==== 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 06-JAN-95 1LPM . 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) . 18431.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 63.7 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 . 26 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 25.3 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 0 105 0, 0.0 14,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -66.7 100.2 38.7 -20.1 2 2 A P - 0 0 8 0, 0.0 12,-2.1 0, 0.0 2,-0.3 -0.453 360.0-170.3 -65.2 147.5 97.4 39.5 -22.5 3 3 A T E -A 13 0A 64 10,-0.2 2,-0.3 -2,-0.1 10,-0.2 -0.988 18.8-179.6-144.8 148.7 98.6 42.0 -25.1 4 4 A A E -A 12 0A 3 8,-2.3 8,-1.7 -2,-0.3 2,-0.5 -0.956 19.9-143.3-140.9 157.5 97.2 44.2 -28.0 5 5 A T E -A 11 0A 80 -2,-0.3 6,-0.3 190,-0.2 4,-0.1 -0.928 27.7-145.1-126.5 101.9 98.8 46.6 -30.5 6 6 A L > - 0 0 12 4,-1.7 3,-1.6 -2,-0.5 186,-0.1 0.077 29.8 -95.0 -59.3 174.9 96.5 49.6 -31.1 7 7 A A T 3 S+ 0 0 75 1,-0.3 -1,-0.1 2,-0.1 185,-0.1 0.917 125.1 55.7 -59.3 -44.6 96.0 51.5 -34.4 8 8 A N T 3 S- 0 0 94 1,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.228 124.0-104.2 -75.4 15.9 98.6 54.1 -33.4 9 9 A G S < S+ 0 0 45 -3,-1.6 -2,-0.1 1,-0.2 -1,-0.1 0.280 74.8 141.4 82.3 -12.8 101.1 51.3 -32.9 10 10 A D - 0 0 13 -5,-0.1 -4,-1.7 39,-0.1 2,-0.5 -0.202 41.1-144.8 -61.7 155.7 101.0 51.3 -29.1 11 11 A T E -A 5 0A 46 -6,-0.3 39,-2.0 -3,-0.1 40,-0.4 -0.963 19.0-175.1-130.6 116.7 101.1 48.0 -27.3 12 12 A I E -A 4 0A 0 -8,-1.7 -8,-2.3 -2,-0.5 2,-0.4 -0.682 15.8-138.2-110.7 163.8 99.2 47.5 -24.2 13 13 A T E -Ab 3 52A 37 38,-2.3 40,-2.8 -2,-0.2 -10,-0.2 -0.905 19.0-174.6-120.9 142.6 98.9 44.7 -21.6 14 14 A G - 0 0 3 -12,-2.1 2,-0.4 -2,-0.4 9,-0.2 -0.434 29.9 -85.7-118.5-160.4 95.8 43.5 -19.9 15 15 A L E -C 22 0B 75 7,-2.8 7,-2.6 38,-0.4 2,-0.8 -0.910 22.0-140.4-118.4 138.4 94.8 41.0 -17.2 16 16 A N E +C 21 0B 68 -2,-0.4 5,-0.2 5,-0.2 3,-0.1 -0.887 19.6 179.3 -99.1 107.6 94.2 37.3 -17.6 17 17 A A - 0 0 42 3,-2.4 2,-2.0 -2,-0.8 4,-0.2 0.191 41.6-123.6 -92.4 14.2 91.3 36.5 -15.4 18 18 A I S S+ 0 0 130 2,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.459 107.8 52.1 77.1 -64.1 91.3 32.8 -16.4 19 19 A I S S- 0 0 100 -2,-2.0 2,-0.3 1,-0.1 -1,-0.2 0.471 130.0 -4.9 -79.5 -3.8 87.7 32.7 -17.6 20 20 A N - 0 0 14 85,-0.2 -3,-2.4 2,-0.0 2,-0.5 -0.949 68.6-114.6-174.5 167.3 88.4 35.8 -19.8 21 21 A E E -CD 16 104B 15 83,-2.3 83,-2.7 -2,-0.3 2,-0.4 -0.977 34.0-163.4-117.0 130.3 91.1 38.4 -20.7 22 22 A A E -CD 15 103B 6 -7,-2.6 -7,-2.8 -2,-0.5 2,-0.5 -0.910 23.6-168.5-124.3 142.3 90.4 42.0 -19.9 23 23 A F E - D 0 102B 0 79,-3.1 79,-2.7 -2,-0.4 2,-0.4 -0.908 29.8-177.8-124.5 94.0 91.8 45.4 -20.9 24 24 A L E +m 54 0C 14 29,-1.6 31,-0.9 -2,-0.5 77,-0.2 -0.805 51.7 17.1-102.8 140.0 90.2 47.8 -18.4 25 25 A G E + 0 0 12 -2,-0.4 76,-0.2 1,-0.2 -1,-0.2 0.677 66.4 165.0 80.3 21.3 90.5 51.6 -18.2 26 26 A I E - D 0 100B 0 74,-2.0 74,-2.9 -3,-0.3 2,-0.3 -0.580 37.6-127.4 -72.0 122.5 91.9 52.5 -21.6 27 27 A P E + D 0 99B 28 0, 0.0 72,-0.3 0, 0.0 3,-0.1 -0.531 30.7 176.3 -73.4 127.9 91.4 56.3 -22.1 28 28 A F + 0 0 6 70,-1.9 16,-1.6 -2,-0.3 2,-0.3 0.558 64.2 29.3-108.1 -6.6 89.6 57.1 -25.3 29 29 A A B S-N 43 0D 2 69,-1.1 -1,-0.1 14,-0.3 15,-0.1 -0.962 85.9 -93.2-148.5 160.8 89.4 60.8 -24.8 30 30 A E - 0 0 54 12,-2.7 12,-0.4 -2,-0.3 14,-0.1 -0.423 64.5 -85.2 -67.5 147.5 91.2 63.8 -23.2 31 31 A P - 0 0 35 0, 0.0 2,-2.1 0, 0.0 65,-0.2 -0.424 33.8-134.3 -60.0 124.7 89.8 64.5 -19.7 32 32 A P + 0 0 4 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.145 64.2 128.7 -75.5 48.2 86.7 66.8 -20.0 33 33 A V > + 0 0 63 -2,-2.1 3,-1.7 3,-0.1 2,-0.2 -0.534 54.3 4.0-104.5 164.2 88.0 69.0 -17.2 34 34 A G G > S- 0 0 40 1,-0.3 3,-1.3 2,-0.2 0, 0.0 -0.424 136.4 -4.9 67.8-129.0 88.5 72.7 -16.9 35 35 A N G 3 S+ 0 0 131 1,-0.2 -1,-0.3 -2,-0.2 245,-0.1 0.407 127.4 73.2 -77.9 1.1 87.3 74.7 -19.9 36 36 A L G X S+ 0 0 59 -3,-1.7 3,-1.3 -5,-0.1 -1,-0.2 0.421 72.5 123.8 -89.9 -2.3 86.5 71.3 -21.6 37 37 A R T < S+ 0 0 9 -3,-1.3 -4,-0.1 1,-0.2 3,-0.1 -0.294 78.4 4.7 -60.7 143.8 83.5 70.9 -19.3 38 38 A F T 3 S+ 0 0 4 123,-0.5 -1,-0.2 -6,-0.2 139,-0.2 0.388 110.6 117.0 60.6 0.5 80.1 70.4 -20.8 39 39 A K S < S- 0 0 76 -3,-1.3 -1,-0.2 1,-0.2 3,-0.1 -0.515 77.1 -77.0 -98.8 165.4 81.9 70.3 -24.2 40 40 A D - 0 0 75 -2,-0.2 -1,-0.2 133,-0.2 2,-0.1 -0.140 59.3 -98.3 -52.8 145.4 82.3 67.6 -27.0 41 41 A P - 0 0 19 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.414 31.7-138.0 -72.6 143.8 84.9 64.9 -26.1 42 42 A V - 0 0 58 -12,-0.4 -12,-2.7 -3,-0.1 3,-0.1 -0.888 27.1-107.9-101.8 131.4 88.4 65.3 -27.6 43 43 A P B -N 29 0D 79 0, 0.0 2,-0.4 0, 0.0 -14,-0.3 -0.222 41.6-100.4 -55.9 146.1 90.0 62.2 -29.0 44 44 A Y - 0 0 89 -16,-1.6 2,-0.5 -15,-0.1 -15,-0.0 -0.598 39.5-176.0 -74.6 126.1 92.9 60.9 -26.8 45 45 A S + 0 0 94 -2,-0.4 2,-0.3 -3,-0.1 -17,-0.0 -0.968 43.5 78.2-123.7 107.1 96.3 61.9 -28.2 46 46 A G S S- 0 0 42 -2,-0.5 2,-0.4 0, 0.0 -2,-0.0 -0.955 79.1 -69.1 179.0-167.6 99.1 60.4 -26.1 47 47 A S + 0 0 69 -2,-0.3 -2,-0.1 1,-0.1 0, 0.0 -0.924 28.8 171.1-119.5 138.7 100.9 57.2 -25.7 48 48 A L > + 0 0 6 -2,-0.4 3,-2.4 3,-0.1 -1,-0.1 0.193 38.0 142.7-115.8 4.6 99.7 54.0 -24.1 49 49 A D T 3 S+ 0 0 100 1,-0.3 -37,-0.2 -39,-0.1 3,-0.1 -0.211 76.0 1.0 -52.6 130.0 102.8 52.1 -25.3 50 50 A G T 3 S+ 0 0 63 -39,-2.0 -1,-0.3 1,-0.2 2,-0.2 0.655 100.0 142.4 64.4 19.2 103.9 49.6 -22.7 51 51 A Q < - 0 0 85 -3,-2.4 -38,-2.3 -40,-0.4 2,-0.4 -0.621 46.6-132.2 -96.9 149.7 101.0 50.4 -20.4 52 52 A K B -b 13 0A 162 -2,-0.2 2,-0.4 -40,-0.2 -38,-0.2 -0.857 15.5-172.7 -99.6 135.3 99.1 48.0 -18.2 53 53 A F + 0 0 14 -40,-2.8 -29,-1.6 -2,-0.4 -38,-0.4 -0.753 32.6 135.3-128.5 82.0 95.3 48.1 -18.2 54 54 A T B +m 24 0C 58 -2,-0.4 2,-0.3 -31,-0.2 -29,-0.1 0.209 59.2 43.1-116.9 14.0 94.1 45.8 -15.5 55 55 A S S S- 0 0 79 -31,-0.9 -1,-0.1 -3,-0.1 2,-0.1 -0.988 82.0 -99.5-158.4 149.0 91.4 47.7 -13.7 56 56 A Y - 0 0 66 -2,-0.3 3,-0.1 1,-0.1 -32,-0.1 -0.398 39.4-129.6 -66.0 146.8 88.4 49.9 -14.3 57 57 A G - 0 0 26 1,-0.2 74,-0.2 40,-0.1 40,-0.1 -0.141 43.0 -66.8 -85.4-174.2 89.0 53.6 -14.0 58 58 A P - 0 0 41 0, 0.0 35,-0.3 0, 0.0 41,-0.2 -0.419 52.3-116.0 -75.0 154.7 86.7 55.9 -11.9 59 59 A S B -o 93 0E 9 33,-2.2 35,-3.5 1,-0.2 70,-0.1 -0.417 40.7 -90.5 -77.4 165.9 83.2 56.5 -13.1 60 60 A a - 0 0 3 68,-0.4 35,-0.2 96,-0.3 -1,-0.2 -0.217 67.9 -62.1 -69.7 170.5 82.2 60.0 -14.1 61 61 A M - 0 0 14 33,-0.2 97,-0.4 32,-0.2 2,-0.3 -0.211 59.1-139.4 -57.8 143.6 80.7 62.2 -11.4 62 62 A Q - 0 0 25 -3,-0.1 2,-0.4 65,-0.1 65,-0.2 -0.778 1.9-136.6-107.4 152.1 77.5 60.9 -9.9 63 63 A Q - 0 0 0 63,-2.1 63,-0.1 -2,-0.3 96,-0.1 -0.877 30.1-107.6-106.9 142.4 74.3 62.8 -8.8 64 64 A N > - 0 0 0 -2,-0.4 3,-2.7 1,-0.2 233,-0.1 -0.556 25.6-143.9 -66.7 113.6 72.5 62.0 -5.6 65 65 A P T 3 S+ 0 0 20 0, 0.0 232,-2.2 0, 0.0 233,-0.7 0.763 102.1 47.3 -49.7 -31.8 69.4 60.2 -6.8 66 66 A E T 3 S+ 0 0 45 8,-0.2 9,-0.1 231,-0.2 233,-0.1 0.066 86.7 132.9 -97.6 18.9 67.4 61.9 -4.0 67 67 A G < + 0 0 0 -3,-2.7 228,-3.0 8,-0.1 2,-0.3 -0.323 20.7 141.2 -69.8 157.2 68.9 65.3 -4.8 68 68 A T - 0 0 6 223,-1.5 225,-0.3 226,-0.3 4,-0.1 -0.894 64.6-101.1 176.2 161.6 66.6 68.3 -5.0 69 69 A Y S S+ 0 0 135 -2,-0.3 2,-0.1 2,-0.1 224,-0.1 0.604 102.4 83.6 -72.5 -14.3 66.6 72.0 -4.0 70 70 A E S S- 0 0 105 -3,-0.0 2,-0.4 1,-0.0 -2,-0.2 -0.447 82.5-125.3 -83.4 162.6 64.4 70.9 -1.1 71 71 A E + 0 0 148 -2,-0.1 2,-0.3 -4,-0.1 -2,-0.1 -0.914 44.8 141.2-112.3 135.3 66.0 69.6 2.1 72 72 A N > - 0 0 65 -2,-0.4 4,-2.3 -4,-0.1 5,-0.1 -0.971 57.8 -92.9-160.9 175.3 64.9 66.2 3.4 73 73 A L H > S+ 0 0 140 -2,-0.3 4,-3.2 2,-0.2 5,-0.2 0.903 116.3 47.6 -65.5 -51.5 66.0 62.9 5.0 74 74 A P H > S+ 0 0 56 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.876 113.4 51.0 -62.3 -33.2 66.6 60.7 2.0 75 75 A K H > S+ 0 0 10 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.985 113.9 44.7 -62.6 -53.8 68.6 63.5 0.4 76 76 A A H X S+ 0 0 56 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.880 113.9 49.8 -54.0 -48.5 70.6 63.8 3.7 77 77 A A H X S+ 0 0 45 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.876 111.4 46.0 -60.7 -47.6 71.1 60.0 4.0 78 78 A L H X S+ 0 0 56 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.810 112.2 52.1 -68.3 -32.7 72.3 59.3 0.5 79 79 A D H X S+ 0 0 53 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.901 106.7 53.2 -68.6 -40.1 74.7 62.3 0.7 80 80 A L H < S+ 0 0 131 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.911 116.4 40.1 -58.9 -45.2 76.1 60.9 4.0 81 81 A V H >< S+ 0 0 70 -4,-1.8 3,-1.7 1,-0.2 6,-0.3 0.961 114.9 50.4 -70.4 -52.0 76.7 57.6 2.2 82 82 A M H 3< S+ 0 0 21 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.771 111.0 47.4 -61.1 -30.7 78.0 59.0 -1.1 83 83 A Q T 3< S+ 0 0 57 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.386 87.3 119.3 -93.7 7.4 80.5 61.3 0.4 84 84 A S <> - 0 0 38 -3,-1.7 4,-2.9 1,-0.1 5,-0.2 -0.424 69.6-130.9 -75.3 146.6 81.9 58.7 2.7 85 85 A K H > S+ 0 0 157 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.854 110.1 55.3 -63.7 -30.8 85.5 57.6 2.4 86 86 A V H > S+ 0 0 111 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.922 111.5 43.0 -66.6 -44.7 84.4 54.0 2.4 87 87 A F H > S+ 0 0 70 -6,-0.3 4,-3.1 1,-0.2 -2,-0.2 0.906 113.2 51.2 -67.1 -44.8 82.1 54.7 -0.6 88 88 A E H < S+ 0 0 67 -4,-2.9 -1,-0.2 2,-0.2 -2,-0.2 0.709 111.6 50.5 -67.5 -18.0 84.7 56.8 -2.4 89 89 A A H < S+ 0 0 75 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.935 118.0 34.9 -82.4 -52.2 87.2 54.0 -1.9 90 90 A V H < S+ 0 0 125 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.793 133.3 28.9 -72.6 -30.8 85.0 51.2 -3.2 91 91 A S S < S- 0 0 41 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.1 -0.606 78.7-172.7-133.8 75.2 83.3 53.4 -5.9 92 92 A P - 0 0 61 0, 0.0 -33,-2.2 0, 0.0 2,-0.3 -0.431 2.5-168.8 -71.5 138.5 85.6 56.2 -7.1 93 93 A S B +o 59 0E 40 -35,-0.3 2,-0.3 -2,-0.1 -33,-0.2 -0.930 9.7 168.2-126.0 150.9 84.2 58.9 -9.4 94 94 A S - 0 0 43 -35,-3.5 -33,-0.2 -2,-0.3 -37,-0.0 -0.990 45.9-124.1-159.4 155.8 86.0 61.5 -11.3 95 95 A E S S+ 0 0 18 -2,-0.3 2,-1.3 -35,-0.2 3,-0.3 0.743 110.0 68.3 -71.3 -25.8 85.5 64.2 -14.1 96 96 A D + 0 0 76 1,-0.2 -1,-0.2 -65,-0.2 -66,-0.0 -0.789 68.5 119.3 -92.7 94.1 88.4 62.4 -15.8 97 97 A a + 0 0 0 -2,-1.3 2,-2.2 -40,-0.1 -1,-0.2 0.329 19.2 123.7-141.4 2.5 86.4 59.3 -16.5 98 98 A L + 0 0 1 -3,-0.3 -70,-1.9 -69,-0.1 -69,-1.1 -0.432 40.6 135.6 -77.0 74.7 86.3 58.8 -20.2 99 99 A T E -D 27 0B 11 -2,-2.2 56,-1.9 -72,-0.3 2,-0.3 -0.752 41.7-142.5-117.8 163.7 87.7 55.3 -20.4 100 100 A I E -DE 26 154B 0 -74,-2.9 -74,-2.0 -2,-0.2 2,-0.4 -0.932 7.3-150.0-129.8 148.0 86.8 52.1 -22.4 101 101 A N E - E 0 153B 0 52,-2.3 52,-1.7 -2,-0.3 2,-0.5 -0.980 6.3-168.3-124.4 126.9 86.9 48.4 -21.4 102 102 A V E +DE 23 152B 0 -79,-2.7 -79,-3.1 -2,-0.4 2,-0.4 -0.952 8.2 178.4-115.9 127.1 87.5 45.4 -23.7 103 103 A V E +DE 22 151B 4 48,-2.4 48,-2.3 -2,-0.5 -81,-0.2 -0.996 7.3 174.9-130.5 129.9 86.9 41.8 -22.4 104 104 A R E -D 21 0B 8 -83,-2.7 -83,-2.3 -2,-0.4 46,-0.1 -0.834 38.5 -86.9-133.2 164.1 87.3 38.7 -24.5 105 105 A P > - 0 0 7 0, 0.0 3,-1.6 0, 0.0 -85,-0.2 -0.398 63.3 -89.7 -64.0 148.6 87.2 34.9 -24.3 106 106 A P T 3 S+ 0 0 59 0, 0.0 -90,-0.0 0, 0.0 -87,-0.0 -0.350 111.8 28.8 -64.2 141.1 90.6 33.5 -23.3 107 107 A G T 3 S+ 0 0 45 1,-0.3 -87,-0.0 -3,-0.1 2,-0.0 0.295 81.3 149.0 96.9 -8.8 92.9 32.7 -26.1 108 108 A T < - 0 0 15 -3,-1.6 -1,-0.3 1,-0.0 2,-0.3 -0.321 23.9-171.8 -64.3 137.7 91.6 35.3 -28.5 109 109 A K > - 0 0 142 88,-0.1 3,-2.0 1,-0.0 87,-0.1 -0.879 35.6 -78.9-127.1 159.6 94.1 36.8 -30.9 110 110 A A T 3 S+ 0 0 70 -2,-0.3 85,-0.2 1,-0.3 84,-0.1 -0.322 118.1 33.3 -57.9 137.7 94.1 39.7 -33.4 111 111 A G T 3 S+ 0 0 51 83,-1.0 -1,-0.3 87,-0.2 84,-0.1 0.255 77.1 118.8 97.6 -11.2 92.3 38.6 -36.5 112 112 A A < - 0 0 53 -3,-2.0 86,-0.2 82,-0.2 -2,-0.1 0.852 60.9-152.4 -55.3 -34.1 89.8 36.3 -34.8 113 113 A N + 0 0 84 81,-0.2 85,-0.3 85,-0.2 86,-0.1 0.831 25.3 174.5 62.5 37.8 87.0 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 -0.368 39.4 -97.1 -71.3 151.0 84.5 37.8 -33.3 115 115 A P E - 0 0 11 0, 0.0 35,-2.5 0, 0.0 2,-0.4 -0.377 41.2-132.6 -66.7 151.2 81.2 39.7 -33.2 116 116 A V E -fg 203 150B 0 86,-2.8 88,-2.7 83,-0.3 2,-0.7 -0.917 14.3-162.1-113.0 132.2 81.3 42.7 -30.8 117 117 A M E -fg 204 151B 0 33,-3.1 35,-2.9 -2,-0.4 2,-0.9 -0.919 10.7-162.2-112.4 102.3 78.7 43.6 -28.1 118 118 A L E -fg 205 152B 1 86,-2.2 88,-2.0 -2,-0.7 2,-0.3 -0.787 11.6-149.8 -90.6 107.6 79.1 47.2 -27.1 119 119 A W E -fg 206 153B 3 33,-3.5 35,-1.2 -2,-0.9 2,-0.5 -0.548 12.4-168.0 -80.4 134.6 77.3 47.8 -23.8 120 120 A I E -f 207 0B 0 86,-2.3 88,-0.9 -2,-0.3 95,-0.1 -0.951 21.9-138.4-123.7 106.9 75.8 51.2 -22.8 121 121 A F - 0 0 1 -2,-0.5 2,-0.5 33,-0.4 93,-0.1 -0.207 6.8-138.7 -65.8 154.4 74.8 51.3 -19.1 122 122 A G + 0 0 13 88,-0.2 7,-0.1 89,-0.1 87,-0.1 -0.956 36.9 148.1-118.7 129.1 71.6 52.9 -17.8 123 123 A G S >> S- 0 0 12 -2,-0.5 3,-1.6 5,-0.1 4,-1.5 -0.082 78.1 -84.6-149.1 39.4 71.5 55.0 -14.7 124 124 A G T 34 S- 0 0 18 1,-0.3 182,-0.2 2,-0.2 4,-0.1 0.677 73.6 -79.5 62.8 22.8 68.8 57.5 -15.3 125 125 A F T 34 S+ 0 0 5 2,-0.3 34,-3.2 1,-0.1 -1,-0.3 0.632 130.4 75.8 57.4 21.2 71.3 59.8 -17.2 126 126 A E T <4 S+ 0 0 0 -3,-1.6 -63,-2.1 1,-0.3 2,-0.3 0.493 98.6 13.6-133.4 -16.3 72.4 60.9 -13.7 127 127 A V S < S+ 0 0 24 -4,-1.5 -1,-0.3 -65,-0.2 -2,-0.3 -0.903 73.0 98.2-150.7 174.6 74.6 58.0 -12.2 128 128 A G - 0 0 15 -2,-0.3 -68,-0.4 -68,-0.2 2,-0.3 -0.254 29.2-162.4 121.2 156.8 76.2 54.9 -13.4 129 129 A G > - 0 0 2 -70,-0.1 3,-0.7 -7,-0.1 -7,-0.1 -0.968 34.3-108.8-165.5 163.9 79.5 53.3 -14.6 130 130 A T G > S+ 0 0 4 -2,-0.3 3,-1.9 1,-0.2 -1,-0.1 0.788 102.5 74.4 -71.9 -30.8 80.8 50.3 -16.4 131 131 A S G 3 S+ 0 0 53 1,-0.3 -1,-0.2 -74,-0.2 -75,-0.1 0.657 89.9 60.0 -59.9 -19.3 82.3 48.5 -13.4 132 132 A T G < S+ 0 0 71 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.1 0.416 90.5 73.2 -91.2 2.8 78.9 47.4 -12.2 133 133 A F S < S- 0 0 22 -3,-1.9 -1,-0.2 -4,-0.0 -14,-0.1 -0.683 75.1-153.7-121.9 80.1 78.0 45.5 -15.2 134 134 A P > - 0 0 36 0, 0.0 3,-0.5 0, 0.0 4,-0.4 -0.308 8.1-164.7 -55.2 114.7 80.0 42.2 -15.2 135 135 A P T 3> + 0 0 10 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.610 68.3 92.4 -77.8 -11.2 80.6 40.8 -18.8 136 136 A A H 3> S+ 0 0 31 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.848 81.9 50.9 -53.5 -44.1 81.7 37.4 -17.6 137 137 A Q H <> S+ 0 0 31 -3,-0.5 4,-2.4 320,-0.3 -1,-0.2 0.954 115.1 44.3 -61.8 -45.6 78.2 35.7 -17.6 138 138 A M H > S+ 0 0 0 -4,-0.4 4,-2.5 318,-0.2 -2,-0.2 0.976 115.1 47.2 -59.4 -59.8 77.7 36.9 -21.2 139 139 A I H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 10,-0.2 0.913 113.0 49.1 -50.8 -48.4 81.2 36.0 -22.4 140 140 A T H >X S+ 0 0 66 -4,-2.8 4,-2.5 -5,-0.2 3,-0.6 0.958 109.9 48.8 -62.3 -50.1 81.1 32.5 -20.9 141 141 A K H 3X S+ 0 0 42 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.899 107.8 57.7 -57.5 -35.9 77.7 31.6 -22.2 142 142 A S H 3<>S+ 0 0 0 -4,-2.5 5,-3.2 1,-0.2 4,-0.3 0.874 107.7 46.1 -63.1 -35.8 78.9 32.7 -25.7 143 143 A I H X<5S+ 0 0 72 -4,-1.6 3,-1.4 -3,-0.6 -1,-0.2 0.935 111.5 51.2 -69.8 -46.1 81.8 30.3 -25.6 144 144 A A H 3<5S+ 0 0 84 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.847 110.4 50.4 -58.7 -36.5 79.5 27.5 -24.3 145 145 A M T 3<5S- 0 0 46 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.561 114.4-119.1 -77.7 -11.4 77.1 28.3 -27.2 146 146 A G T < 5S+ 0 0 59 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.802 90.3 104.0 76.6 24.2 80.0 28.1 -29.7 147 147 A K < - 0 0 45 -5,-3.2 -4,-0.2 -6,-0.2 -3,-0.1 -0.470 57.2-168.8-134.4 62.1 79.4 31.7 -30.6 148 148 A P - 0 0 45 0, 0.0 2,-0.3 0, 0.0 -9,-0.1 -0.221 7.8-176.8 -56.5 137.9 82.2 33.6 -28.8 149 149 A I - 0 0 0 -10,-0.2 2,-0.5 -35,-0.2 -33,-0.2 -0.886 25.8-120.6-134.2 162.6 81.8 37.4 -28.6 150 150 A I E - g 0 116B 0 -35,-2.5 -33,-3.1 -2,-0.3 2,-0.5 -0.924 23.6-144.6-107.9 131.0 83.8 40.3 -27.4 151 151 A H E -Eg 103 117B 4 -48,-2.3 -48,-2.4 -2,-0.5 2,-0.4 -0.831 19.3-178.0 -98.0 123.7 82.2 42.5 -24.7 152 152 A V E -Eg 102 118B 0 -35,-2.9 -33,-3.5 -2,-0.5 2,-0.3 -0.951 2.4-174.3-122.2 141.5 83.0 46.2 -24.9 153 153 A S E -Eg 101 119B 5 -52,-1.7 -52,-2.3 -2,-0.4 2,-0.4 -0.995 6.8-156.3-135.7 145.9 81.8 48.9 -22.5 154 154 A V E -E 100 0B 0 -35,-1.2 -33,-0.4 -2,-0.3 2,-0.2 -0.958 11.3-137.3-129.0 136.5 82.1 52.7 -22.5 155 155 A N - 0 0 2 -56,-1.9 2,-0.3 -2,-0.4 30,-0.1 -0.587 27.3-178.7 -82.7 152.2 82.0 55.3 -19.8 156 156 A Y - 0 0 0 -2,-0.2 -96,-0.3 -28,-0.2 2,-0.2 -0.976 33.3 -93.6-151.6 150.7 80.1 58.5 -20.5 157 157 A R - 0 0 6 -2,-0.3 2,-0.2 20,-0.1 24,-0.1 -0.548 44.0-167.3 -68.1 135.2 79.3 61.7 -18.6 158 158 A V >> + 0 0 0 -97,-0.4 4,-0.9 -2,-0.2 3,-0.7 -0.695 43.9 5.2-120.6 167.4 76.1 61.8 -16.7 159 159 A S H >> S- 0 0 0 -34,-3.2 4,-2.8 1,-0.2 3,-0.9 -0.132 126.3 -15.1 58.5-151.6 73.9 64.4 -14.9 160 160 A S H 3> S+ 0 0 0 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.843 136.5 59.5 -49.6 -40.3 75.0 68.1 -15.3 161 161 A W H <4 S+ 0 0 8 -3,-0.7 -123,-0.5 1,-0.2 -1,-0.2 0.874 122.4 19.6 -60.6 -37.0 78.4 67.1 -16.5 162 162 A G H << S+ 0 0 2 -3,-0.9 16,-3.2 -4,-0.9 17,-0.4 0.621 132.2 34.7-111.8 -11.9 77.1 65.2 -19.5 163 163 A F H < + 0 0 7 -4,-2.8 144,-0.6 14,-0.2 -3,-0.2 0.005 68.8 145.5-134.7 31.7 73.5 66.5 -20.2 164 164 A L < + 0 0 8 -4,-0.8 12,-0.4 -5,-0.2 13,-0.2 -0.439 25.3 175.5 -67.6 146.8 73.4 70.1 -19.3 165 165 A A + 0 0 10 90,-0.4 4,-0.4 10,-0.1 3,-0.2 -0.457 17.8 103.6-134.1-159.8 71.0 72.1 -21.5 166 166 A G S > S- 0 0 0 84,-2.8 4,-1.9 1,-0.2 5,-0.2 -0.310 80.9 -53.3 105.1 173.5 69.5 75.5 -22.1 167 167 A D H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.901 131.9 48.4 -51.5 -52.5 70.0 78.5 -24.4 168 168 A E H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.922 110.6 50.8 -57.6 -49.8 73.7 78.9 -23.8 169 169 A I H >>S+ 0 0 0 -4,-0.4 5,-2.1 2,-0.2 4,-1.0 0.845 112.7 47.4 -58.4 -37.2 74.4 75.2 -24.3 170 170 A K H ><5S+ 0 0 80 -4,-1.9 3,-1.1 2,-0.2 -2,-0.2 0.977 109.3 51.9 -68.1 -53.9 72.5 75.3 -27.6 171 171 A A H 3<5S+ 0 0 94 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.825 112.4 47.9 -49.3 -38.7 74.2 78.5 -28.8 172 172 A E H 3<5S- 0 0 69 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.725 109.4-121.4 -78.8 -22.7 77.6 76.8 -28.1 173 173 A G T <<5S+ 0 0 40 -3,-1.1 -3,-0.2 -4,-1.0 -133,-0.2 0.775 74.4 124.8 84.1 30.8 76.8 73.5 -29.8 174 174 A S > < + 0 0 5 -5,-2.1 3,-0.6 -6,-0.2 -4,-0.2 0.068 28.5 136.8-110.3 25.3 77.5 71.5 -26.7 175 175 A A T 3 + 0 0 3 -6,-0.3 -10,-0.1 1,-0.2 5,-0.1 -0.357 68.1 11.6 -74.5 151.7 74.2 69.6 -26.3 176 176 A N T >> + 0 0 6 -12,-0.4 4,-1.4 131,-0.2 3,-0.8 0.843 68.4 166.7 52.5 48.6 74.1 65.9 -25.3 177 177 A A H <> S+ 0 0 2 -3,-0.6 4,-1.8 1,-0.3 3,-0.3 0.892 73.3 56.9 -59.4 -40.3 77.8 65.7 -24.4 178 178 A G H 3> S+ 0 0 0 -16,-3.2 4,-1.7 1,-0.3 -1,-0.3 0.801 105.6 49.9 -61.6 -32.0 77.3 62.3 -22.7 179 179 A L H <> S+ 0 0 0 -3,-0.8 4,-1.7 -17,-0.4 -1,-0.3 0.800 108.4 54.0 -75.2 -30.1 75.9 60.8 -25.9 180 180 A K H X S+ 0 0 18 -4,-1.4 4,-2.3 -3,-0.3 -2,-0.2 0.831 103.1 55.5 -72.0 -33.1 78.9 62.2 -27.8 181 181 A D H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 3,-0.4 0.984 109.3 48.3 -62.1 -48.3 81.2 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 0.837 109.8 52.2 -57.8 -38.7 79.3 57.3 -26.3 183 183 A R H X S+ 0 0 14 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.859 107.8 50.4 -68.1 -37.5 79.7 58.1 -30.0 184 184 A L H X S+ 0 0 22 -4,-2.3 4,-2.8 -3,-0.4 -2,-0.2 0.893 106.0 56.6 -67.4 -40.3 83.5 58.6 -29.7 185 185 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.908 106.9 50.3 -57.0 -42.3 83.8 55.2 -28.0 186 186 A M H X S+ 0 0 4 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.957 109.6 49.2 -60.2 -49.4 82.1 53.7 -31.0 187 187 A Q H X S+ 0 0 55 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.895 110.1 53.0 -59.1 -35.5 84.5 55.4 -33.4 188 188 A W H X S+ 0 0 28 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.882 108.1 49.4 -66.5 -40.8 87.4 54.1 -31.1 189 189 A V H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.921 107.9 54.9 -64.1 -42.6 86.0 50.5 -31.4 190 190 A A H < S+ 0 0 32 -4,-2.6 4,-0.3 1,-0.2 -2,-0.2 0.936 116.9 36.9 -54.5 -47.5 85.8 50.9 -35.2 191 191 A D H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.831 131.5 24.0 -76.1 -34.4 89.5 51.8 -35.3 192 192 A N H >< S+ 0 0 16 -4,-2.7 3,-1.2 -5,-0.2 4,-0.5 0.676 90.6 88.3-113.0 -16.2 90.9 49.6 -32.6 193 193 A I G >X>S+ 0 0 0 -4,-2.7 5,-1.9 -5,-0.3 3,-1.6 0.803 80.5 68.1 -56.5 -31.0 88.8 46.5 -32.0 194 194 A A G >45S+ 0 0 50 -5,-0.3 3,-1.6 -4,-0.3 -83,-1.0 0.899 92.7 60.5 -54.9 -40.0 90.6 44.4 -34.7 195 195 A A G <45S+ 0 0 20 -3,-1.2 -1,-0.3 1,-0.3 -190,-0.2 0.725 106.3 48.1 -60.0 -24.3 93.7 44.5 -32.5 196 196 A F G <45S- 0 0 0 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.501 125.9 -97.1 -95.4 -6.8 91.7 42.7 -29.8 197 197 A G T <<5S+ 0 0 0 -3,-1.6 -83,-2.8 -4,-0.6 2,-0.2 0.469 83.5 124.0 105.0 2.6 90.2 40.0 -32.1 198 198 A G E < -f 114 0B 1 -5,-1.9 -1,-0.4 -85,-0.3 -87,-0.2 -0.615 60.6-123.4 -96.7 157.7 86.9 41.6 -32.8 199 199 A D E > - 0 0 25 -85,-2.8 3,-2.4 -2,-0.2 -83,-0.3 -0.887 9.7-153.8-102.3 115.7 85.4 42.5 -36.2 200 200 A P E 3 S+ 0 0 44 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.680 95.1 60.2 -60.6 -18.2 84.5 46.2 -36.6 201 201 A T E 3 S+ 0 0 88 1,-0.2 33,-0.1 33,-0.1 -11,-0.0 0.439 99.5 58.5 -88.1 -1.9 81.8 45.2 -39.1 202 202 A K E < S+ 0 0 72 -3,-2.4 -86,-2.8 -88,-0.2 2,-0.5 -0.368 71.0 142.9-124.0 53.8 79.9 43.1 -36.6 203 203 A V E -f 116 0B 3 -3,-0.4 32,-2.8 -88,-0.2 33,-1.0 -0.825 26.5-172.4 -99.3 126.6 79.1 45.5 -33.8 204 204 A T E -fh 117 236B 0 -88,-2.7 -86,-2.2 -2,-0.5 2,-0.3 -0.985 13.8-148.7-115.3 122.6 75.8 45.2 -32.0 205 205 A I E +fh 118 237B 0 31,-2.3 33,-1.9 -2,-0.5 2,-0.3 -0.728 24.2 167.4 -91.0 145.7 75.0 48.1 -29.6 206 206 A F E +fh 119 238B 1 -88,-2.0 -86,-2.3 -2,-0.3 2,-0.3 -0.961 7.3 152.3-159.6 143.6 73.0 47.4 -26.5 207 207 A G E -fh 120 239B 0 31,-1.4 33,-2.1 -2,-0.3 2,-0.4 -0.922 31.6-117.7-156.8 177.8 72.0 48.9 -23.2 208 208 A E E > S- h 0 240B 6 -88,-0.9 3,-2.6 -2,-0.3 2,-0.3 -0.976 71.7 -28.4-130.9 143.0 69.2 49.0 -20.6 209 209 A S T 3> S+ 0 0 14 31,-2.5 4,-2.5 32,-0.4 5,-0.2 -0.345 143.6 10.8 56.0-110.7 67.0 51.8 -19.4 210 210 A A H 3> S+ 0 0 2 -2,-0.3 4,-1.5 1,-0.2 -1,-0.3 0.863 134.4 53.3 -64.8 -32.0 69.1 55.0 -20.1 211 211 A G H <> S+ 0 0 0 -3,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.896 109.9 49.6 -67.3 -34.2 71.5 52.8 -22.0 212 212 A S H > S+ 0 0 0 28,-0.3 4,-2.1 29,-0.3 -2,-0.2 0.920 108.0 49.1 -70.5 -45.0 68.6 51.6 -24.1 213 213 A M H X S+ 0 0 15 -4,-2.5 4,-2.3 28,-0.3 -1,-0.2 0.836 109.8 57.7 -63.8 -25.6 67.2 55.1 -24.8 214 214 A S H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.873 101.5 52.1 -68.7 -44.4 70.8 55.8 -25.8 215 215 A V H X S+ 0 0 0 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.928 109.9 50.5 -60.9 -40.2 70.8 53.0 -28.4 216 216 A M H >X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 3,-0.6 0.939 108.1 52.3 -62.2 -48.4 67.6 54.6 -29.8 217 217 A C H 3X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.858 107.1 52.7 -55.9 -37.8 69.3 58.0 -29.9 218 218 A H H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.823 106.6 52.8 -68.7 -28.1 72.3 56.4 -31.9 219 219 A I H << S+ 0 0 0 -4,-1.4 110,-1.7 -3,-0.6 -1,-0.2 0.824 116.7 39.5 -73.1 -31.6 69.8 55.0 -34.4 220 220 A L H >< S+ 0 0 0 -4,-1.7 3,-1.0 108,-0.2 96,-0.3 0.507 88.8 123.9 -93.8 -12.4 68.4 58.5 -34.9 221 221 A W G >< S+ 0 0 10 -4,-1.1 3,-1.5 1,-0.3 4,-0.3 -0.272 83.1 3.2 -54.6 134.5 71.7 60.3 -34.7 222 222 A N G > S- 0 0 59 92,-3.1 3,-2.0 1,-0.3 -1,-0.3 0.903 132.5 -61.6 51.2 48.5 72.5 62.5 -37.7 223 223 A D G < S- 0 0 70 -3,-1.0 -1,-0.3 91,-0.4 -2,-0.2 0.703 108.5 -44.4 52.0 24.5 69.0 61.7 -39.2 224 224 A G G < S+ 0 0 12 -3,-1.5 2,-1.2 1,-0.2 -1,-0.3 0.339 98.8 135.2 107.3 -5.5 70.0 58.1 -39.4 225 225 A D < + 0 0 84 -3,-2.0 -1,-0.2 -4,-0.3 104,-0.1 -0.643 18.7 167.4 -81.9 103.1 73.5 58.2 -40.7 226 226 A N + 0 0 17 -2,-1.2 7,-3.0 -3,-0.1 8,-0.2 0.094 33.1 121.6-102.0 23.4 75.5 55.8 -38.6 227 227 A T E -P 232 0F 60 5,-0.3 2,-0.4 6,-0.1 -2,-0.0 -0.574 38.4-171.4 -92.0 156.9 78.7 55.6 -40.7 228 228 A Y E > S-P 231 0F 50 3,-3.0 3,-1.9 -2,-0.2 -2,-0.0 -0.986 81.2 -7.0-142.9 122.1 82.3 56.5 -39.8 229 229 A K T 3 S- 0 0 133 -2,-0.4 -1,-0.0 1,-0.3 -2,-0.0 0.819 134.8 -52.6 57.1 32.6 84.9 56.6 -42.5 230 230 A G T 3 S+ 0 0 66 1,-0.2 -1,-0.3 0, 0.0 -3,-0.1 0.526 121.7 95.4 83.2 3.2 82.3 55.2 -44.9 231 231 A K E < S-P 228 0F 114 -3,-1.9 -3,-3.0 -5,-0.0 -1,-0.2 -0.983 80.6-102.4-128.8 144.5 81.3 52.2 -42.8 232 232 A P E -P 227 0F 74 0, 0.0 -5,-0.3 0, 0.0 3,-0.1 -0.251 21.9-137.1 -59.6 146.5 78.4 51.8 -40.4 233 233 A L S S+ 0 0 8 -7,-3.0 2,-0.3 1,-0.2 -6,-0.1 0.597 85.2 7.8 -81.0 -14.6 79.4 52.0 -36.7 234 234 A F - 0 0 4 -8,-0.2 -1,-0.2 -33,-0.1 -30,-0.2 -0.948 54.0-149.9-164.4 145.9 77.1 49.0 -35.8 235 235 A R S S+ 0 0 56 -32,-2.8 2,-0.3 -2,-0.3 -31,-0.2 0.473 79.0 8.8 -98.7 -3.7 75.0 46.5 -37.6 236 236 A A E -h 204 0B 0 -33,-1.0 -31,-2.3 95,-0.2 2,-0.3 -0.980 58.1-141.8-164.5 173.1 72.3 45.9 -34.9 237 237 A G E -hi 205 333B 0 95,-1.3 97,-2.0 -2,-0.3 2,-0.5 -0.999 2.5-161.8-151.7 144.3 70.8 47.0 -31.6 238 238 A I E -hi 206 334B 0 -33,-1.9 -31,-1.4 -2,-0.3 2,-0.7 -0.962 12.6-165.6-128.2 112.9 69.2 45.5 -28.5 239 239 A M E -hi 207 335B 0 95,-2.9 97,-2.2 -2,-0.5 2,-0.9 -0.874 3.4-167.5-106.7 110.4 67.1 47.8 -26.4 240 240 A Q E S-hi 208 336B 0 -33,-2.1 -31,-2.5 -2,-0.7 -28,-0.3 -0.843 74.4 -21.1 -97.3 97.7 66.2 46.5 -22.9 241 241 A S S S+ 0 0 0 95,-2.8 -32,-0.4 -2,-0.9 -28,-0.3 0.999 115.0 65.2 67.6 81.0 63.5 48.8 -21.5 242 242 A G + 0 0 1 94,-0.3 -26,-0.2 -3,-0.3 173,-0.1 -0.116 38.3 170.8 140.7 120.2 63.5 52.2 -23.4 243 243 A A + 0 0 0 1,-0.5 -27,-0.2 171,-0.5 -26,-0.2 0.282 65.0 1.9-114.0-122.5 62.8 53.6 -26.9 244 244 A M S S- 0 0 1 174,-0.2 -1,-0.5 -28,-0.1 -30,-0.1 -0.322 74.0-116.5 -67.6 155.8 62.6 57.3 -27.8 245 245 A V - 0 0 1 -32,-0.2 2,-2.0 -3,-0.1 74,-0.4 -0.831 18.2-136.0 -93.9 128.2 63.1 59.9 -25.1 246 246 A P + 0 0 9 0, 0.0 288,-2.7 0, 0.0 2,-0.3 -0.359 57.7 137.5 -81.7 63.0 59.9 62.0 -24.5 247 247 A S - 0 0 2 -2,-2.0 72,-0.4 286,-0.3 3,-0.1 -0.861 50.9-132.9-122.4 149.3 61.8 65.3 -24.3 248 248 A D - 0 0 27 -2,-0.3 4,-0.1 1,-0.2 286,-0.1 -0.235 53.2 -65.2 -78.0 176.3 61.5 68.9 -25.6 249 249 A A > - 0 0 39 60,-0.2 3,-1.7 2,-0.1 6,-0.3 -0.036 45.4-107.2 -63.4 162.4 64.4 70.7 -27.2 250 250 A V T 3 S+ 0 0 2 60,-2.2 -84,-2.8 1,-0.3 -81,-0.1 0.819 122.5 45.7 -61.9 -33.9 67.6 71.6 -25.5 251 251 A D T 3 S+ 0 0 67 -86,-0.2 -1,-0.3 -84,-0.1 -84,-0.1 0.022 96.9 120.8 -97.9 25.2 66.7 75.3 -25.4 252 252 A G S <> S- 0 0 18 -3,-1.7 4,-1.2 -4,-0.1 -85,-0.2 0.116 79.8 -83.8 -72.4-163.1 63.3 74.4 -24.2 253 253 A I H > S+ 0 0 92 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.946 122.0 33.0 -76.7 -50.6 61.4 75.3 -21.0 254 254 A Y H > S+ 0 0 13 280,-0.3 4,-2.1 2,-0.2 5,-0.2 0.749 114.6 59.3 -80.6 -25.5 62.7 72.8 -18.4 255 255 A G H > S+ 0 0 4 -6,-0.3 4,-1.8 1,-0.2 -90,-0.4 0.908 109.9 44.4 -66.3 -39.5 66.2 72.6 -19.9 256 256 A N H X S+ 0 0 25 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.850 111.6 51.7 -71.1 -39.5 66.5 76.3 -19.4 257 257 A E H X S+ 0 0 101 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.931 110.8 47.9 -60.1 -54.8 65.0 76.3 -15.8 258 258 A I H X S+ 0 0 5 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.933 110.3 52.8 -54.4 -46.7 67.4 73.5 -14.7 259 259 A F H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.946 112.3 44.8 -54.2 -52.2 70.4 75.4 -16.2 260 260 A D H X S+ 0 0 66 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.888 113.3 50.2 -59.5 -43.4 69.4 78.5 -14.3 261 261 A L H X S+ 0 0 47 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.966 110.9 48.7 -60.4 -52.5 68.8 76.6 -11.1 262 262 A L H X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.899 110.5 52.7 -54.6 -42.7 72.2 74.9 -11.3 263 263 A A H X>S+ 0 0 0 -4,-2.5 5,-2.9 -5,-0.3 4,-0.7 0.938 108.8 47.6 -61.9 -47.7 73.8 78.2 -12.0 264 264 A S H ><5S+ 0 0 73 -4,-2.4 3,-1.3 4,-0.3 5,-0.3 0.940 110.6 54.5 -57.7 -44.5 72.3 79.9 -8.9 265 265 A N H 3<5S+ 0 0 56 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.873 108.7 46.5 -55.0 -45.2 73.4 76.8 -6.9 266 266 A A H 3<5S- 0 0 13 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.518 122.3-104.5 -78.6 -6.1 77.0 77.2 -8.0 267 267 A G T <<5S+ 0 0 59 -3,-1.3 -3,-0.2 -4,-0.7 3,-0.2 0.697 90.6 115.7 88.4 27.8 77.0 80.9 -7.3 268 268 A b > < + 0 0 1 -5,-2.9 3,-1.2 -6,-0.2 -4,-0.3 0.177 30.2 111.1-112.9 15.9 76.8 82.0 -10.9 269 269 A G T 3 S+ 0 0 39 -6,-0.4 -1,-0.1 -5,-0.3 -5,-0.1 0.840 83.2 45.4 -59.3 -34.2 73.4 83.7 -10.9 270 270 A S T 3 S+ 0 0 122 -3,-0.2 -1,-0.3 -6,-0.1 2,-0.1 0.437 86.8 113.7 -89.5 -3.4 75.0 87.2 -11.4 271 271 A A < - 0 0 32 -3,-1.2 3,-0.4 1,-0.1 -3,-0.0 -0.447 62.0-145.7 -71.0 143.2 77.5 86.1 -14.1 272 272 A S S S+ 0 0 133 1,-0.3 2,-0.5 -2,-0.1 -1,-0.1 0.793 102.4 34.7 -77.2 -29.8 76.9 87.6 -17.6 273 273 A D S > S+ 0 0 80 1,-0.1 4,-2.0 2,-0.0 -1,-0.3 -0.811 72.6 179.4-125.0 87.1 78.1 84.3 -19.0 274 274 A K H > S+ 0 0 41 -2,-0.5 4,-2.8 -3,-0.4 -1,-0.1 0.791 78.1 61.8 -56.7 -31.9 76.9 81.6 -16.6 275 275 A L H > S+ 0 0 4 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.954 106.6 43.4 -63.0 -47.9 78.4 78.9 -18.7 276 276 A A H > S+ 0 0 49 -3,-0.3 4,-1.3 2,-0.2 3,-0.3 0.892 111.9 54.7 -63.4 -42.3 81.9 80.2 -18.3 277 277 A b H >X S+ 0 0 40 -4,-2.0 4,-1.1 1,-0.2 3,-1.0 0.960 106.6 52.8 -56.6 -45.6 81.2 80.8 -14.6 278 278 A L H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.770 104.8 53.6 -61.2 -31.2 80.2 77.1 -14.4 279 279 A R H 3< S+ 0 0 29 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.761 107.8 54.2 -74.6 -23.4 83.5 75.9 -16.0 280 280 A G H << S+ 0 0 65 -4,-1.3 -2,-0.2 -3,-1.0 -1,-0.2 0.743 85.2 95.2 -83.4 -24.8 85.4 77.9 -13.4 281 281 A V S < S- 0 0 23 -4,-1.1 -14,-0.0 1,-0.1 -15,-0.0 -0.272 82.8-102.3 -68.5 152.2 83.9 76.5 -10.2 282 282 A S > - 0 0 61 1,-0.1 4,-1.7 4,-0.0 5,-0.2 -0.209 31.1-106.4 -66.4 167.8 85.6 73.7 -8.5 283 283 A S H > S+ 0 0 50 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.836 120.1 56.5 -63.0 -35.4 84.4 70.1 -8.8 284 284 A D H > S+ 0 0 125 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.911 107.3 46.3 -64.2 -44.2 83.0 70.3 -5.2 285 285 A T H > S+ 0 0 53 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.842 115.9 46.8 -66.4 -35.7 80.9 73.3 -5.9 286 286 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.954 112.8 48.0 -72.9 -46.8 79.6 71.7 -9.1 287 287 A E H X S+ 0 0 26 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.906 116.1 45.9 -58.7 -41.1 78.9 68.4 -7.4 288 288 A D H X S+ 0 0 94 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.953 110.9 50.6 -66.7 -50.9 77.2 70.3 -4.6 289 289 A A H >< S+ 0 0 0 -4,-2.7 3,-0.5 1,-0.2 -1,-0.2 0.823 110.3 51.3 -56.6 -35.5 75.1 72.5 -6.9 290 290 A T H >< S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.2 -1,-0.2 0.880 103.2 57.0 -71.3 -39.5 74.0 69.4 -8.9 291 291 A N H 3< S+ 0 0 5 -4,-1.7 -223,-1.5 1,-0.3 -1,-0.2 0.589 99.7 62.6 -69.6 -6.9 72.8 67.6 -5.9 292 292 A N T << S+ 0 0 33 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.120 93.4 73.7-101.7 15.5 70.6 70.6 -5.2 293 293 A T S < S- 0 0 0 -3,-1.8 2,-0.0 -225,-0.3 12,-0.0 -0.866 106.4 -71.5-118.4 156.4 68.7 70.0 -8.4 294 294 A P - 0 0 1 0, 0.0 11,-0.5 0, 0.0 -226,-0.3 -0.269 44.8-153.0 -57.1 131.0 66.2 67.1 -8.6 295 295 A G > - 0 0 2 -228,-3.0 3,-1.9 -4,-0.1 6,-0.3 -0.573 35.0 -97.9 -94.5 164.9 67.5 63.5 -8.7 296 296 A F T 3 S+ 0 0 37 1,-0.3 -230,-0.1 -2,-0.2 52,-0.1 0.745 122.2 49.9 -58.2 -26.9 65.6 60.7 -10.4 297 297 A L T 3 S+ 0 0 51 -232,-2.2 -1,-0.3 3,-0.1 -231,-0.2 0.499 91.0 102.3 -89.4 -6.5 64.1 59.4 -7.2 298 298 A A S X S- 0 0 8 -3,-1.9 3,-1.7 -233,-0.7 50,-0.1 -0.147 98.4 -87.1 -67.4 174.7 62.9 62.8 -6.1 299 299 A Y T 3 S+ 0 0 76 1,-0.3 3,-0.1 -233,-0.1 -1,-0.1 0.789 125.3 67.3 -53.7 -34.5 59.3 63.8 -6.4 300 300 A S T > S+ 0 0 25 -5,-0.2 3,-1.9 1,-0.2 -1,-0.3 0.785 78.3 166.7 -58.0 -30.3 59.9 65.0 -10.0 301 301 A S T < + 0 0 1 -3,-1.7 -1,-0.2 -6,-0.3 -3,-0.2 -0.212 63.4 10.9 54.4-132.5 60.5 61.4 -10.9 302 302 A L T 3 S+ 0 0 24 1,-0.2 2,-2.7 -3,-0.1 -1,-0.3 0.624 107.5 88.4 -47.0 -30.4 60.5 60.7 -14.7 303 303 A R S < S- 0 0 42 -3,-1.9 -1,-0.2 -7,-0.1 -2,-0.1 -0.521 79.9-162.5 -73.9 73.7 60.6 64.5 -15.4 304 304 A L - 0 0 22 -2,-2.7 3,-0.1 1,-0.1 -9,-0.1 -0.248 28.6-142.2 -65.3 146.5 64.4 64.2 -15.2 305 305 A S S S+ 0 0 6 -11,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.833 93.4 35.9 -74.1 -32.6 66.6 67.3 -14.8 306 306 A Y S S+ 0 0 1 -182,-0.2 -1,-0.2 -142,-0.1 -147,-0.1 -0.982 76.8 119.7-129.7 126.6 69.2 65.8 -17.2 307 307 A L - 0 0 9 -144,-0.6 -131,-0.2 -2,-0.4 2,-0.1 -0.972 65.3 -62.7-172.9 162.5 68.4 63.7 -20.3 308 308 A P - 0 0 0 0, 0.0 -61,-0.1 0, 0.0 -145,-0.1 -0.381 53.9-175.7 -58.5 132.3 68.9 63.6 -24.1 309 309 A R - 0 0 4 -2,-0.1 -60,-0.2 -63,-0.0 -59,-0.2 -0.995 34.0 -98.3-134.5 137.2 67.1 66.5 -25.8 310 310 A P - 0 0 8 0, 0.0 -60,-2.2 0, 0.0 6,-0.2 -0.280 36.6-179.3 -54.1 130.5 66.7 67.3 -29.5 311 311 A D - 0 0 7 4,-1.4 5,-0.2 -62,-0.2 -136,-0.1 0.513 38.5-123.1-110.1 -11.0 69.3 69.9 -30.5 312 312 A G S S+ 0 0 45 3,-2.8 4,-0.3 1,-0.1 -63,-0.0 0.480 99.9 66.4 80.3 0.6 68.5 70.4 -34.1 313 313 A V S S+ 0 0 93 2,-0.5 3,-0.2 4,-0.0 -1,-0.1 0.735 118.4 4.7-116.0 -63.1 72.1 69.4 -35.0 314 314 A N S S+ 0 0 34 1,-0.4 -92,-3.1 -92,-0.1 2,-0.5 0.658 145.0 32.9 -99.5 -24.2 72.7 65.7 -34.2 315 315 A I S S- 0 0 0 -94,-0.2 -3,-2.8 -93,-0.1 -4,-1.4 -0.938 82.8-168.7-128.4 98.1 69.1 64.9 -33.2 316 316 A T - 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