==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-JUL-09 3IAN . COMPND 2 MOLECULE: CHITINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOCOCCUS LACTIS SUBSP. LACTIS; . AUTHOR J.B.BONANNO,M.RUTTER,K.T.BAIN,S.MILLER,S.OZYURT,J.M.SAUDER, . 319 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13202.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 22 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 25.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 1 0 0 0 0 1 0 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 41 A L 0 0 67 0, 0.0 2,-0.4 0, 0.0 313,-0.2 0.000 360.0 360.0 360.0 104.4 42.8 7.8 53.7 2 42 A D - 0 0 65 313,-0.1 313,-0.3 235,-0.1 2,-0.2 -0.589 360.0-129.8 -76.5 126.9 39.7 7.1 55.7 3 43 A K B -a 315 0A 12 311,-2.8 313,-1.8 -2,-0.4 2,-0.4 -0.484 20.2-159.9 -86.7 144.3 37.7 4.2 54.2 4 44 A V E -b 277 0B 0 272,-2.3 274,-1.8 -2,-0.2 2,-0.4 -0.926 16.8-167.4-122.8 143.8 34.0 4.2 53.4 5 45 A L E -b 278 0B 0 -2,-0.4 33,-2.0 272,-0.2 34,-1.5 -0.957 27.0-162.0-123.0 107.3 31.4 1.5 52.8 6 46 A V E +bc 279 39B 0 272,-2.9 274,-2.1 -2,-0.4 2,-0.4 -0.757 12.8 178.6 -99.2 134.8 28.5 3.3 51.3 7 47 A G E -bc 280 40B 0 32,-2.5 34,-2.6 -2,-0.4 2,-0.3 -1.000 22.4-132.9-137.6 136.6 24.9 1.9 51.2 8 48 A Y E - c 0 41B 1 272,-1.7 275,-2.5 -2,-0.4 276,-0.8 -0.697 16.9-152.7 -84.1 139.2 21.6 3.4 49.8 9 49 A W E - c 0 42B 1 32,-2.8 34,-2.5 -2,-0.3 2,-0.6 -0.944 17.8-124.1-114.4 130.0 18.5 3.2 52.0 10 50 A H E - c 0 43B 3 -2,-0.4 2,-1.3 32,-0.2 18,-0.2 -0.663 9.8-156.8 -78.9 116.2 15.1 3.1 50.3 11 51 A N S S+ 0 0 23 32,-2.8 2,-0.3 -2,-0.6 46,-0.1 -0.342 71.3 68.2 -82.4 52.6 12.6 5.8 51.5 12 52 A W S S- 0 0 85 -2,-1.3 2,-0.5 46,-0.0 -2,-0.1 -0.975 89.3 -94.7-162.1 162.3 9.6 3.7 50.4 13 53 A K - 0 0 137 -2,-0.3 14,-0.1 14,-0.1 -2,-0.1 -0.735 49.0-107.6 -84.1 127.9 7.7 0.6 51.2 14 54 A S - 0 0 11 -2,-0.5 -1,-0.1 1,-0.2 13,-0.1 -0.293 18.5-150.6 -54.9 134.0 8.8 -2.4 49.2 15 55 A T - 0 0 121 1,-0.1 -1,-0.2 -3,-0.0 -2,-0.0 0.509 44.8-113.7 -83.4 -5.1 6.2 -3.3 46.7 16 56 A G S S+ 0 0 32 9,-0.2 8,-0.1 10,-0.0 -1,-0.1 0.386 94.4 35.7 78.8 142.9 7.3 -7.0 46.9 17 57 A K S S+ 0 0 137 5,-0.1 7,-0.3 1,-0.1 6,-0.2 0.868 74.3 139.7 43.5 45.2 8.9 -9.0 44.0 18 58 A D + 0 0 49 5,-0.2 6,-0.2 4,-0.1 -1,-0.1 0.423 34.4 108.4 -92.5 0.0 10.7 -5.8 43.0 19 59 A G S > S- 0 0 12 4,-2.7 3,-1.7 270,-0.1 230,-0.2 -0.367 81.5-117.3 -80.0 156.9 14.0 -7.5 42.3 20 60 A Y T 3 S+ 0 0 141 228,-2.6 228,-0.2 1,-0.3 -1,-0.1 0.778 119.9 38.8 -61.9 -26.5 15.5 -8.1 38.8 21 61 A K T 3 S- 0 0 135 229,-0.0 270,-0.4 0, 0.0 -1,-0.3 -0.026 130.8 -88.6-113.9 29.7 15.1 -11.8 39.5 22 62 A G S < S+ 0 0 20 -3,-1.7 -5,-0.1 1,-0.2 -2,-0.1 0.426 85.0 134.4 82.4 1.6 11.7 -11.8 41.3 23 63 A G - 0 0 0 -6,-0.2 -4,-2.7 -5,-0.1 2,-0.4 -0.105 51.1-120.4 -73.2 179.4 13.2 -11.3 44.8 24 64 A S B -L 289 0C 31 265,-2.2 265,-2.5 -7,-0.3 2,-0.1 -0.986 13.3-132.0-132.0 125.7 11.9 -8.8 47.4 25 65 A S - 0 0 7 -2,-0.4 260,-0.2 263,-0.2 2,-0.2 -0.371 32.1-111.5 -67.1 152.4 13.8 -5.9 49.0 26 66 A A - 0 0 21 258,-2.2 2,-0.4 257,-0.1 262,-0.1 -0.561 18.0-140.2 -83.5 151.9 13.5 -5.6 52.8 27 67 A D + 0 0 73 -2,-0.2 2,-0.3 260,-0.1 -14,-0.1 -0.949 39.0 139.3-106.1 132.4 11.7 -2.8 54.7 28 68 A F - 0 0 37 -2,-0.4 5,-0.1 -18,-0.2 -18,-0.1 -0.965 54.4 -83.9-162.8 159.1 13.3 -1.4 57.8 29 69 A N > - 0 0 60 -2,-0.3 3,-2.3 1,-0.1 4,-0.2 -0.310 40.7-114.7 -64.5 152.5 13.9 1.9 59.6 30 70 A L G > S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.904 118.5 54.8 -51.5 -44.6 16.9 4.0 58.4 31 71 A S G 3 S+ 0 0 25 1,-0.3 -1,-0.3 35,-0.0 -2,-0.1 0.547 97.8 65.4 -72.2 -5.2 18.4 3.5 61.9 32 72 A S G < S+ 0 0 73 -3,-2.3 -1,-0.3 2,-0.0 -2,-0.2 0.353 72.9 134.7 -96.4 4.6 18.1 -0.3 61.5 33 73 A T < - 0 0 4 -3,-1.8 3,-0.1 -4,-0.2 -24,-0.0 -0.158 69.0 -87.5 -52.4 140.3 20.6 -0.3 58.7 34 74 A Q > - 0 0 19 1,-0.1 3,-1.0 249,-0.1 -1,-0.1 -0.177 43.1-109.3 -50.2 140.1 23.1 -3.1 59.0 35 75 A E T 3 S+ 0 0 129 1,-0.2 3,-0.1 -3,-0.1 -1,-0.1 -0.322 100.3 55.9 -62.5 155.5 26.3 -2.4 60.9 36 76 A G T 3 S+ 0 0 26 1,-0.4 2,-0.3 -3,-0.1 -1,-0.2 -0.283 78.9 101.5 110.3 -50.5 29.3 -2.1 58.7 37 77 A Y < + 0 0 2 -3,-1.0 -1,-0.4 1,-0.1 -31,-0.2 -0.559 43.5 178.3 -65.1 128.6 28.0 0.7 56.5 38 78 A N S S+ 0 0 4 -33,-2.0 41,-2.9 -2,-0.3 2,-0.4 0.454 70.8 47.5-113.2 -3.3 29.5 4.0 57.5 39 79 A V E S-cd 6 79B 0 -34,-1.5 -32,-2.5 39,-0.2 2,-0.5 -0.980 70.3-172.1-133.4 120.9 27.8 6.2 54.9 40 80 A I E -cd 7 80B 2 39,-2.7 41,-1.9 -2,-0.4 2,-0.7 -0.963 9.6-152.6-120.9 122.6 24.1 5.7 54.4 41 81 A N E -cd 8 81B 0 -34,-2.6 -32,-2.8 -2,-0.5 2,-0.3 -0.828 9.7-142.3-107.3 108.0 22.3 7.4 51.5 42 82 A V E -cd 9 82B 0 39,-2.9 41,-3.1 -2,-0.7 2,-0.5 -0.532 32.2-115.1 -70.5 124.4 18.6 8.2 51.9 43 83 A S E +cd 10 83B 0 -34,-2.5 -32,-2.8 -2,-0.3 41,-0.1 -0.940 68.8 10.0-120.1 115.5 16.9 7.6 48.6 44 84 A F E + 0 0 34 39,-0.7 2,-0.5 -2,-0.5 40,-0.2 0.607 30.1 178.6-143.0 158.6 15.6 9.9 47.1 45 85 A M E + d 0 84B 0 38,-3.1 40,-2.8 -3,-0.3 2,-0.3 -0.817 46.9 149.5 -81.5 124.0 15.2 13.6 47.0 46 86 A K B -N 55 0D 97 9,-2.3 9,-2.8 -2,-0.5 44,-0.1 -0.944 54.2 -89.4-155.1 166.6 13.0 14.1 44.0 47 87 A T - 0 0 13 42,-2.6 3,-0.1 -2,-0.3 2,-0.0 -0.784 47.9-134.0 -88.8 115.2 10.3 16.4 42.5 48 88 A P > - 0 0 37 0, 0.0 3,-2.3 0, 0.0 5,-0.1 -0.376 34.0 -80.0 -72.4 154.1 6.9 15.1 43.6 49 89 A E T 3 S+ 0 0 101 1,-0.3 3,-0.1 3,-0.0 41,-0.0 -0.179 119.4 9.8 -44.4 129.2 4.0 14.7 41.1 50 90 A G T 3 S+ 0 0 89 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.664 111.8 97.2 65.2 17.3 2.4 18.2 40.6 51 91 A Q < - 0 0 116 -3,-2.3 -1,-0.2 1,-0.0 -4,-0.1 -0.777 60.6-150.0-120.6 176.1 5.2 20.1 42.4 52 92 A T + 0 0 108 -2,-0.3 40,-0.2 -3,-0.1 -5,-0.1 0.435 69.0 66.7-131.8 -4.1 8.2 21.8 40.8 53 93 A L S S- 0 0 38 -7,-0.1 -7,-0.1 -5,-0.1 -1,-0.1 -0.973 83.5-110.8-118.4 136.2 11.2 21.7 43.3 54 94 A P + 0 0 1 0, 0.0 -7,-0.3 0, 0.0 2,-0.3 -0.419 51.9 158.2 -59.5 141.6 13.1 18.5 44.4 55 95 A T B -N 46 0D 31 -9,-2.8 -9,-2.3 -11,-0.1 2,-0.3 -0.894 30.1-133.9-154.4 179.5 12.4 17.7 48.0 56 96 A F + 0 0 5 -2,-0.3 -11,-0.1 -11,-0.2 -9,-0.0 -0.989 17.6 169.6-148.2 136.2 12.4 15.0 50.6 57 97 A K - 0 0 136 -2,-0.3 5,-0.1 -46,-0.1 2,-0.0 -0.981 42.7-107.4-141.7 135.3 10.1 13.7 53.3 58 98 A P - 0 0 9 0, 0.0 3,-0.2 0, 0.0 5,-0.1 -0.363 24.2-148.1 -62.0 135.7 10.5 10.5 55.2 59 99 A Y S S+ 0 0 90 1,-0.2 -46,-0.1 -2,-0.0 -48,-0.0 0.776 90.3 26.8 -77.7 -24.1 7.8 8.0 54.1 60 100 A N S S+ 0 0 44 2,-0.1 2,-0.3 -48,-0.1 -1,-0.2 0.164 115.5 54.7-122.7 3.1 7.3 6.2 57.4 61 101 A K S S- 0 0 47 -3,-0.2 2,-0.1 -32,-0.0 0, 0.0 -0.977 75.4-109.9-144.7 152.4 8.3 8.7 60.1 62 102 A T > - 0 0 77 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.411 43.7-106.5 -71.4 161.8 7.6 12.2 61.4 63 103 A D H > S+ 0 0 44 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.883 122.6 52.8 -57.3 -42.7 10.3 14.7 60.9 64 104 A T H > S+ 0 0 114 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.898 111.1 46.1 -59.9 -43.0 11.1 14.5 64.7 65 105 A E H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.921 113.9 47.6 -65.4 -45.5 11.4 10.8 64.5 66 106 A F H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.917 109.9 51.9 -67.5 -41.0 13.6 10.8 61.4 67 107 A R H X S+ 0 0 122 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.902 109.0 52.5 -56.9 -40.7 15.9 13.5 62.8 68 108 A A H X S+ 0 0 55 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.896 106.5 52.7 -66.1 -39.2 16.3 11.3 65.9 69 109 A E H X S+ 0 0 13 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.929 111.5 45.7 -60.2 -46.8 17.2 8.3 63.7 70 110 A I H X S+ 0 0 0 -4,-2.3 4,-3.0 42,-0.2 -2,-0.2 0.899 111.2 52.5 -63.9 -38.3 19.9 10.4 62.0 71 111 A S H X S+ 0 0 66 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.900 110.7 48.3 -63.8 -38.7 21.2 11.8 65.3 72 112 A K H X S+ 0 0 105 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.938 112.5 47.5 -63.9 -49.9 21.5 8.3 66.6 73 113 A L H <>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 4,-0.3 0.912 111.2 51.9 -58.3 -42.7 23.4 7.1 63.5 74 114 A N H ><5S+ 0 0 21 -4,-3.0 3,-1.6 1,-0.2 -1,-0.2 0.905 108.5 50.0 -60.3 -46.1 25.7 10.1 63.7 75 115 A A H 3<5S+ 0 0 80 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.824 106.4 57.5 -61.0 -34.9 26.5 9.3 67.4 76 116 A E T 3<5S- 0 0 81 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.493 127.7-102.1 -74.3 -3.7 27.2 5.8 66.3 77 117 A G T < 5S+ 0 0 15 -3,-1.6 241,-1.1 1,-0.3 2,-0.4 0.638 79.2 131.3 94.8 15.5 29.8 7.1 63.9 78 118 A K < - 0 0 12 -5,-2.6 2,-0.3 239,-0.2 -1,-0.3 -0.847 48.3-140.5-105.9 139.3 27.8 6.9 60.6 79 119 A S E -d 39 0B 2 -41,-2.9 -39,-2.7 -2,-0.4 2,-0.5 -0.754 13.2-157.6 -91.4 143.5 27.3 9.6 58.0 80 120 A V E -d 40 0B 0 -2,-0.3 35,-3.4 33,-0.3 36,-0.6 -0.977 11.3-175.5-125.3 118.1 23.8 10.0 56.4 81 121 A L E -de 41 116B 0 -41,-1.9 -39,-2.9 -2,-0.5 2,-0.5 -0.702 24.9-126.1-104.6 159.5 23.5 11.7 53.0 82 122 A I E -de 42 117B 1 34,-2.1 36,-2.6 -2,-0.3 2,-0.6 -0.929 25.1-140.0-100.3 129.8 20.4 12.6 51.0 83 123 A A E -de 43 118B 0 -41,-3.1 -38,-3.1 -2,-0.5 -39,-0.7 -0.843 10.4-149.3 -95.7 120.6 20.5 11.1 47.5 84 124 A L E +de 45 119B 0 34,-3.1 36,-2.9 -2,-0.6 2,-0.5 -0.785 62.6 3.8 -90.3 121.6 19.2 13.5 44.8 85 125 A G E + e 0 120B 1 -40,-2.8 36,-0.2 -2,-0.5 -41,-0.1 -0.927 54.6 164.1 118.1-121.2 17.6 11.8 41.8 86 126 A G E > - e 0 121B 7 34,-3.0 3,-0.8 -2,-0.5 36,-0.6 -0.197 62.1 -32.1 77.4 176.1 17.0 8.1 41.2 87 127 A A T 3 S+ 0 0 73 1,-0.2 -2,-0.1 2,-0.1 34,-0.0 -0.347 129.3 7.5 -70.2 142.9 14.5 6.8 38.5 88 128 A D T 3 S+ 0 0 115 1,-0.1 -1,-0.2 -2,-0.1 -3,-0.0 0.848 82.5 143.3 55.5 41.4 11.5 8.9 37.6 89 129 A A < - 0 0 0 -3,-0.8 -42,-2.6 -43,-0.1 3,-0.2 0.602 48.7-146.0 -86.0 -16.7 12.7 11.8 39.8 90 130 A H + 0 0 111 1,-0.2 2,-0.8 -44,-0.1 -3,-0.1 0.820 30.3 172.9 51.3 37.7 11.5 14.5 37.4 91 131 A I + 0 0 3 1,-0.1 2,-0.2 2,-0.0 -1,-0.2 -0.667 10.2 154.5 -80.6 110.0 14.5 16.7 38.3 92 132 A E - 0 0 113 -2,-0.8 2,-0.5 -40,-0.2 37,-0.1 -0.647 20.4-171.9-138.7 73.7 14.3 19.7 36.0 93 133 A L - 0 0 0 35,-0.2 37,-2.6 -2,-0.2 2,-0.3 -0.594 6.3-156.9 -80.2 123.1 16.0 22.6 37.7 94 134 A K > - 0 0 97 -2,-0.5 3,-2.2 35,-0.2 4,-0.2 -0.683 28.8-117.1 -91.3 149.9 15.8 25.9 36.0 95 135 A K G > S+ 0 0 129 -2,-0.3 3,-1.5 1,-0.3 4,-0.3 0.843 116.9 61.5 -51.3 -35.7 18.3 28.7 36.6 96 136 A S G 3 S+ 0 0 108 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.691 100.4 56.0 -65.2 -19.7 15.5 30.7 38.1 97 137 A Q G <> S+ 0 0 36 -3,-2.2 4,-2.4 1,-0.2 -1,-0.3 0.373 76.3 101.8 -93.4 3.7 15.0 28.0 40.8 98 138 A E H <> S+ 0 0 22 -3,-1.5 4,-3.1 1,-0.2 5,-0.2 0.896 80.7 45.7 -61.8 -48.3 18.6 28.0 42.1 99 139 A S H > S+ 0 0 79 -4,-0.3 4,-2.5 -3,-0.2 -1,-0.2 0.908 114.5 48.6 -61.7 -43.8 18.1 30.0 45.3 100 140 A D H > S+ 0 0 100 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.871 111.7 50.7 -63.2 -38.9 15.0 28.0 46.2 101 141 A F H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.951 110.8 48.4 -64.7 -47.8 17.0 24.8 45.5 102 142 A V H X S+ 0 0 13 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.907 113.3 47.7 -55.5 -46.4 19.9 26.0 47.8 103 143 A N H X S+ 0 0 99 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.848 110.4 51.7 -65.9 -37.1 17.4 26.9 50.6 104 144 A E H X S+ 0 0 26 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.910 109.0 49.7 -68.1 -41.9 15.6 23.6 50.3 105 145 A I H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.934 113.0 47.7 -60.3 -45.8 18.9 21.6 50.6 106 146 A I H X S+ 0 0 26 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.917 111.4 51.2 -58.2 -43.9 19.8 23.7 53.7 107 147 A R H X S+ 0 0 101 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.933 111.0 47.4 -61.0 -48.0 16.3 23.1 55.1 108 148 A L H X S+ 0 0 1 -4,-2.7 4,-2.2 1,-0.2 6,-0.6 0.903 113.0 48.6 -59.4 -45.2 16.6 19.4 54.6 109 149 A V H X S+ 0 0 14 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.928 117.1 40.9 -61.0 -45.8 20.0 19.3 56.2 110 150 A D H < S+ 0 0 80 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.801 117.1 48.9 -76.0 -30.2 19.0 21.4 59.2 111 151 A T H < S+ 0 0 34 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.900 128.9 17.8 -72.6 -44.7 15.6 19.6 59.6 112 152 A Y H < S- 0 0 1 -4,-2.2 -42,-0.2 -5,-0.2 -2,-0.2 0.684 100.7-114.4-106.6 -22.8 16.8 16.1 59.5 113 153 A G < + 0 0 24 -4,-2.1 -33,-0.3 -5,-0.5 -4,-0.2 0.621 45.5 175.3 92.0 18.9 20.5 16.2 60.1 114 154 A F - 0 0 5 -6,-0.6 -33,-0.2 -5,-0.2 -1,-0.2 -0.270 24.7-150.3 -53.0 140.5 21.8 15.1 56.7 115 155 A D - 0 0 26 -35,-3.4 39,-2.8 1,-0.2 2,-0.3 0.424 66.2 -35.4 -94.0 -1.5 25.6 15.2 56.5 116 156 A G E -ef 81 154B 0 -36,-0.6 -34,-2.1 37,-0.3 2,-0.4 -0.977 63.5 -91.5 166.6-172.7 25.7 15.9 52.8 117 157 A L E -ef 82 155B 0 37,-2.6 39,-2.3 -2,-0.3 2,-0.5 -0.987 18.6-149.4-136.5 138.5 24.1 15.1 49.4 118 158 A D E -ef 83 156B 0 -36,-2.6 -34,-3.1 -2,-0.4 2,-0.8 -0.944 17.0-137.7-107.4 130.7 24.8 12.4 46.8 119 159 A I E +ef 84 157B 0 37,-2.5 39,-3.1 -2,-0.5 -34,-0.1 -0.788 33.4 163.0 -92.4 109.9 24.1 13.3 43.1 120 160 A D E +e 85 0B 17 -36,-2.9 -34,-3.0 -2,-0.8 2,-0.2 -0.509 12.9 174.4-127.6 59.3 22.4 10.3 41.7 121 161 A L E -e 86 0B 6 -36,-0.2 -36,-0.1 -2,-0.1 -34,-0.1 -0.510 27.4-127.8 -77.0 130.8 20.8 11.7 38.5 122 162 A E >> - 0 0 43 -36,-0.6 4,-1.2 -2,-0.2 3,-0.9 -0.286 36.9 -95.5 -63.1 159.7 19.1 9.3 36.0 123 163 A Q H >> S+ 0 0 39 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.889 125.1 51.2 -48.3 -49.9 20.1 9.4 32.4 124 164 A A H 34 S+ 0 0 79 1,-0.2 3,-0.3 2,-0.1 4,-0.3 0.815 108.7 53.6 -57.8 -32.2 17.3 11.8 31.4 125 165 A A H X4 S+ 0 0 4 -3,-0.9 3,-0.8 1,-0.2 -1,-0.2 0.749 85.7 82.8 -77.6 -23.4 18.2 14.2 34.2 126 166 A I H << S+ 0 0 1 -4,-1.2 -1,-0.2 -3,-0.8 6,-0.1 0.886 112.8 14.0 -56.4 -44.7 21.9 14.6 33.3 127 167 A E T 3< S+ 0 0 114 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.272 97.5 131.4-112.4 10.8 21.3 17.3 30.7 128 168 A A S X S- 0 0 25 -3,-0.8 3,-2.4 -4,-0.3 4,-0.3 -0.321 77.1 -36.5 -68.1 144.1 17.6 18.2 31.6 129 169 A A T 3 S- 0 0 37 1,-0.3 3,-0.2 -37,-0.1 -35,-0.2 -0.080 118.9 -35.4 47.3-130.2 16.7 21.8 32.0 130 170 A D T >> S+ 0 0 41 -37,-2.6 4,-2.7 1,-0.1 3,-1.4 0.018 97.3 127.4-109.5 25.7 19.6 23.7 33.6 131 171 A N H <> + 0 0 0 -3,-2.4 4,-2.0 1,-0.2 -1,-0.1 0.883 65.2 60.3 -45.9 -46.9 20.7 20.8 35.8 132 172 A Q H 34 S+ 0 0 50 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.718 119.0 25.3 -61.9 -25.3 24.3 20.9 34.7 133 173 A T H <> S+ 0 0 81 -3,-1.4 4,-1.7 3,-0.1 -1,-0.2 0.770 121.9 50.8-104.9 -40.5 24.9 24.4 35.9 134 174 A V H X S+ 0 0 0 -4,-2.7 4,-3.4 -41,-0.2 5,-0.3 0.932 106.9 53.0 -67.3 -46.1 22.4 24.9 38.7 135 175 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.3 5,-0.2 0.943 114.2 40.2 -61.3 -50.6 23.2 21.7 40.7 136 176 A P H > S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.925 117.8 48.8 -62.9 -41.9 26.9 22.4 40.9 137 177 A S H X S+ 0 0 42 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.948 113.8 45.9 -62.4 -47.4 26.4 26.1 41.6 138 178 A A H X S+ 0 0 0 -4,-3.4 4,-2.4 1,-0.2 -1,-0.2 0.917 111.9 51.7 -59.8 -46.8 23.8 25.4 44.3 139 179 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.852 106.5 53.3 -64.7 -34.5 25.9 22.7 45.9 140 180 A K H X S+ 0 0 82 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.918 109.8 49.0 -62.4 -42.9 28.9 25.1 46.1 141 181 A K H X S+ 0 0 105 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.908 112.5 48.0 -62.6 -42.4 26.7 27.7 47.9 142 182 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 5,-0.2 0.938 111.9 49.1 -64.0 -46.9 25.5 25.0 50.3 143 183 A K H X S+ 0 0 4 -4,-2.6 4,-2.2 1,-0.2 10,-0.3 0.927 112.0 48.1 -59.3 -44.1 28.9 23.7 51.0 144 184 A D H X S+ 0 0 49 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.884 106.3 58.5 -67.2 -35.6 30.3 27.3 51.7 145 185 A H H < S+ 0 0 81 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.929 112.3 39.4 -54.8 -48.9 27.3 28.0 54.0 146 186 A Y H ><>S+ 0 0 12 -4,-2.0 5,-2.5 1,-0.2 3,-1.1 0.827 109.0 61.9 -76.1 -28.7 28.3 25.1 56.2 147 187 A R H ><5S+ 0 0 108 -4,-2.2 3,-1.9 1,-0.3 -1,-0.2 0.876 98.1 56.5 -61.3 -38.9 32.0 25.9 55.9 148 188 A K T 3<5S+ 0 0 183 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.705 107.3 51.8 -61.9 -19.0 31.4 29.3 57.5 149 189 A D T < 5S- 0 0 117 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.271 120.5-110.9 -95.1 -2.6 29.9 27.2 60.4 150 190 A G T < 5S+ 0 0 77 -3,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.667 80.7 122.8 69.1 17.5 33.1 24.9 60.6 151 191 A K < - 0 0 45 -5,-2.5 2,-0.7 -8,-0.1 -1,-0.3 -0.841 60.6-132.5-110.8 149.6 31.0 21.9 59.3 152 192 A N - 0 0 89 -2,-0.3 2,-0.8 -3,-0.1 -9,-0.1 -0.899 12.4-160.9-101.7 103.3 31.7 19.7 56.1 153 193 A F - 0 0 6 -2,-0.7 -37,-0.3 -10,-0.3 2,-0.2 -0.796 27.2-135.0 -77.2 109.7 28.6 19.3 54.0 154 194 A M E -f 116 0B 15 -39,-2.8 -37,-2.6 -2,-0.8 2,-0.5 -0.481 19.0-162.9 -72.4 139.2 29.7 16.2 52.1 155 195 A I E +f 117 0B 0 25,-0.3 27,-3.2 -39,-0.2 28,-1.2 -0.994 17.6 162.4-121.0 126.6 29.1 16.1 48.3 156 196 A T E -fg 118 183B 0 -39,-2.3 -37,-2.5 -2,-0.5 2,-0.3 -0.822 19.4-150.2-130.1 173.5 29.3 12.7 46.5 157 197 A M E -fg 119 184B 0 26,-0.7 28,-3.0 -39,-0.3 -37,-0.2 -0.995 11.9-156.4-147.1 149.4 28.0 11.5 43.1 158 198 A A + 0 0 1 -39,-3.1 2,-0.1 -2,-0.3 29,-0.1 -0.532 26.9 175.8-123.9 60.2 26.9 8.2 41.7 159 199 A P - 0 0 3 0, 0.0 28,-2.4 0, 0.0 2,-0.3 -0.377 38.2-114.0 -64.1 140.3 27.5 8.5 37.9 160 200 A E B > -h 187 0B 37 26,-0.2 3,-1.9 1,-0.1 4,-0.2 -0.646 36.8-119.1 -69.3 135.2 26.8 5.5 35.7 161 201 A F G > S+ 0 0 1 26,-1.7 3,-2.0 -2,-0.3 -1,-0.1 0.757 104.6 64.3 -60.1 -33.3 30.3 4.7 34.5 162 202 A P G 3 S+ 0 0 33 0, 0.0 3,-0.3 0, 0.0 -1,-0.3 0.741 96.3 60.6 -63.3 -20.8 29.8 5.1 30.7 163 203 A Y G < S+ 0 0 41 -3,-1.9 7,-1.1 1,-0.2 8,-0.3 0.437 79.3 92.8 -80.6 -0.9 29.1 8.8 31.2 164 204 A L < + 0 0 1 -3,-2.0 68,-2.6 -4,-0.2 -1,-0.2 -0.076 51.9 130.5 -92.1 35.2 32.6 9.4 32.8 165 205 A T B > S-O 231 0E 59 -3,-0.3 3,-1.8 66,-0.3 66,-0.3 -0.507 73.4-104.6 -81.4 156.4 34.4 10.4 29.6 166 206 A S T 3 S+ 0 0 59 64,-2.9 65,-0.1 1,-0.3 -1,-0.1 0.807 120.1 22.5 -48.6 -41.2 36.5 13.6 29.6 167 207 A S T 3 S+ 0 0 117 63,-0.3 -1,-0.3 4,-0.0 -3,-0.1 -0.090 100.9 125.0-121.6 33.7 34.0 15.6 27.6 168 208 A G S X S- 0 0 18 -3,-1.8 3,-1.0 -5,-0.1 -5,-0.1 -0.109 79.6 -84.6 -83.6-173.3 30.9 13.5 28.4 169 209 A K T 3 S+ 0 0 69 1,-0.3 4,-0.3 2,-0.1 -5,-0.1 0.739 125.8 49.9 -65.6 -28.7 27.6 14.5 29.9 170 210 A Y T >> S+ 0 0 2 -7,-1.1 4,-1.7 1,-0.2 3,-0.7 0.600 82.5 92.3 -86.6 -16.3 28.9 14.3 33.5 171 211 A A H <> S+ 0 0 6 -3,-1.0 4,-3.2 -8,-0.3 5,-0.4 0.867 81.4 55.8 -53.7 -44.0 32.0 16.3 33.0 172 212 A P H 3> S+ 0 0 34 0, 0.0 4,-2.6 0, 0.0 -1,-0.3 0.908 106.3 51.6 -58.2 -39.7 30.4 19.6 34.1 173 213 A Y H <> S+ 0 0 0 -3,-0.7 4,-0.8 -4,-0.3 -2,-0.2 0.935 118.2 37.4 -60.0 -45.8 29.3 18.1 37.4 174 214 A I H >< S+ 0 0 4 -4,-1.7 3,-0.6 2,-0.2 4,-0.2 0.957 119.5 45.6 -73.6 -50.7 32.8 16.8 38.2 175 215 A N H >< S+ 0 0 92 -4,-3.2 3,-1.2 1,-0.2 -2,-0.2 0.923 115.0 47.4 -58.2 -44.6 34.8 19.7 36.8 176 216 A N H 3< S+ 0 0 90 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.2 0.644 113.3 48.3 -80.1 -10.2 32.6 22.4 38.4 177 217 A L T XX S+ 0 0 0 -4,-0.8 3,-2.6 -3,-0.6 4,-2.4 0.179 77.0 140.5-109.5 13.0 32.6 20.7 41.8 178 218 A D T <4 S+ 0 0 101 -3,-1.2 -3,-0.1 1,-0.3 -4,-0.0 -0.407 77.4 14.9 -56.6 133.1 36.4 20.2 41.9 179 219 A S T 34 S+ 0 0 71 2,-0.2 -1,-0.3 -2,-0.1 -3,-0.0 0.237 123.1 68.9 76.7 -6.6 37.6 20.8 45.5 180 220 A Y T <4 S+ 0 0 33 -3,-2.6 -25,-0.3 -26,-0.0 -2,-0.2 0.758 78.7 79.7-106.1 -38.9 34.0 20.6 46.7 181 221 A Y < - 0 0 5 -4,-2.4 -2,-0.2 -7,-0.2 -25,-0.2 -0.465 59.3-158.3 -74.6 143.7 33.1 16.9 46.2 182 222 A D - 0 0 39 -27,-3.2 2,-0.3 1,-0.4 -26,-0.2 0.830 69.3 -22.3 -87.4 -41.8 34.3 14.5 48.9 183 223 A F E -g 156 0B 2 -28,-1.2 -26,-0.7 2,-0.0 2,-0.4 -0.970 52.1-132.4-163.4 162.5 34.2 11.4 46.7 184 224 A I E -gi 157 239B 0 54,-2.7 56,-2.5 -2,-0.3 -26,-0.2 -0.976 11.9-169.5-119.9 131.4 32.6 9.8 43.6 185 225 A N - 0 0 0 -28,-3.0 56,-0.2 -2,-0.4 54,-0.1 -0.795 16.0-161.0-118.2 84.7 31.1 6.3 43.7 186 226 A P - 0 0 0 0, 0.0 56,-1.7 0, 0.0 2,-0.8 -0.265 24.4-110.0 -66.5 156.1 30.3 5.4 40.1 187 227 A Q B -hj 160 242B 18 -28,-2.4 -26,-1.7 54,-0.1 2,-0.3 -0.795 25.7-171.4 -89.2 112.3 27.9 2.6 39.3 188 228 A Y + 0 0 1 54,-2.5 2,-0.3 -2,-0.8 -1,-0.1 -0.353 64.8 72.2 -92.3 47.1 29.8 -0.4 37.9 189 229 A Y S S+ 0 0 9 -2,-0.3 64,-0.2 54,-0.1 -28,-0.2 -0.958 70.3 40.6-157.5 163.4 26.5 -2.1 37.1 190 230 A N S S+ 0 0 54 62,-2.0 63,-0.1 -2,-0.3 -1,-0.1 0.634 81.7 102.4 65.7 20.8 23.4 -2.0 34.8 191 231 A Q > - 0 0 43 1,-0.3 3,-2.2 3,-0.1 16,-0.2 0.202 63.0-160.2-117.1 13.8 25.4 -1.3 31.7 192 232 A G T 3 S+ 0 0 27 1,-0.3 16,-0.4 15,-0.1 15,-0.3 -0.157 71.4 0.7 55.3-121.2 25.4 -4.9 30.2 193 233 A G T 3 S+ 0 0 53 14,-0.2 -1,-0.3 13,-0.1 16,-0.0 0.392 104.0 112.8 -83.1 1.5 28.2 -5.4 27.6 194 234 A D < + 0 0 60 -3,-2.2 13,-3.1 12,-0.1 14,-0.3 -0.240 32.7 111.2 -71.5 163.5 29.6 -1.9 27.9 195 235 A G E -P 206 0F 7 11,-0.3 2,-0.3 12,-0.1 11,-0.2 -0.852 61.4 -61.1 168.4-132.1 33.1 -1.4 29.4 196 236 A F E -P 205 0F 4 9,-1.9 9,-2.9 -2,-0.3 2,-0.5 -0.984 34.4-110.5-151.5 158.3 36.4 -0.3 28.0 197 237 A W E -P 204 0F 111 -2,-0.3 2,-0.7 7,-0.2 7,-0.2 -0.796 23.8-157.6 -93.6 126.8 39.0 -1.2 25.4 198 238 A D E >> -P 203 0F 20 5,-3.3 5,-1.9 -2,-0.5 4,-0.8 -0.911 6.1-170.7-106.5 108.1 42.4 -2.5 26.8 199 239 A S T 45S+ 0 0 84 -2,-0.7 -1,-0.1 1,-0.2 5,-0.0 0.828 83.7 57.0 -69.5 -31.3 45.1 -2.0 24.2 200 240 A D T 45S+ 0 0 153 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.902 118.7 31.8 -66.1 -41.0 47.7 -4.0 26.2 201 241 A L T 45S- 0 0 89 2,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.466 103.1-132.1 -87.9 -8.9 45.5 -7.1 26.2 202 242 A N T <5 + 0 0 124 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.925 66.8 120.1 53.9 49.3 43.9 -6.3 22.9 203 243 A M E < -P 198 0F 52 -5,-1.9 -5,-3.3 2,-0.0 2,-0.5 -0.989 68.5-125.1-147.0 145.0 40.5 -6.9 24.4 204 244 A W E -P 197 0F 121 -2,-0.3 2,-0.7 -7,-0.2 -7,-0.2 -0.856 27.9-156.4 -84.6 125.6 37.2 -5.3 25.2 205 245 A I E -P 196 0F 2 -9,-2.9 -9,-1.9 -2,-0.5 2,-0.2 -0.921 13.3-160.6-110.6 104.6 36.6 -5.8 28.9 206 246 A S E > -P 195 0F 19 -2,-0.7 3,-1.2 -11,-0.2 -11,-0.3 -0.461 28.5-122.5 -86.9 158.9 32.8 -5.6 29.7 207 247 A Q T 3 S+ 0 0 0 -13,-3.1 -14,-0.2 -15,-0.3 -15,-0.1 0.544 114.4 51.5 -72.7 -10.7 31.1 -4.9 32.9 208 248 A S T 3 S+ 0 0 46 -16,-0.4 2,-1.0 -14,-0.3 -1,-0.2 0.263 78.1 114.2-112.7 12.7 29.3 -8.3 32.6 209 249 A N < + 0 0 38 -3,-1.2 7,-0.2 1,-0.2 -16,-0.0 -0.743 39.7 179.6 -81.9 101.5 32.4 -10.3 32.0 210 250 A D S > S+ 0 0 85 -2,-1.0 3,-1.5 1,-0.2 4,-0.3 0.875 77.6 57.3 -71.3 -39.2 32.6 -12.5 35.1 211 251 A E T 3 S+ 0 0 182 1,-0.3 3,-0.3 -3,-0.1 -1,-0.2 0.906 117.9 32.6 -58.6 -40.9 35.8 -14.2 34.0 212 252 A K T 3> S+ 0 0 62 1,-0.2 4,-2.0 -6,-0.1 -1,-0.3 -0.022 80.5 125.3-106.4 27.7 37.7 -10.9 33.8 213 253 A K H <> S+ 0 0 8 -3,-1.5 4,-2.7 1,-0.2 5,-0.2 0.879 72.7 53.2 -55.8 -41.5 35.8 -9.2 36.6 214 254 A E H > S+ 0 0 51 -3,-0.3 4,-3.0 -4,-0.3 -1,-0.2 0.936 111.1 45.3 -62.3 -46.0 39.0 -8.3 38.4 215 255 A D H > S+ 0 0 29 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.812 111.5 53.6 -66.7 -30.8 40.6 -6.7 35.4 216 256 A F H X S+ 0 0 0 -4,-2.0 4,-2.4 -7,-0.2 5,-0.4 0.964 114.0 41.7 -64.9 -50.3 37.3 -4.8 34.7 217 257 A L H X S+ 0 0 1 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.935 121.3 41.6 -63.7 -46.1 37.3 -3.4 38.2 218 258 A Y H X S+ 0 0 45 -4,-3.0 4,-2.8 -5,-0.2 -2,-0.2 0.949 117.8 45.3 -65.4 -52.0 41.0 -2.7 38.2 219 259 A G H X S+ 0 0 4 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.834 114.0 46.0 -67.3 -38.0 41.2 -1.3 34.7 220 260 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.940 116.7 45.8 -69.5 -44.5 38.2 1.0 34.7 221 261 A T H X S+ 0 0 0 -4,-1.5 4,-2.7 -5,-0.4 5,-0.2 0.933 110.7 52.9 -62.2 -45.6 39.2 2.4 38.1 222 262 A Q H X S+ 0 0 42 -4,-2.8 4,-0.8 1,-0.2 -1,-0.2 0.892 109.8 49.3 -60.8 -40.6 42.8 2.9 37.0 223 263 A R H >X>S+ 0 0 27 -4,-1.8 5,-2.0 1,-0.2 4,-1.1 0.930 113.1 46.8 -62.9 -42.5 41.7 4.8 34.0 224 264 A L H 3<5S+ 0 0 0 -4,-2.2 10,-2.4 1,-0.2 -2,-0.2 0.884 111.9 48.7 -67.1 -39.6 39.4 7.0 36.1 225 265 A V H 3<5S+ 0 0 3 -4,-2.7 11,-0.4 1,-0.2 -1,-0.2 0.555 121.2 36.8 -84.2 -5.6 42.0 7.7 38.8 226 266 A T H <<5S- 0 0 45 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.411 103.8-126.6-113.1 -9.1 44.6 8.7 36.2 227 267 A G T <5 + 0 0 28 -4,-1.1 6,-0.2 5,-0.5 3,-0.2 0.893 62.1 140.1 59.5 44.9 42.3 10.4 33.8 228 268 A T > < + 0 0 69 -5,-2.0 3,-1.8 4,-0.2 -1,-0.2 -0.646 40.4 34.3-115.1 168.5 43.5 8.2 30.9 229 269 A D T 3 S- 0 0 85 1,-0.3 -1,-0.2 -2,-0.2 -32,-0.1 0.785 133.3 -54.7 60.9 31.1 42.0 6.4 27.9 230 270 A G T 3 S+ 0 0 48 1,-0.3 -64,-2.9 -3,-0.2 -63,-0.3 0.380 106.8 128.6 85.9 -2.3 39.5 9.1 27.4 231 271 A F B < -O 165 0E 18 -3,-1.8 -1,-0.3 -66,-0.3 -66,-0.3 -0.550 63.5-108.0 -89.4 149.0 38.1 9.0 30.9 232 272 A I - 0 0 9 -68,-2.6 -5,-0.5 -2,-0.2 2,-0.4 -0.393 39.0-108.1 -66.1 150.3 37.7 12.0 33.2 233 273 A K + 0 0 125 -6,-0.2 -8,-0.2 -7,-0.2 -9,-0.1 -0.723 38.0 172.0 -88.1 131.3 40.2 12.2 36.2 234 274 A I - 0 0 0 -10,-2.4 -7,-0.1 -2,-0.4 5,-0.1 -0.982 40.0-113.3-131.3 116.9 38.9 11.5 39.7 235 275 A P > - 0 0 41 0, 0.0 3,-2.0 0, 0.0 -9,-0.1 -0.240 20.4-125.3 -53.5 141.6 41.6 11.3 42.3 236 276 A A G > S+ 0 0 11 -11,-0.4 3,-1.6 1,-0.3 40,-0.8 0.823 110.2 59.7 -58.4 -35.9 42.0 7.9 43.8 237 277 A S G 3 S+ 0 0 60 1,-0.3 -1,-0.3 38,-0.2 38,-0.1 0.607 109.5 45.0 -69.7 -10.0 41.5 9.2 47.4 238 278 A K G < S+ 0 0 61 -3,-2.0 -54,-2.7 -55,-0.1 2,-0.4 -0.049 97.2 102.3-117.9 28.0 38.1 10.5 46.3 239 279 A F B < +i 184 0B 0 -3,-1.6 37,-2.3 -56,-0.2 38,-0.8 -0.953 40.6 176.3-125.0 136.2 37.1 7.3 44.5 240 280 A V E - k 0 277B 0 -56,-2.5 2,-0.6 -2,-0.4 38,-0.3 -0.995 27.6-128.5-138.5 131.1 34.7 4.6 45.5 241 281 A I E - k 0 278B 1 36,-2.2 38,-2.5 -2,-0.4 2,-0.5 -0.767 21.8-147.4 -87.3 123.8 33.6 1.5 43.5 242 282 A G E +jk 187 279B 0 -56,-1.7 -54,-2.5 -2,-0.6 38,-0.2 -0.804 23.8 171.4 -96.0 129.5 29.9 1.1 43.3 243 283 A L E - k 0 280B 2 36,-3.0 38,-1.3 -2,-0.5 2,-0.2 -0.903 35.4-103.6-134.0 151.1 28.5 -2.5 43.1 244 284 A P E - k 0 281B 2 0, 0.0 11,-0.4 0, 0.0 38,-0.2 -0.539 23.2-135.8 -74.2 144.8 25.2 -4.3 43.3 245 285 A S S S- 0 0 6 36,-2.6 2,-0.3 -2,-0.2 37,-0.2 0.822 79.3 -27.9 -65.6 -34.3 24.5 -6.1 46.5 246 286 A N S >> S- 0 0 6 35,-0.4 4,-0.9 53,-0.1 3,-0.5 -0.932 78.0 -77.3-166.9 178.7 23.1 -9.1 44.6 247 287 A N T 34 S+ 0 0 60 -2,-0.3 -227,-0.0 1,-0.2 7,-0.0 0.538 125.1 56.7 -75.0 -6.7 21.5 -10.1 41.3 248 288 A D T 34 S+ 0 0 1 -228,-0.2 -228,-2.6 -229,-0.1 -1,-0.2 0.780 101.0 58.3 -82.0 -32.8 18.1 -8.9 42.5 249 289 A A T <4 S+ 0 0 4 -3,-0.5 2,-0.3 -230,-0.2 -2,-0.2 0.774 120.7 11.1 -66.6 -30.9 19.5 -5.3 43.2 250 290 A A < - 0 0 0 -4,-0.9 4,-0.2 1,-0.1 -1,-0.2 -0.991 67.5-124.2-152.1 152.1 20.7 -4.8 39.6 251 291 A A S S+ 0 0 55 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.904 94.8 0.5 -63.0 -45.4 20.3 -6.5 36.2 252 292 A T S S+ 0 0 39 1,-0.1 -62,-2.0 -3,-0.1 -1,-0.2 -0.952 100.4 64.4-141.6 159.1 24.1 -6.9 35.7 253 293 A G + 0 0 6 1,-0.4 -1,-0.1 -2,-0.3 -2,-0.1 0.214 53.5 146.1 113.7 -12.8 27.4 -6.1 37.5 254 294 A Y - 0 0 64 -4,-0.2 2,-0.8 -11,-0.1 -1,-0.4 -0.354 49.2-128.6 -56.0 133.3 27.1 -8.3 40.6 255 295 A V - 0 0 4 -11,-0.4 -1,-0.1 1,-0.2 -45,-0.0 -0.772 21.9-172.2 -90.9 109.9 30.5 -9.6 41.6 256 296 A K S S+ 0 0 137 -2,-0.8 -1,-0.2 1,-0.2 3,-0.1 0.830 77.6 44.3 -71.1 -33.1 30.4 -13.4 41.9 257 297 A D >> - 0 0 87 -47,-0.1 3,-2.4 1,-0.1 4,-0.5 -0.910 66.4-162.1-121.1 103.7 33.9 -13.7 43.4 258 298 A P H >> S+ 0 0 41 0, 0.0 4,-2.4 0, 0.0 3,-0.5 0.727 87.6 73.7 -57.6 -22.2 34.8 -11.1 46.1 259 299 A N H 3> S+ 0 0 84 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.831 87.0 63.6 -62.4 -27.9 38.4 -11.9 45.5 260 300 A A H <> S+ 0 0 9 -3,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.906 107.3 41.9 -57.8 -43.5 38.1 -10.0 42.3 261 301 A V H S+ 0 0 0 -4,-2.5 5,-2.8 -5,-0.2 3,-0.3 0.950 112.1 46.1 -59.7 -47.7 45.2 -0.1 42.9 269 309 A K H ><5S+ 0 0 123 -4,-2.4 3,-2.0 1,-0.2 5,-0.4 0.937 111.1 52.8 -60.6 -45.0 47.1 0.4 46.2 270 310 A A H 3<5S+ 0 0 92 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.770 105.6 54.7 -65.1 -25.2 50.2 -1.2 44.7 271 311 A S T 3<5S- 0 0 46 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.355 124.6-102.8 -85.9 5.4 50.1 1.1 41.7 272 312 A G T < 5S+ 0 0 65 -3,-2.0 -3,-0.2 -4,-0.1 -2,-0.2 0.701 98.6 104.0 80.4 21.9 50.1 4.2 44.1 273 313 A N < + 0 0 30 -5,-2.8 -4,-0.2 -6,-0.2 -3,-0.1 -0.359 45.9 175.5-132.4 51.0 46.3 4.7 43.6 274 314 A E - 0 0 63 -5,-0.4 2,-0.2 -6,-0.1 -35,-0.2 -0.378 22.3-142.7 -58.3 131.6 44.7 3.4 46.8 275 315 A I - 0 0 7 -10,-0.2 -38,-0.2 -38,-0.1 -35,-0.2 -0.520 14.6-115.2-101.2 170.2 41.0 4.2 46.6 276 316 A K - 0 0 30 -37,-2.3 -272,-2.3 -40,-0.8 2,-0.3 0.718 63.6 -93.5 -81.4 -22.4 38.5 5.2 49.4 277 317 A G E -bk 4 240B 2 -38,-0.8 -36,-2.2 -274,-0.2 2,-0.3 -1.000 47.2 -46.1 151.8-148.3 36.3 2.2 49.5 278 318 A L E -bk 5 241B 0 -274,-1.8 -272,-2.9 -2,-0.3 2,-0.3 -0.897 29.2-160.2-132.5 155.2 33.1 0.6 48.1 279 319 A M E -bk 6 242B 0 -38,-2.5 -36,-3.0 -2,-0.3 2,-0.4 -0.922 10.8-162.9-130.3 147.8 29.4 1.5 47.5 280 320 A T E -bk 7 243B 0 -274,-2.1 -272,-1.7 -2,-0.3 2,-0.7 -0.988 24.0-118.6-137.9 141.0 26.3 -0.7 47.1 281 321 A W E S+ k 0 244B 40 -38,-1.3 -36,-2.6 -2,-0.4 -35,-0.4 -0.955 86.1 8.9 -94.0 106.7 22.8 -0.5 45.8 282 322 A S > - 0 0 0 -2,-0.7 4,-2.5 -274,-0.4 -1,-0.2 0.719 26.4-173.6-161.7 166.1 21.4 -1.2 48.4 283 323 A V H > S+ 0 0 0 -275,-2.5 4,-1.4 -3,-0.3 -274,-0.2 0.901 108.3 53.1 -65.1 -35.3 21.1 -1.9 52.1 284 324 A N H 4 S+ 0 0 1 -276,-0.8 -258,-2.2 1,-0.2 -1,-0.2 0.884 111.8 45.6 -67.5 -35.2 17.5 -2.9 51.6 285 325 A W H >4 S+ 0 0 10 -260,-0.2 3,-1.8 1,-0.2 -2,-0.2 0.876 105.9 58.4 -69.3 -39.2 18.6 -5.4 48.9 286 326 A D H 3< S+ 0 0 1 -4,-2.5 12,-2.4 1,-0.3 13,-0.5 0.828 114.1 39.6 -61.9 -29.1 21.4 -6.7 51.0 287 327 A A T 3< S+ 0 0 21 -4,-1.4 -1,-0.3 10,-0.2 -2,-0.2 0.204 102.9 105.5 -97.9 10.6 18.7 -7.6 53.6 288 328 A G < - 0 0 1 -3,-1.8 8,-2.9 -262,-0.1 9,-0.6 0.046 66.5-117.2 -83.5-170.5 16.3 -8.8 51.0 289 329 A T B -LM 24 295C 28 -265,-2.5 -265,-2.2 6,-0.3 6,-0.2 -0.951 18.9-123.1-127.6 148.7 15.1 -12.2 49.9 290 330 A N > - 0 0 34 4,-2.5 3,-2.1 -2,-0.3 -266,-0.2 -0.233 48.2 -84.3 -76.3 179.2 15.4 -14.0 46.5 291 331 A S T 3 S+ 0 0 64 -270,-0.4 -269,-0.1 1,-0.3 -1,-0.1 0.778 131.1 54.8 -59.2 -30.1 12.3 -15.3 44.6 292 332 A N T 3 S- 0 0 140 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.404 120.6-107.4 -82.7 -1.0 12.3 -18.5 46.7 293 333 A G < + 0 0 49 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.486 70.0 146.3 86.4 5.0 12.3 -16.5 50.0 294 334 A E - 0 0 128 1,-0.1 -4,-2.5 2,-0.0 -1,-0.3 -0.569 51.9-114.4 -74.9 134.0 15.9 -17.3 50.9 295 335 A K B -M 289 0C 148 -2,-0.3 -6,-0.3 -6,-0.2 -7,-0.1 -0.456 6.0-147.5 -72.1 131.2 17.5 -14.4 52.7 296 336 A Y > - 0 0 43 -8,-2.9 3,-1.1 -2,-0.2 -1,-0.2 0.805 34.0-157.0 -62.7 -28.4 20.4 -12.5 51.1 297 337 A N T 3 - 0 0 103 -9,-0.6 -10,-0.2 1,-0.3 -11,-0.1 0.805 51.1 -67.5 60.2 39.3 21.4 -12.2 54.7 298 338 A N T 3> S+ 0 0 44 -12,-2.4 4,-2.9 -10,-0.1 -1,-0.3 0.776 82.2 154.2 59.8 31.1 23.7 -9.1 54.5 299 339 A T H <> + 0 0 66 -3,-1.1 4,-1.3 -13,-0.5 5,-0.2 0.839 67.1 54.5 -64.4 -33.6 26.2 -11.0 52.4 300 340 A F H > S+ 0 0 7 2,-0.2 4,-2.9 1,-0.2 3,-0.4 0.981 115.2 36.5 -65.0 -55.4 27.5 -7.8 50.8 301 341 A V H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.876 116.4 54.1 -64.4 -37.3 28.3 -6.0 54.1 302 342 A N H < S+ 0 0 98 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.752 117.5 38.7 -67.3 -24.4 29.4 -9.2 55.8 303 343 A T H X S+ 0 0 45 -4,-1.3 4,-0.9 -3,-0.4 -2,-0.2 0.891 124.4 32.6 -89.6 -49.8 31.9 -9.7 52.9 304 344 A Y H X S+ 0 0 10 -4,-2.9 4,-2.5 -5,-0.2 5,-0.3 0.779 106.1 66.0 -90.8 -25.1 33.2 -6.2 52.1 305 345 A A H X S+ 0 0 12 -4,-1.7 4,-2.9 -5,-0.4 5,-0.3 0.964 107.3 41.9 -61.4 -50.7 33.1 -4.5 55.5 306 346 A P H > S+ 0 0 43 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.884 111.8 58.2 -64.6 -36.5 35.9 -6.8 56.9 307 347 A M H < S+ 0 0 52 -4,-0.9 -2,-0.2 1,-0.2 -3,-0.1 0.917 118.0 30.4 -53.6 -45.1 37.7 -6.4 53.6 308 348 A L H < S+ 0 0 14 -4,-2.5 -1,-0.2 -3,-0.1 -3,-0.2 0.794 131.1 34.0 -83.7 -31.9 37.8 -2.7 54.0 309 349 A F H >< S+ 0 0 23 -4,-2.9 3,-1.7 -5,-0.3 -2,-0.2 0.722 80.6 102.2-108.7 -24.2 38.0 -2.4 57.7 310 350 A N T 3< S- 0 0 108 -4,-2.2 3,-0.1 -5,-0.3 0, 0.0 -0.447 107.1 -2.9 -62.7 127.6 39.9 -5.3 59.3 311 351 A N T 3 S+ 0 0 178 1,-0.2 2,-0.6 -2,-0.2 -1,-0.3 0.748 100.8 134.1 60.6 25.6 43.4 -4.0 60.3 312 352 A E < - 0 0 48 -3,-1.7 -1,-0.2 1,-0.1 3,-0.1 -0.944 39.8-167.8-110.6 119.1 42.6 -0.6 58.7 313 353 A G S S+ 0 0 67 -2,-0.6 2,-0.6 1,-0.2 -1,-0.1 0.559 75.5 65.4 -80.4 -11.4 43.6 2.4 60.9 314 354 A H + 0 0 105 -313,-0.2 -311,-2.8 2,-0.0 2,-0.5 -0.830 61.6 162.5-123.1 92.7 41.7 4.9 58.9 315 355 A H B -a 3 0A 74 -2,-0.6 -311,-0.1 -313,-0.3 -313,-0.1 -0.944 40.1-120.2-117.0 111.4 38.0 4.3 59.2 316 356 A H + 0 0 26 -313,-1.8 2,-0.4 -2,-0.5 -311,-0.1 -0.268 40.5 169.9 -55.5 130.3 35.6 7.1 58.2 317 357 A H - 0 0 112 -239,-0.1 -239,-0.2 -313,-0.0 -240,-0.1 -0.997 42.4-100.8-140.6 137.2 33.4 8.0 61.1 318 358 A H 0 0 35 -241,-1.1 -239,-0.1 -2,-0.4 -240,-0.0 -0.434 360.0 360.0 -49.1 134.1 31.1 10.9 61.5 319 359 A H 0 0 172 -2,-0.0 -1,-0.2 -242,-0.0 -244,-0.1 0.168 360.0 360.0 29.6 360.0 32.8 13.5 63.7