==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-NOV-01 1KHL . COMPND 2 MOLECULE: ALKALINE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.H.LE DU,C.LAMOURE,B.H.MULLER,O.V.BULGAKOV,E.LAJEUNESSE, . 888 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26673.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 581 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 94 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 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 . 46 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 204 23.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.8 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 0 4 8 2 0 2 3 3 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 2 6 0 6 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 . 8 6 4 0 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 6 A V 0 0 20 0, 0.0 2,-0.3 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 151.6 98.4 100.1 58.9 2 7 A L - 0 0 46 70,-0.2 3,-0.1 25,-0.1 18,-0.0 -0.859 360.0-146.6 179.1 147.7 100.6 99.4 61.8 3 8 A E S S+ 0 0 68 -2,-0.3 2,-0.6 1,-0.2 68,-0.1 0.685 88.0 59.4 -99.5 -24.9 104.3 98.6 62.2 4 9 A N + 0 0 85 1,-0.1 -1,-0.2 15,-0.1 17,-0.1 -0.906 49.6 160.5-111.9 110.6 104.0 96.2 65.2 5 10 A R + 0 0 7 -2,-0.6 2,-0.2 -3,-0.1 15,-0.1 -0.034 34.9 122.6-114.8 26.4 101.9 93.2 64.6 6 11 A A S S- 0 0 20 13,-0.2 59,-0.2 1,-0.1 60,-0.1 -0.540 78.7 -78.6 -85.1 158.9 103.2 91.0 67.4 7 12 A A - 0 0 20 57,-3.2 10,-0.2 -2,-0.2 12,-0.2 -0.233 42.0-128.4 -52.9 145.0 100.8 89.6 70.1 8 13 A Q - 0 0 74 10,-1.6 9,-0.2 7,-0.3 8,-0.2 0.890 65.6 -53.9 -68.4 -40.6 100.0 92.4 72.5 9 14 A G S S+ 0 0 50 7,-2.7 2,-1.0 9,-0.1 -2,-0.1 -0.278 107.5 21.1-157.9-116.2 100.8 90.5 75.7 10 15 A N > - 0 0 90 1,-0.2 3,-2.4 4,-0.1 6,-0.4 -0.687 56.5-156.1 -80.3 105.5 100.0 87.2 77.5 11 16 A I T 3 S+ 0 0 31 -2,-1.0 543,-0.6 5,-0.3 6,-0.3 0.628 90.8 59.2 -60.3 -11.3 98.7 85.0 74.7 12 17 A T T 3 S+ 0 0 19 4,-0.1 552,-0.3 541,-0.1 -1,-0.3 0.546 97.5 76.8 -92.4 -7.7 96.7 82.9 77.3 13 18 A A S X> S- 0 0 32 -3,-2.4 3,-2.4 1,-0.1 4,-0.5 -0.699 99.6 -80.5-103.8 156.0 94.8 85.9 78.4 14 19 A P T 34 S+ 0 0 72 0, 0.0 539,-0.2 0, 0.0 -4,-0.1 -0.276 116.8 0.7 -55.5 123.9 91.8 87.8 76.8 15 20 A G T 34 S+ 0 0 8 537,-2.4 3,-0.5 -4,-0.1 -7,-0.3 0.379 99.8 113.5 78.5 -5.0 93.2 90.1 74.1 16 21 A G T <4 S+ 0 0 8 -3,-2.4 -7,-2.7 -6,-0.4 -5,-0.3 0.776 74.9 49.2 -69.5 -28.8 96.8 89.0 74.7 17 22 A A S < S+ 0 0 1 -4,-0.5 -1,-0.2 535,-0.3 860,-0.2 0.544 83.7 120.5 -88.1 -9.1 97.2 87.4 71.3 18 23 A R - 0 0 68 -3,-0.5 -10,-1.6 534,-0.2 -9,-0.1 -0.180 44.7-167.2 -55.7 147.7 95.8 90.3 69.4 19 24 A R + 0 0 0 -12,-0.2 2,-0.4 855,-0.1 -13,-0.2 0.601 66.8 83.3-109.0 -21.3 98.2 91.9 66.9 20 25 A L - 0 0 4 1,-0.1 -12,-0.1 -15,-0.1 -15,-0.1 -0.707 52.2-172.9 -88.7 134.1 96.0 95.0 66.3 21 26 A T S S- 0 0 88 -2,-0.4 2,-0.2 -17,-0.1 -1,-0.1 0.569 70.5 -27.4 -97.8 -16.7 96.4 97.8 68.8 22 27 A G S S- 0 0 43 846,-0.0 2,-0.5 0, 0.0 -2,-0.0 -0.730 96.0 -33.4-164.0-147.4 93.5 99.8 67.4 23 28 A D - 0 0 67 -2,-0.2 4,-0.5 1,-0.1 3,-0.2 -0.850 37.5-161.7 -98.6 128.4 91.5 100.5 64.2 24 29 A Q > + 0 0 0 -2,-0.5 4,-3.4 1,-0.2 5,-0.3 0.714 67.1 95.7 -79.9 -22.7 93.4 100.3 60.9 25 30 A T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.821 90.9 35.3 -35.6 -60.1 90.8 102.3 58.9 26 31 A A H > S+ 0 0 47 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.912 118.7 51.2 -65.2 -45.6 92.4 105.7 59.1 27 32 A A H > S+ 0 0 35 -4,-0.5 4,-1.0 1,-0.2 -2,-0.2 0.881 113.7 45.6 -58.9 -41.8 95.9 104.4 59.0 28 33 A L H >< S+ 0 0 2 -4,-3.4 3,-0.5 2,-0.2 4,-0.5 0.900 108.2 55.0 -69.3 -42.2 95.1 102.4 55.9 29 34 A R H >< S+ 0 0 82 -4,-2.5 3,-0.6 -5,-0.3 -2,-0.2 0.852 108.8 51.5 -60.0 -31.5 93.3 105.3 54.3 30 35 A N H 3< S+ 0 0 133 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.752 103.7 54.9 -76.9 -27.7 96.5 107.3 54.8 31 36 A S T << S+ 0 0 28 -4,-1.0 2,-1.0 -3,-0.5 387,-0.3 0.470 84.4 101.6 -86.7 1.9 98.9 104.7 53.2 32 37 A L < + 0 0 12 -3,-0.6 2,-0.4 -4,-0.5 -1,-0.1 -0.748 48.0 159.5 -90.5 101.4 96.8 104.7 50.0 33 38 A S - 0 0 38 -2,-1.0 387,-3.0 385,-0.4 389,-0.3 -0.983 31.0-175.4-128.2 132.5 98.6 106.9 47.5 34 39 A D + 0 0 89 -2,-0.4 3,-0.1 385,-0.2 -1,-0.1 0.145 50.1 121.1-107.4 16.2 98.3 106.9 43.7 35 40 A K S S- 0 0 69 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.487 77.8 -86.2 -72.4 152.7 101.1 109.4 43.2 36 41 A P - 0 0 84 0, 0.0 2,-0.3 0, 0.0 405,-0.2 -0.183 36.8-124.0 -62.9 150.5 103.9 108.0 41.1 37 42 A A - 0 0 6 403,-2.9 320,-0.2 1,-0.1 3,-0.1 -0.750 13.1-163.1 -92.5 142.9 106.7 105.9 42.5 38 43 A K S S+ 0 0 66 318,-2.9 274,-0.5 -2,-0.3 2,-0.3 0.743 77.4 21.0 -91.3 -34.7 110.2 107.1 41.9 39 44 A N E -a 357 0A 5 317,-1.6 319,-2.4 272,-0.2 2,-0.4 -0.934 63.9-157.9-132.8 160.4 111.7 103.7 42.8 40 45 A I E -ab 358 313A 0 272,-1.9 274,-2.9 -2,-0.3 2,-0.5 -0.994 3.7-171.4-141.9 128.7 110.6 100.1 43.1 41 46 A I E -ab 359 314A 0 317,-2.5 319,-2.4 -2,-0.4 2,-0.6 -0.990 7.9-169.5-121.1 117.7 112.1 97.3 45.1 42 47 A L E -ab 360 315A 0 272,-2.7 274,-2.7 -2,-0.5 2,-0.5 -0.969 3.9-167.2-110.8 112.4 110.6 93.9 44.4 43 48 A L E -ab 361 316A 0 317,-3.4 319,-1.9 -2,-0.6 2,-0.5 -0.898 3.0-166.6-101.6 131.9 111.7 91.2 46.9 44 49 A I E -ab 362 317A 0 272,-2.9 274,-2.5 -2,-0.5 2,-0.8 -0.976 12.2-158.9-123.0 123.8 111.0 87.6 46.0 45 50 A G E > - b 0 318A 0 317,-2.9 3,-2.0 -2,-0.5 2,-0.5 -0.920 32.9-123.3 -98.9 112.7 111.2 84.8 48.5 46 51 A D T 3 S- 0 0 0 272,-2.6 276,-0.6 -2,-0.8 3,-0.1 -0.465 89.0 -7.7 -62.9 116.2 111.6 81.7 46.2 47 52 A G T 3 S+ 0 0 0 -2,-0.5 2,-1.5 1,-0.2 -1,-0.3 0.659 92.7 151.5 72.8 20.1 108.8 79.3 47.0 48 53 A M < + 0 0 4 -3,-2.0 -1,-0.2 314,-0.1 -3,-0.2 -0.548 14.0 162.6 -88.7 77.2 107.8 81.4 50.0 49 54 A G > - 0 0 2 -2,-1.5 4,-2.2 -3,-0.1 3,-0.4 -0.230 59.0 -84.7 -83.0-179.3 104.1 80.7 50.4 50 55 A D H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 806,-0.6 0.820 129.4 56.0 -54.3 -35.1 102.1 81.5 53.5 51 56 A S H > S+ 0 0 19 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.906 107.6 47.7 -65.4 -43.8 103.1 78.2 55.0 52 57 A E H > S+ 0 0 2 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.891 111.6 50.5 -65.8 -40.1 106.8 79.0 54.6 53 58 A I H X S+ 0 0 2 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.918 113.3 46.2 -63.4 -43.1 106.3 82.4 56.2 54 59 A T H X S+ 0 0 3 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.895 110.5 51.3 -67.3 -43.7 104.4 80.9 59.1 55 60 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.926 112.6 45.6 -60.2 -46.9 106.9 78.1 59.8 56 61 A A H X>S+ 0 0 1 -4,-2.0 4,-3.3 2,-0.2 5,-0.5 0.867 113.9 49.0 -65.2 -39.7 109.9 80.5 59.9 57 62 A R H X>S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 5,-2.0 0.951 110.5 50.8 -65.9 -47.7 108.0 83.0 62.1 58 63 A N H <5S+ 0 0 5 -4,-2.9 330,-0.7 3,-0.2 331,-0.5 0.899 120.0 37.5 -56.0 -39.9 107.0 80.2 64.5 59 64 A Y H <5S+ 0 0 19 -4,-2.1 329,-1.0 -5,-0.2 -2,-0.2 0.941 127.6 28.9 -75.7 -57.5 110.6 79.2 64.7 60 65 A A H <5S+ 0 0 25 -4,-3.3 -3,-0.2 -5,-0.1 -2,-0.2 0.831 140.1 14.8 -75.9 -40.1 112.5 82.4 64.6 61 66 A E T < < - 0 0 0 -5,-2.0 3,-2.2 -6,-0.2 -3,-0.2 0.090 38.7 -72.9 92.3 154.0 107.5 82.5 67.8 63 68 A A T 3 S+ 0 0 0 -5,-0.3 -1,-0.1 1,-0.3 -5,-0.1 0.868 135.5 38.5 -46.9 -48.0 103.8 82.0 67.0 64 69 A G T 3 S+ 0 0 14 -6,-0.1 -57,-3.2 -3,-0.1 -1,-0.3 0.284 102.1 93.3 -90.8 8.1 102.9 85.4 68.4 65 70 A G < - 0 0 12 -3,-2.2 2,-0.3 -59,-0.2 -3,-0.1 -0.126 63.7-139.7 -86.2-170.8 105.9 87.2 67.1 66 71 A F - 0 0 20 -5,-0.1 2,-0.7 -60,-0.1 -60,-0.1 -0.990 17.5-112.2-157.6 140.7 106.3 89.0 63.8 67 72 A F > - 0 0 2 -2,-0.3 4,-1.6 1,-0.2 5,-0.3 -0.723 23.4-150.3 -75.3 114.9 108.8 89.5 61.0 68 73 A K T 4 S+ 0 0 115 -2,-0.7 -1,-0.2 3,-0.2 274,-0.0 0.627 95.0 27.0 -60.3 -17.3 109.8 93.1 61.3 69 74 A G T >4 S+ 0 0 0 2,-0.0 3,-1.3 279,-0.0 4,-0.2 0.747 127.4 36.6-106.7 -69.8 110.4 93.1 57.5 70 75 A I G >4 S+ 0 0 0 1,-0.3 3,-0.5 2,-0.1 -2,-0.1 0.813 122.7 42.4 -54.9 -40.0 108.2 90.5 55.9 71 76 A D G 3< S+ 0 0 5 -4,-1.6 801,-0.4 1,-0.2 -1,-0.3 0.461 99.0 75.9 -89.4 -2.2 105.1 91.0 58.1 72 77 A A G < + 0 0 9 -3,-1.3 -70,-0.2 -5,-0.3 -1,-0.2 0.364 60.2 107.9 -92.5 2.9 105.3 94.8 58.2 73 78 A L < - 0 0 2 -3,-0.5 344,-0.1 -4,-0.2 799,-0.1 -0.745 57.0-155.1 -83.3 119.7 103.9 95.6 54.7 74 79 A P S S+ 0 0 12 0, 0.0 2,-0.7 0, 0.0 343,-0.2 0.794 71.7 67.9 -63.2 -39.6 100.4 97.1 55.3 75 80 A L E +C 416 0A 3 341,-1.8 341,-2.7 795,-0.1 2,-0.3 -0.812 68.4 175.8 -93.6 117.2 98.7 96.3 52.0 76 81 A T E +C 415 0A 0 -2,-0.7 350,-0.8 445,-0.5 445,-0.5 -0.838 11.4 147.0-122.2 156.4 98.1 92.6 51.5 77 82 A G E -Cd 414 426A 0 337,-1.8 337,-1.8 -2,-0.3 2,-0.4 -0.878 38.6-107.8-164.2-174.1 96.4 90.3 49.0 78 83 A Q E -Cd 413 427A 1 348,-1.8 350,-1.5 -2,-0.2 2,-0.3 -0.990 31.1-163.8-130.6 139.7 96.7 86.8 47.4 79 84 A Y E -Cd 412 428A 0 333,-2.5 333,-1.7 -2,-0.4 2,-0.3 -0.938 14.9-126.2-132.9 152.1 97.7 86.2 43.9 80 85 A T E + d 0 429A 4 348,-1.9 350,-2.0 -2,-0.3 351,-0.2 -0.682 18.3 179.8 -91.4 150.2 97.5 83.4 41.3 81 86 A H + 0 0 3 328,-0.3 14,-0.2 -2,-0.3 22,-0.1 0.097 19.0 154.4-139.7 26.1 100.5 82.0 39.5 82 87 A Y - 0 0 9 426,-0.1 11,-0.2 327,-0.1 2,-0.1 -0.236 30.8-145.6 -59.4 141.9 99.4 79.2 37.2 83 88 A A E -J 92 0B 2 9,-2.4 9,-2.4 26,-0.1 2,-0.3 -0.189 17.2-108.0 -92.2-169.3 101.6 78.6 34.1 84 89 A L E -Jk 91 111B 1 26,-2.1 28,-0.5 7,-0.3 2,-0.4 -0.937 20.0-117.4-125.5 151.2 100.5 77.5 30.6 85 90 A N > - 0 0 50 5,-2.8 4,-2.0 -2,-0.3 5,-0.1 -0.731 25.0-140.3 -82.6 132.4 100.9 74.2 28.9 86 91 A K T 4 S+ 0 0 77 -2,-0.4 -1,-0.1 2,-0.2 25,-0.1 0.847 95.5 40.5 -64.2 -40.5 103.0 74.9 25.7 87 92 A K T 4 S+ 0 0 181 1,-0.1 -1,-0.1 3,-0.1 -2,-0.0 0.989 128.6 26.2 -68.4 -67.8 101.1 72.6 23.4 88 93 A T T 4 S- 0 0 75 1,-0.1 -2,-0.2 2,-0.1 -1,-0.1 0.677 87.5-136.7 -72.6 -26.2 97.5 73.3 24.5 89 94 A G < + 0 0 14 -4,-2.0 -3,-0.1 1,-0.3 -1,-0.1 0.615 62.4 133.1 74.9 7.9 97.8 76.8 25.8 90 95 A K - 0 0 92 1,-0.1 -5,-2.8 -5,-0.1 -1,-0.3 -0.609 67.8 -77.6 -87.8 156.9 95.6 75.5 28.7 91 96 A P E -J 84 0B 10 0, 0.0 2,-0.6 0, 0.0 -7,-0.3 -0.079 31.0-154.8 -57.1 145.1 96.5 76.3 32.3 92 97 A D E -J 83 0B 34 -9,-2.4 -9,-2.4 -3,-0.1 746,-0.1 -0.986 14.4-150.6-119.3 107.5 99.2 74.3 34.0 93 98 A Y S S+ 0 0 8 -2,-0.6 2,-0.5 744,-0.3 -12,-0.2 0.654 79.0 53.0 -59.2 -20.5 98.3 74.6 37.7 94 99 A V S S- 0 0 12 -12,-0.1 -1,-0.2 723,-0.1 315,-0.1 -0.936 74.5-163.5-123.6 108.3 101.8 74.4 39.1 95 100 A T - 0 0 2 -2,-0.5 2,-0.2 -14,-0.2 312,-0.1 -0.346 9.6-137.5 -84.7 163.9 104.4 76.8 37.7 96 101 A D > - 0 0 21 -2,-0.1 4,-1.5 311,-0.0 5,-0.2 -0.531 40.2 -89.1-107.2-178.8 108.2 76.6 38.0 97 102 A S H > S+ 0 0 4 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.818 121.2 53.6 -61.8 -37.8 110.5 79.6 38.7 98 103 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 18,-0.3 0.941 107.9 45.2 -66.0 -53.4 110.9 80.5 35.0 99 104 A A H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.885 117.9 45.1 -63.1 -36.4 107.3 80.8 33.9 100 105 A S H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 5,-0.2 0.929 111.6 50.4 -74.5 -41.5 106.3 82.8 37.0 101 106 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.877 110.3 52.5 -60.6 -38.4 109.3 85.1 36.9 102 107 A T H X>S+ 0 0 0 -4,-2.1 4,-1.4 12,-0.3 5,-0.5 0.875 105.2 57.4 -64.3 -38.0 108.5 85.7 33.2 103 108 A A H X5S+ 0 0 1 -4,-1.4 4,-2.5 3,-0.2 331,-0.2 0.929 111.1 37.4 -61.3 -51.5 104.9 86.6 34.2 104 109 A W H <5S+ 0 0 1 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.793 121.7 45.3 -75.8 -24.7 105.7 89.5 36.7 105 110 A S H <5S+ 0 0 0 -4,-1.6 22,-1.7 -5,-0.2 -1,-0.2 0.628 130.1 22.9 -92.2 -10.2 108.6 90.8 34.6 106 111 A T H <5S- 0 0 9 -4,-1.4 -3,-0.2 20,-0.2 -2,-0.2 0.690 91.2-127.9-123.6 -33.8 106.7 90.6 31.3 107 112 A G S < -k 84 0B 22 -2,-0.3 3,-1.8 -28,-0.2 2,-0.2 -0.527 57.8 -83.6 -87.4 158.7 105.1 77.6 29.9 112 117 A N T 3 S+ 0 0 53 -28,-0.5 -1,-0.1 1,-0.2 3,-0.1 -0.406 115.5 26.3 -63.9 126.3 107.3 76.1 32.6 113 118 A G T 3 S+ 0 0 11 1,-0.4 48,-2.1 -2,-0.2 -1,-0.2 0.195 91.2 124.7 107.5 -14.2 111.0 76.5 31.7 114 119 A A < - 0 0 0 -3,-1.8 2,-0.5 46,-0.2 -1,-0.4 -0.573 41.7-162.3 -85.1 141.5 110.6 79.6 29.6 115 120 A L B S-L 158 0C 0 43,-2.5 43,-2.1 -2,-0.2 -16,-0.1 -0.974 71.8 -20.4-125.2 113.8 112.5 82.8 30.2 116 121 A G S S+ 0 0 0 -2,-0.5 8,-1.6 -18,-0.3 2,-0.3 0.617 112.0 96.5 69.3 15.2 111.3 86.0 28.6 117 122 A V B -M 123 0D 0 41,-0.3 6,-0.2 6,-0.2 -6,-0.2 -0.985 66.1-130.0-137.4 145.7 109.2 84.4 25.9 118 123 A D > - 0 0 3 4,-2.3 3,-2.0 -2,-0.3 -8,-0.2 -0.040 50.5 -78.4 -78.3-171.9 105.5 83.6 25.6 119 124 A I T 3 S+ 0 0 17 -10,-0.4 -9,-0.1 338,-0.4 -1,-0.1 0.663 133.0 58.2 -68.0 -11.2 104.2 80.1 24.6 120 125 A H T 3 S- 0 0 106 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.317 118.6-112.5 -94.7 2.8 105.0 80.9 20.9 121 126 A E < + 0 0 93 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.682 69.1 148.2 73.2 16.0 108.6 81.5 21.8 122 127 A K - 0 0 117 1,-0.1 -4,-2.3 0, 0.0 -1,-0.3 -0.689 47.7-118.5 -85.2 139.6 108.2 85.2 21.1 123 128 A D B -M 117 0D 65 -2,-0.3 -6,-0.2 -6,-0.2 -7,-0.1 -0.426 27.4-171.7 -76.2 144.7 110.3 87.6 23.1 124 129 A H - 0 0 35 -8,-1.6 -17,-0.1 -2,-0.1 -16,-0.1 -0.997 31.2-103.0-137.6 138.5 108.6 90.3 25.3 125 130 A P - 0 0 74 0, 0.0 2,-0.2 0, 0.0 30,-0.1 -0.370 33.6-134.7 -64.2 140.2 110.4 93.1 27.0 126 131 A T > - 0 0 0 28,-0.2 4,-1.9 1,-0.1 3,-0.2 -0.590 23.2-109.7 -91.3 159.1 111.0 92.8 30.8 127 132 A I H > S+ 0 0 0 -22,-1.7 4,-1.9 1,-0.2 5,-0.1 0.780 119.1 56.7 -58.6 -30.1 110.3 95.5 33.3 128 133 A L H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.941 106.0 48.9 -68.5 -46.1 114.1 95.9 33.8 129 134 A E H > S+ 0 0 60 25,-0.4 4,-2.0 -3,-0.2 -2,-0.2 0.902 113.1 48.6 -60.1 -38.4 114.7 96.6 30.1 130 135 A M H X S+ 0 0 34 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.849 110.9 49.5 -70.9 -35.2 111.8 99.1 30.2 131 136 A A H <>S+ 0 0 0 -4,-1.9 5,-1.9 2,-0.2 4,-0.3 0.913 111.3 48.9 -69.4 -41.9 113.2 100.9 33.3 132 137 A K H ><5S+ 0 0 61 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.876 108.6 54.2 -64.9 -37.4 116.7 101.1 31.7 133 138 A A H 3<5S+ 0 0 87 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.798 105.5 53.2 -67.3 -30.4 115.2 102.5 28.6 134 139 A A T 3<5S- 0 0 53 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.474 124.3-101.9 -84.7 -0.6 113.5 105.2 30.5 135 140 A G T < 5S+ 0 0 29 -3,-1.1 175,-0.3 -4,-0.3 -3,-0.2 0.333 76.2 137.3 100.4 -7.8 116.7 106.3 32.2 136 141 A L < - 0 0 18 -5,-1.9 -1,-0.3 -6,-0.2 2,-0.3 -0.272 58.2-110.5 -70.8 156.8 116.2 104.6 35.6 137 142 A A E -e 312 0A 4 174,-2.7 176,-2.3 168,-0.2 2,-0.4 -0.665 35.4-149.4 -84.3 147.5 119.0 102.7 37.3 138 143 A T E -e 313 0A 0 -2,-0.3 59,-2.0 174,-0.2 58,-0.6 -0.972 15.4-176.8-128.6 135.6 118.5 98.9 37.5 139 144 A G E -ef 314 197A 0 174,-2.5 176,-1.5 -2,-0.4 2,-0.4 -0.937 7.5-174.4-128.3 153.6 119.6 96.3 40.0 140 145 A N E +ef 315 198A 0 57,-2.3 59,-2.1 -2,-0.3 2,-0.4 -0.921 14.1 170.0-148.9 105.9 119.3 92.5 40.1 141 146 A V E +ef 316 199A 0 174,-3.2 176,-1.5 -2,-0.4 2,-0.3 -0.954 3.0 156.6-125.6 146.4 120.4 90.6 43.2 142 147 A S E -e 317 0A 0 57,-1.7 176,-0.2 -2,-0.4 59,-0.1 -0.975 43.5-133.4-159.8 153.3 119.9 87.0 44.2 143 148 A T E S+ 0 0 5 174,-1.5 116,-2.3 -2,-0.3 2,-0.1 0.416 89.9 73.9 -90.4 -0.3 121.5 84.4 46.5 144 149 A A E S- 0 0 0 114,-0.2 57,-2.5 173,-0.2 -2,-0.2 -0.362 105.8 -64.2 -99.7-176.8 121.3 81.9 43.7 145 150 A E E > - f 0 201A 23 55,-0.2 3,-1.2 1,-0.1 57,-0.3 -0.399 46.3-126.2 -62.4 148.0 123.3 81.5 40.5 146 151 A L T 3 S+ 0 0 0 55,-1.3 -1,-0.1 1,-0.2 56,-0.1 0.770 110.9 65.1 -69.6 -22.2 122.7 84.6 38.3 147 152 A Q T 3 S+ 0 0 0 4,-0.1 -1,-0.2 5,-0.1 55,-0.1 0.603 81.3 117.1 -77.5 1.1 121.7 82.2 35.5 148 153 A H S <> S- 0 0 3 -3,-1.2 4,-2.7 1,-0.1 5,-0.2 -0.288 81.5-108.1 -74.5 146.8 118.5 81.0 37.7 149 154 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.742 110.1 55.1 -43.2 -48.1 115.4 81.7 36.3 150 155 A T H 4 S+ 0 0 1 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.972 118.1 32.1 -62.8 -57.0 114.3 84.5 38.7 151 156 A P H >4 S+ 0 0 0 0, 0.0 3,-1.2 0, 0.0 4,-0.4 0.934 119.6 55.5 -67.8 -34.1 117.2 86.8 38.2 152 157 A A H >X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 3,-1.3 0.810 92.2 70.9 -64.3 -31.3 117.7 85.7 34.6 153 158 A A T 3< S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.3 -3,-0.1 0.695 93.0 57.3 -59.6 -24.0 114.1 86.5 33.5 154 159 A L T <4 S+ 0 0 0 -3,-1.2 -25,-0.4 -4,-0.4 -1,-0.3 0.763 123.3 20.5 -79.9 -22.8 114.8 90.2 33.8 155 160 A V T <4 S+ 0 0 4 -3,-1.3 2,-0.3 -4,-0.4 38,-0.2 0.475 112.2 69.7-125.0 -7.4 117.6 90.1 31.3 156 161 A A < - 0 0 0 -4,-2.3 2,-0.5 2,-0.1 30,-0.1 -0.896 47.7-163.1-124.5 150.6 117.3 87.0 29.2 157 162 A H + 0 0 6 -2,-0.3 2,-0.3 27,-0.2 -41,-0.2 -0.880 35.5 150.0-130.0 93.4 115.0 85.7 26.5 158 163 A V B -L 115 0C 0 -43,-2.1 -43,-2.5 -2,-0.5 -41,-0.3 -0.920 48.5-139.1-129.6 149.3 115.5 82.0 26.3 159 164 A T S S+ 0 0 28 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.645 94.9 33.1 -80.5 -18.7 113.3 79.1 25.3 160 165 A S S > S- 0 0 22 -46,-0.1 3,-2.2 -45,-0.1 -1,-0.2 -0.971 71.3-139.7-141.8 127.5 114.7 76.8 28.1 161 166 A R T 3 S+ 0 0 62 -48,-2.1 -47,-0.1 -2,-0.3 25,-0.1 0.659 98.1 73.2 -58.4 -15.0 115.9 77.9 31.5 162 167 A K T 3 + 0 0 116 1,-0.2 2,-1.9 -49,-0.2 3,-0.3 0.535 65.8 98.2 -79.3 -6.3 118.8 75.4 31.2 163 168 A a < + 0 0 0 -3,-2.2 23,-2.4 1,-0.2 -1,-0.2 -0.362 42.8 148.7 -84.6 64.0 120.6 77.5 28.6 164 169 A Y + 0 0 50 -2,-1.9 23,-2.5 21,-0.2 24,-0.2 0.914 62.9 1.2 -59.8 -58.5 123.0 79.0 31.1 165 170 A G S >> S- 0 0 0 -3,-0.3 4,-2.3 21,-0.2 3,-0.5 -0.696 92.8 -74.3-125.5-175.4 126.1 79.5 29.0 166 171 A P H 3> S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 13,-0.1 0.843 124.5 50.3 -46.9 -48.1 127.3 79.1 25.4 167 172 A S H 3> S+ 0 0 66 2,-0.2 4,-1.0 1,-0.2 5,-0.1 0.831 112.7 42.9 -66.1 -39.8 127.6 75.3 25.6 168 173 A A H <> S+ 0 0 16 -3,-0.5 4,-2.8 1,-0.2 5,-0.4 0.895 113.6 54.3 -74.4 -38.0 124.2 74.5 27.1 169 174 A T H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 8,-0.4 0.834 101.0 57.8 -63.9 -37.3 122.6 77.0 24.7 170 175 A S H < S+ 0 0 36 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.895 118.6 31.5 -61.7 -40.9 124.0 75.4 21.6 171 176 A Q H < S+ 0 0 146 -4,-1.0 -2,-0.2 -3,-0.2 -1,-0.2 0.838 133.3 27.0 -87.7 -33.8 122.4 72.0 22.4 172 177 A K H < S+ 0 0 91 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.703 131.8 28.0-102.9 -26.1 119.2 73.1 24.2 173 178 A a >X + 0 0 0 -4,-1.8 3,-1.9 -5,-0.4 4,-1.3 -0.485 66.6 158.1-133.3 62.1 118.4 76.6 22.8 174 179 A P T 34 S+ 0 0 61 0, 0.0 8,-0.2 0, 0.0 6,-0.2 0.829 73.7 59.4 -56.8 -33.3 119.9 76.5 19.3 175 180 A G T 34 S+ 0 0 65 1,-0.2 8,-0.2 -3,-0.1 -5,-0.1 0.661 113.1 40.3 -70.4 -14.2 117.6 79.2 18.1 176 181 A N T <4 S+ 0 0 15 -3,-1.9 8,-2.5 -7,-0.3 -1,-0.2 0.567 87.1 121.8-104.0 -17.4 119.1 81.4 20.8 177 182 A A <> - 0 0 0 -4,-1.3 5,-2.8 -8,-0.4 3,-0.2 -0.192 65.9-134.9 -51.6 130.7 122.7 80.1 20.3 178 183 A L T > 5S+ 0 0 46 1,-0.2 3,-1.8 3,-0.2 -1,-0.1 0.914 106.5 52.8 -56.3 -44.6 124.9 83.0 19.5 179 184 A E T 3 5S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.2 34,-0.1 0.857 105.4 56.8 -59.3 -36.7 126.6 81.0 16.6 180 185 A K T 3 5S- 0 0 125 -6,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.308 128.2 -96.8 -78.5 8.5 123.1 80.3 15.2 181 186 A G T < 5S+ 0 0 71 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.2 0.590 83.4 134.6 86.8 9.7 122.3 84.0 15.0 182 187 A G S - 0 0 0 -2,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.022 64.3 -96.4 -66.7 176.1 122.9 82.3 26.4 186 191 A I H > S+ 0 0 0 -23,-2.4 4,-2.4 2,-0.2 -21,-0.2 0.970 127.1 47.8 -59.5 -51.2 121.4 83.6 29.7 187 192 A T H > S+ 0 0 0 -23,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.881 112.5 48.7 -58.3 -42.7 124.9 84.7 30.8 188 193 A E H > S+ 0 0 4 -24,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.899 112.6 47.0 -68.0 -37.6 125.6 86.4 27.5 189 194 A Q H X S+ 0 0 10 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.825 109.2 55.5 -72.8 -28.8 122.2 88.2 27.5 190 195 A L H X S+ 0 0 4 -4,-2.4 4,-1.2 -5,-0.2 5,-0.4 0.953 108.6 47.8 -64.5 -47.1 122.8 89.2 31.1 191 196 A L H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.832 114.1 47.5 -60.5 -36.9 126.2 90.8 30.0 192 197 A N H < S+ 0 0 81 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.913 102.6 61.8 -71.3 -44.7 124.4 92.6 27.1 193 198 A A H < S- 0 0 20 -4,-2.6 -1,-0.2 -38,-0.2 -2,-0.2 0.820 87.2-161.2 -50.7 -38.9 121.5 93.9 29.3 194 199 A R < - 0 0 45 -4,-1.2 2,-0.1 1,-0.1 -56,-0.1 0.925 8.6-171.5 54.0 58.6 124.0 95.8 31.3 195 200 A A - 0 0 2 -5,-0.4 3,-0.1 1,-0.1 -1,-0.1 -0.512 31.1-119.4 -73.4 151.9 122.0 96.5 34.5 196 201 A D S S+ 0 0 9 -58,-0.6 54,-2.9 1,-0.2 2,-0.4 0.875 97.4 25.2 -60.9 -41.4 123.8 98.9 36.8 197 202 A V E +fg 139 250A 0 -59,-2.0 -57,-2.3 52,-0.2 2,-0.4 -0.988 63.4 167.8-131.6 122.6 124.1 96.5 39.7 198 203 A T E +fg 140 251A 2 52,-1.5 54,-2.7 -2,-0.4 2,-0.4 -0.969 11.5 169.0-135.6 117.1 124.1 92.7 39.4 199 204 A L E +fg 141 252A 0 -59,-2.1 -57,-1.7 -2,-0.4 2,-0.3 -0.993 24.4 79.8-133.4 136.6 125.0 90.6 42.4 200 205 A G E - g 0 253A 0 52,-1.6 54,-3.1 -2,-0.4 55,-0.3 -0.960 68.2 -65.2 168.6-151.5 124.8 86.9 43.1 201 206 A G E S+f 145 0A 0 -57,-2.5 -55,-1.3 -2,-0.3 57,-0.2 -0.150 70.9 100.7-110.8-155.7 126.4 83.6 42.5 202 207 A G + 0 0 0 55,-1.9 3,-0.5 -57,-0.3 4,-0.4 0.862 33.5 147.7 80.0 39.5 127.0 81.6 39.3 203 208 A A > + 0 0 15 52,-2.3 3,-1.4 1,-0.2 4,-0.3 0.828 60.7 71.3 -74.2 -31.0 130.6 82.4 38.6 204 209 A K G > S+ 0 0 109 52,-1.4 3,-1.0 1,-0.3 -1,-0.2 0.767 90.8 56.3 -60.3 -29.2 131.4 79.1 37.0 205 210 A T G > S+ 0 0 5 -3,-0.5 3,-1.4 51,-0.4 -1,-0.3 0.779 96.9 67.0 -73.6 -21.7 129.3 79.7 33.9 206 211 A F G < S+ 0 0 2 -3,-1.4 15,-2.2 -4,-0.4 14,-0.7 0.570 85.6 70.7 -72.6 -9.4 131.5 82.8 33.4 207 212 A A G < S+ 0 0 72 -3,-1.0 -1,-0.3 -4,-0.3 2,-0.2 0.395 79.6 100.3 -86.8 1.4 134.5 80.5 32.7 208 213 A E S < S- 0 0 48 -3,-1.4 12,-1.7 11,-0.0 2,-0.4 -0.621 72.7-126.1 -86.2 150.1 132.9 79.5 29.4 209 214 A T B -N 219 0E 70 10,-0.2 10,-0.2 -2,-0.2 7,-0.1 -0.779 22.4-111.4-101.8 140.4 134.1 81.0 26.1 210 215 A A B -o 216 0F 4 8,-1.5 7,-2.4 5,-0.5 8,-0.1 -0.423 18.8-148.6 -66.0 138.6 131.9 82.6 23.6 211 216 A T S S+ 0 0 68 5,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.540 73.2 2.7 -87.5 -9.6 131.6 80.6 20.4 212 217 A A S S+ 0 0 25 3,-0.0 3,-0.3 0, 0.0 -33,-0.1 -0.917 91.3 54.6-159.8-178.5 131.1 83.5 18.1 213 218 A G S > S- 0 0 46 -2,-0.3 3,-1.2 1,-0.2 -34,-0.0 -0.214 98.8 -38.5 80.8-170.5 130.9 87.3 18.0 214 219 A E T 3 S+ 0 0 162 1,-0.3 -1,-0.2 3,-0.0 -4,-0.0 0.819 138.5 40.9 -62.6 -34.7 133.3 90.1 19.1 215 220 A W T > S+ 0 0 60 -3,-0.3 3,-1.9 2,-0.1 -5,-0.5 0.159 81.3 145.1-104.0 21.2 134.4 88.3 22.3 216 221 A Q B < +o 210 0F 123 -3,-1.2 -5,-0.2 1,-0.3 3,-0.1 -0.214 69.1 23.2 -56.1 144.6 134.6 84.9 20.8 217 222 A G T 3 S+ 0 0 59 -7,-2.4 2,-0.4 1,-0.2 -1,-0.3 0.069 102.9 103.3 85.7 -28.7 137.5 82.9 22.3 218 223 A K S < S- 0 0 83 -3,-1.9 -8,-1.5 1,-0.1 -1,-0.2 -0.737 79.0-113.0 -90.5 135.6 137.4 85.0 25.5 219 224 A T B > -N 209 0E 30 -2,-0.4 4,-2.2 -10,-0.2 -10,-0.2 -0.105 30.3-109.6 -57.2 164.0 135.8 83.6 28.6 220 225 A L H > S+ 0 0 0 -12,-1.7 4,-2.0 -14,-0.7 -13,-0.2 0.831 120.7 56.0 -68.1 -28.1 132.6 85.4 29.7 221 226 A R H > S+ 0 0 86 -15,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.928 107.4 48.5 -68.5 -43.0 134.5 86.8 32.7 222 227 A E H > S+ 0 0 81 -16,-0.3 4,-2.8 1,-0.2 5,-0.2 0.921 110.0 52.1 -61.6 -44.8 137.1 88.3 30.3 223 228 A E H X S+ 0 0 5 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.871 105.7 54.6 -60.0 -39.8 134.2 89.8 28.2 224 229 A A H <>S+ 0 0 0 -4,-2.0 5,-2.3 2,-0.2 -1,-0.2 0.960 112.6 43.6 -57.8 -50.9 132.6 91.4 31.3 225 230 A E H ><5S+ 0 0 115 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.912 111.9 51.5 -60.0 -47.3 135.9 93.1 32.0 226 231 A A H 3<5S+ 0 0 59 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.810 107.8 55.9 -59.8 -30.5 136.5 94.1 28.4 227 232 A R T 3<5S- 0 0 48 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.383 126.4 -98.8 -84.2 0.9 133.0 95.6 28.4 228 233 A G T < 5 + 0 0 32 -3,-1.8 2,-0.2 1,-0.3 -3,-0.2 0.633 69.5 151.1 93.3 14.6 133.7 97.8 31.4 229 234 A Y < - 0 0 12 -5,-2.3 2,-0.6 -6,-0.2 -1,-0.3 -0.569 42.3-136.4 -81.1 139.2 132.2 95.7 34.3 230 235 A Q E -h 250 0A 48 19,-3.0 21,-2.5 -2,-0.2 2,-0.5 -0.871 23.8-153.7 -91.4 124.2 133.7 96.1 37.8 231 236 A L E +h 251 0A 41 -2,-0.6 2,-0.4 19,-0.2 21,-0.2 -0.891 16.2 178.9-105.6 128.7 133.9 92.5 39.1 232 237 A V E -h 252 0A 10 19,-2.1 21,-1.9 -2,-0.5 3,-0.0 -0.978 11.5-175.8-125.1 141.1 133.8 91.9 42.9 233 238 A S + 0 0 71 -2,-0.4 2,-0.3 19,-0.2 3,-0.1 0.312 61.7 25.6-121.3 9.2 134.0 88.5 44.5 234 239 A D S > S- 0 0 51 1,-0.1 4,-1.8 57,-0.1 57,-0.2 -0.940 85.0 -89.6-157.4 178.9 133.5 89.0 48.2 235 240 A A H > S+ 0 0 22 55,-3.3 4,-2.7 -2,-0.3 5,-0.2 0.945 117.6 54.7 -60.4 -49.1 132.1 91.3 50.9 236 241 A A H > S+ 0 0 67 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.901 112.7 39.7 -51.2 -56.9 135.2 93.4 51.2 237 242 A S H > S+ 0 0 37 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.840 113.3 55.3 -66.2 -34.5 135.5 94.4 47.5 238 243 A L H >< S+ 0 0 6 -4,-1.8 3,-2.3 1,-0.2 -2,-0.2 0.988 108.3 49.4 -58.1 -56.8 131.7 94.9 47.1 239 244 A N H 3< S+ 0 0 122 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.801 102.5 63.3 -48.7 -38.1 131.8 97.3 50.0 240 245 A S H 3< S+ 0 0 88 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.671 78.6 106.9 -66.5 -21.4 134.7 99.1 48.3 241 246 A V << + 0 0 11 -3,-2.3 3,-0.1 -4,-0.7 63,-0.0 -0.384 42.2 179.0 -63.7 137.5 132.6 100.1 45.3 242 247 A T + 0 0 107 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.595 64.0 13.0-113.4 -22.4 131.6 103.7 45.3 243 248 A E - 0 0 82 5,-0.1 -1,-0.3 2,-0.0 2,-0.3 -0.993 49.7-174.7-155.2 155.7 129.7 103.9 42.1 244 249 A A + 0 0 11 -2,-0.3 2,-0.3 60,-0.3 -48,-0.1 -0.948 29.0 129.5-153.1 126.2 128.0 101.7 39.5 245 250 A N S S- 0 0 46 3,-1.0 -2,-0.0 -2,-0.3 60,-0.0 -0.853 72.4 -62.8-157.5-166.7 126.4 103.0 36.3 246 251 A Q S S+ 0 0 57 -2,-0.3 -109,-0.0 1,-0.2 -51,-0.0 0.735 134.7 44.1 -65.7 -20.9 126.3 102.5 32.6 247 252 A Q S S+ 0 0 155 1,-0.2 -1,-0.2 -18,-0.0 -51,-0.0 0.793 130.1 25.8 -91.0 -30.5 130.0 103.4 32.3 248 253 A K S S- 0 0 82 -19,-0.0 -3,-1.0 -18,-0.0 -1,-0.2 -0.626 79.6-176.7-134.2 70.4 130.9 101.3 35.3 249 254 A P - 0 0 0 0, 0.0 -19,-3.0 0, 0.0 2,-0.4 -0.425 22.6-129.0 -68.9 143.5 128.4 98.5 35.8 250 255 A L E -gh 197 230A 0 -54,-2.9 -52,-1.5 -21,-0.2 2,-0.4 -0.766 24.1-177.4 -98.9 140.3 128.9 96.3 38.9 251 256 A L E -gh 198 231A 0 -21,-2.5 -19,-2.1 -2,-0.4 2,-0.5 -0.912 3.0-171.7-139.9 108.2 129.0 92.5 38.8 252 257 A G E -gh 199 232A 0 -54,-2.7 -52,-1.6 -2,-0.4 2,-0.5 -0.897 6.2-177.8-105.3 126.9 129.4 90.5 41.9 253 258 A L E +g 200 0A 6 -21,-1.9 -52,-0.2 -2,-0.5 -51,-0.1 -0.919 8.4 170.0-123.4 97.9 130.0 86.8 41.7 254 259 A F + 0 0 16 -54,-3.1 2,-0.3 -2,-0.5 -53,-0.2 0.405 61.9 16.2 -94.9 3.6 130.1 85.5 45.2 255 260 A A - 0 0 21 -55,-0.3 -52,-2.3 2,-0.1 -53,-0.2 -0.974 69.9-116.6-167.0 157.5 130.1 81.7 44.5 256 261 A D S S- 0 0 118 -2,-0.3 -52,-1.4 -54,-0.2 -51,-0.4 0.927 105.0 -6.2 -65.6 -45.2 130.6 79.2 41.7 257 262 A G S S- 0 0 19 1,-0.4 -55,-1.9 -55,-0.2 2,-0.2 0.197 126.1 -11.9-116.3-124.2 127.0 78.1 42.0 258 263 A N S S- 0 0 60 -57,-0.2 -1,-0.4 -113,-0.1 -114,-0.2 -0.610 78.4-102.5 -82.3 145.5 124.4 79.2 44.5 259 264 A M - 0 0 4 -116,-2.3 -4,-0.1 -2,-0.2 -1,-0.1 -0.388 50.0 -90.3 -65.9 144.2 125.6 81.1 47.6 260 265 A P - 0 0 40 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.115 43.0-109.7 -55.5 147.4 125.8 78.9 50.8 261 266 A V - 0 0 22 1,-0.1 25,-0.1 -3,-0.1 23,-0.1 -0.504 19.1-130.1 -78.8 153.6 122.7 78.7 53.1 262 267 A R S S+ 0 0 45 70,-0.2 22,-3.2 -2,-0.2 2,-0.3 0.857 81.6 49.7 -74.9 -34.3 122.9 80.4 56.5 263 268 A W E -P 283 0G 50 20,-0.3 2,-0.4 69,-0.3 73,-0.1 -0.828 63.5-149.2-115.8 151.7 121.7 77.6 58.7 264 269 A L E +P 282 0G 75 18,-3.3 18,-2.1 -2,-0.3 -2,-0.0 -0.867 30.8 139.5-115.9 139.7 122.5 74.0 59.2 265 270 A G - 0 0 16 -2,-0.4 67,-0.1 16,-0.2 16,-0.1 -0.950 51.2 -85.9-166.5 159.2 120.1 71.3 60.2 266 271 A P - 0 0 75 0, 0.0 65,-0.4 0, 0.0 2,-0.2 -0.299 47.3 -97.6 -74.1 166.6 119.5 67.7 59.3 267 272 A K - 0 0 94 62,-0.1 62,-0.2 1,-0.1 61,-0.1 -0.597 45.3-103.3 -79.7 141.3 117.2 66.6 56.4 268 273 A A - 0 0 1 60,-3.3 2,-0.3 -2,-0.2 115,-0.2 -0.323 44.2-159.4 -63.3 150.8 113.7 65.6 57.4 269 274 A T E > -Q 382 0H 52 113,-2.3 113,-3.2 -3,-0.1 3,-2.2 -0.865 30.0 -76.8-134.1 165.9 113.1 61.9 57.5 270 275 A Y E 3 S-Q 381 0H 125 1,-0.3 111,-0.2 -2,-0.3 5,-0.1 -0.483 121.1 -5.1 -62.2 116.3 110.3 59.3 57.3 271 276 A H T >> S+ 0 0 28 109,-0.6 4,-3.2 -2,-0.4 3,-0.9 0.776 91.4 144.3 66.5 26.2 108.7 59.4 60.9 272 277 A G H <> + 0 0 3 -3,-2.2 4,-1.6 1,-0.3 112,-0.3 0.802 64.3 59.4 -66.0 -30.8 111.4 61.8 62.0 273 278 A N H 34 S+ 0 0 18 -4,-0.3 -1,-0.3 110,-0.2 110,-0.1 0.702 117.4 34.7 -71.5 -14.4 109.1 63.6 64.3 274 279 A I H <4 S+ 0 0 84 -3,-0.9 -2,-0.2 108,-0.1 -1,-0.1 0.860 126.6 33.0-101.3 -52.2 108.6 60.3 66.0 275 280 A D H < S+ 0 0 120 -4,-3.2 -3,-0.2 -5,-0.1 -2,-0.2 0.508 113.4 60.2 -85.1 -12.2 112.0 58.6 65.9 276 281 A K S < S- 0 0 124 -4,-1.6 108,-0.1 -5,-0.3 3,-0.1 -0.922 83.4-111.0-122.7 146.6 114.2 61.5 66.0 277 282 A P - 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0 0 0 -4,-1.4 5,-2.7 -8,-0.4 3,-0.4 -0.244 67.1-132.8 -52.4 129.6 77.0 68.0 83.4 623 183 B L T > 5S+ 0 0 48 1,-0.2 3,-1.7 3,-0.2 -1,-0.1 0.884 106.0 53.5 -53.9 -44.1 73.5 69.3 84.4 624 184 B E T 3 5S+ 0 0 76 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.841 105.5 55.3 -59.9 -36.7 73.1 66.8 87.2 625 185 B K T 3 5S- 0 0 124 -3,-0.4 -1,-0.3 -6,-0.2 -2,-0.2 0.285 129.4 -96.2 -80.3 8.9 76.5 67.9 88.6 626 186 B G T < 5S+ 0 0 73 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.2 0.596 82.1 138.2 87.1 10.0 75.3 71.5 88.8 627 187 B G S - 0 0 0 -2,-0.2 4,-2.4 -3,-0.1 -21,-0.2 -0.054 65.3 -93.8 -70.0 178.6 75.7 69.7 77.4 631 191 B I H > S+ 0 0 0 -23,-2.4 4,-2.0 1,-0.2 -21,-0.2 0.943 127.5 47.9 -61.6 -48.4 76.3 71.6 74.2 632 192 B T H > S+ 0 0 0 -23,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.843 112.0 49.1 -62.1 -38.8 72.8 70.9 73.0 633 193 B E H > S+ 0 0 5 -24,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.925 112.0 47.9 -68.8 -41.2 71.3 72.0 76.3 634 194 B Q H X S+ 0 0 11 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.834 109.6 54.1 -68.2 -31.4 73.3 75.2 76.3 635 195 B L H X S+ 0 0 3 -4,-2.0 4,-1.4 2,-0.2 5,-0.4 0.951 108.9 48.6 -65.7 -46.1 72.2 75.8 72.7 636 196 B L H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.827 115.1 45.5 -61.9 -35.0 68.6 75.5 73.8 637 197 B N H < S+ 0 0 80 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.903 102.9 62.7 -75.3 -41.8 69.2 77.9 76.6 638 198 B A H < S- 0 0 19 -4,-2.9 -2,-0.2 -38,-0.2 -1,-0.2 0.811 86.6-161.1 -52.1 -37.4 71.1 80.4 74.5 639 199 B R < - 0 0 43 -4,-1.4 2,-0.2 1,-0.1 -3,-0.1 0.926 8.6-171.5 52.3 59.3 68.0 80.9 72.5 640 200 B A - 0 0 1 -5,-0.4 55,-0.2 1,-0.1 3,-0.1 -0.516 31.2-119.9 -71.9 150.9 69.4 82.5 69.3 641 201 B D S S+ 0 0 9 -58,-0.5 54,-3.1 1,-0.2 2,-0.4 0.906 97.3 25.5 -60.9 -41.7 66.6 83.7 67.0 642 202 B V E +ab 584 695J 0 -59,-2.0 -57,-2.1 52,-0.2 2,-0.4 -0.988 63.4 167.5-130.6 123.3 67.7 81.5 64.1 643 203 B T E +ab 585 696J 3 52,-1.4 54,-2.9 -2,-0.4 2,-0.4 -0.954 10.4 170.5-136.1 114.8 69.5 78.2 64.4 644 204 B L E +ab 586 697J 0 -59,-2.1 -57,-1.7 -2,-0.4 2,-0.3 -0.986 24.7 82.5-130.5 136.4 69.7 75.9 61.3 645 205 B G E - b 0 698J 0 52,-1.5 54,-3.2 -2,-0.4 55,-0.3 -0.964 66.0 -69.6 172.5-153.6 71.8 72.8 60.7 646 206 B G E S+a 590 0J 0 -57,-2.5 -55,-1.5 -2,-0.3 57,-0.2 -0.197 70.7 100.2-111.0-156.5 72.0 69.1 61.3 647 207 B G + 0 0 0 55,-2.0 3,-0.4 -57,-0.3 4,-0.3 0.892 33.1 149.5 78.8 41.4 72.5 67.0 64.4 648 208 B A > + 0 0 10 52,-2.4 3,-1.3 1,-0.2 4,-0.2 0.796 61.4 73.0 -74.1 -29.8 68.9 66.0 65.1 649 209 B K G > S+ 0 0 118 52,-1.6 3,-1.2 1,-0.3 -1,-0.2 0.797 89.2 54.8 -58.7 -32.8 70.1 62.8 66.7 650 210 B T G > S+ 0 0 4 -3,-0.4 3,-1.2 51,-0.4 -1,-0.3 0.741 97.9 67.3 -74.0 -18.7 71.5 64.4 69.9 651 211 B F G < S+ 0 0 0 -3,-1.3 15,-2.1 -4,-0.3 14,-0.4 0.509 85.2 71.3 -75.8 -7.1 68.0 65.9 70.4 652 212 B A G < S+ 0 0 75 -3,-1.2 2,-0.3 -4,-0.2 -1,-0.3 0.305 80.0 98.5 -88.2 3.4 66.6 62.4 70.9 653 213 B E S < S- 0 0 50 -3,-1.2 12,-1.9 10,-0.0 2,-0.3 -0.677 72.6-127.3 -91.7 151.0 68.4 62.3 74.3 654 214 B T B -I 664 0N 68 -2,-0.3 10,-0.2 10,-0.3 7,-0.1 -0.757 23.3-110.4-101.0 143.7 66.5 63.0 77.5 655 215 B A B -j 661 0O 5 8,-1.5 7,-2.5 5,-0.6 8,-0.1 -0.434 19.0-147.9 -67.4 143.4 67.7 65.5 80.1 656 216 B T S S+ 0 0 65 5,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.623 73.5 2.6 -89.5 -13.4 68.9 63.9 83.3 657 217 B A S S+ 0 0 25 3,-0.0 3,-0.3 0, 0.0 -33,-0.1 -0.877 91.8 55.4-156.5-177.5 67.9 66.7 85.7 658 218 B G S > S- 0 0 42 -2,-0.3 3,-1.7 1,-0.2 -34,-0.0 -0.106 99.0 -39.6 78.8-174.7 66.1 70.1 85.8 659 219 B E T 3 S+ 0 0 162 1,-0.3 -1,-0.2 3,-0.0 -4,-0.0 0.797 138.9 40.1 -58.9 -35.4 62.7 71.3 84.6 660 220 B W T > S+ 0 0 60 -3,-0.3 3,-1.7 2,-0.1 -5,-0.6 0.122 82.0 145.7-104.4 22.3 62.7 69.2 81.4 661 221 B Q B < S+j 655 0O 125 -3,-1.7 -5,-0.2 1,-0.3 3,-0.1 -0.248 70.0 20.3 -57.9 145.7 64.2 66.1 82.9 662 222 B G T 3 S+ 0 0 59 -7,-2.5 2,-0.4 1,-0.2 -1,-0.3 0.119 104.0 105.1 82.3 -24.3 62.9 62.9 81.4 663 223 B K S < S- 0 0 80 -3,-1.7 -8,-1.5 1,-0.1 -1,-0.2 -0.760 79.5-111.7 -90.4 131.1 61.8 64.9 78.4 664 224 B T B > -I 654 0N 33 -2,-0.4 4,-2.4 -10,-0.2 -10,-0.3 -0.106 26.4-113.1 -57.1 164.8 63.8 64.6 75.2 665 225 B L H > S+ 0 0 0 -12,-1.9 4,-1.9 -14,-0.4 -13,-0.2 0.787 119.6 54.1 -70.0 -27.2 65.8 67.6 74.1 666 226 B R H > S+ 0 0 82 -15,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.851 108.9 46.9 -74.1 -39.4 63.5 67.9 71.1 667 227 B E H > S+ 0 0 85 -16,-0.3 4,-2.9 2,-0.2 5,-0.2 0.910 111.1 53.6 -67.1 -42.8 60.4 67.9 73.3 668 228 B E H X S+ 0 0 6 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.904 103.7 55.4 -57.9 -44.7 62.1 70.5 75.5 669 229 B A H <>S+ 0 0 0 -4,-1.9 5,-2.3 1,-0.2 -1,-0.2 0.947 112.2 43.4 -52.8 -49.5 62.8 72.7 72.4 670 230 B E H ><5S+ 0 0 119 -4,-1.6 3,-2.2 1,-0.2 -2,-0.2 0.927 110.8 53.6 -62.5 -46.7 59.0 72.7 71.7 671 231 B A H 3<5S+ 0 0 56 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.808 107.0 55.1 -58.7 -29.5 58.1 73.2 75.4 672 232 B R T 3<5S- 0 0 48 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.364 125.7-100.2 -87.4 4.4 60.3 76.2 75.3 673 233 B G T < 5 + 0 0 31 -3,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.665 68.6 151.5 89.2 16.3 58.5 77.8 72.3 674 234 B Y < - 0 0 12 -5,-2.3 2,-0.7 -6,-0.2 -1,-0.3 -0.622 43.4-134.0 -82.4 141.3 60.9 76.8 69.5 675 235 B Q E -c 695 0J 46 19,-3.2 21,-2.8 -2,-0.3 2,-0.5 -0.851 23.7-153.6 -90.6 118.0 59.5 76.4 66.0 676 236 B L E +c 696 0J 41 -2,-0.7 2,-0.4 19,-0.2 21,-0.2 -0.845 16.6 177.6-100.4 127.7 61.0 73.2 64.7 677 237 B V E -c 697 0J 9 19,-1.7 21,-1.9 -2,-0.5 3,-0.1 -0.970 9.8-177.1-122.9 139.7 61.4 72.8 60.9 678 238 B S + 0 0 66 -2,-0.4 2,-0.3 19,-0.2 19,-0.1 0.354 61.6 27.5-122.5 6.0 63.0 69.7 59.3 679 239 B D S > S- 0 0 57 1,-0.1 4,-2.0 57,-0.1 57,-0.2 -0.930 86.2 -91.4-154.0 175.7 63.1 70.3 55.6 680 240 B A H > S+ 0 0 23 55,-3.1 4,-2.4 -2,-0.3 5,-0.2 0.917 117.7 54.8 -59.1 -47.3 63.2 73.0 53.0 681 241 B A H > S+ 0 0 69 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.926 112.9 40.7 -55.3 -52.3 59.4 73.4 52.6 682 242 B S H > S+ 0 0 39 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.902 112.7 55.3 -65.9 -37.4 58.8 74.0 56.3 683 243 B L H >< S+ 0 0 7 -4,-2.0 3,-2.0 1,-0.2 -2,-0.2 0.973 109.0 48.2 -53.9 -57.5 61.8 76.3 56.7 684 244 B N H 3< S+ 0 0 119 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.740 102.1 64.0 -51.0 -35.6 60.5 78.4 53.9 685 245 B S H 3< S+ 0 0 87 -4,-1.2 -1,-0.3 -5,-0.2 2,-0.2 0.630 78.0 107.5 -70.5 -18.2 57.1 78.6 55.4 686 246 B V << - 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