.750 81.3 55.9 -56.8 -22.7 0.5 8.7 28.7 217 216 A D T 3 S+ 0 0 67 3,-0.0 -2,-0.1 2,-0.0 -3,-0.0 0.356 74.1 134.1 -90.6 4.2 0.0 11.6 26.3 218 217 A R X - 0 0 22 -3,-2.4 3,-1.3 -4,-0.2 81,-0.0 -0.280 62.7-126.4 -53.1 139.8 -3.5 10.6 25.2 219 218 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.768 105.0 51.6 -60.9 -31.5 -5.8 13.8 25.2 220 219 A W T 3 S+ 0 0 109 78,-0.1 -2,-0.1 2,-0.0 -3,-0.0 0.258 77.1 143.6 -93.7 7.5 -8.4 12.2 27.5 221 220 A A < - 0 0 45 -3,-1.3 -6,-0.0 -6,-0.1 77,-0.0 -0.183 28.5-167.9 -51.8 137.1 -6.1 11.0 30.3 222 221 A K > - 0 0 112 4,-0.1 3,-2.1 1,-0.1 -2,-0.0 -0.970 30.4-120.1-129.1 151.1 -7.4 11.3 33.8 223 222 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.769 111.4 58.5 -60.0 -30.6 -5.6 10.9 37.2 224 223 A E T 3 S+ 0 0 145 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.566 84.9 106.4 -77.1 -8.5 -7.8 8.0 38.3 225 224 A D S < S- 0 0 35 -3,-2.1 -4,-0.0 1,-0.1 71,-0.0 -0.435 83.0-104.3 -68.7 142.7 -6.6 6.0 35.2 226 225 A P - 0 0 20 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.342 33.0-146.8 -62.3 149.2 -4.1 3.2 35.8 227 226 A S > - 0 0 55 1,-0.2 3,-0.7 -3,-0.1 4,-0.4 -0.909 13.6-168.2-128.2 110.9 -0.6 4.2 34.7 228 227 A L G > S+ 0 0 3 -2,-0.5 3,-1.5 1,-0.3 6,-0.2 0.908 89.7 51.8 -60.5 -47.2 1.7 1.5 33.4 229 228 A L G 3 S+ 0 0 46 -16,-0.5 -1,-0.3 1,-0.3 16,-0.1 0.730 115.1 43.2 -67.1 -23.5 4.9 3.6 33.5 230 229 A E G < S+ 0 0 129 -3,-0.7 -1,-0.3 15,-0.1 -2,-0.2 0.313 82.0 121.3 -98.1 2.9 4.2 4.4 37.2 231 230 A D <> - 0 0 9 -3,-1.5 4,-2.7 -4,-0.4 3,-0.5 -0.566 54.6-152.0 -72.9 116.5 3.2 0.9 38.2 232 231 A P H > S+ 0 0 90 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.784 93.2 59.1 -64.7 -23.0 5.6 -0.2 41.0 233 232 A R H > S+ 0 0 115 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.916 110.8 41.6 -67.5 -39.7 5.2 -3.8 40.1 234 233 A I H > S+ 0 0 0 -3,-0.5 4,-2.6 2,-0.2 5,-0.2 0.916 112.4 54.0 -75.1 -41.0 6.5 -3.1 36.6 235 234 A K H X S+ 0 0 92 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.867 107.1 53.1 -58.9 -37.2 9.2 -0.8 37.9 236 235 A A H X S+ 0 0 59 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.937 108.6 48.4 -64.8 -46.8 10.3 -3.6 40.1 237 236 A I H X S+ 0 0 13 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.913 113.3 48.1 -57.8 -42.2 10.6 -6.0 37.2 238 237 A A H <>S+ 0 0 2 -4,-2.6 5,-2.5 1,-0.2 4,-0.5 0.936 110.0 52.0 -61.6 -47.5 12.6 -3.3 35.2 239 238 A A H ><5S+ 0 0 67 -4,-2.7 3,-1.4 1,-0.2 -1,-0.2 0.901 105.1 56.0 -56.6 -43.7 14.9 -2.7 38.2 240 239 A K H 3<5S+ 0 0 129 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.852 113.1 41.3 -58.5 -34.5 15.6 -6.4 38.4 241 240 A H T 3<5S- 0 0 46 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.385 110.5-119.8 -93.7 3.4 16.8 -6.4 34.8 242 241 A N T < 5S+ 0 0 152 -3,-1.4 2,-0.3 -4,-0.5 -3,-0.2 0.881 77.1 114.7 56.1 38.7 18.6 -3.1 35.0 243 242 A K S - 0 0 49 -2,-0.3 4,-2.0 28,-0.1 5,-0.2 -0.435 33.0-114.2 -79.8 159.4 13.8 1.1 32.2 245 244 A T H > S+ 0 0 23 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.908 119.5 53.4 -57.7 -43.1 10.1 0.5 32.7 246 245 A A H > S+ 0 0 10 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.911 105.8 53.2 -59.3 -41.5 9.5 1.5 29.1 247 246 A Q H > S+ 0 0 14 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.914 109.9 47.7 -62.1 -41.6 12.1 -1.1 27.9 248 247 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.928 110.7 51.4 -60.3 -47.3 10.2 -3.8 29.9 249 248 A L H < S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.746 113.6 45.3 -63.8 -26.5 6.9 -2.7 28.4 250 249 A I H X S+ 0 0 0 -4,-1.6 4,-1.1 -5,-0.2 -2,-0.2 0.857 112.9 48.5 -81.9 -41.7 8.4 -2.9 24.9 251 250 A R H X S+ 0 0 11 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.849 99.6 72.0 -66.8 -32.4 10.1 -6.2 25.4 252 251 A F H >< S+ 0 0 2 -4,-2.3 3,-0.5 1,-0.2 4,-0.4 0.946 102.0 37.8 -51.0 -61.1 6.9 -7.7 26.8 253 252 A P H >4>S+ 0 0 4 0, 0.0 5,-2.1 0, 0.0 3,-1.2 0.844 109.3 64.0 -64.5 -29.1 5.0 -7.9 23.5 254 253 A M H ><5S+ 0 0 2 -4,-1.1 3,-1.6 1,-0.3 -2,-0.2 0.910 100.5 51.4 -58.6 -40.4 8.1 -8.9 21.6 255 254 A Q T <<5S+ 0 0 46 -4,-1.9 -1,-0.3 -3,-0.5 -3,-0.1 0.538 103.0 59.8 -77.1 -5.8 8.3 -12.2 23.6 256 255 A R T < 5S- 0 0 34 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.255 122.9-107.0 -94.4 7.1 4.6 -12.8 22.7 257 256 A N T < 5S+ 0 0 118 -3,-1.6 -50,-0.4 1,-0.3 2,-0.3 0.783 77.1 137.1 67.2 32.8 5.6 -12.8 19.0 258 257 A L < - 0 0 0 -5,-2.1 2,-0.3 -6,-0.1 -1,-0.3 -0.746 57.0-124.7-105.2 150.2 3.9 -9.4 18.5 259 258 A V E - j 0 208B 0 -52,-2.3 -50,-3.4 -2,-0.3 2,-0.4 -0.712 32.5-157.2 -81.4 146.2 5.2 -6.4 16.6 260 259 A V E -bj 16 209B 0 -245,-3.2 -243,-2.3 -2,-0.3 -50,-0.2 -0.991 16.5-167.5-135.3 143.9 5.3 -3.3 18.9 261 260 A I - 0 0 7 -52,-1.6 -50,-0.3 -2,-0.4 -243,-0.1 -0.444 8.8-175.6-131.5 63.5 5.2 0.4 18.0 262 261 A P - 0 0 1 0, 0.0 -243,-2.3 0, 0.0 2,-0.4 -0.280 21.1-135.8 -59.0 140.8 6.1 2.8 21.0 263 262 A K B +d 19 0B 54 -245,-0.2 2,-0.3 -243,-0.0 -243,-0.1 -0.839 33.5 154.0-101.9 132.8 5.7 6.5 20.2 264 263 A S - 0 0 6 -245,-0.7 -241,-0.1 -2,-0.4 0, 0.0 -0.957 31.7-175.4-151.0 142.3 8.3 9.1 21.1 265 264 A V + 0 0 23 -2,-0.3 3,-0.1 -234,-0.0 -1,-0.1 0.268 67.6 99.7-100.9 1.7 9.4 12.6 19.9 266 265 A T > - 0 0 56 1,-0.2 4,-3.1 -235,-0.0 3,-0.4 -0.822 67.6-147.9 -94.1 115.7 12.2 12.7 22.5 267 266 A P H > S+ 0 0 52 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.870 97.0 50.6 -52.0 -43.0 15.6 11.7 20.9 268 267 A E H > S+ 0 0 90 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.895 114.9 42.9 -62.5 -43.4 16.9 10.1 24.2 269 268 A R H > S+ 0 0 150 -3,-0.4 4,-2.9 2,-0.2 5,-0.2 0.864 108.9 58.3 -71.1 -39.4 13.7 8.0 24.6 270 269 A I H X S+ 0 0 0 -4,-3.1 4,-0.8 1,-0.2 -2,-0.2 0.958 112.7 40.9 -52.7 -49.7 13.7 7.1 20.9 271 270 A A H >X S+ 0 0 26 -4,-2.5 3,-0.7 -5,-0.2 4,-0.6 0.919 115.4 50.2 -63.1 -45.7 17.2 5.7 21.3 272 271 A E H >< S+ 0 0 51 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.916 104.9 57.1 -60.5 -44.3 16.4 4.0 24.7 273 272 A N H 3< S+ 0 0 6 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.733 102.6 58.4 -61.3 -25.2 13.2 2.4 23.4 274 273 A F H << S+ 0 0 49 -4,-0.8 2,-1.7 -3,-0.7 3,-0.4 0.686 83.8 79.1 -83.4 -17.1 15.2 0.6 20.7 275 274 A K << + 0 0 129 -3,-1.5 -1,-0.2 -4,-0.6 -28,-0.0 -0.492 56.0 112.4-100.7 84.1 17.7 -1.2 22.9 276 275 A V + 0 0 0 -2,-1.7 3,-0.4 -3,-0.1 -1,-0.2 0.161 54.4 79.4-113.4 -1.1 15.4 -4.0 23.8 277 276 A F S S+ 0 0 59 -3,-0.4 -2,-0.1 1,-0.2 -1,-0.1 0.509 79.9 69.3 -94.5 -3.6 17.2 -6.8 22.0 278 277 A D S S+ 0 0 110 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 0.289 97.6 42.9 -97.9 3.1 19.9 -7.3 24.7 279 278 A F - 0 0 26 -3,-0.4 2,-0.4 2,-0.0 -38,-0.0 -0.966 65.3-138.7-146.6 162.1 17.9 -8.8 27.5 280 279 A E - 0 0 137 -2,-0.3 2,-0.3 -39,-0.0 -3,-0.0 -0.987 10.3-137.5-128.7 135.5 15.2 -11.4 28.2 281 280 A L - 0 0 2 -2,-0.4 -44,-0.0 -30,-0.1 -2,-0.0 -0.703 33.0-120.2 -80.3 137.2 12.1 -11.5 30.4 282 281 A S > - 0 0 43 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.286 22.3-109.5 -70.7 161.1 11.6 -14.8 32.2 283 282 A S H > S+ 0 0 98 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 125.2 53.4 -55.2 -40.5 8.5 -16.9 31.6 284 283 A Q H > S+ 0 0 147 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.920 107.6 49.3 -59.8 -46.3 7.7 -15.9 35.2 285 284 A D H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.942 112.3 49.4 -55.7 -49.2 8.1 -12.2 34.3 286 285 A M H X S+ 0 0 19 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.924 112.4 45.3 -58.3 -48.7 5.8 -12.7 31.3 287 286 A T H X S+ 0 0 85 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.896 113.1 51.9 -63.4 -38.9 3.1 -14.5 33.3 288 287 A T H < S+ 0 0 49 -4,-2.5 4,-0.4 -5,-0.2 -2,-0.2 0.920 110.2 47.4 -62.9 -46.7 3.3 -11.9 36.1 289 288 A L H >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.918 111.0 52.9 -61.3 -41.3 3.0 -9.0 33.5 290 289 A L H >< S+ 0 0 38 -4,-2.4 3,-1.7 1,-0.3 -1,-0.2 0.850 97.1 66.8 -61.2 -34.5 0.0 -10.8 32.0 291 290 A S T 3< S+ 0 0 85 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.659 86.5 71.9 -63.1 -13.5 -1.6 -11.1 35.4 292 291 A Y T < + 0 0 30 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.1 0.460 66.5 136.2 -83.0 0.5 -2.0 -7.3 35.5 293 292 A N < + 0 0 52 -3,-1.7 -103,-0.2 1,-0.2 -102,-0.2 -0.277 19.0 163.7 -57.1 121.7 -4.8 -7.3 32.9 294 293 A R - 0 0 141 -104,-1.5 -103,-0.2 2,-0.1 -1,-0.2 0.269 54.8-115.5-104.7 1.7 -7.7 -5.0 33.7 295 294 A N + 0 0 122 -105,-0.7 2,-0.5 1,-0.2 -104,-0.2 0.906 61.2 161.2 56.2 43.2 -9.3 -4.9 30.3 296 295 A W - 0 0 34 -106,-2.2 2,-0.5 -71,-0.0 -1,-0.2 -0.843 23.7-155.7-101.2 127.5 -8.5 -1.1 30.3 297 296 A R - 0 0 61 -2,-0.5 3,-0.2 1,-0.2 -106,-0.0 -0.880 24.6-170.1-111.3 131.5 -8.5 0.7 26.9 298 297 A V S S+ 0 0 1 -2,-0.5 2,-0.8 1,-0.3 -1,-0.2 0.908 92.8 40.5 -68.5 -49.5 -6.7 3.9 25.8 299 298 A C + 0 0 13 1,-0.1 -1,-0.3 2,-0.1 -113,-0.1 -0.835 59.5 153.3-113.0 102.8 -8.7 4.0 22.6 300 299 A A - 0 0 23 -2,-0.8 12,-0.2 -3,-0.2 -1,-0.1 0.390 49.4-133.0-100.6 -3.3 -12.3 3.1 23.1 301 300 A L > - 0 0 20 1,-0.1 3,-2.1 2,-0.1 4,-0.1 0.928 33.7-176.6 47.8 53.2 -13.6 5.0 20.1 302 301 A L G > S+ 0 0 128 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.701 70.1 58.5 -63.3 -24.4 -16.3 6.4 22.4 303 302 A S G 3 S+ 0 0 59 1,-0.2 -172,-1.0 2,-0.1 -1,-0.3 0.604 104.0 56.1 -76.7 -13.6 -18.3 8.4 19.8 304 303 A C G X + 0 0 0 -3,-2.1 3,-2.0 1,-0.1 -1,-0.2 0.215 65.6 117.7 -98.7 6.9 -18.8 5.3 17.8 305 304 A T T < S+ 0 0 57 -3,-0.9 -1,-0.1 1,-0.3 -2,-0.1 0.707 80.0 45.5 -58.3 -22.2 -20.5 3.0 20.4 306 305 A S T 3 S+ 0 0 111 -3,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.507 82.7 118.2 -95.9 -3.6 -23.7 2.7 18.4 307 306 A H S X S- 0 0 8 -3,-2.0 3,-2.3 1,-0.2 -3,-0.0 -0.402 73.6-126.5 -62.7 135.3 -22.1 2.1 15.0 308 307 A K T 3 S+ 0 0 131 1,-0.3 -1,-0.2 -2,-0.1 -194,-0.0 0.808 111.2 44.9 -53.7 -32.3 -23.1 -1.3 13.8 309 308 A D T 3 S+ 0 0 23 -194,-0.1 -1,-0.3 -5,-0.1 -195,-0.1 0.260 74.4 141.8 -96.3 6.3 -19.4 -2.2 13.4 310 309 A Y X - 0 0 21 -3,-2.3 3,-0.6 -6,-0.2 4,-0.3 -0.372 42.3-151.2 -52.4 122.4 -18.2 -0.8 16.7 311 310 A P T 3 S+ 0 0 1 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.673 76.4 64.6 -72.8 -25.9 -15.5 -3.4 17.7 312 311 A F T 3 S+ 0 0 34 1,-0.2 -2,-0.1 -12,-0.2 -7,-0.0 0.234 75.2 79.2 -97.4 6.4 -15.6 -3.3 21.5 313 312 A H S < S+ 0 0 127 -3,-0.6 -1,-0.2 -8,-0.0 -8,-0.0 0.916 84.4 77.2 -67.4 -49.1 -19.1 -4.5 22.6 314 313 A E S S- 0 0 89 -4,-0.3 -150,-0.0 -3,-0.3 0, 0.0 -0.242 95.8-116.7 -60.4 147.4 -17.9 -8.1 22.0 315 314 A E 0 0 161 1,-0.1 -1,-0.1 -152,-0.0 -3,-0.0 0.879 360.0 360.0 -56.2 -41.3 -15.7 -9.6 24.7 316 315 A F 0 0 51 -121,-0.1 -152,-1.7 -120,-0.0 -1,-0.1 0.306 360.0 360.0-156.3 360.0 -12.8 -9.9 22.2