==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NON SPECIFIC MONO-ESTERASE 18-JUL-95 1AJC . COMPND 2 MOLECULE: ALKALINE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.G.DEALWIS,L.CHEN,C.ABAD-ZAPATERO . 895 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28198.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 612 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 93 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 80 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 1 0.1 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 . 58 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 23.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 4 2 2 6 4 0 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 0 2 6 0 5 1 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 . 9 6 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A T 0 0 164 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 31.3 66.9 53.2 2.4 2 2 A P + 0 0 128 0, 0.0 2,-0.3 0, 0.0 33,-0.0 -0.549 360.0 160.9 -74.5 125.4 68.4 50.4 4.5 3 3 A E - 0 0 141 -2,-0.4 355,-0.1 32,-0.0 354,-0.1 -0.983 40.2-120.4-141.0 127.3 67.3 50.7 8.2 4 4 A M - 0 0 26 -2,-0.3 32,-0.1 353,-0.2 356,-0.1 -0.593 33.6-129.2 -74.5 121.2 67.4 47.8 10.7 5 5 A P - 0 0 43 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.309 12.5-153.5 -71.2 148.7 63.9 47.0 12.1 6 6 A V - 0 0 13 72,-0.1 2,-0.5 73,-0.1 72,-0.2 -0.974 43.4 -93.5-119.5 133.3 63.1 46.7 15.8 7 7 A L - 0 0 20 70,-2.0 3,-0.2 -2,-0.4 69,-0.1 -0.304 43.8-169.0 -50.0 100.5 60.1 44.5 16.6 8 8 A E - 0 0 140 -2,-0.5 2,-0.2 1,-0.2 -1,-0.2 0.735 67.3 -1.4 -68.8 -25.3 57.4 47.3 16.6 9 9 A N + 0 0 91 67,-0.1 -1,-0.2 15,-0.1 4,-0.0 -0.652 51.9 160.3-173.4 111.7 54.6 45.1 18.1 10 10 A R + 0 0 9 -3,-0.2 2,-0.2 -2,-0.2 15,-0.1 -0.378 40.7 130.3-127.5 45.6 54.5 41.5 19.1 11 11 A A S S- 0 0 21 13,-0.2 2,-0.6 1,-0.1 59,-0.2 -0.562 81.7 -69.9 -93.4 162.2 51.5 41.7 21.4 12 12 A A - 0 0 20 57,-2.9 12,-0.2 -2,-0.2 11,-0.1 -0.431 51.9-144.2 -54.3 106.6 48.6 39.3 21.1 13 13 A Q - 0 0 85 10,-3.2 -1,-0.2 -2,-0.6 9,-0.2 0.488 64.9 -22.2 -58.5 -2.8 47.3 40.7 17.8 14 14 A G S S+ 0 0 47 7,-1.9 2,-0.9 9,-0.2 7,-0.1 -0.543 107.5 1.4-163.6-132.9 43.7 40.2 18.7 15 15 A D > - 0 0 94 4,-0.2 3,-2.3 -2,-0.2 6,-0.4 -0.765 48.1-150.8 -90.5 103.7 41.2 38.3 20.8 16 16 A I T 3 S+ 0 0 27 -2,-0.9 546,-0.5 5,-0.3 6,-0.2 0.758 96.7 47.9 -37.9 -40.3 42.9 35.9 23.2 17 17 A T T 3 S+ 0 0 24 4,-0.1 -1,-0.3 544,-0.1 555,-0.3 0.677 101.1 78.9 -79.3 -23.2 39.8 33.6 23.1 18 18 A A S X S- 0 0 33 -3,-2.3 3,-1.5 1,-0.1 4,-0.4 -0.473 96.7 -81.8 -88.2 157.6 39.4 33.5 19.3 19 19 A P T 3 S- 0 0 71 0, 0.0 542,-0.2 0, 0.0 -4,-0.2 -0.300 114.3 -1.9 -56.0 138.5 41.4 31.5 16.7 20 20 A G T > S+ 0 0 16 540,-2.1 3,-1.5 1,-0.2 -7,-0.1 0.399 99.1 117.5 60.5 -5.9 44.6 33.2 15.8 21 21 A G T < S+ 0 0 8 -3,-1.5 -7,-1.9 -6,-0.4 -5,-0.3 0.718 73.0 51.8 -64.7 -20.9 43.7 36.1 18.2 22 22 A A T 3 S+ 0 0 2 -4,-0.4 -1,-0.3 538,-0.3 863,-0.2 0.406 81.0 120.9 -95.0 -0.5 46.8 35.3 20.4 23 23 A R < - 0 0 69 -3,-1.5 -10,-3.2 1,-0.1 -9,-0.2 -0.337 44.3-166.9 -63.9 144.9 49.3 35.3 17.5 24 24 A R + 0 0 2 -12,-0.2 2,-0.4 858,-0.2 -13,-0.2 0.564 69.8 72.2-105.2 -18.6 52.0 37.9 17.9 25 25 A L - 0 0 7 -15,-0.1 -12,-0.1 1,-0.1 3,-0.1 -0.787 56.1-169.4-100.1 141.8 53.2 37.6 14.3 26 26 A T S S- 0 0 112 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.326 70.2 -21.2-109.3 3.2 51.2 39.1 11.5 27 27 A G S S- 0 0 35 849,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.956 96.7 -30.4-179.9-163.9 53.2 37.5 8.7 28 28 A D - 0 0 69 -2,-0.3 4,-0.3 1,-0.1 3,-0.2 -0.586 38.2-165.9 -79.9 135.3 56.5 35.9 7.7 29 29 A Q > + 0 0 27 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.514 62.7 99.1 -97.2 -8.7 59.6 37.2 9.5 30 30 A T H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.876 89.0 44.3 -46.7 -43.9 62.3 35.8 7.2 31 31 A A H > S+ 0 0 57 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.944 109.9 53.4 -68.2 -49.3 62.7 39.1 5.4 32 32 A A H 4 S+ 0 0 30 -4,-0.3 4,-0.2 1,-0.2 -2,-0.2 0.878 109.8 50.4 -54.4 -39.0 62.7 41.2 8.6 33 33 A L H >X S+ 0 0 6 -4,-2.5 3,-1.7 2,-0.2 4,-0.6 0.915 106.9 52.6 -66.7 -43.3 65.5 39.1 10.0 34 34 A R H >< S+ 0 0 99 -4,-1.7 3,-1.6 1,-0.3 -2,-0.2 0.932 106.8 53.7 -59.1 -41.4 67.7 39.4 6.9 35 35 A D T 3< S+ 0 0 106 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.588 105.8 56.3 -68.5 -8.4 67.3 43.2 7.2 36 36 A S T <4 S+ 0 0 5 -3,-1.7 2,-0.6 -4,-0.2 385,-0.3 0.500 86.4 94.0 -98.3 -9.7 68.6 42.7 10.8 37 37 A L << + 0 0 10 -3,-1.6 2,-0.3 -4,-0.6 383,-0.0 -0.772 45.5 148.5 -92.8 119.9 71.8 41.0 9.8 38 38 A S - 0 0 17 -2,-0.6 385,-2.5 383,-0.3 387,-0.4 -0.992 32.7-170.1-148.4 141.7 74.8 43.3 9.4 39 39 A D + 0 0 79 -2,-0.3 3,-0.1 383,-0.2 -1,-0.0 0.185 49.0 129.6-114.2 11.4 78.6 42.7 10.0 40 40 A K S S- 0 0 66 1,-0.1 -2,-0.1 0, 0.0 2,-0.1 -0.228 72.9 -88.1 -62.3 154.4 79.4 46.4 9.6 41 41 A P - 0 0 100 0, 0.0 2,-0.4 0, 0.0 403,-0.2 -0.427 39.1-127.6 -67.6 145.3 81.5 47.8 12.4 42 42 A A - 0 0 6 401,-1.9 320,-0.2 1,-0.2 3,-0.1 -0.812 14.6-163.8 -94.0 131.9 79.6 49.1 15.4 43 43 A K S S+ 0 0 90 318,-2.3 274,-0.5 -2,-0.4 2,-0.3 0.890 75.5 18.1 -80.9 -44.2 80.5 52.7 16.4 44 44 A N E -a 362 0A 6 317,-1.5 319,-1.6 272,-0.2 2,-0.4 -0.857 65.3-154.0-125.5 160.9 78.9 52.5 19.8 45 45 A I E -ab 363 318A 0 272,-1.6 274,-2.8 -2,-0.3 2,-0.5 -0.994 4.9-170.4-138.7 128.7 77.7 49.7 22.1 46 46 A I E -ab 364 319A 0 317,-2.7 319,-2.5 -2,-0.4 2,-0.6 -0.990 6.3-168.9-120.9 121.6 75.0 49.9 24.8 47 47 A L E -ab 365 320A 0 272,-2.2 274,-2.7 -2,-0.5 2,-0.7 -0.948 2.9-165.1-116.6 109.6 74.7 46.9 27.1 48 48 A L E -ab 366 321A 0 317,-3.4 319,-2.1 -2,-0.6 2,-0.6 -0.856 8.3-166.7 -97.4 116.3 71.6 46.8 29.4 49 49 A I E -ab 367 322A 0 272,-3.3 274,-1.7 -2,-0.7 2,-0.8 -0.911 9.8-162.0-108.2 118.3 72.1 44.3 32.2 50 50 A G E > - b 0 323A 0 317,-3.1 3,-2.3 -2,-0.6 2,-0.8 -0.870 28.2-127.2 -96.8 106.1 69.0 43.2 34.2 51 51 A D T 3 S- 0 0 10 272,-1.8 276,-0.1 -2,-0.8 3,-0.1 -0.368 89.6 -7.5 -60.0 100.0 70.5 41.6 37.4 52 52 A G T 3 S+ 0 0 0 -2,-0.8 2,-2.0 318,-0.2 -1,-0.3 0.527 87.7 150.7 92.9 10.9 68.8 38.2 37.6 53 53 A M < + 0 0 3 -3,-2.3 -1,-0.2 314,-0.2 -3,-0.1 -0.509 17.1 162.7 -78.9 77.6 66.4 38.8 34.8 54 54 A G > - 0 0 2 -2,-2.0 4,-1.9 -3,-0.1 3,-0.3 -0.330 59.7 -87.2 -83.6-179.0 66.0 35.3 33.6 55 55 A D H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 809,-0.6 0.879 129.5 56.4 -58.6 -36.3 63.2 34.2 31.3 56 56 A S H > S+ 0 0 21 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 107.5 48.1 -62.8 -40.2 61.0 33.6 34.4 57 57 A E H > S+ 0 0 3 -3,-0.3 4,-1.7 -5,-0.2 -1,-0.2 0.876 112.0 49.6 -69.6 -34.9 61.5 37.2 35.6 58 58 A I H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.942 112.3 46.1 -68.1 -48.2 60.7 38.6 32.2 59 59 A T H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.854 111.7 53.6 -63.6 -35.2 57.5 36.6 31.8 60 60 A A H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.879 112.0 44.2 -65.9 -41.0 56.5 37.5 35.4 61 61 A A H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.4 0.857 114.6 47.7 -73.0 -39.4 56.9 41.2 34.7 62 62 A R H X>S+ 0 0 0 -4,-2.5 4,-3.5 2,-0.2 5,-1.6 0.989 110.2 52.9 -63.8 -57.6 55.2 41.2 31.3 63 63 A N H X5S+ 0 0 4 -4,-2.4 4,-1.0 3,-0.2 330,-0.5 0.906 118.3 35.5 -39.5 -62.0 52.2 39.2 32.6 64 64 A Y H <5S+ 0 0 22 -4,-1.7 329,-1.7 328,-0.2 -1,-0.2 0.914 127.6 33.9 -64.0 -49.8 51.6 41.7 35.5 65 65 A A H <5S+ 0 0 21 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.836 136.8 15.7 -80.3 -36.4 52.5 45.0 33.7 66 66 A E H <5S- 0 0 66 -4,-3.5 -3,-0.2 -5,-0.4 -2,-0.2 0.481 109.2-109.0-115.0 -8.4 51.4 44.4 30.1 67 67 A G ><< - 0 0 0 -5,-1.6 3,-2.9 -4,-1.0 -1,-0.1 0.014 42.5 -72.9 92.6 155.6 49.2 41.4 30.5 68 68 A A T 3 S+ 0 0 0 1,-0.3 -1,-0.2 -5,-0.2 -5,-0.1 0.850 139.5 44.0 -54.0 -35.8 50.0 37.9 29.3 69 69 A G T 3 S+ 0 0 14 -3,-0.1 -57,-2.9 -6,-0.1 -1,-0.3 0.269 97.6 114.4 -92.9 12.8 49.4 39.0 25.8 70 70 A G < - 0 0 8 -3,-2.9 2,-0.4 -59,-0.2 -3,-0.1 -0.018 55.7-140.3 -74.8-176.8 51.3 42.2 26.3 71 71 A F - 0 0 12 -9,-0.1 2,-0.7 -5,-0.1 -60,-0.1 -0.994 9.9-137.2-149.2 127.7 54.6 43.4 24.8 72 72 A F > - 0 0 0 -2,-0.4 4,-1.5 1,-0.1 5,-0.3 -0.867 17.8-148.3 -85.8 117.6 57.4 45.2 26.5 73 73 A K T 4 S+ 0 0 113 -2,-0.7 -1,-0.1 3,-0.1 274,-0.0 0.577 92.3 27.9 -62.8 -11.6 58.3 47.9 23.9 74 74 A G T >4 S+ 0 0 0 3,-0.1 3,-1.4 2,-0.0 4,-0.5 0.709 122.8 41.9-109.9 -70.4 62.0 47.7 25.0 75 75 A I T 34 S+ 0 0 0 1,-0.3 3,-0.3 2,-0.2 -2,-0.1 0.758 124.9 35.7 -51.1 -35.3 62.8 44.3 26.4 76 76 A D T 3< S+ 0 0 1 -4,-1.5 804,-0.5 1,-0.2 -1,-0.3 0.482 98.7 80.0-100.5 -3.5 60.9 42.3 23.7 77 77 A A < + 0 0 2 -3,-1.4 -70,-2.0 -5,-0.3 -1,-0.2 0.544 62.8 108.5 -81.1 -7.4 61.6 44.6 20.7 78 78 A L - 0 0 0 -4,-0.5 342,-0.1 -3,-0.3 -72,-0.1 -0.629 59.2-153.1 -76.6 114.2 65.1 43.2 20.1 79 79 A P S S+ 0 0 5 0, 0.0 2,-0.6 0, 0.0 341,-0.2 0.831 72.8 60.7 -54.7 -49.1 65.0 41.2 16.9 80 80 A L E +C 419 0A 0 339,-1.7 339,-2.5 -44,-0.1 2,-0.3 -0.808 66.6 174.1 -93.6 124.5 67.9 38.6 17.4 81 81 A T E +C 418 0A 0 -2,-0.6 348,-0.7 448,-0.5 448,-0.5 -0.906 7.8 145.4-128.6 151.9 67.5 36.3 20.4 82 82 A G E -Cd 417 429A 0 335,-2.3 335,-1.1 -2,-0.3 2,-0.4 -0.772 39.6 -97.2-158.0-162.4 69.4 33.3 21.8 83 83 A Q E -Cd 416 430A 1 346,-1.6 348,-2.0 -2,-0.2 2,-0.4 -0.999 29.1-167.0-137.3 135.0 70.5 31.6 25.0 84 84 A Y E -Cd 415 431A 0 331,-2.0 331,-1.6 -2,-0.4 2,-0.3 -0.947 16.2-131.6-129.8 144.9 73.8 31.8 26.9 85 85 A T E - d 0 432A 5 346,-2.1 348,-2.5 -2,-0.4 349,-0.2 -0.666 16.8-176.8 -86.7 148.8 75.4 29.8 29.7 86 86 A H + 0 0 4 -2,-0.3 14,-0.4 326,-0.2 19,-0.1 -0.219 19.3 155.8-142.0 45.2 77.0 31.6 32.6 87 87 A Y - 0 0 11 12,-0.1 11,-0.2 1,-0.1 2,-0.1 -0.377 30.2-139.9 -75.8 153.9 78.6 29.1 34.9 88 88 A A E -J 97 0B 2 9,-2.7 9,-2.5 26,-0.1 2,-0.3 -0.265 17.3-112.7 -97.3-170.1 81.4 30.0 37.3 89 89 A L E -Jk 96 116B 1 26,-2.3 2,-0.7 7,-0.3 28,-0.5 -0.947 19.6-116.1-128.9 149.5 84.6 28.1 38.2 90 90 A N > - 0 0 61 5,-3.2 4,-2.8 -2,-0.3 5,-0.2 -0.780 25.6-142.3 -85.0 117.5 85.8 26.4 41.4 91 91 A K T 4 S+ 0 0 54 -2,-0.7 -1,-0.1 1,-0.2 25,-0.1 0.799 93.7 40.0 -50.4 -37.4 88.9 28.4 42.4 92 92 A K T 4 S+ 0 0 175 1,-0.1 -1,-0.2 -3,-0.0 -2,-0.0 0.979 127.4 26.2 -77.4 -62.2 90.7 25.3 43.7 93 93 A T T 4 S- 0 0 88 2,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.771 92.6-133.8 -75.3 -29.7 89.9 22.6 41.2 94 94 A G < + 0 0 11 -4,-2.8 -3,-0.1 1,-0.3 3,-0.1 0.546 61.5 132.1 83.5 9.3 89.3 24.8 38.2 95 95 A K - 0 0 82 -5,-0.2 -5,-3.2 1,-0.1 -1,-0.3 -0.316 66.3 -73.4 -86.9 171.2 86.1 22.9 37.4 96 96 A P E -J 89 0B 9 0, 0.0 2,-0.6 0, 0.0 -7,-0.3 -0.379 31.0-155.4 -70.3 142.9 82.7 24.4 36.7 97 97 A D E -J 88 0B 34 -9,-2.5 -9,-2.7 1,-0.1 749,-0.1 -0.959 15.8-148.1-116.8 100.4 80.6 25.8 39.5 98 98 A Y S S+ 0 0 9 -2,-0.6 2,-0.5 747,-0.3 -12,-0.2 0.607 79.6 50.5 -49.5 -18.2 77.1 25.5 38.1 99 99 A V S S- 0 0 8 726,-0.1 -1,-0.1 -12,-0.1 313,-0.1 -0.950 75.1-157.5-131.2 113.9 75.7 28.6 39.8 100 100 A T - 0 0 3 -2,-0.5 2,-0.2 -14,-0.4 310,-0.1 -0.382 9.7-135.0 -85.5 161.4 77.5 31.9 39.5 101 101 A D > - 0 0 22 -2,-0.1 4,-1.7 1,-0.1 5,-0.3 -0.603 39.6 -96.0-102.8 172.5 77.3 34.9 41.7 102 102 A S H > S+ 0 0 1 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.927 121.5 53.7 -58.1 -41.6 77.0 38.4 40.2 103 103 A A H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 18,-0.3 0.926 108.1 46.7 -57.9 -52.6 80.8 39.1 40.4 104 104 A A H >> S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 3,-0.5 0.952 116.1 44.8 -57.1 -53.8 81.9 36.0 38.5 105 105 A S H 3X S+ 0 0 1 -4,-1.7 4,-1.6 1,-0.2 5,-0.3 0.932 108.7 56.6 -56.1 -49.0 79.4 36.4 35.7 106 106 A A H 3X S+ 0 0 0 -4,-2.6 4,-1.5 -5,-0.3 -1,-0.2 0.816 109.1 48.6 -53.2 -33.6 80.2 40.1 35.4 107 107 A T H S+ 0 0 0 -4,-1.6 4,-3.0 -3,-0.5 5,-0.9 0.962 101.2 62.4 -73.0 -49.8 83.8 39.2 34.8 108 108 A A H X5S+ 0 0 2 -4,-2.2 4,-1.4 1,-0.2 329,-0.3 0.860 114.8 32.5 -42.9 -49.1 83.1 36.6 32.2 109 109 A W H <5S+ 0 0 0 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.799 121.8 46.3 -83.1 -30.9 81.6 39.2 29.8 110 110 A S H <5S+ 0 0 0 -4,-1.5 22,-2.8 -5,-0.3 -2,-0.2 0.731 131.0 19.3 -85.7 -15.1 83.6 42.2 30.7 111 111 A T H <5S- 0 0 8 -4,-3.0 -3,-0.2 20,-0.2 -2,-0.2 0.574 94.8-124.5-126.5 -18.6 87.0 40.5 30.6 112 112 A G S < -k 89 0B 23 -2,-0.2 3,-2.4 -28,-0.2 -26,-0.1 -0.738 59.7 -84.5 -94.6 146.8 85.4 31.9 40.8 117 117 A N T 3 S+ 0 0 50 -28,-0.5 -1,-0.1 -2,-0.3 3,-0.1 -0.147 116.3 25.1 -48.6 127.5 82.4 33.3 42.5 118 118 A G T 3 S+ 0 0 12 1,-0.4 48,-1.9 47,-0.1 -1,-0.3 0.085 88.8 125.9 105.2 -24.5 83.3 36.6 44.2 119 119 A A < - 0 0 0 -3,-2.4 2,-0.5 46,-0.2 -1,-0.4 -0.383 43.9-157.6 -69.4 144.5 86.2 37.5 42.0 120 120 A L B S-L 163 0C 0 43,-2.4 43,-2.1 -3,-0.1 45,-0.1 -0.846 72.0 -25.6-129.8 95.8 86.2 40.9 40.4 121 121 A G S S+ 0 0 0 -2,-0.5 8,-1.4 1,-0.3 2,-0.3 0.745 113.7 96.8 77.2 25.5 88.3 41.3 37.3 122 122 A V B -M 128 0D 1 6,-0.2 -1,-0.3 41,-0.2 6,-0.2 -0.943 66.4-128.4-139.6 153.9 90.8 38.5 38.2 123 123 A D > - 0 0 12 4,-1.4 3,-2.4 -2,-0.3 -8,-0.2 -0.297 47.1 -80.1 -93.1-174.3 90.9 34.9 37.1 124 124 A I T 3 S+ 0 0 13 -10,-0.4 -9,-0.1 1,-0.3 -1,-0.0 0.786 133.3 55.6 -60.8 -24.3 91.3 31.9 39.5 125 125 A H T 3 S- 0 0 143 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.229 118.7-114.1 -89.9 14.2 95.0 32.5 39.7 126 126 A E < + 0 0 104 -3,-2.4 2,-0.3 1,-0.2 -2,-0.1 0.637 65.3 151.5 63.2 19.2 94.2 36.0 40.9 127 127 A K - 0 0 126 1,-0.1 -4,-1.4 0, 0.0 -1,-0.2 -0.621 46.7-118.5 -81.6 133.8 95.7 37.5 37.7 128 128 A D B -M 122 0D 58 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.404 27.6-166.7 -71.0 147.7 94.3 40.9 36.5 129 129 A H - 0 0 18 -8,-1.4 2,-0.2 -2,-0.1 -17,-0.1 -1.000 29.0-106.8-136.4 130.4 92.6 41.0 33.1 130 130 A P - 0 0 77 0, 0.0 2,-0.1 0, 0.0 30,-0.1 -0.408 35.9-134.7 -63.4 124.7 91.8 44.2 31.2 131 131 A T > - 0 0 0 -2,-0.2 4,-1.7 28,-0.1 -20,-0.2 -0.396 22.9-107.2 -73.2 161.5 88.0 44.8 31.2 132 132 A I H > S+ 0 0 0 -22,-2.8 4,-2.3 1,-0.2 5,-0.2 0.812 120.0 55.0 -60.3 -30.7 86.1 45.9 28.1 133 133 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.932 106.4 48.8 -71.7 -40.9 85.7 49.4 29.5 134 134 A E H > S+ 0 0 56 25,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.837 115.1 47.1 -66.2 -31.1 89.4 49.8 30.1 135 135 A M H X S+ 0 0 16 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.857 108.8 51.5 -77.3 -40.1 90.0 48.6 26.5 136 136 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.1 1,-0.2 3,-0.5 0.974 114.4 46.1 -59.2 -50.6 87.4 50.8 24.9 137 137 A K H ><5S+ 0 0 57 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.844 106.3 57.2 -59.6 -40.2 89.0 53.7 26.7 138 138 A A H 3<5S+ 0 0 85 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.875 105.2 53.1 -61.4 -34.2 92.5 52.7 25.7 139 139 A A T <<5S- 0 0 50 -4,-1.7 -1,-0.3 -3,-0.5 -2,-0.2 0.230 127.1-102.4 -83.9 10.5 91.4 52.9 22.1 140 140 A G T < 5S+ 0 0 38 -3,-1.9 175,-0.2 1,-0.2 -3,-0.2 0.650 75.6 137.2 80.5 14.8 90.1 56.4 22.7 141 141 A L < - 0 0 19 -5,-2.1 176,-0.2 -6,-0.2 -1,-0.2 -0.471 58.4-104.5 -88.1 165.5 86.4 55.7 23.0 142 142 A A E -e 317 0A 3 174,-2.2 176,-1.8 168,-0.2 2,-0.4 -0.584 35.5-153.5 -84.8 154.5 84.1 57.3 25.5 143 143 A T E -e 318 0A 0 174,-0.2 59,-1.6 -2,-0.2 58,-0.5 -0.989 12.6-176.4-133.3 140.6 83.0 55.1 28.4 144 144 A G E -ef 319 202A 0 174,-2.1 176,-1.2 -2,-0.4 2,-0.4 -1.000 8.1-170.5-138.9 140.8 80.0 55.2 30.6 145 145 A N E +ef 320 203A 1 57,-2.2 59,-2.1 -2,-0.4 2,-0.3 -0.960 16.7 171.9-134.9 108.0 78.9 53.1 33.6 146 146 A V E +ef 321 204A 0 174,-2.8 176,-1.0 -2,-0.4 2,-0.3 -0.916 4.7 151.4-119.9 148.4 75.4 53.6 34.9 147 147 A S E -e 322 0A 0 57,-1.8 176,-0.2 -2,-0.3 4,-0.1 -0.986 46.6-134.1-167.6 159.1 73.4 51.7 37.5 148 148 A T E S+ 0 0 8 174,-1.4 116,-1.9 -2,-0.3 2,-0.1 0.290 91.2 70.1-100.5 5.9 70.6 52.0 40.1 149 149 A A E S- 0 0 3 114,-0.2 57,-3.0 173,-0.2 2,-0.4 -0.267 106.4 -65.1-104.0-164.4 72.8 50.1 42.6 150 150 A E E > - f 0 206A 35 55,-0.2 3,-3.7 1,-0.1 57,-0.3 -0.739 45.5-121.7 -84.6 134.3 75.9 51.3 44.5 151 151 A L T 3 S+ 0 0 0 55,-2.6 56,-0.1 -2,-0.4 -1,-0.1 0.559 113.8 62.9 -53.3 -6.4 78.8 51.8 42.0 152 152 A Q T 3 S+ 0 0 1 54,-0.1 -1,-0.3 4,-0.1 55,-0.1 0.453 78.0 114.3 -96.3 -4.2 80.6 49.2 44.2 153 153 A G S <> S- 0 0 10 -3,-3.7 4,-2.0 1,-0.1 5,-0.3 -0.238 85.1-100.1 -62.7 159.8 78.1 46.5 43.3 154 154 A A H > S+ 0 0 7 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.832 113.8 51.4 -51.5 -45.2 79.4 43.5 41.3 155 155 A T H 4 S+ 0 0 0 2,-0.2 4,-0.3 1,-0.1 -1,-0.2 0.919 117.5 32.0 -65.9 -51.0 78.1 44.6 37.9 156 156 A P H >4 S+ 0 0 0 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.944 118.1 54.2 -75.1 -39.6 79.4 48.2 37.6 157 157 A A H >X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.3 3,-1.6 0.785 93.9 73.0 -61.3 -27.5 82.6 47.6 39.6 158 158 A A T 3< S+ 0 0 0 -4,-1.3 -1,-0.3 -5,-0.3 -3,-0.1 0.741 92.7 54.8 -59.1 -27.5 83.5 44.7 37.3 159 159 A L T <4 S+ 0 0 0 -3,-1.7 -25,-0.4 -4,-0.3 -1,-0.3 0.577 122.2 24.0 -85.4 -9.1 84.4 47.2 34.5 160 160 A V T <4 S+ 0 0 3 -3,-1.6 2,-0.3 -4,-0.3 38,-0.2 0.382 110.5 69.1-137.1 2.6 86.8 49.2 36.6 161 161 A A < - 0 0 0 -4,-1.6 2,-0.4 33,-0.1 30,-0.1 -0.927 44.8-167.2-132.6 153.6 88.1 47.1 39.4 162 162 A H + 0 0 12 -2,-0.3 2,-0.3 27,-0.2 -41,-0.2 -0.860 34.8 141.4-136.4 95.5 90.4 44.0 39.9 163 163 A V B -L 120 0C 0 -43,-2.1 -43,-2.4 -2,-0.4 -41,-0.2 -0.942 56.0-125.2-134.7 156.8 90.0 42.6 43.4 164 164 A T S S+ 0 0 36 -2,-0.3 2,-0.3 1,-0.2 -43,-0.1 0.675 97.3 35.2 -77.7 -14.3 90.0 39.1 44.8 165 165 A S > - 0 0 27 -45,-0.1 3,-2.0 -46,-0.1 -1,-0.2 -0.963 67.2-140.9-148.2 128.4 86.7 39.7 46.6 166 166 A R T 3 S+ 0 0 75 -48,-1.9 25,-0.1 -2,-0.3 -1,-0.1 0.758 97.5 74.6 -52.1 -30.4 83.6 41.8 45.7 167 167 A K T 3 + 0 0 123 1,-0.2 2,-1.6 -49,-0.1 3,-0.3 0.492 66.6 99.2 -65.4 -3.5 83.3 42.8 49.4 168 168 A a < + 0 0 0 -3,-2.0 23,-2.7 1,-0.2 24,-0.3 -0.341 39.6 147.4 -86.5 59.8 86.2 45.2 49.0 169 169 A Y - 0 0 71 -2,-1.6 23,-2.1 21,-0.2 24,-0.2 0.922 66.0 -7.4 -56.8 -53.7 84.1 48.4 48.6 170 170 A G S > S- 0 0 0 -3,-0.3 4,-2.9 21,-0.2 3,-0.2 -0.810 88.3 -73.3-138.8-178.8 86.5 50.8 50.2 171 171 A P H > S+ 0 0 5 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.844 124.7 56.6 -44.2 -43.5 89.8 51.1 52.2 172 172 A S H > S+ 0 0 89 1,-0.2 4,-0.9 2,-0.2 -4,-0.0 0.962 115.0 34.4 -56.9 -56.8 88.1 49.8 55.3 173 173 A A H > S+ 0 0 25 -3,-0.2 4,-2.7 1,-0.2 5,-0.4 0.884 115.9 56.7 -68.4 -39.4 86.9 46.5 53.7 174 174 A T H X S+ 0 0 1 -4,-2.9 4,-2.3 1,-0.2 8,-0.4 0.909 98.7 57.8 -62.0 -44.1 89.9 46.1 51.5 175 175 A S H < S+ 0 0 33 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.884 119.3 32.9 -53.2 -39.2 92.6 46.2 54.2 176 176 A E H < S+ 0 0 149 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.782 131.7 26.3 -89.3 -35.1 90.8 43.2 55.8 177 177 A K H < S+ 0 0 101 -4,-2.7 -3,-0.2 1,-0.1 -2,-0.2 0.703 132.5 29.9-106.1 -21.8 89.4 41.2 52.9 178 178 A a >X + 0 0 0 -4,-2.3 3,-2.8 -5,-0.4 4,-1.8 -0.398 66.4 157.7-132.1 56.2 91.7 42.1 50.0 179 179 A P T 34 S+ 0 0 62 0, 0.0 8,-0.2 0, 0.0 -1,-0.1 0.829 76.2 58.0 -52.7 -31.5 95.0 42.8 51.9 180 180 A G T 34 S+ 0 0 62 1,-0.2 8,-0.2 -3,-0.1 -5,-0.1 0.674 111.7 41.2 -71.1 -19.0 96.9 42.1 48.6 181 181 A N T <4 S+ 0 0 10 -3,-2.8 8,-2.3 -7,-0.3 -1,-0.2 0.646 86.6 122.9 -98.7 -21.8 94.8 44.8 47.0 182 182 A A ><> - 0 0 0 -4,-1.8 3,-2.2 -8,-0.4 5,-2.2 -0.131 63.5-137.5 -45.6 125.4 95.1 47.2 50.0 183 183 A L G > 5S+ 0 0 44 1,-0.3 3,-1.5 3,-0.2 35,-0.1 0.866 104.6 55.9 -55.6 -38.8 96.7 50.5 48.9 184 184 A E G 3 5S+ 0 0 72 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.431 105.6 54.4 -76.0 2.1 98.8 50.5 52.1 185 185 A K G < 5S- 0 0 114 -3,-2.2 -1,-0.3 -6,-0.1 -2,-0.2 0.049 128.0 -92.8-119.5 18.8 100.2 47.1 51.1 186 186 A G T < 5S+ 0 0 79 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.569 84.8 132.3 81.8 8.5 101.3 48.1 47.6 187 187 A G S - 0 0 0 -2,-0.2 4,-3.0 -3,-0.1 5,-0.2 -0.134 65.4 -96.4 -69.9 174.2 89.7 49.1 46.9 191 191 A I H > S+ 0 0 0 -23,-2.7 4,-3.0 1,-0.2 5,-0.2 0.934 126.8 48.7 -60.1 -45.9 86.9 49.0 44.3 192 192 A T H > S+ 0 0 0 -23,-2.1 4,-2.1 -24,-0.3 -1,-0.2 0.883 112.4 47.2 -63.7 -38.5 86.1 52.7 44.9 193 193 A E H > S+ 0 0 6 -24,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.943 114.4 46.7 -69.1 -42.6 89.8 53.7 44.6 194 194 A Q H X S+ 0 0 13 -4,-3.0 4,-2.4 1,-0.2 3,-0.3 0.917 110.2 53.8 -64.7 -39.7 90.2 51.7 41.5 195 195 A L H X S+ 0 0 7 -4,-3.0 4,-1.3 1,-0.3 5,-0.3 0.903 106.6 52.3 -59.4 -44.6 86.9 53.2 40.1 196 196 A L H < S+ 0 0 0 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.833 113.5 44.4 -62.0 -32.7 88.3 56.7 40.7 197 197 A N H < S+ 0 0 80 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.798 102.3 63.7 -82.0 -33.2 91.5 55.7 38.8 198 198 A A H < S- 0 0 17 -4,-2.4 -2,-0.2 -38,-0.2 -1,-0.2 0.843 87.3-162.8 -58.0 -36.4 89.7 54.0 35.9 199 199 A R < - 0 0 45 -4,-1.3 2,-0.2 -5,-0.2 -3,-0.1 0.945 7.5-169.0 50.3 72.2 88.1 57.4 35.1 200 200 A A - 0 0 2 -5,-0.3 -56,-0.1 1,-0.1 -1,-0.1 -0.624 31.3-120.0 -82.9 149.2 85.2 56.7 32.8 201 201 A D S S+ 0 0 9 -58,-0.5 54,-3.2 -2,-0.2 2,-0.4 0.864 98.7 23.3 -60.1 -33.1 83.7 59.8 31.2 202 202 A V E +fg 144 255A 0 -59,-1.6 -57,-2.2 52,-0.2 2,-0.4 -1.000 61.3 167.3-138.6 131.7 80.4 59.1 32.9 203 203 A T E +fg 145 256A 6 52,-0.9 54,-3.0 -2,-0.4 2,-0.4 -0.939 12.3 176.5-144.9 112.4 79.6 57.1 36.0 204 204 A L E +fg 146 257A 0 -59,-2.1 -57,-1.8 -2,-0.4 2,-0.3 -0.986 27.4 87.6-125.4 131.1 76.1 57.4 37.4 205 205 A G E - g 0 258A 0 52,-2.3 54,-2.2 -2,-0.4 55,-0.3 -0.987 63.0 -81.7 171.2-170.0 74.7 55.5 40.3 206 206 A G E +f 150 0A 0 -57,-3.0 -55,-2.6 -2,-0.3 57,-0.2 -0.261 68.6 100.9-105.5-160.5 74.3 55.2 44.1 207 207 A G + 0 0 0 55,-1.7 4,-0.5 53,-1.0 3,-0.4 0.823 34.0 149.9 86.8 34.8 76.6 54.0 46.8 208 208 A A + 0 0 8 52,-2.6 3,-0.3 54,-0.3 53,-0.2 0.672 54.1 83.7 -71.8 -18.2 77.8 57.3 48.0 209 209 A K S > S+ 0 0 141 52,-2.2 3,-1.7 1,-0.2 -1,-0.2 0.944 90.0 47.7 -51.3 -54.5 78.3 55.9 51.5 210 210 A T G > S+ 0 0 11 -3,-0.4 3,-2.5 51,-0.3 15,-0.3 0.822 96.3 71.3 -60.0 -31.7 81.7 54.5 50.7 211 211 A F G 3 S+ 0 0 2 -4,-0.5 15,-1.8 -3,-0.3 -1,-0.3 0.447 86.3 70.7 -65.0 1.3 82.9 57.7 49.1 212 212 A A G < S+ 0 0 70 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.498 79.1 99.2 -93.1 -7.4 83.0 59.1 52.6 213 213 A E S < S- 0 0 56 -3,-2.5 12,-2.8 -4,-0.1 2,-0.4 -0.430 71.0-127.4 -78.8 155.3 86.0 57.0 53.5 214 214 A T B -N 224 0E 68 10,-0.3 10,-0.2 -2,-0.1 2,-0.2 -0.832 24.3-107.2-107.2 143.1 89.6 58.3 53.5 215 215 A A B -o 221 0F 3 8,-1.7 7,-2.3 5,-0.6 8,-0.2 -0.450 17.7-148.9 -68.1 136.0 92.5 56.8 51.7 216 216 A T S S- 0 0 56 5,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.528 75.6 -4.4 -83.3 -6.7 95.1 55.0 54.0 217 217 A A S S+ 0 0 21 3,-0.0 3,-0.3 -32,-0.0 -33,-0.1 -0.834 91.4 68.5-161.5-166.2 98.1 55.8 51.7 218 218 A G S > S- 0 0 54 -2,-0.2 3,-1.2 1,-0.2 -34,-0.0 -0.099 98.3 -45.3 75.3-173.1 98.9 57.3 48.4 219 219 A E T 3 S+ 0 0 155 1,-0.3 -1,-0.2 0, 0.0 0, 0.0 0.740 137.6 45.5 -66.9 -27.5 98.8 60.9 47.2 220 220 A W T > S+ 0 0 56 -3,-0.3 3,-1.8 3,-0.1 -5,-0.6 -0.072 77.6 152.7-110.2 31.5 95.3 61.5 48.6 221 221 A Q B < S+o 215 0F 119 -3,-1.2 -5,-0.2 1,-0.3 3,-0.1 -0.269 70.4 17.4 -59.0 145.1 95.9 60.0 52.1 222 222 A G T 3 S+ 0 0 52 -7,-2.3 2,-0.4 1,-0.2 -1,-0.3 0.355 101.7 108.2 74.2 -11.8 93.6 61.5 54.7 223 223 A K S < S- 0 0 106 -3,-1.8 -8,-1.7 -8,-0.2 -1,-0.2 -0.798 77.4-112.9 -95.8 143.9 91.3 63.0 52.1 224 224 A T B > -N 214 0E 32 -2,-0.4 4,-2.1 -10,-0.2 -10,-0.3 -0.385 27.8-113.2 -68.7 156.9 87.9 61.3 51.7 225 225 A L H > S+ 0 0 0 -12,-2.8 4,-2.5 -15,-0.3 -13,-0.2 0.798 120.6 58.6 -63.2 -25.7 87.4 59.6 48.4 226 226 A R H > S+ 0 0 89 -15,-1.8 4,-1.7 -13,-0.3 -1,-0.2 0.927 107.4 45.8 -68.0 -40.7 84.8 62.2 47.6 227 227 A E H > S+ 0 0 92 -16,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.840 109.4 56.8 -68.1 -35.7 87.5 64.9 48.1 228 228 A Q H >X S+ 0 0 8 -4,-2.1 4,-2.7 2,-0.2 3,-0.5 0.995 103.8 52.1 -58.0 -59.0 89.8 62.8 46.0 229 229 A A H 3<>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.3 -2,-0.2 0.865 111.7 46.9 -42.0 -51.3 87.4 62.8 43.1 230 230 A E H ><5S+ 0 0 116 -4,-1.7 3,-1.5 1,-0.2 -1,-0.3 0.876 111.5 50.0 -60.6 -43.5 87.2 66.6 43.3 231 231 A A H <<5S+ 0 0 66 -4,-2.4 -1,-0.2 -3,-0.5 -2,-0.2 0.851 107.1 56.3 -64.4 -33.6 90.9 67.0 43.5 232 232 A R T 3<5S- 0 0 44 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.258 126.6-103.3 -81.6 10.4 91.2 64.7 40.4 233 233 A G T < 5 + 0 0 35 -3,-1.5 -3,-0.2 -5,-0.2 2,-0.2 0.737 64.3 161.7 75.4 28.8 88.9 67.1 38.6 234 234 A Y < - 0 0 19 -5,-2.3 2,-0.7 -6,-0.2 21,-0.2 -0.495 40.1-130.3 -83.6 150.0 85.6 65.2 38.7 235 235 A Q E -h 255 0A 51 19,-3.3 21,-3.2 -2,-0.2 2,-0.6 -0.876 26.9-162.9 -95.9 109.6 82.1 66.7 38.2 236 236 A L E +h 256 0A 47 -2,-0.7 2,-0.4 19,-0.2 21,-0.2 -0.878 13.3 174.1-101.7 120.6 80.0 65.6 41.1 237 237 A V E -h 257 0A 12 19,-1.8 21,-1.7 -2,-0.6 3,-0.1 -0.938 12.0-175.0-119.5 142.5 76.3 65.8 40.7 238 238 A S + 0 0 60 -2,-0.4 2,-0.3 19,-0.2 -1,-0.1 0.306 61.0 31.4-122.4 9.7 73.9 64.5 43.4 239 239 A D S > S- 0 0 63 57,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.991 84.3 -94.2-160.2 165.6 70.4 65.0 41.9 240 240 A A H > S+ 0 0 14 55,-3.6 4,-1.9 -2,-0.3 56,-0.1 0.825 116.9 55.1 -51.3 -41.3 68.3 65.1 38.7 241 241 A A H > S+ 0 0 70 2,-0.2 4,-0.7 1,-0.2 3,-0.2 0.979 114.4 37.2 -58.7 -59.3 68.5 68.9 38.4 242 242 A S H >> S+ 0 0 33 1,-0.2 3,-1.0 2,-0.2 4,-0.9 0.872 111.2 60.5 -62.5 -39.2 72.3 69.1 38.5 243 243 A L H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.3 -1,-0.2 0.917 108.0 46.9 -54.4 -41.5 72.7 65.9 36.4 244 244 A N H 3< S+ 0 0 92 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.638 101.8 63.4 -78.0 -14.3 70.8 67.7 33.7 245 245 A S H << S+ 0 0 92 -3,-1.0 2,-0.3 -4,-0.7 -1,-0.2 0.639 75.1 110.2 -82.4 -16.6 72.8 70.9 33.9 246 246 A V << - 0 0 8 -4,-0.9 3,-0.1 -3,-0.8 63,-0.0 -0.448 44.5-177.3 -62.4 119.8 76.0 69.0 32.8 247 247 A T + 0 0 112 1,-0.3 2,-0.3 -2,-0.3 -1,-0.2 0.818 64.9 8.5 -89.3 -35.2 76.8 70.2 29.3 248 248 A E - 0 0 71 5,-0.0 2,-0.4 2,-0.0 -1,-0.3 -0.992 54.7-165.8-147.9 152.4 79.8 68.0 28.7 249 249 A A + 0 0 6 60,-0.4 2,-0.2 -2,-0.3 63,-0.1 -0.976 30.5 129.6-142.1 124.6 81.6 65.1 30.2 250 250 A N - 0 0 41 3,-1.8 60,-0.0 -2,-0.4 -2,-0.0 -0.737 69.0 -68.9-151.4-162.5 85.1 63.9 29.2 251 251 A Q S S+ 0 0 61 -2,-0.2 -109,-0.0 1,-0.2 -51,-0.0 0.760 128.1 49.5 -75.6 -24.1 88.5 63.0 30.5 252 252 A Q S S+ 0 0 145 1,-0.3 -1,-0.2 -18,-0.0 -3,-0.0 0.850 132.1 17.2 -80.8 -35.7 89.4 66.5 31.5 253 253 A K S S- 0 0 127 -19,-0.0 -3,-1.8 -18,-0.0 -1,-0.3 -0.737 84.4-176.0-135.8 79.0 86.1 66.9 33.4 254 254 A P - 0 0 0 0, 0.0 -19,-3.3 0, 0.0 2,-0.3 -0.536 22.9-121.4 -77.1 150.7 84.6 63.4 33.9 255 255 A L E -gh 202 235A 0 -54,-3.2 -52,-0.9 -21,-0.2 2,-0.4 -0.733 24.6-176.3 -97.8 141.1 81.2 63.0 35.6 256 256 A L E -gh 203 236A 0 -21,-3.2 -19,-1.8 -2,-0.3 2,-0.6 -0.960 6.1-167.6-136.3 112.3 80.4 61.2 38.8 257 257 A G E +gh 204 237A 0 -54,-3.0 -52,-2.3 -2,-0.4 2,-0.7 -0.910 8.3 179.9-106.5 115.6 76.8 61.0 39.9 258 258 A L E +g 205 0A 6 -21,-1.7 -52,-0.2 -2,-0.6 -51,-0.1 -0.784 8.5 168.7-113.5 86.0 76.1 59.7 43.4 259 259 A F + 0 0 14 -54,-2.2 2,-0.2 -2,-0.7 -53,-0.2 0.192 62.1 12.6 -85.5 16.7 72.4 59.8 43.7 260 260 A A - 0 0 25 -55,-0.3 -52,-2.6 1,-0.1 -53,-1.0 -0.869 67.9-116.7 177.5 150.7 72.1 57.9 47.0 261 261 A D S S- 0 0 109 -2,-0.2 -52,-2.2 -54,-0.2 -51,-0.3 0.892 104.0 -3.8 -65.7 -40.9 74.0 56.5 50.0 262 262 A G S S- 0 0 25 1,-0.4 -55,-1.7 -55,-0.2 -54,-0.3 0.085 126.0 -12.6-118.2-125.5 73.2 52.9 49.1 263 263 A N S S- 0 0 59 -57,-0.2 -1,-0.4 -56,-0.1 -114,-0.2 -0.552 77.4-103.8 -80.5 144.6 71.0 51.7 46.3 264 264 A M - 0 0 7 -116,-1.9 61,-0.1 -2,-0.2 -4,-0.1 -0.344 55.9 -78.9 -64.9 149.4 68.8 54.2 44.5 265 265 A P - 0 0 47 0, 0.0 -1,-0.1 0, 0.0 24,-0.0 -0.152 48.8-110.0 -52.6 140.9 65.1 53.9 45.6 266 266 A V - 0 0 25 -3,-0.1 26,-0.1 1,-0.1 25,-0.1 -0.288 17.9-129.2 -70.4 157.0 62.9 51.1 44.2 267 267 A R S S+ 0 0 40 70,-0.3 22,-2.7 1,-0.1 2,-0.3 0.896 84.2 30.0 -76.3 -46.0 60.1 51.9 41.7 268 268 A W E -P 288 0G 37 20,-0.3 2,-0.3 68,-0.2 -1,-0.1 -0.915 68.4-141.2-120.8 151.1 57.1 50.1 43.3 269 269 A L E +P 287 0G 75 18,-3.5 18,-1.7 -2,-0.3 -2,-0.0 -0.777 33.7 141.8-107.1 147.2 56.2 49.3 46.9 270 270 A G - 0 0 26 -2,-0.3 67,-0.1 16,-0.2 16,-0.1 -0.959 47.6 -79.9-175.1 163.0 54.6 46.0 48.0 271 271 A P - 0 0 73 0, 0.0 65,-0.4 0, 0.0 66,-0.1 -0.335 50.2-101.6 -72.4 156.4 54.5 43.3 50.7 272 272 A K - 0 0 115 62,-0.1 62,-0.2 1,-0.1 61,-0.1 -0.401 42.8 -96.2 -74.2 152.0 57.0 40.5 51.0 273 273 A A - 0 0 1 60,-3.2 2,-0.3 59,-0.3 115,-0.2 -0.361 48.3-158.9 -65.0 153.2 56.1 37.1 49.7 274 274 A T E > -Q 387 0H 52 113,-2.0 113,-2.9 -3,-0.1 3,-2.5 -0.951 27.3 -87.3-139.4 150.4 54.9 34.9 52.6 275 275 A Y E 3 S-Q 386 0H 104 -2,-0.3 111,-0.2 1,-0.3 5,-0.1 -0.432 118.6 -1.8 -57.7 125.9 54.6 31.1 53.3 276 276 A H T >> S+ 0 0 25 109,-0.6 4,-2.8 107,-0.2 3,-1.3 0.763 93.7 146.7 58.0 28.5 51.2 30.0 51.9 277 277 A G H <> + 0 0 3 -3,-2.5 4,-1.1 1,-0.3 112,-0.2 0.887 57.4 65.5 -61.7 -41.6 50.8 33.7 51.0 278 278 A N H 34 S+ 0 0 15 -4,-0.3 -1,-0.3 1,-0.2 110,-0.1 0.698 118.0 26.5 -57.9 -17.5 48.8 32.9 47.9 279 279 A I H <4 S+ 0 0 72 -3,-1.3 -2,-0.2 108,-0.1 -1,-0.2 0.766 118.1 52.3-113.2 -41.1 46.0 31.6 50.2 280 280 A D H < S+ 0 0 103 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.404 114.2 48.0 -77.0 2.3 46.3 33.3 53.6 281 281 A K S < S- 0 0 112 -4,-1.1 108,-0.1 -5,-0.2 3,-0.1 -0.998 82.5-110.5-147.2 151.9 46.3 36.7 51.8 282 282 A P - 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0 0 0 -3,-1.1 5,-2.9 -4,-0.9 3,-1.5 -0.370 65.4-137.4 -60.8 126.2 30.5 9.8 24.5 631 183 B L G > 5S+ 0 0 39 1,-0.3 3,-1.0 3,-0.2 35,-0.2 0.773 105.7 59.0 -56.1 -28.6 29.9 7.6 21.4 632 184 B E G 3 5S+ 0 0 76 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.809 106.0 49.4 -70.1 -31.0 26.7 6.4 23.1 633 185 B K G < 5S- 0 0 125 -3,-1.5 -1,-0.3 -6,-0.3 -2,-0.2 -0.218 129.5 -95.6-100.4 38.8 25.5 10.0 23.2 634 186 B G T < 5S+ 0 0 75 -3,-1.0 -3,-0.2 1,-0.2 -2,-0.1 0.531 79.6 150.1 61.9 2.9 26.3 10.6 19.6 635 187 B G < - 0 0 7 -5,-2.9 -6,-0.2 -8,-0.3 -1,-0.2 -0.238 61.8-112.0 -63.6 158.8 29.6 12.0 20.8 636 188 B K - 0 0 97 -8,-0.3 2,-0.2 1,-0.2 -6,-0.1 0.690 67.8 -97.7 -66.4 -20.6 32.5 11.7 18.4 637 189 B G - 0 0 0 -8,-2.2 -1,-0.2 -27,-0.1 -27,-0.2 -0.577 41.2 -56.8 126.8 169.1 34.2 9.2 20.7 638 190 B S > - 0 0 0 -2,-0.2 4,-2.8 -3,-0.1 5,-0.3 -0.318 63.1 -92.9 -75.7 168.4 36.9 8.8 23.5 639 191 B I H > S+ 0 0 0 -23,-2.7 4,-2.0 1,-0.2 -21,-0.2 0.934 129.8 45.3 -49.1 -50.4 40.5 9.9 22.9 640 192 B T H > S+ 0 0 0 -23,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.918 110.7 52.5 -61.9 -45.0 41.3 6.4 21.8 641 193 B E H > S+ 0 0 9 -24,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.916 112.2 45.2 -59.2 -41.5 38.2 6.0 19.6 642 194 B Q H X S+ 0 0 8 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.822 106.7 61.7 -70.2 -29.5 39.1 9.3 17.8 643 195 B L H X S+ 0 0 5 -4,-2.0 4,-1.0 -5,-0.3 5,-0.3 0.975 107.0 44.0 -58.0 -55.5 42.7 8.1 17.5 644 196 B L H < S+ 0 0 0 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.847 113.8 51.3 -59.6 -36.3 41.5 5.1 15.5 645 197 B N H < S+ 0 0 75 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.896 100.9 61.9 -68.3 -40.5 39.3 7.4 13.4 646 198 B A H < S- 0 0 16 -4,-3.0 -1,-0.2 -38,-0.1 -2,-0.2 0.749 86.1-160.9 -56.2 -32.2 42.1 9.8 12.7 647 199 B R < - 0 0 30 -4,-1.0 2,-0.3 -3,-0.4 -3,-0.1 0.917 7.7-169.8 46.2 68.8 44.0 7.1 10.8 648 200 B A - 0 0 1 -5,-0.3 55,-0.2 1,-0.1 -1,-0.1 -0.700 27.9-126.4 -85.1 139.6 47.5 8.6 10.8 649 201 B D S S+ 0 0 10 -58,-0.5 54,-3.2 -2,-0.3 2,-0.5 0.930 98.3 28.1 -51.7 -48.8 49.9 6.6 8.6 650 202 B V E +ab 592 703J 0 -59,-1.9 -57,-2.5 52,-0.2 2,-0.4 -0.972 65.7 165.1-123.3 124.7 52.3 6.2 11.4 651 203 B T E +ab 593 704J 3 52,-0.8 54,-2.7 -2,-0.5 2,-0.4 -0.974 11.3 168.8-134.9 117.7 51.3 6.1 15.1 652 204 B L E +ab 594 705J 0 -59,-2.5 -57,-1.9 -2,-0.4 2,-0.3 -0.999 23.8 83.6-135.6 134.9 53.9 4.8 17.6 653 205 B G E - b 0 706J 0 52,-2.3 54,-1.6 -2,-0.4 55,-0.3 -0.977 65.4 -72.8 163.6-171.5 53.9 4.9 21.4 654 206 B G E S+a 598 0J 0 -57,-1.8 -55,-1.4 -2,-0.3 57,-0.2 0.130 71.3 97.7 -93.1-150.8 52.7 3.2 24.6 655 207 B G + 0 0 0 55,-2.9 4,-0.5 -57,-0.3 3,-0.3 0.839 30.3 149.0 74.8 37.3 49.2 3.1 26.2 656 208 B A > + 0 0 8 52,-3.0 3,-0.6 54,-0.2 4,-0.5 0.727 57.5 84.1 -72.3 -18.6 47.9 -0.3 24.9 657 209 B K G > S+ 0 0 132 52,-1.7 3,-2.2 1,-0.3 4,-0.4 0.925 89.7 44.4 -50.1 -59.3 46.0 -0.5 28.2 658 210 B T G > S+ 0 0 8 51,-0.3 3,-1.5 -3,-0.3 15,-0.3 0.775 99.6 72.4 -60.9 -23.0 43.0 1.5 27.0 659 211 B F G < S+ 0 0 1 -3,-0.6 15,-1.8 -4,-0.5 -1,-0.3 0.649 88.5 63.4 -67.5 -10.4 43.0 -0.4 23.7 660 212 B A G < S+ 0 0 67 -3,-2.2 -1,-0.3 -4,-0.5 -2,-0.2 0.750 82.0 105.3 -80.7 -26.2 41.7 -3.3 25.7 661 213 B E S < S- 0 0 47 -3,-1.5 12,-3.0 -4,-0.4 2,-0.4 -0.109 70.6-128.6 -52.5 152.5 38.6 -1.3 26.4 662 214 B T B -I 672 0N 59 10,-0.3 10,-0.3 11,-0.1 -42,-0.1 -0.873 18.3-110.4-113.2 141.4 35.5 -2.3 24.5 663 215 B A - 0 0 3 8,-2.5 7,-2.1 5,-0.4 3,-0.1 -0.310 15.4-159.6 -66.4 150.2 33.2 -0.1 22.4 664 216 B T S S- 0 0 58 5,-0.2 2,-0.3 6,-0.1 -1,-0.1 0.345 73.0 -4.4-111.7 3.6 29.7 0.6 23.7 665 217 B A S > S+ 0 0 20 3,-0.1 3,-0.5 0, 0.0 -33,-0.1 -0.879 85.3 80.7-168.5-164.7 28.2 1.7 20.3 666 218 B G G > S- 0 0 47 -2,-0.3 3,-1.8 -35,-0.2 -34,-0.0 0.094 98.8 -54.3 73.1 172.0 29.2 2.4 16.7 667 219 B E G 3 S+ 0 0 180 1,-0.3 -1,-0.2 2,-0.0 0, 0.0 0.453 139.8 50.3 -65.0 2.3 29.6 -0.2 13.9 668 220 B W G X S+ 0 0 85 -3,-0.5 3,-1.6 3,-0.1 -5,-0.4 -0.011 76.7 155.7-129.5 29.0 32.1 -1.9 16.3 669 221 B Q T < + 0 0 128 -3,-1.8 -5,-0.2 1,-0.2 3,-0.1 -0.066 68.6 17.2 -54.1 154.0 30.2 -2.2 19.5 670 222 B G T 3 S+ 0 0 46 -7,-2.1 2,-0.4 1,-0.2 -1,-0.2 0.325 101.4 111.6 66.3 -15.2 31.2 -5.0 21.9 671 223 B K S < S- 0 0 85 -3,-1.6 -8,-2.5 1,-0.1 -1,-0.2 -0.745 75.6-113.9 -91.0 138.4 34.5 -5.3 20.1 672 224 B T B > -I 662 0N 35 -2,-0.4 4,-2.4 -10,-0.3 -10,-0.3 -0.364 27.6-112.1 -66.6 153.9 37.6 -4.1 22.0 673 225 B L H > S+ 0 0 0 -12,-3.0 4,-1.8 -15,-0.3 -13,-0.2 0.779 119.6 53.9 -59.5 -27.0 39.4 -1.1 20.5 674 226 B R H > S+ 0 0 93 -15,-1.8 4,-2.2 -13,-0.3 -1,-0.2 0.926 107.3 48.8 -71.9 -46.1 42.3 -3.2 19.5 675 227 B E H > S+ 0 0 86 -16,-0.3 4,-3.1 1,-0.2 -2,-0.2 0.912 111.7 51.7 -57.2 -42.8 40.1 -5.7 17.6 676 228 B Q H X S+ 0 0 5 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.890 104.9 55.5 -60.0 -44.6 38.5 -2.6 16.0 677 229 B A H >X>S+ 0 0 0 -4,-1.8 5,-2.2 2,-0.2 4,-0.6 0.965 114.0 40.2 -53.8 -53.9 42.0 -1.3 15.0 678 230 B E H ><5S+ 0 0 108 -4,-2.2 3,-1.7 1,-0.3 -2,-0.2 0.939 113.2 52.9 -62.2 -50.7 42.8 -4.6 13.2 679 231 B A H 3<5S+ 0 0 73 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.732 108.5 54.2 -58.4 -22.5 39.3 -5.0 11.7 680 232 B R H <<5S- 0 0 55 -4,-1.6 -1,-0.3 -3,-0.5 -2,-0.2 0.582 128.1 -91.6 -90.5 -9.4 39.7 -1.4 10.3 681 233 B G T <<5S+ 0 0 27 -3,-1.7 -3,-0.2 -4,-0.6 -2,-0.1 0.289 75.8 143.3 119.9 -10.3 43.0 -2.0 8.5 682 234 B Y < - 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