==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 16-NOV-03 1US0 . COMPND 2 MOLECULE: ALDOSE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.I.HOWARD,R.SANISHVILI,R.E.CACHAU,A.MITSCHLER,B.CHEVRIER, . 313 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13974.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 10.9 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 . 11 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 3 1 1 1 0 2 1 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 92 0, 0.0 275,-0.1 0, 0.0 254,-0.0 0.000 360.0 360.0 360.0 144.5 17.9 11.7 40.4 2 1 A A - 0 0 79 1,-0.1 13,-0.1 2,-0.0 0, 0.0 -0.229 360.0-140.0 -48.6 136.9 14.2 11.8 39.6 3 2 A S S S+ 0 0 66 11,-0.1 12,-2.6 12,-0.1 13,-0.4 0.689 72.7 48.9 -86.1 -17.2 13.0 8.5 38.5 4 3 A R E -A 14 0A 116 10,-0.3 2,-0.4 11,-0.1 8,-0.0 -0.906 61.7-146.7-128.5 155.0 10.6 9.4 35.7 5 4 A I E -A 13 0A 34 8,-2.5 8,-2.8 -2,-0.3 2,-0.5 -0.919 27.4-115.5-117.1 141.1 10.6 11.6 32.6 6 5 A L E -A 12 0A 111 -2,-0.4 6,-0.2 6,-0.2 2,-0.2 -0.649 29.2-151.3 -80.3 127.1 7.5 13.4 31.3 7 6 A L > - 0 0 5 4,-3.0 3,-2.2 -2,-0.5 198,-0.1 -0.533 28.2-108.5 -91.6 162.4 6.3 12.3 27.9 8 7 A N T 3 S+ 0 0 64 196,-0.4 171,-0.2 173,-0.3 -1,-0.1 0.431 116.7 64.7 -75.6 6.4 4.4 14.4 25.3 9 8 A N T 3 S- 0 0 63 2,-0.2 -1,-0.3 172,-0.1 3,-0.1 0.343 119.8-107.5 -99.4 5.3 1.3 12.4 26.1 10 9 A G S < S+ 0 0 60 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.372 83.6 115.5 87.5 -5.5 1.2 13.8 29.6 11 10 A A - 0 0 34 144,-0.1 -4,-3.0 95,-0.1 2,-0.4 -0.621 63.4-121.4 -94.9 160.9 2.3 10.5 31.3 12 11 A K E -A 6 0A 111 -6,-0.2 -6,-0.2 -2,-0.2 -8,-0.0 -0.816 21.0-158.9-106.3 138.9 5.5 9.8 33.2 13 12 A M E -A 5 0A 1 -8,-2.8 -8,-2.5 -2,-0.4 2,-0.1 -0.956 23.7-115.5-119.0 127.4 8.0 7.1 32.1 14 13 A P E -A 4 0A 11 0, 0.0 -10,-0.3 0, 0.0 -11,-0.1 -0.414 19.6-141.7 -62.3 132.8 10.6 5.5 34.4 15 14 A I S S+ 0 0 9 -12,-2.6 245,-2.8 -2,-0.1 2,-0.4 0.606 86.3 54.9 -72.7 -14.2 14.0 6.4 33.1 16 15 A L B +b 260 0B 3 -13,-0.4 25,-0.5 243,-0.2 2,-0.3 -0.992 68.3 164.9-123.2 126.9 15.4 2.9 33.9 17 16 A G - 0 0 0 243,-2.4 2,-0.6 -2,-0.4 26,-0.2 -0.872 37.4-105.7-131.6 168.6 13.8 -0.2 32.6 18 17 A L E -c 43 0B 1 24,-2.3 26,-2.9 -2,-0.3 245,-0.2 -0.858 29.6-141.5 -98.1 124.2 14.6 -3.9 32.2 19 18 A G E -cd 44 263B 5 243,-2.0 245,-0.7 -2,-0.6 26,-0.1 -0.509 14.9-173.5 -78.9 153.5 15.4 -5.2 28.8 20 19 A T > + 0 0 0 24,-0.6 3,-1.5 -2,-0.2 2,-0.3 0.361 37.6 124.4-132.0 1.5 14.2 -8.6 27.7 21 20 A W T 3 S+ 0 0 64 1,-0.3 -2,-0.1 23,-0.1 29,-0.1 -0.563 90.0 7.7 -68.2 129.3 15.7 -9.4 24.3 22 21 A K T 3 S+ 0 0 47 -2,-0.3 -1,-0.3 1,-0.3 -2,-0.0 0.295 89.0 139.7 82.2 -3.6 17.6 -12.7 24.6 23 22 A S < - 0 0 3 -3,-1.5 -1,-0.3 1,-0.1 5,-0.1 -0.590 60.0-118.9 -70.9 118.0 16.2 -13.3 28.1 24 23 A P >> - 0 0 47 0, 0.0 3,-2.2 0, 0.0 4,-2.2 -0.259 13.0-122.7 -63.3 149.0 15.5 -17.1 28.0 25 24 A P H 3> S+ 0 0 72 0, 0.0 4,-0.6 0, 0.0 -2,-0.1 0.820 112.2 54.5 -63.3 -27.4 11.9 -18.0 28.5 26 25 A G H 34 S+ 0 0 80 1,-0.2 4,-0.1 2,-0.1 -3,-0.0 0.482 119.1 33.4 -80.8 -3.3 12.9 -20.3 31.4 27 26 A Q H <> S+ 0 0 96 -3,-2.2 4,-2.1 2,-0.1 -1,-0.2 0.558 99.3 75.8-119.0 -22.6 14.7 -17.4 33.1 28 27 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.807 88.0 59.6 -75.2 -27.1 12.8 -14.2 32.3 29 28 A T H X S+ 0 0 27 -4,-0.6 4,-2.4 1,-0.2 -1,-0.2 0.969 112.0 41.1 -62.1 -49.3 9.8 -14.8 34.6 30 29 A E H > S+ 0 0 106 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.895 112.5 56.2 -62.6 -38.5 12.2 -14.8 37.6 31 30 A A H X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.929 110.9 42.7 -59.1 -46.1 14.2 -11.9 36.1 32 31 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.882 113.2 52.7 -69.7 -38.8 11.1 -9.7 35.9 33 32 A K H X S+ 0 0 56 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.940 112.9 44.5 -59.1 -48.0 9.9 -10.8 39.3 34 33 A V H X S+ 0 0 19 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.929 111.4 54.1 -60.6 -46.1 13.2 -9.9 40.9 35 34 A A H X>S+ 0 0 0 -4,-2.6 5,-2.6 -5,-0.3 4,-0.6 0.937 110.8 44.9 -55.5 -49.6 13.4 -6.7 38.9 36 35 A I H ><5S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.2 -1,-0.2 0.929 111.2 54.2 -62.6 -41.4 10.0 -5.6 40.3 37 36 A D H 3<5S+ 0 0 89 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.837 110.9 45.7 -59.8 -33.7 10.9 -6.7 43.8 38 37 A V H 3<5S- 0 0 63 -4,-2.1 -1,-0.2 -3,-0.3 -2,-0.2 0.394 132.4 -83.2 -96.7 2.9 14.1 -4.5 43.7 39 38 A G T <<5S+ 0 0 19 -3,-1.1 -3,-0.2 -4,-0.6 -2,-0.1 0.264 75.4 142.7 125.6 -11.0 12.4 -1.4 42.2 40 39 A Y < + 0 0 1 -5,-2.6 -1,-0.3 -6,-0.2 -23,-0.1 -0.411 14.8 172.1 -64.2 140.6 12.1 -1.7 38.5 41 40 A R + 0 0 70 -25,-0.5 33,-2.3 1,-0.1 2,-0.4 0.218 59.4 66.0-129.1 8.7 8.8 -0.2 37.2 42 41 A H E - e 0 74B 0 -26,-0.2 -24,-2.3 31,-0.2 2,-0.4 -0.997 56.3-173.9-139.9 126.1 9.5 -0.3 33.5 43 42 A I E -ce 18 75B 0 31,-1.6 33,-2.4 -2,-0.4 2,-0.6 -0.996 15.1-146.8-123.6 129.9 9.9 -3.5 31.3 44 43 A D E +ce 19 76B 4 -26,-2.9 -24,-0.6 -2,-0.4 2,-0.2 -0.897 31.4 165.1 -99.8 122.9 10.9 -3.3 27.7 45 44 A C - 0 0 0 31,-2.3 2,-0.3 -2,-0.6 3,-0.1 -0.728 19.4-170.2-127.3 170.7 9.3 -6.1 25.6 46 45 A A > > - 0 0 0 -2,-0.2 3,-1.3 31,-0.2 5,-0.5 -0.899 30.8-129.8-163.3 146.8 8.6 -7.1 22.1 47 46 A H G > 5S+ 0 0 36 31,-1.1 3,-1.9 -2,-0.3 5,-0.2 0.895 109.4 59.7 -57.8 -40.4 6.6 -9.8 20.3 48 47 A V G 3 5S+ 0 0 24 1,-0.3 -1,-0.3 30,-0.3 74,-0.1 0.716 89.9 70.9 -65.7 -18.4 9.7 -10.7 18.2 49 48 A Y G < 5S- 0 0 41 -3,-1.3 -1,-0.3 1,-0.1 -27,-0.3 0.658 95.3-142.2 -73.2 -14.6 11.6 -11.6 21.4 50 49 A Q T < 5S+ 0 0 144 -3,-1.9 -3,-0.1 -4,-0.3 -2,-0.1 0.655 78.1 87.6 68.2 21.7 9.3 -14.7 21.8 51 50 A N >< + 0 0 2 -5,-0.5 4,-2.3 2,-0.1 5,-0.2 0.212 42.4 110.9-135.4 16.6 9.1 -14.4 25.5 52 51 A E H > S+ 0 0 4 -6,-0.2 4,-2.8 1,-0.2 5,-0.2 0.846 76.4 58.7 -66.5 -32.1 6.2 -12.0 26.2 53 52 A N H > S+ 0 0 79 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.950 110.6 43.0 -58.1 -45.6 4.1 -14.8 27.7 54 53 A E H > S+ 0 0 55 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.865 112.5 51.6 -71.5 -36.8 6.7 -15.5 30.3 55 54 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 3,-0.2 0.939 109.6 52.9 -58.5 -45.4 7.3 -11.8 31.0 56 55 A G H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.854 100.5 59.2 -60.5 -37.8 3.6 -11.5 31.5 57 56 A V H X S+ 0 0 66 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.923 109.0 45.7 -56.3 -44.1 3.5 -14.3 34.0 58 57 A A H X S+ 0 0 0 -4,-1.4 4,-2.3 -3,-0.2 -2,-0.2 0.923 112.8 48.4 -64.3 -48.0 5.9 -12.3 36.2 59 58 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.949 113.5 47.7 -56.7 -49.2 3.9 -9.0 35.8 60 59 A Q H X S+ 0 0 82 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.889 110.5 51.3 -63.0 -40.2 0.7 -10.7 36.6 61 60 A E H X S+ 0 0 48 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.902 110.6 48.0 -64.2 -41.4 2.0 -12.4 39.6 62 61 A K H <>S+ 0 0 13 -4,-2.3 5,-2.3 2,-0.2 6,-0.9 0.865 113.5 48.0 -69.9 -32.4 3.5 -9.2 41.0 63 62 A L H ><5S+ 0 0 32 -4,-2.4 3,-0.9 -5,-0.2 -2,-0.2 0.925 113.8 46.8 -67.0 -44.0 0.2 -7.5 40.4 64 63 A R H 3<5S+ 0 0 153 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.896 111.2 51.7 -64.2 -43.5 -1.7 -10.3 42.0 65 64 A E T 3<5S- 0 0 90 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.562 110.4-127.6 -59.3 -19.7 0.8 -10.3 45.0 66 65 A Q T < 5 + 0 0 168 -3,-0.9 -3,-0.2 -4,-0.4 3,-0.1 0.817 68.9 135.1 61.2 35.3 0.1 -6.5 45.3 67 66 A V S > - 0 0 126 -2,-0.3 3,-1.7 -3,-0.1 4,-0.5 -0.733 30.2-117.3 -98.0 153.1 -0.2 -1.5 41.2 70 69 A R G >4 S+ 0 0 39 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.875 114.3 59.7 -57.2 -38.4 -0.8 -1.6 37.5 71 70 A E G 34 S+ 0 0 145 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.719 101.1 56.2 -62.9 -23.3 -0.7 2.2 37.4 72 71 A E G <4 S+ 0 0 87 -3,-1.7 2,-0.3 2,-0.0 -1,-0.3 0.536 94.9 82.2 -84.9 -11.5 2.8 2.1 38.8 73 72 A L << - 0 0 3 -3,-1.6 2,-0.5 -4,-0.5 -31,-0.2 -0.723 61.3-158.3 -94.8 153.0 4.2 -0.1 36.0 74 73 A F E -e 42 0B 7 -33,-2.3 -31,-1.6 -2,-0.3 2,-0.5 -0.929 15.7-172.9-130.9 98.7 5.3 1.2 32.6 75 74 A I E -e 43 0B 0 -2,-0.5 31,-1.6 -33,-0.2 32,-1.5 -0.878 0.7-169.4-105.8 127.4 5.1 -1.7 30.1 76 75 A V E +ef 44 107B 0 -33,-2.4 -31,-2.3 -2,-0.5 2,-0.3 -0.920 10.5 165.7-114.8 135.5 6.5 -1.2 26.6 77 76 A S E - f 0 108B 0 30,-2.0 32,-2.3 -2,-0.4 2,-0.4 -0.830 21.9-131.2-138.3-175.4 6.2 -3.4 23.6 78 77 A K E - f 0 109B 0 -2,-0.3 -31,-1.1 30,-0.2 2,-0.5 -0.998 14.6-121.6-145.4 139.4 6.7 -3.1 19.9 79 78 A L E - f 0 110B 0 30,-2.9 32,-1.9 -2,-0.4 33,-0.4 -0.686 38.5-128.4 -79.1 120.8 4.9 -3.9 16.6 80 79 A W > - 0 0 8 -2,-0.5 3,-1.9 31,-0.1 36,-0.1 -0.289 19.6-108.2 -77.1 161.5 7.0 -6.3 14.6 81 80 A C G > S+ 0 0 0 1,-0.3 35,-2.7 2,-0.2 3,-0.9 0.700 113.6 62.0 -62.7 -27.5 7.8 -5.6 10.9 82 81 A T G 3 S+ 0 0 1 1,-0.2 -1,-0.3 33,-0.2 37,-0.3 0.335 98.2 60.2 -82.6 8.9 5.5 -8.3 9.5 83 82 A Y G < + 0 0 50 -3,-1.9 2,-1.9 35,-0.1 -1,-0.2 0.078 63.5 120.0-124.9 22.5 2.5 -6.5 11.0 84 83 A H < + 0 0 0 -3,-0.9 2,-0.3 32,-0.3 52,-0.2 -0.524 49.8 103.4 -79.7 66.3 2.8 -3.2 9.2 85 84 A E S >> S- 0 0 40 -2,-1.9 3,-2.4 1,-0.1 4,-1.1 -0.927 79.3-121.1-146.8 133.5 -0.5 -3.5 7.5 86 85 A K H 3> S+ 0 0 183 -2,-0.3 4,-0.5 1,-0.3 3,-0.5 0.775 112.8 47.3 -26.7 -61.6 -3.8 -1.7 8.5 87 86 A G H 34 S+ 0 0 73 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.474 114.0 46.2 -78.2 -0.9 -5.6 -4.9 9.1 88 87 A L H <> S+ 0 0 64 -3,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.582 88.7 80.1-111.8 -19.2 -2.9 -6.6 11.2 89 88 A V H X S+ 0 0 2 -4,-1.1 4,-2.4 -3,-0.5 5,-0.2 0.908 93.4 47.8 -63.4 -47.2 -1.8 -3.8 13.7 90 89 A K H X S+ 0 0 102 -4,-0.5 4,-3.0 1,-0.2 -1,-0.2 0.938 113.2 47.7 -62.1 -44.8 -4.7 -4.3 16.2 91 90 A G H > S+ 0 0 48 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 110.4 52.3 -64.4 -35.3 -4.3 -8.0 16.3 92 91 A A H X S+ 0 0 11 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.928 112.3 45.6 -63.5 -44.5 -0.6 -7.8 16.8 93 92 A C H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.935 112.4 51.2 -63.6 -44.2 -1.1 -5.4 19.7 94 93 A Q H X S+ 0 0 89 -4,-3.0 4,-2.9 2,-0.2 -2,-0.2 0.844 106.6 53.5 -64.8 -34.5 -3.8 -7.6 21.1 95 94 A K H X S+ 0 0 101 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.934 110.8 47.2 -63.6 -43.8 -1.6 -10.7 21.0 96 95 A T H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.927 113.1 48.9 -60.3 -45.7 1.1 -8.8 22.9 97 96 A L H X>S+ 0 0 1 -4,-2.7 5,-2.5 2,-0.2 4,-0.7 0.923 112.2 48.3 -59.0 -45.4 -1.6 -7.6 25.4 98 97 A S H ><5S+ 0 0 76 -4,-2.9 3,-0.7 1,-0.2 -2,-0.2 0.927 113.9 46.6 -62.2 -43.2 -2.9 -11.1 25.8 99 98 A D H 3<5S+ 0 0 18 -4,-2.7 -43,-0.2 1,-0.2 -2,-0.2 0.900 113.3 47.9 -65.2 -42.3 0.6 -12.6 26.3 100 99 A L H 3<5S- 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.535 109.8-122.2 -77.0 -5.4 1.6 -9.9 28.8 101 100 A K T <<5 + 0 0 68 -4,-0.7 2,-0.3 -3,-0.7 -3,-0.2 0.833 68.8 131.2 65.8 38.2 -1.6 -10.3 30.8 102 101 A L < - 0 0 17 -5,-2.5 -1,-0.2 -6,-0.2 3,-0.1 -0.833 58.3-154.1-121.8 157.8 -2.5 -6.7 30.3 103 102 A D S S+ 0 0 127 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.402 88.6 14.1-103.7 -4.2 -5.5 -4.6 29.1 104 103 A Y - 0 0 33 -7,-0.1 2,-0.4 3,-0.0 -1,-0.3 -0.956 67.5-133.3-157.4 158.0 -3.3 -1.7 28.0 105 104 A L B -k 154 0C 0 48,-2.0 50,-2.7 -2,-0.3 51,-0.4 -0.857 13.2-142.8-101.4 145.7 0.3 -1.0 27.2 106 105 A D S S+ 0 0 16 -31,-1.6 2,-0.3 -2,-0.4 -30,-0.2 0.842 89.7 8.1 -71.6 -32.1 2.0 2.2 28.5 107 106 A L E -f 76 0B 1 -32,-1.5 -30,-2.0 48,-0.2 2,-0.4 -0.971 62.6-168.4-153.1 133.5 3.9 2.5 25.3 108 107 A Y E -fg 77 157B 1 48,-1.8 50,-2.2 -2,-0.3 2,-0.4 -0.996 16.3-162.9-127.2 126.9 3.7 0.7 21.9 109 108 A L E -fg 78 158B 0 -32,-2.3 -30,-2.9 -2,-0.4 2,-0.7 -0.842 30.0-119.7-111.7 145.5 6.5 1.3 19.4 110 109 A I E -fg 79 159B 0 48,-2.1 50,-1.1 -2,-0.4 -30,-0.1 -0.731 36.2-148.8 -72.4 114.1 6.9 0.7 15.7 111 110 A H S S- 0 0 10 -32,-1.9 -1,-0.2 -2,-0.7 -31,-0.1 0.889 71.4 -1.2 -63.6 -45.5 9.9 -1.7 16.2 112 111 A W S S- 0 0 40 -33,-0.4 -1,-0.2 2,-0.2 49,-0.2 -0.974 71.4-120.6-138.3 154.8 11.7 -0.9 13.0 113 112 A P S S+ 0 0 1 0, 0.0 2,-0.4 0, 0.0 197,-0.1 0.770 87.2 91.5 -68.8 -21.2 10.6 1.5 10.2 114 113 A T - 0 0 4 195,-0.1 2,-0.4 193,-0.0 -2,-0.2 -0.597 64.4-150.3 -83.0 127.8 10.6 -1.3 7.6 115 114 A G - 0 0 1 -2,-0.4 19,-2.1 21,-0.3 2,-0.3 -0.758 14.7-162.4 -91.2 140.7 7.5 -3.3 6.9 116 115 A F B -L 133 0D 3 -35,-2.7 -32,-0.3 -2,-0.4 3,-0.1 -0.839 36.0 -77.2-117.2 160.3 8.0 -6.9 5.7 117 116 A K - 0 0 108 15,-2.7 17,-0.1 -2,-0.3 15,-0.1 -0.276 56.7-113.6 -53.3 130.2 5.7 -9.3 4.0 118 117 A P + 0 0 47 0, 0.0 2,-0.3 0, 0.0 -35,-0.1 -0.275 65.2 96.3 -66.7 154.4 3.2 -10.7 6.5 119 118 A G S S- 0 0 46 -37,-0.3 -37,-0.1 1,-0.1 -3,-0.0 -0.945 86.2 -59.7 152.2-173.1 3.3 -14.4 7.4 120 119 A K S S+ 0 0 195 -2,-0.3 2,-0.3 3,-0.0 -1,-0.1 0.863 105.5 82.6 -70.1 -36.1 4.6 -16.8 10.0 121 120 A E - 0 0 121 1,-0.1 -2,-0.0 -3,-0.1 0, 0.0 -0.533 66.8-151.1 -75.3 133.6 8.3 -15.9 9.4 122 121 A F S S+ 0 0 40 -2,-0.3 -1,-0.1 1,-0.3 -41,-0.1 0.769 96.8 32.9 -72.1 -26.0 9.6 -12.8 11.2 123 122 A F S S- 0 0 77 -42,-0.1 -1,-0.3 -41,-0.0 2,-0.2 -0.720 81.0-164.9-129.2 79.5 12.2 -12.2 8.4 124 123 A P - 0 0 4 0, 0.0 8,-2.6 0, 0.0 2,-0.3 -0.511 16.0-165.2 -67.8 130.4 10.6 -13.4 5.1 125 124 A L B -M 131 0E 82 6,-0.3 6,-0.2 -2,-0.2 2,-0.1 -0.873 18.7-127.8-118.8 150.9 13.5 -13.8 2.6 126 125 A D > - 0 0 64 4,-2.7 3,-2.0 -2,-0.3 6,-0.1 -0.264 48.3 -89.7 -80.2 175.4 13.7 -14.1 -1.1 127 126 A E T 3 S+ 0 0 193 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.674 129.1 53.6 -68.7 -10.5 15.8 -17.0 -2.5 128 127 A S T 3 S- 0 0 108 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.257 121.9-103.2-103.2 7.5 18.8 -14.7 -2.5 129 128 A G S < S+ 0 0 29 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.509 75.2 134.0 90.7 4.7 18.5 -13.8 1.1 130 129 A N - 0 0 70 1,-0.1 -4,-2.7 174,-0.1 -1,-0.3 -0.685 62.8-105.8 -83.9 143.3 17.0 -10.3 0.9 131 130 A V B -M 125 0E 9 172,-2.6 -6,-0.3 -2,-0.3 -1,-0.1 -0.347 30.9-122.6 -63.7 147.4 14.1 -9.5 3.1 132 131 A V - 0 0 40 -8,-2.6 -15,-2.7 -15,-0.1 -1,-0.1 -0.825 33.1-142.1 -93.0 111.5 10.8 -9.3 1.3 133 132 A P B -L 116 0D 70 0, 0.0 2,-0.3 0, 0.0 -17,-0.3 -0.267 3.2-131.5 -70.3 159.3 9.3 -5.8 1.9 134 133 A S - 0 0 17 -19,-2.1 -19,-0.3 2,-0.2 -17,-0.1 -0.811 16.3-133.3 -89.6 149.0 5.8 -4.8 2.4 135 134 A D S S+ 0 0 156 -2,-0.3 2,-0.4 -19,-0.0 -50,-0.1 0.560 73.8 110.5 -75.1 -8.9 4.5 -1.9 0.4 136 135 A T - 0 0 19 -52,-0.2 -21,-0.3 1,-0.1 -2,-0.2 -0.564 61.3-142.3 -76.0 126.7 3.0 -0.2 3.5 137 136 A N > - 0 0 68 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.207 24.3-103.4 -86.7 174.6 4.8 3.1 4.5 138 137 A I H > S+ 0 0 6 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.752 117.8 57.9 -66.5 -27.3 5.7 4.5 8.0 139 138 A L H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.930 108.3 42.6 -71.5 -42.1 2.8 7.1 7.7 140 139 A D H > S+ 0 0 99 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.891 114.4 52.4 -68.9 -35.0 0.1 4.5 7.2 141 140 A T H X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.917 107.9 52.5 -63.9 -41.2 1.6 2.4 9.9 142 141 A W H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.915 104.8 54.3 -60.1 -42.2 1.6 5.5 12.2 143 142 A A H X S+ 0 0 36 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.899 107.4 51.6 -59.0 -37.7 -2.1 6.1 11.5 144 143 A A H X S+ 0 0 13 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.883 108.1 51.5 -64.1 -38.5 -2.7 2.5 12.6 145 144 A M H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 3,-0.5 0.901 105.5 55.8 -62.3 -41.6 -0.8 3.2 15.8 146 145 A E H X S+ 0 0 14 -4,-2.6 4,-1.9 1,-0.2 3,-0.4 0.884 101.1 58.4 -60.0 -37.0 -2.9 6.2 16.4 147 146 A E H X S+ 0 0 98 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.866 98.6 59.5 -60.3 -35.3 -6.0 4.1 16.3 148 147 A L H <>S+ 0 0 2 -4,-1.1 5,-1.7 -3,-0.5 6,-1.0 0.867 104.5 49.4 -63.1 -36.8 -4.7 2.0 19.1 149 148 A V H ><5S+ 0 0 34 -4,-1.1 3,-1.5 -3,-0.4 -1,-0.2 0.939 110.7 50.7 -60.6 -47.8 -4.6 5.0 21.4 150 149 A D H 3<5S+ 0 0 80 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.642 109.8 50.5 -69.7 -13.6 -8.2 5.9 20.3 151 150 A E T 3<5S- 0 0 71 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.391 113.5-115.5-100.3 -2.2 -9.3 2.3 21.2 152 151 A G T < 5S+ 0 0 44 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.540 83.3 117.0 82.7 7.3 -7.7 2.3 24.6 153 152 A L S - 0 0 44 -2,-0.5 4,-2.8 -3,-0.1 5,-0.3 -0.238 33.5 -89.0 -80.7 175.0 16.5 8.0 11.6 164 163 A H H > S+ 0 0 79 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.911 127.4 46.9 -53.4 -48.1 16.3 11.7 11.5 165 164 A L H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.861 112.2 51.0 -67.5 -29.6 14.5 11.9 8.2 166 165 A Q H > S+ 0 0 13 2,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.887 109.6 49.0 -74.4 -39.5 12.0 9.2 9.3 167 166 A V H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.944 111.8 50.9 -59.4 -48.5 11.2 11.0 12.5 168 167 A E H X S+ 0 0 71 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.879 106.7 53.8 -57.0 -40.1 10.7 14.2 10.5 169 168 A M H < S+ 0 0 93 -4,-1.9 4,-0.3 2,-0.2 -1,-0.2 0.906 109.3 48.4 -59.5 -49.1 8.4 12.3 8.1 170 169 A I H >< S+ 0 0 0 -4,-2.1 3,-1.8 2,-0.2 -2,-0.2 0.960 113.0 47.4 -53.0 -51.3 6.3 11.2 11.1 171 170 A L H 3< S+ 0 0 30 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.816 114.6 46.8 -63.5 -30.2 6.2 14.8 12.5 172 171 A N T 3< S+ 0 0 115 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.361 81.5 136.3 -94.4 10.8 5.3 16.2 9.1 173 172 A K X - 0 0 37 -3,-1.8 3,-2.1 -4,-0.3 -3,-0.1 -0.267 63.9-111.8 -61.3 130.0 2.5 13.6 8.4 174 173 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.359 102.6 9.6 -59.6 131.7 -0.6 15.3 7.0 175 174 A G T 3 S- 0 0 74 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.650 86.1-176.0 73.7 16.7 -3.3 15.1 9.6 176 175 A L < - 0 0 49 -3,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.178 8.4-178.3 -48.5 129.9 -0.9 13.8 12.4 177 176 A K + 0 0 120 1,-0.3 2,-0.4 0, 0.0 -1,-0.1 0.847 66.3 20.9-101.4 -45.5 -3.1 13.1 15.4 178 177 A Y S S- 0 0 76 -22,-0.0 -1,-0.3 -169,-0.0 -32,-0.1 -0.994 74.2-135.4-128.0 127.6 -0.5 12.0 18.0 179 178 A K - 0 0 122 -2,-0.4 -22,-0.3 -171,-0.2 2,-0.1 -0.435 40.5 -91.8 -68.0 153.3 3.2 12.8 17.9 180 179 A P - 0 0 0 0, 0.0 -22,-0.3 0, 0.0 -1,-0.1 -0.467 32.1-157.0 -61.9 137.8 5.5 9.9 18.7 181 180 A A S S+ 0 0 2 -24,-3.0 25,-2.4 1,-0.2 2,-0.3 0.772 71.1 17.0 -82.8 -32.1 6.3 10.0 22.4 182 181 A V E - i 0 206B 0 -25,-0.3 -23,-2.8 23,-0.2 2,-0.4 -0.987 51.6-157.1-142.8 145.2 9.6 8.1 22.2 183 182 A N E -hi 159 207B 0 23,-2.0 25,-1.7 -2,-0.3 2,-0.6 -0.990 21.0-156.6-120.6 116.7 12.2 7.0 19.7 184 183 A Q E +hi 160 208B 4 -25,-2.1 -23,-2.1 -2,-0.4 2,-0.3 -0.867 26.3 160.4 -96.9 119.2 14.1 4.0 21.0 185 184 A I E - i 0 209B 4 23,-2.7 25,-2.5 -2,-0.6 2,-0.2 -0.926 46.7 -89.2-137.6 159.3 17.5 3.7 19.5 186 185 A E E + i 0 210B 0 -2,-0.3 2,-0.3 23,-0.2 25,-0.2 -0.487 54.3 164.5 -67.2 135.3 20.9 2.1 20.1 187 186 A C + 0 0 2 23,-2.2 5,-0.2 -2,-0.2 27,-0.1 -0.904 9.1 123.2-161.7 130.3 23.1 4.4 22.2 188 187 A H B > S-N 191 0F 4 3,-1.5 3,-1.7 -2,-0.3 25,-0.1 -0.919 73.7 -70.6-168.7 176.7 26.2 3.9 24.3 189 188 A P T 3 S+ 0 0 0 0, 0.0 3,-0.3 0, 0.0 24,-0.0 0.709 130.7 49.9 -60.9 -21.4 29.7 5.4 24.4 190 189 A Y T 3 S+ 0 0 11 1,-0.3 104,-2.4 103,-0.2 106,-2.1 0.562 123.4 30.3 -90.8 -6.2 30.8 3.8 21.1 191 190 A L B < S+N 188 0F 7 -3,-1.7 -3,-1.5 104,-0.2 -1,-0.3 -0.728 73.7 172.3-146.3 78.4 27.6 5.0 19.3 192 191 A T - 0 0 0 -3,-0.3 5,-0.1 -5,-0.2 -1,-0.1 0.698 22.6-153.7 -80.1 -17.6 26.8 8.2 21.0 193 192 A Q > + 0 0 28 1,-0.1 4,-2.6 3,-0.1 5,-0.3 0.754 31.9 158.2 62.9 31.0 24.0 9.4 18.7 194 193 A E H > S+ 0 0 86 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.906 70.1 48.0 -59.4 -40.8 24.5 13.1 19.4 195 194 A K H > S+ 0 0 184 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 115.4 41.4 -66.5 -49.5 22.8 14.3 16.2 196 195 A L H > S+ 0 0 19 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.904 114.8 52.7 -68.2 -36.9 19.7 12.1 16.4 197 196 A I H X S+ 0 0 6 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.935 109.3 48.2 -61.9 -46.9 19.3 12.7 20.1 198 197 A Q H X S+ 0 0 125 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.922 112.5 49.6 -63.4 -39.9 19.4 16.5 19.7 199 198 A Y H X S+ 0 0 26 -4,-2.2 4,-1.0 -5,-0.2 -2,-0.2 0.974 115.1 42.7 -59.6 -51.9 16.9 16.3 16.8 200 199 A C H ><>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 3,-1.0 0.941 115.2 48.5 -61.1 -47.0 14.5 14.2 18.8 201 200 A Q H ><5S+ 0 0 59 -4,-3.1 3,-1.8 1,-0.3 -1,-0.2 0.881 106.0 58.3 -60.2 -38.9 14.9 16.1 22.0 202 201 A S H 3<5S+ 0 0 71 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.763 108.0 48.1 -61.6 -24.5 14.3 19.4 20.2 203 202 A K T <<5S- 0 0 98 -3,-1.0 -1,-0.3 -4,-1.0 -2,-0.2 0.322 121.0-107.5 -98.0 4.8 11.0 18.0 19.0 204 203 A G T < 5S+ 0 0 40 -3,-1.8 2,-0.5 1,-0.3 -196,-0.4 0.589 73.9 139.2 80.3 9.8 9.9 16.9 22.5 205 204 A I < - 0 0 1 -5,-2.3 2,-0.3 -6,-0.2 -1,-0.3 -0.760 50.7-132.1 -87.3 129.6 10.4 13.1 21.7 206 205 A V E -i 182 0B 12 -25,-2.4 -23,-2.0 -2,-0.5 2,-0.5 -0.666 18.2-139.7 -79.7 136.5 12.0 11.2 24.6 207 206 A V E -i 183 0B 0 50,-0.4 52,-2.4 -2,-0.3 2,-0.5 -0.848 9.5-158.4-100.7 131.4 14.9 9.0 23.5 208 207 A T E -ij 184 259B 0 -25,-1.7 -23,-2.7 -2,-0.5 2,-0.6 -0.955 13.8-140.7-103.9 130.4 15.3 5.5 25.0 209 208 A A E -ij 185 260B 0 50,-3.3 52,-1.5 -2,-0.5 -23,-0.2 -0.812 19.3-168.1 -91.5 117.9 18.8 4.1 24.7 210 209 A Y E +i 186 0B 18 -25,-2.5 -23,-2.2 -2,-0.6 4,-0.1 -0.607 67.1 24.1-101.2 165.1 19.0 0.4 24.0 211 210 A S S > S+ 0 0 16 50,-0.3 3,-2.1 -2,-0.2 -1,-0.2 0.884 70.5 165.4 47.6 48.1 22.0 -1.9 24.2 212 211 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.703 73.8 47.5 -68.3 -19.8 23.6 0.5 26.7 213 212 A L T 3 S- 0 0 25 -25,-0.1 16,-0.5 -24,-0.0 15,-0.2 0.288 125.5-100.4 -97.3 6.8 26.2 -2.1 27.7 214 213 A G < - 0 0 5 -3,-2.1 4,-0.2 1,-0.2 -3,-0.1 0.635 51.1 -94.6 80.2 16.7 27.0 -2.9 24.1 215 214 A S > - 0 0 8 1,-0.1 3,-2.4 2,-0.1 -1,-0.2 0.897 49.8-175.5 47.3 59.7 24.9 -6.1 24.0 216 215 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.744 81.4 54.2 -61.8 -21.9 27.7 -8.5 24.9 217 216 A D T 3 S+ 0 0 65 3,-0.0 -2,-0.1 2,-0.0 -3,-0.0 0.310 73.9 135.1 -93.0 7.1 25.3 -11.4 24.4 218 217 A R X - 0 0 17 -3,-2.4 3,-1.9 -4,-0.2 81,-0.0 -0.270 63.9-125.3 -52.5 140.1 24.2 -10.3 20.9 219 218 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.769 106.0 51.9 -69.9 -16.4 24.2 -13.5 18.8 220 219 A W T 3 S+ 0 0 113 78,-0.1 -2,-0.1 2,-0.1 -3,-0.0 0.224 76.9 138.6-103.3 14.0 26.6 -12.1 16.2 221 220 A A < - 0 0 44 -3,-1.9 -6,-0.0 -6,-0.1 3,-0.0 -0.295 38.5-154.0 -56.5 145.2 29.3 -10.9 18.6 222 221 A K > - 0 0 121 1,-0.1 3,-1.7 0, 0.0 -2,-0.1 -0.918 23.6-119.8-120.1 148.2 32.8 -11.5 17.4 223 222 A P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.864 112.6 51.8 -57.6 -31.4 35.9 -11.9 19.7 224 223 A E T 3 S+ 0 0 141 2,-0.0 3,-0.1 -3,-0.0 -3,-0.0 0.614 83.6 113.6 -81.8 -13.3 37.7 -8.9 18.2 225 224 A D S < S- 0 0 43 -3,-1.7 2,-0.0 1,-0.1 -4,-0.0 -0.212 79.5 -93.5 -56.6 149.3 34.7 -6.4 18.6 226 225 A P - 0 0 28 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.378 37.6-147.6 -64.1 151.2 35.1 -3.5 21.0 227 226 A S > - 0 0 40 1,-0.1 4,-0.5 -3,-0.1 3,-0.4 -0.937 14.7-169.2-129.9 108.4 33.8 -4.2 24.6 228 227 A L T >4 S+ 0 0 3 -2,-0.5 3,-1.2 1,-0.2 6,-0.2 0.903 90.4 53.9 -58.0 -47.2 32.4 -1.4 26.6 229 228 A L T 34 S+ 0 0 55 -16,-0.5 -1,-0.2 1,-0.3 16,-0.1 0.783 115.6 40.0 -64.9 -25.2 32.3 -3.4 29.8 230 229 A E T 34 S+ 0 0 145 -3,-0.4 -1,-0.3 15,-0.1 -2,-0.2 0.363 81.3 121.6-101.9 3.8 36.0 -4.2 29.4 231 230 A D XX - 0 0 10 -3,-1.2 4,-2.7 -4,-0.5 3,-0.8 -0.521 55.7-149.7 -71.9 118.4 37.2 -0.8 28.2 232 231 A P H 3> S+ 0 0 89 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.787 94.7 60.7 -67.4 -20.6 39.8 0.3 30.8 233 232 A R H 3> S+ 0 0 116 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.873 110.5 40.2 -68.2 -36.0 39.0 4.0 30.2 234 233 A I H <> S+ 0 0 0 -3,-0.8 4,-2.4 2,-0.2 5,-0.2 0.903 112.2 55.6 -76.9 -40.2 35.4 3.3 31.3 235 234 A K H X S+ 0 0 107 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.867 104.7 55.2 -56.2 -38.3 36.5 1.0 34.1 236 235 A A H X S+ 0 0 58 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.890 107.2 47.9 -65.1 -41.0 38.7 3.9 35.4 237 236 A I H X S+ 0 0 13 -4,-1.2 4,-1.6 2,-0.2 -2,-0.2 0.927 112.8 50.1 -62.4 -43.1 35.7 6.2 35.6 238 237 A A H X>S+ 0 0 2 -4,-2.4 5,-2.4 1,-0.2 4,-0.5 0.939 109.6 49.9 -58.9 -47.9 33.8 3.5 37.4 239 238 A A H ><5S+ 0 0 76 -4,-2.8 3,-1.2 1,-0.2 -1,-0.2 0.900 106.5 55.5 -57.8 -40.4 36.6 3.0 39.9 240 239 A K H 3<5S+ 0 0 136 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.877 114.2 40.6 -61.9 -37.7 36.8 6.7 40.6 241 240 A H H 3<5S- 0 0 47 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.393 110.4-120.4 -90.7 3.2 33.1 6.7 41.5 242 241 A N T <<5S+ 0 0 149 -3,-1.2 2,-0.3 -4,-0.5 -3,-0.2 0.890 76.5 116.9 53.4 44.7 33.3 3.3 43.4 243 242 A K < - 0 0 41 -5,-2.4 -1,-0.2 -6,-0.1 2,-0.1 -0.802 70.0 -96.6-129.5 168.1 30.7 1.9 41.0 244 243 A T > - 0 0 48 -2,-0.3 4,-2.1 28,-0.1 5,-0.2 -0.487 33.1-112.8 -80.5 162.5 30.8 -0.9 38.4 245 244 A T H > S+ 0 0 21 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.917 119.9 53.8 -60.4 -41.1 31.4 -0.3 34.7 246 245 A A H > S+ 0 0 9 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.899 105.4 53.4 -59.5 -42.0 27.8 -1.3 34.0 247 246 A Q H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.900 109.8 47.7 -62.5 -38.8 26.5 1.3 36.5 248 247 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.920 110.3 52.2 -62.6 -43.7 28.5 4.0 34.8 249 248 A L H < S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.777 113.8 44.0 -64.7 -27.1 27.2 2.8 31.4 250 249 A I H X S+ 0 0 0 -4,-1.7 4,-1.2 -5,-0.2 -2,-0.2 0.868 113.2 49.2 -82.0 -42.4 23.6 3.0 32.8 251 250 A R H X S+ 0 0 10 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.844 99.2 70.6 -65.5 -34.0 24.0 6.4 34.5 252 251 A F H X S+ 0 0 1 -4,-2.3 4,-0.5 1,-0.2 3,-0.4 0.948 102.8 38.6 -51.3 -58.3 25.6 7.9 31.4 253 252 A P H >4>S+ 0 0 4 0, 0.0 5,-2.2 0, 0.0 3,-1.4 0.877 109.9 62.6 -63.9 -34.1 22.4 8.0 29.3 254 253 A M H ><5S+ 0 0 2 -4,-1.2 3,-1.6 1,-0.3 -2,-0.2 0.917 102.3 50.3 -55.5 -41.4 20.3 9.0 32.3 255 254 A Q H 3<5S+ 0 0 40 -4,-2.1 -1,-0.3 -3,-0.4 -3,-0.1 0.561 102.8 60.7 -77.8 -4.6 22.3 12.2 32.6 256 255 A R T <<5S- 0 0 30 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.208 123.4-105.1 -95.4 10.2 21.7 12.9 28.9 257 256 A N T < 5S+ 0 0 105 -3,-1.6 -50,-0.4 1,-0.3 2,-0.3 0.755 79.6 135.4 66.4 31.2 17.9 12.9 29.7 258 257 A L < - 0 0 1 -5,-2.2 2,-0.3 -6,-0.1 -1,-0.3 -0.673 57.4-125.3-101.7 158.2 17.5 9.5 28.1 259 258 A V E - j 0 208B 0 -52,-2.4 -50,-3.3 -2,-0.3 2,-0.4 -0.751 30.4-158.1 -89.3 149.7 15.6 6.5 29.3 260 259 A V E -bj 16 209B 0 -245,-2.8 -243,-2.4 -2,-0.3 -50,-0.2 -0.996 15.6-168.0-140.8 143.1 17.8 3.4 29.4 261 260 A I - 0 0 10 -52,-1.5 -50,-0.3 -2,-0.4 -243,-0.1 -0.485 10.3-175.6-133.6 62.2 16.9 -0.3 29.3 262 261 A P - 0 0 1 0, 0.0 -243,-2.0 0, 0.0 2,-0.4 -0.321 19.7-136.6 -60.5 140.9 19.8 -2.6 30.3 263 262 A K B +d 19 0B 51 -245,-0.2 2,-0.3 -242,-0.0 -243,-0.1 -0.817 33.3 151.9 -99.1 137.6 19.0 -6.3 30.0 264 263 A S - 0 0 6 -245,-0.7 -241,-0.1 -2,-0.4 0, 0.0 -0.963 31.7-173.3-154.5 150.2 19.9 -9.0 32.5 265 264 A V + 0 0 23 -2,-0.3 3,-0.1 -233,-0.0 -1,-0.1 0.256 66.9 100.8-112.0 8.8 18.7 -12.3 33.7 266 265 A T >> - 0 0 46 1,-0.2 4,-2.7 -235,-0.0 3,-0.7 -0.821 67.7-147.2 -95.5 116.0 21.2 -12.5 36.5 267 266 A P H 3> S+ 0 0 56 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.853 96.8 51.1 -53.8 -41.6 19.5 -11.5 39.8 268 267 A E H 3> S+ 0 0 139 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.870 113.6 45.1 -63.4 -38.0 22.6 -9.8 41.2 269 268 A R H <> S+ 0 0 145 -3,-0.7 4,-3.2 2,-0.2 -1,-0.2 0.867 105.7 59.6 -74.1 -37.6 23.1 -7.8 38.1 270 269 A I H X S+ 0 0 0 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.948 112.6 41.4 -53.7 -47.2 19.4 -6.8 37.9 271 270 A A H >X S+ 0 0 21 -4,-2.1 3,-1.3 -5,-0.2 4,-0.8 0.935 113.0 52.8 -64.2 -46.2 19.9 -5.3 41.3 272 271 A E H >< S+ 0 0 60 -4,-2.3 3,-1.1 1,-0.3 -2,-0.2 0.905 106.1 54.0 -55.0 -44.0 23.3 -3.8 40.5 273 272 A N H 3< S+ 0 0 4 -4,-3.2 -1,-0.3 1,-0.3 -2,-0.2 0.670 105.1 55.1 -69.2 -16.6 21.9 -2.1 37.4 274 273 A F H << S+ 0 0 44 -3,-1.3 2,-1.9 -4,-0.6 3,-0.3 0.627 85.5 83.3 -85.9 -16.2 19.2 -0.4 39.5 275 274 A K << + 0 0 127 -3,-1.1 -1,-0.2 -4,-0.8 3,-0.1 -0.412 59.2 105.4 -89.9 64.4 21.6 1.2 42.0 276 275 A V + 0 0 0 -2,-1.9 3,-0.3 1,-0.1 -1,-0.2 0.219 52.7 81.1-129.5 11.8 22.3 4.2 39.8 277 276 A F S S+ 0 0 53 -3,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.278 82.2 63.3-103.2 7.5 20.3 6.9 41.5 278 277 A D S S+ 0 0 120 -3,-0.1 2,-0.3 1,-0.0 -1,-0.2 0.129 96.5 53.1-124.2 29.9 22.9 7.8 44.2 279 278 A F - 0 0 27 -3,-0.3 2,-0.4 2,-0.0 -38,-0.0 -0.986 62.3-144.7-159.0 155.1 25.9 9.1 42.2 280 279 A E - 0 0 140 -2,-0.3 2,-0.3 -3,-0.0 -3,-0.0 -0.977 10.7-139.4-128.4 129.7 26.6 11.7 39.6 281 280 A L - 0 0 2 -2,-0.4 2,-0.0 -30,-0.1 -2,-0.0 -0.634 33.3-120.3 -75.5 139.1 29.0 11.6 36.7 282 281 A S > - 0 0 47 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.315 23.3-106.7 -72.9 168.4 30.7 15.0 36.3 283 282 A S H > S+ 0 0 95 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.890 125.1 53.2 -60.8 -37.4 30.4 17.0 33.1 284 283 A Q H > S+ 0 0 147 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.905 108.1 49.6 -64.0 -42.3 34.0 16.0 32.3 285 284 A D H > S+ 0 0 4 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.916 111.9 49.1 -58.2 -45.7 33.1 12.4 32.8 286 285 A M H X S+ 0 0 19 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.936 113.3 44.8 -61.5 -47.9 30.2 12.8 30.5 287 286 A T H X S+ 0 0 86 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.883 112.4 53.1 -65.6 -37.3 32.2 14.5 27.8 288 287 A T H < S+ 0 0 46 -4,-2.6 4,-0.4 -5,-0.2 3,-0.3 0.946 110.1 47.1 -62.7 -45.9 35.0 11.9 28.2 289 288 A L H >< S+ 0 0 0 -4,-2.8 3,-1.6 1,-0.2 -2,-0.2 0.922 110.1 53.3 -61.7 -41.2 32.5 9.1 27.7 290 289 A L H >< S+ 0 0 40 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.829 97.8 66.9 -60.3 -30.9 31.1 10.9 24.7 291 290 A S T 3< S+ 0 0 83 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.648 85.5 71.8 -67.6 -13.7 34.6 11.1 23.2 292 291 A Y T < + 0 0 27 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.479 67.7 132.6 -82.1 1.7 34.6 7.3 22.9 293 292 A N < + 0 0 51 -3,-1.7 -103,-0.2 1,-0.2 -102,-0.2 -0.216 19.1 161.1 -55.8 137.3 32.2 7.4 20.0 294 293 A R - 0 0 142 -104,-2.4 -103,-0.2 2,-0.1 -1,-0.2 0.142 59.3-108.6-137.1 13.3 33.3 5.3 17.0 295 294 A N + 0 0 123 -105,-0.5 2,-0.5 1,-0.2 -104,-0.2 0.905 62.9 161.2 54.3 50.5 29.9 4.9 15.2 296 295 A W - 0 0 36 -106,-2.1 2,-0.5 2,-0.0 -1,-0.2 -0.850 21.7-160.0-109.7 121.0 29.7 1.2 16.2 297 296 A R - 0 0 73 -2,-0.5 3,-0.1 1,-0.2 -106,-0.0 -0.895 24.0-172.0-107.5 130.1 26.3 -0.6 16.1 298 297 A V S S+ 0 0 2 -2,-0.5 2,-0.9 1,-0.2 -1,-0.2 0.923 83.9 58.7 -62.3 -53.8 25.2 -3.7 17.8 299 298 A C + 0 0 15 2,-0.0 2,-0.3 -88,-0.0 -1,-0.2 -0.759 68.1 111.9-103.2 106.7 21.9 -3.7 15.8 300 299 A A - 0 0 43 -2,-0.9 2,-0.3 -3,-0.1 0, 0.0 -0.929 42.0-154.2-154.4 164.5 22.2 -3.8 12.1 301 300 A L > - 0 0 70 -2,-0.3 3,-1.8 1,-0.1 4,-0.4 -0.831 11.1-156.4-156.2 113.2 21.2 -6.5 9.7 302 301 A L G > S+ 0 0 148 -2,-0.3 3,-1.6 1,-0.3 4,-0.3 0.840 92.5 62.5 -57.6 -40.8 22.6 -7.1 6.2 303 302 A S G 3 S+ 0 0 32 1,-0.3 -172,-2.6 2,-0.1 -1,-0.3 0.705 108.1 44.3 -61.5 -19.2 19.5 -8.9 4.9 304 303 A C G X S+ 0 0 7 -3,-1.8 3,-1.7 -174,-0.2 -1,-0.3 0.436 82.0 100.3-103.1 -1.1 17.4 -5.8 5.4 305 304 A T T < S+ 0 0 65 -3,-1.6 -1,-0.1 -4,-0.4 -2,-0.1 0.641 80.5 51.9 -68.2 -18.2 19.8 -3.1 4.0 306 305 A S T 3 S+ 0 0 102 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.508 78.3 116.2 -91.1 -7.3 18.1 -2.8 0.6 307 306 A H S X S- 0 0 12 -3,-1.7 3,-2.0 1,-0.2 -193,-0.0 -0.406 77.1-123.2 -59.4 139.5 14.6 -2.2 2.1 308 307 A K T 3 S+ 0 0 189 1,-0.3 -1,-0.2 -2,-0.0 -3,-0.0 0.782 109.9 43.2 -54.8 -32.7 13.6 1.2 1.0 309 308 A D T 3 S+ 0 0 39 -194,-0.1 -1,-0.3 -143,-0.0 -195,-0.1 0.209 74.3 138.9-103.5 14.3 13.1 2.2 4.7 310 309 A Y < - 0 0 33 -3,-2.0 -5,-0.0 -6,-0.2 -148,-0.0 -0.401 46.5-147.0 -58.5 132.2 16.2 0.6 6.2 311 310 A P + 0 0 6 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.660 61.4 69.3 -85.0 -18.4 17.3 3.3 8.6 312 311 A F 0 0 28 -149,-0.1 -2,-0.0 -150,-0.0 -149,-0.0 -0.710 360.0 360.0-112.8 156.2 21.1 3.1 8.7 313 312 A H 0 0 171 -2,-0.3 -8,-0.0 0, 0.0 0, 0.0 -0.834 360.0 360.0-138.7 360.0 24.0 3.8 6.4