==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-JAN-95 1LPP . COMPND 2 MOLECULE: LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CANDIDA RUGOSA; . AUTHOR P.G.GROCHULSKI,M.C.CYGLER . 534 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18314.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 341 63.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 30 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.1 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 1 3 2 1 3 3 2 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 1 2 1 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 . 1 2 1 2 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 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 1 A A 0 0 111 0, 0.0 14,-0.1 0, 0.0 20,-0.0 0.000 360.0 360.0 360.0 150.1 99.7 38.6 -20.2 2 2 A P - 0 0 9 0, 0.0 12,-2.8 0, 0.0 2,-0.3 -0.378 360.0-173.4 -60.0 139.2 97.0 39.6 -22.7 3 3 A T E -A 13 0A 68 10,-0.2 2,-0.3 -2,-0.0 10,-0.2 -0.977 16.3-179.7-140.5 151.5 98.4 42.1 -25.2 4 4 A A E -A 12 0A 3 8,-1.9 8,-2.9 -2,-0.3 2,-0.7 -0.987 21.2-141.4-151.4 139.1 97.1 44.2 -28.0 5 5 A T E -A 11 0A 75 -2,-0.3 6,-0.3 190,-0.3 4,-0.1 -0.899 29.1-141.0-104.9 108.1 98.7 46.7 -30.4 6 6 A L > - 0 0 10 4,-2.8 3,-1.8 -2,-0.7 186,-0.1 0.045 29.2 -93.8 -59.9 173.7 96.4 49.7 -31.0 7 7 A A T 3 S+ 0 0 73 1,-0.3 -1,-0.1 2,-0.1 185,-0.1 0.844 125.0 54.1 -57.7 -38.8 95.9 51.5 -34.2 8 8 A N T 3 S- 0 0 99 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.228 124.4 -99.8 -83.0 13.6 98.5 54.0 -33.4 9 9 A G S < S+ 0 0 44 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.371 77.1 139.8 87.2 -8.4 101.2 51.4 -32.8 10 10 A D - 0 0 14 39,-0.1 -4,-2.8 -5,-0.1 2,-0.5 -0.485 41.7-148.6 -71.5 139.6 100.9 51.4 -28.9 11 11 A T E -A 5 0A 49 -6,-0.3 39,-2.4 -2,-0.2 40,-0.4 -0.949 18.7-173.1-111.0 125.8 101.1 48.0 -27.3 12 12 A I E -A 4 0A 0 -8,-2.9 -8,-1.9 -2,-0.5 2,-0.4 -0.793 16.2-131.8-117.9 161.3 99.1 47.7 -24.1 13 13 A T E -Ab 3 52A 36 38,-2.7 40,-3.2 -2,-0.3 -10,-0.2 -0.920 21.0-170.0-115.7 138.1 98.8 44.9 -21.5 14 14 A G - 0 0 4 -12,-2.8 2,-0.4 -2,-0.4 9,-0.2 -0.334 27.6 -89.1-109.8-164.4 95.6 43.5 -20.1 15 15 A L E -C 22 0B 69 7,-3.6 7,-2.7 38,-0.4 2,-0.8 -0.905 22.6-142.3-114.5 135.2 94.6 41.1 -17.2 16 16 A N E +C 21 0B 87 -2,-0.4 5,-0.2 5,-0.2 3,-0.1 -0.872 22.1 173.5 -99.1 109.1 94.3 37.4 -17.5 17 17 A A - 0 0 41 3,-2.5 2,-2.7 -2,-0.8 4,-0.2 0.144 42.8-126.4 -99.7 17.2 91.2 36.4 -15.4 18 18 A I S S+ 0 0 125 2,-0.2 -1,-0.1 1,-0.2 3,-0.1 -0.389 106.8 53.3 71.6 -64.2 91.4 32.8 -16.6 19 19 A I S S- 0 0 94 -2,-2.7 2,-0.3 1,-0.1 -1,-0.2 0.582 129.1 -3.3 -76.2 -10.4 87.8 32.7 -17.7 20 20 A N - 0 0 14 85,-0.2 -3,-2.5 2,-0.0 2,-0.4 -0.961 67.9-118.2-167.0 169.5 88.4 35.8 -19.8 21 21 A E E -CD 16 104B 22 83,-2.1 83,-2.9 -2,-0.3 2,-0.4 -0.987 34.0-165.3-120.9 130.2 91.1 38.4 -20.7 22 22 A A E -CD 15 103B 5 -7,-2.7 -7,-3.6 -2,-0.4 2,-0.5 -0.955 25.3-168.6-128.2 141.0 90.3 42.0 -19.9 23 23 A F E - D 0 102B 0 79,-2.8 79,-2.7 -2,-0.4 2,-0.4 -0.956 29.8-176.6-120.7 100.6 91.7 45.4 -20.8 24 24 A L E +m 54 0C 14 29,-1.6 31,-0.8 -2,-0.5 77,-0.2 -0.846 52.1 17.0-107.7 142.4 90.1 47.8 -18.4 25 25 A G E + 0 0 12 -2,-0.4 76,-0.2 1,-0.2 -1,-0.2 0.727 66.5 166.3 77.4 25.9 90.3 51.6 -18.1 26 26 A I E - D 0 100B 0 74,-2.0 74,-2.5 -3,-0.3 2,-0.2 -0.596 37.2-126.5 -73.8 122.5 91.7 52.5 -21.5 27 27 A P E + D 0 99B 29 0, 0.0 72,-0.2 0, 0.0 3,-0.1 -0.514 33.0 173.1 -71.6 133.1 91.3 56.3 -22.0 28 28 A F + 0 0 6 70,-2.0 16,-1.4 -2,-0.2 2,-0.3 0.468 64.0 33.2-116.0 -4.1 89.4 57.1 -25.2 29 29 A A B S-N 43 0D 2 69,-1.0 -1,-0.2 14,-0.3 15,-0.1 -0.967 88.1 -95.6-147.1 158.0 89.0 60.9 -24.7 30 30 A E - 0 0 55 12,-2.9 12,-0.4 -2,-0.3 14,-0.1 -0.481 62.8 -83.5 -70.8 146.0 90.9 63.8 -23.2 31 31 A P - 0 0 36 0, 0.0 2,-2.1 0, 0.0 65,-0.2 -0.335 37.2-137.4 -54.9 119.0 89.7 64.5 -19.6 32 32 A P + 0 0 6 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.201 60.5 127.9 -75.8 51.4 86.5 66.7 -20.0 33 33 A V > + 0 0 64 -2,-2.1 3,-2.1 4,-0.1 4,-0.1 -0.525 55.3 2.7-107.5 169.9 87.7 69.0 -17.1 34 34 A G G > S- 0 0 36 1,-0.3 3,-1.6 2,-0.2 247,-0.1 -0.325 136.4 -1.2 59.2-127.0 88.1 72.7 -16.7 35 35 A N G 3 S+ 0 0 121 1,-0.3 -1,-0.3 -2,-0.1 244,-0.1 0.465 127.8 69.4 -74.7 -1.6 87.1 74.6 -19.8 36 36 A L G X S+ 0 0 57 -3,-2.1 3,-1.5 -5,-0.1 -1,-0.3 0.451 73.4 124.6 -91.4 -3.1 86.3 71.3 -21.5 37 37 A R T < S+ 0 0 11 -3,-1.6 -4,-0.1 1,-0.3 3,-0.1 -0.276 80.3 4.0 -57.8 142.6 83.3 70.8 -19.2 38 38 A F T 3 S+ 0 0 4 123,-0.5 -1,-0.3 -6,-0.2 2,-0.2 0.406 109.5 117.7 61.5 -0.9 79.9 70.3 -20.9 39 39 A K S < S- 0 0 71 -3,-1.5 -1,-0.2 1,-0.2 3,-0.1 -0.554 77.5 -78.7 -95.5 162.4 81.7 70.3 -24.2 40 40 A D - 0 0 75 -2,-0.2 -1,-0.2 133,-0.1 2,-0.1 -0.114 59.1 -97.5 -50.9 147.3 82.0 67.6 -26.9 41 41 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.416 33.1-137.4 -73.5 146.8 84.6 64.9 -26.0 42 42 A V - 0 0 57 -12,-0.4 -12,-2.9 -3,-0.1 3,-0.1 -0.899 27.1-104.9-104.4 132.7 88.1 65.3 -27.6 43 43 A P B -N 29 0D 75 0, 0.0 2,-0.5 0, 0.0 -14,-0.3 -0.182 43.2-102.1 -52.9 141.8 89.8 62.2 -29.0 44 44 A Y - 0 0 81 -16,-1.4 2,-0.7 -15,-0.1 -15,-0.0 -0.619 36.5-168.8 -73.4 121.8 92.6 61.0 -26.7 45 45 A S + 0 0 94 -2,-0.5 2,-0.3 -3,-0.1 -17,-0.0 -0.949 44.4 88.2-111.0 108.1 95.9 62.1 -28.1 46 46 A G S S- 0 0 36 -2,-0.7 2,-0.5 -16,-0.0 -2,-0.0 -0.973 74.6 -84.9 177.6 175.2 98.6 60.3 -26.1 47 47 A S + 0 0 70 -2,-0.3 -2,-0.1 1,-0.1 0, 0.0 -0.903 26.0 173.5-108.7 130.4 100.7 57.2 -25.8 48 48 A L > + 0 0 4 -2,-0.5 3,-2.3 3,-0.1 -1,-0.1 0.237 37.9 140.8-110.0 4.3 99.4 54.1 -24.1 49 49 A D T 3 S+ 0 0 94 1,-0.3 -37,-0.2 -37,-0.1 3,-0.1 -0.238 72.4 6.0 -54.9 128.5 102.5 52.2 -25.2 50 50 A G T 3 S+ 0 0 65 -39,-2.4 -1,-0.3 1,-0.2 2,-0.2 0.526 100.4 133.0 75.1 7.6 103.8 49.9 -22.5 51 51 A Q < - 0 0 80 -3,-2.3 -38,-2.7 -40,-0.4 2,-0.4 -0.595 49.9-134.6 -95.3 153.4 100.9 50.5 -20.2 52 52 A K B -b 13 0A 154 -2,-0.2 2,-0.4 -40,-0.2 -38,-0.2 -0.840 10.4-167.1-103.6 142.2 98.8 48.0 -18.3 53 53 A F + 0 0 13 -40,-3.2 -29,-1.6 -2,-0.4 -38,-0.4 -0.810 37.4 132.7-131.2 87.0 95.0 48.2 -18.2 54 54 A T B +m 24 0C 59 -2,-0.4 2,-0.3 -31,-0.2 -29,-0.1 0.279 58.1 55.2-121.8 6.3 93.9 45.8 -15.4 55 55 A S S S- 0 0 86 -31,-0.8 2,-0.2 -3,-0.1 -1,-0.1 -0.993 81.2-109.9-142.5 147.6 91.4 47.9 -13.4 56 56 A Y - 0 0 68 -2,-0.3 3,-0.1 1,-0.1 -32,-0.1 -0.537 39.1-130.6 -70.7 141.2 88.2 49.8 -14.2 57 57 A G - 0 0 24 1,-0.2 74,-0.2 -2,-0.2 -1,-0.1 -0.130 41.2 -67.5 -81.3-175.4 88.8 53.5 -13.9 58 58 A P - 0 0 38 0, 0.0 35,-0.3 0, 0.0 -1,-0.2 -0.376 51.5-115.6 -73.3 158.1 86.5 55.8 -11.8 59 59 A S B -o 93 0E 7 33,-2.7 35,-2.5 1,-0.2 70,-0.1 -0.372 40.7 -90.2 -79.2 169.1 83.0 56.4 -13.0 60 60 A a - 0 0 4 68,-0.4 35,-0.2 96,-0.3 -1,-0.2 -0.266 67.3 -63.1 -72.8 169.4 81.9 59.9 -14.0 61 61 A M - 0 0 15 33,-0.3 97,-0.4 32,-0.1 2,-0.4 -0.249 58.4-140.3 -56.8 142.4 80.5 62.1 -11.3 62 62 A Q - 0 0 25 -3,-0.1 2,-0.3 20,-0.1 65,-0.2 -0.865 2.0-136.3-110.2 141.9 77.2 60.8 -9.9 63 63 A Q - 0 0 0 63,-2.3 63,-0.1 -2,-0.4 228,-0.1 -0.752 30.2-107.7 -95.0 144.1 74.1 62.7 -8.9 64 64 A N > - 0 0 0 -2,-0.3 3,-2.6 1,-0.2 233,-0.1 -0.617 25.1-144.9 -68.7 115.6 72.3 61.9 -5.6 65 65 A P T 3 S+ 0 0 17 0, 0.0 232,-2.2 0, 0.0 233,-0.9 0.764 102.3 47.3 -54.8 -27.8 69.1 60.2 -6.9 66 66 A E T 3 S+ 0 0 42 231,-0.2 9,-0.2 8,-0.2 233,-0.1 0.210 87.5 131.8 -96.1 9.8 67.2 61.8 -4.0 67 67 A G < + 0 0 0 -3,-2.6 228,-2.8 8,-0.1 2,-0.3 -0.239 23.0 141.0 -61.6 154.1 68.8 65.1 -4.7 68 68 A T - 0 0 5 223,-1.5 225,-0.2 226,-0.3 4,-0.1 -0.931 64.3-101.1 178.6 164.3 66.4 68.1 -4.9 69 69 A Y S S+ 0 0 136 -2,-0.3 2,-0.1 2,-0.1 223,-0.1 0.612 101.7 81.1 -76.8 -12.1 66.3 71.8 -4.0 70 70 A E S S- 0 0 102 -3,-0.0 2,-0.5 1,-0.0 -2,-0.2 -0.475 84.4-122.0 -86.1 164.4 64.2 70.8 -0.9 71 71 A E + 0 0 148 -2,-0.1 2,-0.3 -4,-0.1 -2,-0.1 -0.936 46.4 144.6-110.7 129.2 65.8 69.4 2.2 72 72 A N > - 0 0 57 -2,-0.5 4,-2.5 1,-0.1 5,-0.2 -0.975 57.1-100.5-155.2 169.5 64.6 66.0 3.4 73 73 A L H > S+ 0 0 138 -2,-0.3 4,-3.4 2,-0.2 5,-0.2 0.932 114.9 51.7 -60.7 -53.2 65.7 62.7 5.0 74 74 A P H > S+ 0 0 60 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.893 114.3 46.4 -52.4 -43.6 66.2 60.5 1.9 75 75 A K H > S+ 0 0 11 2,-0.2 4,-2.2 -9,-0.2 -2,-0.2 0.966 114.9 45.6 -62.7 -53.0 68.4 63.2 0.4 76 76 A A H X S+ 0 0 51 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.868 113.7 50.1 -59.0 -40.6 70.4 63.7 3.6 77 77 A A H X S+ 0 0 43 -4,-3.4 4,-2.1 2,-0.2 -1,-0.2 0.919 111.5 45.4 -66.9 -46.1 70.8 60.0 4.0 78 78 A L H X S+ 0 0 52 -4,-2.2 4,-3.6 -5,-0.2 -2,-0.2 0.865 111.4 53.9 -66.4 -36.5 72.0 59.2 0.5 79 79 A D H X S+ 0 0 59 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.911 106.8 51.7 -63.1 -42.2 74.4 62.1 0.6 80 80 A L H < S+ 0 0 128 -4,-1.8 4,-0.3 -5,-0.2 -2,-0.2 0.948 114.7 43.7 -59.4 -47.7 75.8 60.7 3.9 81 81 A V H >< S+ 0 0 71 -4,-2.1 3,-1.2 1,-0.2 6,-0.3 0.948 115.6 47.3 -62.7 -49.4 76.3 57.3 2.1 82 82 A M H 3< S+ 0 0 20 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.2 0.737 111.4 48.7 -68.4 -26.7 77.7 58.8 -1.1 83 83 A Q T 3< S+ 0 0 56 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.394 86.4 119.2 -95.3 6.9 80.2 61.2 0.5 84 84 A S S <> S- 0 0 36 -3,-1.2 4,-3.3 -4,-0.3 5,-0.2 -0.415 70.4-129.4 -74.0 146.1 81.6 58.5 2.7 85 85 A K H > S+ 0 0 153 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.807 110.5 54.3 -62.9 -29.2 85.2 57.5 2.4 86 86 A V H > S+ 0 0 107 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.942 112.2 41.5 -70.3 -47.1 84.2 53.8 2.2 87 87 A F H > S+ 0 0 65 -6,-0.3 4,-3.0 1,-0.2 -2,-0.2 0.950 111.8 56.5 -62.2 -48.0 81.8 54.5 -0.7 88 88 A E H < S+ 0 0 65 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.791 112.5 44.0 -52.4 -31.2 84.4 56.8 -2.2 89 89 A A H < S+ 0 0 78 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.850 116.6 40.9 -85.3 -41.1 86.8 53.8 -2.1 90 90 A V H < S+ 0 0 119 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.762 130.8 27.0 -78.2 -27.7 84.6 51.0 -3.4 91 91 A S S < S- 0 0 34 -4,-3.0 -1,-0.2 -5,-0.3 2,-0.2 -0.676 79.3-171.3-137.9 77.0 83.0 53.2 -6.1 92 92 A P - 0 0 61 0, 0.0 -33,-2.7 0, 0.0 2,-0.3 -0.501 4.8-175.6 -72.9 143.3 85.4 56.0 -7.2 93 93 A S B +o 59 0E 39 -35,-0.3 2,-0.3 -2,-0.2 -33,-0.2 -0.922 8.4 161.0-134.6 157.2 84.1 58.7 -9.5 94 94 A S - 0 0 45 -35,-2.5 -33,-0.3 -2,-0.3 0, 0.0 -0.971 50.4-112.0-168.5 162.4 85.7 61.7 -11.1 95 95 A E S S+ 0 0 18 -2,-0.3 2,-1.3 -35,-0.2 3,-0.2 0.732 111.3 70.6 -76.1 -22.5 85.3 64.2 -14.0 96 96 A D + 0 0 80 1,-0.2 -1,-0.2 -65,-0.2 -66,-0.0 -0.779 68.2 118.8 -91.1 93.3 88.3 62.4 -15.7 97 97 A a + 0 0 1 -2,-1.3 2,-2.1 -40,-0.1 -1,-0.2 0.328 18.0 124.6-142.9 5.3 86.3 59.3 -16.4 98 98 A L + 0 0 1 -3,-0.2 -70,-2.0 -69,-0.1 -69,-1.0 -0.479 39.4 137.6 -78.4 77.5 86.1 58.7 -20.1 99 99 A T E -D 27 0B 13 -2,-2.1 56,-2.2 -72,-0.2 2,-0.3 -0.809 39.7-147.7-119.8 160.5 87.5 55.2 -20.3 100 100 A I E -DE 26 154B 0 -74,-2.5 -74,-2.0 -2,-0.3 2,-0.4 -0.928 8.5-149.9-127.2 148.0 86.5 52.1 -22.3 101 101 A N E - E 0 153B 0 52,-2.3 52,-1.7 -2,-0.3 2,-0.5 -0.985 5.3-165.9-124.2 136.6 86.8 48.4 -21.4 102 102 A V E +DE 23 152B 0 -79,-2.7 -79,-2.8 -2,-0.4 2,-0.4 -0.972 9.4 177.7-123.2 119.9 87.4 45.3 -23.6 103 103 A V E +DE 22 151B 5 48,-2.9 48,-2.6 -2,-0.5 -81,-0.2 -0.986 10.0 171.6-124.1 132.8 86.8 41.8 -22.3 104 104 A R E -D 21 0B 6 -83,-2.9 -83,-2.1 -2,-0.4 46,-0.1 -0.817 39.1 -78.6-137.2 169.9 87.2 38.7 -24.4 105 105 A P > - 0 0 8 0, 0.0 3,-1.4 0, 0.0 -85,-0.2 -0.429 63.2 -91.2 -66.3 146.6 87.3 34.9 -24.4 106 106 A P T 3 S+ 0 0 57 0, 0.0 -90,-0.0 0, 0.0 -87,-0.0 -0.271 112.5 23.8 -57.2 141.4 90.6 33.5 -23.2 107 107 A G T 3 S+ 0 0 48 1,-0.3 2,-0.3 -3,-0.1 -87,-0.0 0.659 82.7 150.8 79.0 13.4 93.0 32.8 -26.0 108 108 A T < - 0 0 12 -3,-1.4 2,-0.3 88,-0.0 -1,-0.3 -0.623 24.7-167.3 -81.1 140.7 91.4 35.4 -28.4 109 109 A K > - 0 0 139 -2,-0.3 3,-1.9 88,-0.1 4,-0.2 -0.889 32.4 -82.3-126.7 158.8 93.9 36.8 -30.9 110 110 A A T 3 S+ 0 0 67 -2,-0.3 85,-0.2 85,-0.3 84,-0.1 -0.264 117.4 33.5 -56.8 141.6 93.9 39.8 -33.2 111 111 A G T 3 S+ 0 0 48 83,-1.3 -1,-0.3 87,-0.2 84,-0.1 0.357 77.6 118.9 90.9 -6.3 92.2 38.8 -36.4 112 112 A A < - 0 0 50 -3,-1.9 86,-0.1 82,-0.2 -2,-0.1 0.834 62.0-151.3 -60.7 -30.3 89.7 36.4 -34.7 113 113 A N + 0 0 79 85,-0.3 85,-0.3 81,-0.2 86,-0.1 0.872 25.9 175.0 58.7 44.0 86.9 38.6 -36.1 114 114 A L E -f 198 0B 23 83,-2.8 85,-2.8 1,-0.1 88,-0.2 -0.404 38.3 -98.0 -77.1 151.0 84.5 37.9 -33.3 115 115 A P E - 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0 0 13 -2,-0.3 -68,-0.4 -68,-0.1 2,-0.3 -0.263 27.4-167.1 127.1 151.6 76.0 54.8 -13.6 129 129 A G > - 0 0 2 -70,-0.1 3,-0.7 -7,-0.1 -7,-0.1 -0.963 33.5-115.1-163.4 159.1 79.3 53.2 -14.4 130 130 A T G > S+ 0 0 3 -2,-0.3 3,-1.5 1,-0.2 -1,-0.0 0.733 100.9 74.0 -74.8 -23.2 80.7 50.3 -16.4 131 131 A S G 3 S+ 0 0 49 1,-0.3 -1,-0.2 -74,-0.2 -75,-0.1 0.692 87.1 62.2 -66.5 -19.5 82.2 48.4 -13.4 132 132 A T G < S+ 0 0 73 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.1 0.312 90.3 73.7 -90.7 11.0 78.8 47.3 -12.1 133 133 A F S < S- 0 0 24 -3,-1.5 -1,-0.2 -14,-0.0 -14,-0.1 -0.619 72.0-159.8-125.1 73.7 78.0 45.3 -15.2 134 134 A P - 0 0 39 0, 0.0 3,-0.3 0, 0.0 4,-0.3 -0.285 5.4-163.6 -56.8 124.6 80.2 42.1 -15.1 135 135 A P > + 0 0 9 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.497 65.7 96.6 -87.6 -6.1 80.5 40.6 -18.7 136 136 A A H > S+ 0 0 29 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.883 81.7 51.0 -51.3 -47.8 81.7 37.2 -17.5 137 137 A Q H > S+ 0 0 30 320,-0.4 4,-2.1 -3,-0.3 -1,-0.2 0.913 113.2 45.4 -59.5 -44.5 78.3 35.5 -17.6 138 138 A M H > S+ 0 0 0 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.968 116.8 45.3 -63.0 -52.2 77.6 36.7 -21.1 139 139 A I H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.931 112.4 49.5 -59.0 -48.0 81.1 35.7 -22.3 140 140 A T H X S+ 0 0 68 -4,-3.4 4,-2.2 1,-0.2 3,-0.5 0.952 112.5 47.8 -58.7 -49.1 81.1 32.3 -20.7 141 141 A K H X S+ 0 0 50 -4,-2.1 4,-1.4 -5,-0.3 -1,-0.2 0.857 107.9 56.9 -61.0 -33.9 77.7 31.4 -22.1 142 142 A S H <>S+ 0 0 0 -4,-2.1 5,-2.9 2,-0.2 4,-0.3 0.861 107.6 47.6 -66.7 -34.5 78.9 32.6 -25.6 143 143 A I H ><5S+ 0 0 77 -4,-1.8 3,-1.6 -3,-0.5 -2,-0.2 0.938 110.4 51.0 -70.1 -47.2 81.8 30.2 -25.5 144 144 A A H 3<5S+ 0 0 86 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.752 109.3 52.8 -60.2 -28.4 79.6 27.3 -24.4 145 145 A M T 3<5S- 0 0 44 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.543 112.7-120.6 -83.9 -10.1 77.2 28.2 -27.3 146 146 A G T < 5S+ 0 0 60 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.774 90.0 104.7 73.0 23.9 80.1 28.0 -29.8 147 147 A K < - 0 0 46 -5,-2.9 -4,-0.1 -6,-0.2 -3,-0.1 -0.525 56.5-170.4-134.7 63.9 79.3 31.7 -30.5 148 148 A P - 0 0 44 0, 0.0 2,-0.3 0, 0.0 -9,-0.1 -0.293 4.9-174.9 -61.0 138.9 82.0 33.6 -28.8 149 149 A I - 0 0 0 -10,-0.2 2,-0.5 -35,-0.2 -33,-0.2 -0.891 24.0-123.3-131.8 160.2 81.6 37.4 -28.6 150 150 A I E - g 0 116B 0 -35,-2.6 -33,-2.5 -2,-0.3 2,-0.5 -0.910 24.8-141.5-106.1 132.0 83.8 40.3 -27.4 151 151 A H E +Eg 103 117B 4 -48,-2.6 -48,-2.9 -2,-0.5 2,-0.4 -0.851 20.8 179.6 -99.4 125.9 82.3 42.5 -24.7 152 152 A V E -Eg 102 118B 0 -35,-2.5 -33,-3.5 -2,-0.5 2,-0.4 -0.967 2.5-178.0-124.4 137.0 82.9 46.3 -24.8 153 153 A S E -Eg 101 119B 5 -52,-1.7 -52,-2.3 -2,-0.4 2,-0.4 -0.996 8.4-157.5-135.2 143.5 81.6 48.9 -22.3 154 154 A V E -E 100 0B 1 -35,-1.3 -33,-0.4 -2,-0.4 -54,-0.2 -0.956 12.3-135.7-126.7 135.8 82.0 52.7 -22.4 155 155 A N - 0 0 2 -56,-2.2 2,-0.3 -2,-0.4 30,-0.1 -0.580 27.8-178.2 -80.0 153.9 81.8 55.3 -19.6 156 156 A Y - 0 0 0 -2,-0.2 -96,-0.3 -28,-0.2 2,-0.2 -0.959 33.4 -93.7-149.4 153.7 79.9 58.4 -20.5 157 157 A R - 0 0 6 -2,-0.3 2,-0.2 4,-0.1 24,-0.1 -0.559 44.2-169.6 -72.0 136.3 79.1 61.6 -18.5 158 158 A V >> + 0 0 0 -97,-0.4 4,-0.7 -2,-0.2 3,-0.6 -0.720 44.3 9.8-121.8 169.3 75.8 61.7 -16.7 159 159 A S H >> S- 0 0 0 -34,-3.3 4,-2.8 -2,-0.2 3,-1.0 -0.176 125.7 -16.8 61.6-146.3 73.7 64.3 -14.9 160 160 A S H 3> S+ 0 0 0 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.877 136.4 60.2 -58.7 -39.0 74.7 68.0 -15.2 161 161 A W H <4 S+ 0 0 10 -3,-0.6 -123,-0.5 1,-0.2 -1,-0.3 0.817 121.5 21.1 -59.7 -31.2 78.2 67.0 -16.5 162 162 A G H << S+ 0 0 1 -3,-1.0 16,-2.7 -4,-0.7 15,-0.4 0.644 130.9 34.0-116.4 -15.8 76.7 65.2 -19.5 163 163 A F H < + 0 0 5 -4,-2.8 144,-0.5 14,-0.2 2,-0.2 -0.088 68.7 147.7-134.9 38.1 73.2 66.5 -20.2 164 164 A L < + 0 0 8 -4,-0.7 12,-0.4 10,-0.2 13,-0.2 -0.499 24.6 176.4 -71.5 143.0 73.2 70.1 -19.3 165 165 A A + 0 0 10 90,-0.4 4,-0.3 -2,-0.2 3,-0.2 -0.541 18.8 98.7-132.9-164.8 70.7 72.0 -21.5 166 166 A G S > S- 0 0 0 84,-2.8 4,-2.0 -2,-0.2 5,-0.2 -0.408 82.7 -51.4 109.9 177.5 69.3 75.5 -22.1 167 167 A D H > S+ 0 0 87 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.868 130.3 49.8 -57.1 -44.6 69.9 78.5 -24.3 168 168 A E H > S+ 0 0 55 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.918 111.2 47.0 -64.3 -46.1 73.6 78.8 -23.6 169 169 A I H >>S+ 0 0 0 -4,-0.3 5,-2.1 2,-0.2 4,-1.3 0.887 113.6 50.3 -63.1 -40.9 74.4 75.1 -24.3 170 170 A K H ><5S+ 0 0 82 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.952 108.7 50.7 -61.5 -51.1 72.3 75.3 -27.5 171 171 A A H 3<5S+ 0 0 91 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.791 113.0 47.9 -58.2 -30.8 74.1 78.4 -28.7 172 172 A E H 3<5S- 0 0 72 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.715 108.4-121.7 -86.2 -20.4 77.5 76.7 -28.1 173 173 A G T <<5S+ 0 0 37 -4,-1.3 -3,-0.2 -3,-0.7 -133,-0.1 0.713 74.3 126.2 83.2 23.6 76.6 73.4 -29.8 174 174 A S > < + 0 0 6 -5,-2.1 3,-0.5 -6,-0.2 -4,-0.2 0.051 29.1 139.7-102.7 26.1 77.3 71.5 -26.6 175 175 A A T 3 + 0 0 3 -6,-0.3 5,-0.1 1,-0.2 -10,-0.1 -0.367 66.4 8.8 -73.3 146.2 74.0 69.5 -26.3 176 176 A N T >> + 0 0 5 -12,-0.4 4,-1.7 131,-0.2 3,-0.6 0.887 67.6 171.5 55.0 51.2 73.9 65.9 -25.2 177 177 A A H <> S+ 0 0 2 -3,-0.5 4,-2.0 -15,-0.4 -14,-0.2 0.914 74.6 56.8 -57.0 -42.4 77.6 65.6 -24.2 178 178 A G H 3> S+ 0 0 0 -16,-2.7 4,-1.7 1,-0.3 -1,-0.2 0.817 106.1 48.8 -59.9 -35.1 77.0 62.2 -22.7 179 179 A L H <> S+ 0 0 0 -3,-0.6 4,-2.3 -17,-0.3 -1,-0.3 0.856 109.0 53.9 -73.5 -34.2 75.6 60.8 -26.0 180 180 A K H X S+ 0 0 15 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.865 104.5 54.9 -67.5 -32.5 78.6 62.2 -27.8 181 181 A D H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.957 109.4 47.6 -63.5 -48.9 80.9 60.4 -25.3 182 182 A Q H X S+ 0 0 0 -4,-1.7 4,-1.5 1,-0.2 -2,-0.2 0.899 110.3 52.5 -56.9 -42.2 79.2 57.1 -26.3 183 183 A R H X S+ 0 0 14 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.890 107.8 50.6 -63.1 -40.9 79.5 58.0 -30.0 184 184 A L H X S+ 0 0 21 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.904 107.0 54.3 -64.4 -41.3 83.3 58.6 -29.7 185 185 A G H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.857 106.1 53.6 -60.5 -35.2 83.7 55.2 -27.9 186 186 A M H X S+ 0 0 2 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.893 108.5 48.6 -66.2 -38.6 81.9 53.7 -30.9 187 187 A Q H X S+ 0 0 53 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.881 108.1 54.2 -69.5 -35.0 84.4 55.3 -33.2 188 188 A W H X S+ 0 0 28 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.869 108.9 50.1 -64.3 -38.5 87.3 54.0 -31.0 189 189 A V H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.959 108.6 50.8 -65.5 -47.2 85.8 50.5 -31.4 190 190 A A H < S+ 0 0 25 -4,-2.5 4,-0.3 1,-0.2 -2,-0.2 0.934 118.5 39.9 -56.4 -41.1 85.6 50.9 -35.2 191 191 A D H < S+ 0 0 64 -4,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.799 130.8 20.1 -78.6 -31.5 89.3 52.0 -35.2 192 192 A N H >< S+ 0 0 16 -4,-2.7 3,-1.3 -5,-0.2 4,-0.4 0.626 91.4 89.6-119.7 -14.5 90.8 49.7 -32.6 193 193 A I G >X>S+ 0 0 0 -4,-2.5 5,-2.1 -5,-0.3 3,-1.8 0.784 78.5 68.2 -60.7 -30.4 88.7 46.5 -31.9 194 194 A A G >45S+ 0 0 47 -5,-0.3 -83,-1.3 1,-0.3 3,-1.0 0.844 92.7 63.0 -57.2 -31.2 90.4 44.4 -34.6 195 195 A A G <45S+ 0 0 22 -3,-1.3 -190,-0.3 1,-0.3 -85,-0.3 0.718 104.9 45.5 -65.9 -23.2 93.5 44.5 -32.5 196 196 A F G <45S- 0 0 0 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.474 128.8 -94.5 -98.2 -5.8 91.7 42.6 -29.7 197 197 A G T <<5S+ 0 0 0 -3,-1.0 -83,-2.8 -4,-0.6 -3,-0.2 0.508 83.4 127.0 105.8 7.3 90.1 40.1 -32.0 198 198 A G E < -f 114 0B 0 -5,-2.1 -1,-0.3 -85,-0.3 -85,-0.3 -0.593 58.9-123.0 -97.5 159.8 86.8 41.7 -32.7 199 199 A D E > - 0 0 22 -85,-2.8 3,-2.2 -2,-0.2 -83,-0.3 -0.903 10.7-155.0-102.5 114.1 85.2 42.5 -36.1 200 200 A P E 3 S+ 0 0 25 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.687 95.7 56.9 -61.1 -16.8 84.3 46.2 -36.5 201 201 A T E 3 S+ 0 0 79 1,-0.2 33,-0.1 33,-0.1 -11,-0.0 0.438 100.8 58.6 -92.6 -3.1 81.6 45.3 -39.0 202 202 A K E < S+ 0 0 56 -3,-2.2 -86,-2.7 -88,-0.2 2,-0.5 -0.292 72.1 141.8-120.5 47.1 79.9 43.0 -36.6 203 203 A V E -f 116 0B 2 -3,-0.4 32,-3.1 -88,-0.2 33,-0.9 -0.789 28.1-171.2 -94.5 128.1 79.1 45.5 -33.8 204 204 A T E -fh 117 236B 0 -88,-3.2 -86,-2.8 -2,-0.5 2,-0.4 -0.978 12.4-149.3-116.6 123.1 75.8 45.2 -31.9 205 205 A I E +fh 118 237B 0 31,-2.3 33,-2.4 -2,-0.5 2,-0.3 -0.767 24.3 166.5 -94.5 140.8 74.9 48.0 -29.5 206 206 A F E +fh 119 238B 1 -88,-2.3 -86,-2.1 -2,-0.4 2,-0.3 -0.997 6.4 154.8-152.6 151.2 72.8 47.3 -26.5 207 207 A G E -fh 120 239B 0 31,-1.5 33,-2.3 -2,-0.3 2,-0.4 -0.981 31.6-114.5-165.7 170.2 71.8 48.8 -23.2 208 208 A E E > S- h 0 240B 5 -88,-0.9 3,-2.8 -2,-0.3 33,-0.2 -0.935 71.0 -34.6-122.3 143.9 69.2 48.9 -20.5 209 209 A S T >> S+ 0 0 11 31,-2.5 4,-2.7 -2,-0.4 3,-0.7 -0.281 142.0 14.8 49.7-113.9 66.8 51.7 -19.5 210 210 A A H 3> S+ 0 0 2 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.837 134.3 51.8 -55.1 -30.0 68.8 55.0 -20.0 211 211 A G H <> S+ 0 0 0 -3,-2.8 4,-1.9 2,-0.2 -1,-0.3 0.835 107.4 50.6 -74.7 -32.8 71.2 52.9 -22.0 212 212 A S H <> S+ 0 0 0 -3,-0.7 4,-2.1 28,-0.3 -2,-0.2 0.911 110.8 48.2 -70.5 -44.2 68.3 51.5 -24.1 213 213 A M H X S+ 0 0 19 -4,-2.7 4,-2.4 28,-0.3 -1,-0.2 0.840 108.4 56.2 -63.2 -35.2 67.1 54.9 -24.8 214 214 A S H X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.921 105.1 51.5 -59.7 -45.6 70.7 55.9 -25.7 215 215 A V H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.922 109.2 50.4 -57.4 -44.8 70.7 53.0 -28.3 216 216 A M H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 3,-0.3 0.912 108.8 51.4 -59.1 -45.9 67.5 54.5 -29.7 217 217 A C H X S+ 0 0 0 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.841 107.9 53.6 -60.2 -32.8 69.1 58.0 -29.9 218 218 A H H < S+ 0 0 0 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.812 106.4 51.3 -73.1 -27.4 72.0 56.3 -31.7 219 219 A I H < S+ 0 0 0 -4,-1.5 110,-1.7 -3,-0.3 -1,-0.2 0.820 117.4 39.9 -74.5 -33.5 69.7 54.9 -34.3 220 220 A L H >< S+ 0 0 0 -4,-1.7 3,-1.0 108,-0.2 4,-0.3 0.598 89.6 122.1 -90.2 -16.2 68.2 58.3 -34.8 221 221 A W G >X S+ 0 0 11 -4,-1.4 3,-1.5 1,-0.3 4,-0.5 -0.179 82.1 5.3 -52.0 138.6 71.5 60.2 -34.6 222 222 A N G >4 S- 0 0 66 92,-2.5 3,-1.5 1,-0.3 -1,-0.3 0.875 133.1 -63.1 51.2 42.3 72.5 62.4 -37.6 223 223 A D G <4 S- 0 0 65 -3,-1.0 -1,-0.3 91,-0.6 105,-0.3 0.748 105.7 -44.9 54.8 29.4 69.0 61.6 -39.1 224 224 A G G <4 S+ 0 0 12 -3,-1.5 2,-1.0 -4,-0.3 -1,-0.3 0.462 100.7 133.7 98.9 0.0 69.9 57.9 -39.3 225 225 A D << + 0 0 78 -3,-1.5 -1,-0.2 -4,-0.5 104,-0.1 -0.770 20.2 167.4 -87.1 104.3 73.4 58.2 -40.7 226 226 A N + 0 0 16 -2,-1.0 7,-3.1 -3,-0.1 8,-0.2 0.060 32.0 125.0-103.1 24.3 75.4 55.8 -38.5 227 227 A T E -P 232 0F 64 5,-0.3 2,-0.4 6,-0.1 -2,-0.0 -0.544 37.4-172.3 -90.8 151.8 78.5 55.7 -40.7 228 228 A Y E > S-P 231 0F 49 3,-3.1 3,-1.4 -2,-0.2 -2,-0.0 -0.977 80.3 -10.4-140.3 116.0 82.1 56.5 -39.7 229 229 A K T 3 S- 0 0 145 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.879 134.0 -50.2 60.8 38.1 84.7 56.6 -42.5 230 230 A G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 0, 0.0 -3,-0.1 0.468 123.1 91.1 81.4 3.1 82.2 55.2 -44.9 231 231 A K E < S-P 228 0F 79 -3,-1.4 -3,-3.1 -5,-0.0 -1,-0.2 -0.973 81.1-103.2-131.7 145.5 81.1 52.2 -42.8 232 232 A P E -P 227 0F 69 0, 0.0 -5,-0.3 0, 0.0 3,-0.1 -0.340 20.8-137.9 -66.6 146.0 78.3 51.9 -40.3 233 233 A L S S+ 0 0 7 -7,-3.1 2,-0.3 1,-0.2 -6,-0.1 0.612 85.3 13.4 -75.7 -19.5 79.3 51.9 -36.6 234 234 A F - 0 0 4 -8,-0.2 -30,-0.2 -33,-0.1 -1,-0.2 -0.974 54.2-153.9-155.3 151.5 76.9 49.1 -35.7 235 235 A R S S- 0 0 61 -32,-3.1 2,-0.3 -2,-0.3 -31,-0.2 0.443 79.5 -0.3-105.3 -9.1 74.9 46.4 -37.6 236 236 A A E -h 204 0B 0 -33,-0.9 -31,-2.3 95,-0.2 2,-0.3 -0.978 60.8-143.3-167.7 171.2 72.1 45.9 -35.0 237 237 A G E -hi 205 333B 0 95,-1.3 97,-1.6 -2,-0.3 2,-0.5 -0.998 4.6-150.4-151.5 151.4 70.9 46.9 -31.6 238 238 A I E -hi 206 334B 0 -33,-2.4 -31,-1.5 -2,-0.3 2,-0.7 -0.987 12.5-162.0-125.4 122.2 69.2 45.5 -28.5 239 239 A M E -hi 207 335B 0 95,-3.3 97,-2.5 -2,-0.5 2,-0.9 -0.903 3.2-169.8-112.2 105.9 67.0 47.7 -26.4 240 240 A Q E S-hi 208 336B 0 -33,-2.3 -31,-2.5 -2,-0.7 -28,-0.3 -0.845 73.6 -22.4 -95.5 98.2 66.2 46.5 -22.9 241 241 A S S S+ 0 0 0 95,-2.7 -29,-0.3 -2,-0.9 -32,-0.3 1.000 115.0 63.3 66.2 79.6 63.5 48.7 -21.4 242 242 A G + 0 0 0 94,-0.4 -26,-0.2 -3,-0.3 173,-0.2 -0.217 38.7 170.1 142.4 128.2 63.4 52.0 -23.3 243 243 A A + 0 0 0 171,-0.5 -27,-0.2 1,-0.5 -26,-0.2 0.103 62.6 4.1-123.5-125.4 62.7 53.5 -26.7 244 244 A M - 0 0 1 174,-0.2 -1,-0.5 171,-0.1 -30,-0.1 -0.320 69.7-123.0 -66.3 150.4 62.3 57.2 -27.7 245 245 A V - 0 0 4 -32,-0.2 2,-1.9 -3,-0.1 74,-0.4 -0.822 16.1-138.2 -92.9 125.2 62.8 59.9 -25.1 246 246 A P + 0 0 17 0, 0.0 288,-2.3 0, 0.0 2,-0.3 -0.477 53.8 141.3 -84.1 71.9 59.7 62.1 -24.8 247 247 A S - 0 0 2 -2,-1.9 72,-0.3 286,-0.3 3,-0.1 -0.888 49.7-128.2-123.1 148.2 61.6 65.4 -24.5 248 248 A D - 0 0 27 -2,-0.3 4,-0.1 1,-0.2 286,-0.1 -0.274 54.2 -66.7 -74.7 170.6 61.3 69.0 -25.7 249 249 A A > - 0 0 42 60,-0.2 3,-2.1 1,-0.1 6,-0.3 -0.040 48.5-105.1 -58.2 159.0 64.2 70.7 -27.4 250 250 A V T 3 S+ 0 0 2 60,-2.3 -84,-2.8 1,-0.3 -81,-0.1 0.778 123.7 47.1 -58.0 -30.2 67.4 71.5 -25.5 251 251 A D T 3 S+ 0 0 65 -86,-0.2 -1,-0.3 4,-0.1 -84,-0.1 0.071 92.3 119.7-100.3 21.9 66.4 75.2 -25.3 252 252 A G S <> S- 0 0 18 -3,-2.1 4,-1.9 -4,-0.1 5,-0.2 -0.047 81.6 -83.4 -74.8-174.0 62.9 74.4 -24.2 253 253 A I H > S+ 0 0 88 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.924 124.3 37.0 -59.9 -53.6 61.2 75.4 -21.0 254 254 A Y H > S+ 0 0 12 280,-0.2 4,-2.1 2,-0.2 5,-0.2 0.825 112.0 57.7 -74.8 -30.9 62.4 72.8 -18.6 255 255 A G H > S+ 0 0 3 -6,-0.3 4,-1.6 1,-0.2 -90,-0.4 0.925 112.5 44.0 -62.6 -40.1 65.9 72.6 -20.1 256 256 A N H X S+ 0 0 24 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.870 110.1 53.5 -71.9 -39.1 66.2 76.3 -19.3 257 257 A E H X S+ 0 0 96 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.913 110.8 46.6 -60.9 -49.0 64.7 76.2 -15.8 258 258 A I H X S+ 0 0 8 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.887 110.5 53.2 -61.0 -41.4 67.1 73.5 -14.7 259 259 A F H X S+ 0 0 0 -4,-1.6 4,-2.6 -5,-0.2 -2,-0.2 0.949 111.5 45.3 -59.2 -51.2 70.1 75.4 -16.2 260 260 A D H X S+ 0 0 63 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.855 113.4 50.3 -60.9 -38.5 69.2 78.6 -14.3 261 261 A L H X S+ 0 0 50 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.935 111.6 46.7 -66.1 -48.3 68.6 76.7 -11.0 262 262 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 6,-0.2 0.914 111.7 53.1 -59.1 -43.6 71.9 74.9 -11.2 263 263 A A H X>S+ 0 0 0 -4,-2.6 5,-3.0 -5,-0.2 4,-0.7 0.930 110.1 46.6 -59.0 -46.7 73.6 78.2 -12.1 264 264 A S H ><5S+ 0 0 72 -4,-2.4 3,-1.1 4,-0.3 5,-0.3 0.929 111.0 53.5 -60.9 -43.6 72.0 79.8 -9.0 265 265 A N H 3<5S+ 0 0 59 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.813 108.5 48.4 -59.8 -37.4 73.1 76.8 -6.9 266 266 A A H 3<5S- 0 0 13 -4,-2.0 -1,-0.3 -3,-0.2 -2,-0.2 0.562 121.6-105.2 -81.8 -8.5 76.7 77.1 -8.0 267 267 A G T <<5S+ 0 0 60 -3,-1.1 3,-0.3 -4,-0.7 -3,-0.2 0.662 91.9 114.9 91.5 19.9 76.8 80.8 -7.2 268 268 A b > < + 0 0 0 -5,-3.0 3,-1.3 -6,-0.2 -4,-0.3 0.203 31.5 112.8-104.8 14.0 76.7 81.8 -10.9 269 269 A G T 3 S+ 0 0 42 -6,-0.5 -1,-0.2 -5,-0.3 -5,-0.1 0.769 82.6 42.2 -57.6 -27.8 73.3 83.5 -10.7 270 270 A S T 3 S+ 0 0 121 -3,-0.3 -1,-0.2 -7,-0.1 2,-0.1 0.378 85.1 116.0-101.5 1.3 74.8 87.0 -11.4 271 271 A A < - 0 0 30 -3,-1.3 3,-0.4 1,-0.2 4,-0.1 -0.448 61.6-143.2 -70.8 143.5 77.4 86.1 -14.1 272 272 A S S S+ 0 0 138 1,-0.3 2,-0.5 -2,-0.1 -1,-0.2 0.822 103.7 36.0 -74.6 -29.6 76.8 87.6 -17.5 273 273 A D S > S- 0 0 86 1,-0.1 4,-1.5 2,-0.0 -1,-0.3 -0.872 73.1-179.4-122.9 92.5 78.0 84.3 -19.0 274 274 A K H > S+ 0 0 42 -2,-0.5 4,-2.7 -3,-0.4 5,-0.2 0.841 78.2 60.3 -63.0 -32.9 76.7 81.6 -16.7 275 275 A L H > S+ 0 0 5 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.939 107.2 43.1 -62.0 -49.1 78.3 78.9 -18.7 276 276 A A H > S+ 0 0 50 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.829 113.0 55.1 -65.9 -32.3 81.8 80.2 -18.3 277 277 A b H >X S+ 0 0 38 -4,-1.5 4,-0.8 1,-0.2 3,-0.6 0.933 106.7 49.8 -66.3 -41.4 81.0 80.8 -14.6 278 278 A L H 3< S+ 0 0 0 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.820 106.4 56.2 -65.9 -31.4 80.0 77.1 -14.3 279 279 A R H 3< S+ 0 0 20 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.762 106.6 52.4 -70.8 -24.1 83.2 76.0 -15.9 280 280 A G H << S+ 0 0 66 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.646 86.3 95.5 -87.9 -18.1 85.2 77.9 -13.3 281 281 A V S < S- 0 0 25 -4,-0.8 -247,-0.1 -3,-0.4 -14,-0.0 -0.350 82.6 -98.8 -72.8 156.7 83.6 76.5 -10.1 282 282 A S > - 0 0 60 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.263 29.6-110.1 -69.5 165.3 85.3 73.6 -8.3 283 283 A S H > S+ 0 0 50 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.846 120.2 52.4 -61.6 -38.2 84.1 70.0 -8.7 284 284 A D H > S+ 0 0 113 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.946 109.9 47.6 -64.8 -45.8 82.8 70.0 -5.2 285 285 A T H > S+ 0 0 56 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.924 114.8 46.0 -60.5 -46.7 80.8 73.2 -5.8 286 286 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.924 111.9 51.2 -64.2 -42.8 79.4 71.8 -9.0 287 287 A E H X S+ 0 0 25 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.913 112.4 47.3 -60.8 -41.1 78.6 68.5 -7.4 288 288 A D H X S+ 0 0 99 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.923 110.2 51.2 -64.8 -48.1 76.8 70.3 -4.6 289 289 A A H >< S+ 0 0 2 -4,-2.6 3,-0.7 1,-0.2 -1,-0.2 0.891 111.1 49.6 -57.2 -39.8 74.9 72.5 -7.0 290 290 A T H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.869 104.2 56.6 -69.8 -37.5 73.8 69.4 -8.9 291 291 A N H 3< S+ 0 0 7 -4,-2.0 -223,-1.5 1,-0.3 -1,-0.2 0.628 101.1 61.6 -72.3 -7.0 72.6 67.5 -5.8 292 292 A N T << S+ 0 0 38 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.067 92.0 76.3-102.2 15.9 70.4 70.5 -5.2 293 293 A T S < S- 0 0 0 -3,-1.7 12,-0.0 -225,-0.2 -35,-0.0 -0.910 105.0 -76.6-118.2 150.4 68.5 69.9 -8.5 294 294 A P - 0 0 3 0, 0.0 11,-0.5 0, 0.0 -226,-0.3 -0.254 42.8-151.9 -53.7 132.8 66.0 67.0 -8.6 295 295 A G > - 0 0 2 -228,-2.8 3,-1.8 -230,-0.1 6,-0.3 -0.607 34.1 -99.2 -96.9 164.4 67.3 63.5 -8.9 296 296 A F T 3 S+ 0 0 22 1,-0.3 -230,-0.1 -2,-0.2 52,-0.1 0.648 121.8 49.9 -62.1 -18.5 65.2 60.7 -10.5 297 297 A L T 3 S+ 0 0 28 -232,-2.2 -1,-0.3 -233,-0.1 -231,-0.2 0.518 92.2 96.0 -96.1 -8.1 63.9 59.3 -7.2 298 298 A A S X S- 0 0 6 -3,-1.8 3,-2.2 -233,-0.9 50,-0.1 -0.174 101.7 -82.1 -71.6 177.2 62.8 62.7 -5.9 299 299 A Y T 3 S+ 0 0 64 1,-0.3 3,-0.1 -233,-0.1 -1,-0.1 0.830 127.9 63.3 -49.6 -43.2 59.2 63.8 -6.2 300 300 A S T > S+ 0 0 17 1,-0.2 3,-2.1 -5,-0.1 -1,-0.3 0.721 83.2 172.7 -55.4 -26.0 59.7 65.0 -9.8 301 301 A S T < + 0 0 2 -3,-2.2 -1,-0.2 -6,-0.3 -3,-0.2 -0.159 61.7 3.5 56.6-128.1 60.4 61.4 -10.6 302 302 A L T 3 S+ 0 0 47 1,-0.2 2,-2.2 -3,-0.1 -1,-0.3 0.448 102.8 97.0 -73.4 0.3 60.7 60.7 -14.3 303 303 A R S < S- 0 0 33 -3,-2.1 -1,-0.2 -7,-0.1 -3,-0.0 -0.641 80.8-153.7 -84.3 75.2 60.3 64.3 -15.3 304 304 A L - 0 0 13 -2,-2.2 3,-0.1 1,-0.1 -2,-0.1 -0.253 28.6-148.0 -61.2 140.9 64.2 64.2 -15.4 305 305 A S S S+ 0 0 6 -11,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.855 92.5 32.0 -72.8 -34.9 66.4 67.2 -14.8 306 306 A Y S S+ 0 0 1 -182,-0.2 -1,-0.2 -142,-0.1 -147,-0.2 -0.991 78.3 119.6-130.1 126.1 69.0 65.8 -17.2 307 307 A L - 0 0 10 -144,-0.5 -131,-0.2 -2,-0.4 2,-0.1 -0.959 66.2 -62.0-171.8 165.0 68.3 63.6 -20.3 308 308 A P - 0 0 0 0, 0.0 -145,-0.1 0, 0.0 -61,-0.1 -0.411 53.5-176.2 -62.3 137.4 68.7 63.5 -24.1 309 309 A R - 0 0 4 -2,-0.1 -60,-0.2 -63,-0.0 6,-0.1 -0.991 34.1 -98.7-137.6 141.2 66.9 66.4 -25.9 310 310 A P - 0 0 7 0, 0.0 -60,-2.3 0, 0.0 6,-0.2 -0.336 35.8-178.5 -57.8 135.6 66.5 67.2 -29.6 311 311 A D - 0 0 8 4,-2.0 5,-0.2 -62,-0.2 -136,-0.1 0.402 40.6-118.9-116.9 -3.1 69.1 69.9 -30.5 312 312 A G S S+ 0 0 51 3,-2.2 4,-0.3 1,-0.1 -63,-0.0 0.443 102.4 60.3 78.9 -4.2 68.3 70.5 -34.2 313 313 A V S S+ 0 0 88 2,-0.4 3,-0.3 4,-0.0 -1,-0.1 0.710 119.3 8.3-118.2 -60.8 71.8 69.3 -35.2 314 314 A N S S+ 0 0 32 1,-0.4 -92,-2.5 -92,-0.1 2,-0.6 0.779 144.4 31.5 -93.5 -35.3 72.6 65.7 -34.1 315 315 A I S S- 0 0 0 -94,-0.2 -3,-2.2 -6,-0.1 -4,-2.0 -0.931 85.1-169.4-120.1 92.2 69.0 64.9 -33.0 316 316 A T - 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