==== 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 LIPASE 08-FEB-95 1CLE . COMPND 2 MOLECULE: CHOLESTEROL ESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CANDIDA CYLINDRACEA; . AUTHOR D.GHOSH . 1068 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36468.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 695 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 5.9 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 2 0.2 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 . 57 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 136 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 273 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.2 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 3 2 7 3 4 4 4 6 2 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 2 4 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 2 3 3 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 . 2 2 0 0 0 0 0 0 0 1 1 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 0 114 0, 0.0 2,-0.2 0, 0.0 14,-0.1 0.000 360.0 360.0 360.0 -43.0 10.4 -28.0 27.4 2 2 A P - 0 0 11 0, 0.0 12,-3.1 0, 0.0 2,-0.3 -0.520 360.0-173.6 -63.7 126.9 9.1 -29.4 24.1 3 3 A T E -A 13 0A 73 10,-0.2 2,-0.3 -2,-0.2 10,-0.2 -0.915 15.7-171.7-125.4 156.8 11.9 -31.8 23.1 4 4 A A E -A 12 0A 5 8,-2.5 8,-3.0 -2,-0.3 2,-0.5 -0.993 17.8-135.8-144.5 149.0 12.6 -33.9 20.0 5 5 A K E -A 11 0A 114 190,-0.7 6,-0.2 -2,-0.3 190,-0.2 -0.922 20.0-147.9-109.7 123.0 15.2 -36.5 19.1 6 6 A L > - 0 0 11 4,-2.6 3,-2.1 -2,-0.5 186,-0.1 -0.378 33.0 -98.0 -82.8 167.8 16.9 -36.4 15.7 7 7 A A T 3 S+ 0 0 70 1,-0.3 -1,-0.1 2,-0.1 185,-0.1 0.779 123.2 54.9 -54.9 -32.1 18.0 -39.4 13.7 8 8 A N T 3 S- 0 0 98 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.509 123.2-103.2 -82.3 -4.3 21.6 -39.0 14.9 9 9 A G S < S+ 0 0 34 -3,-2.1 -2,-0.1 1,-0.3 -1,-0.0 0.278 72.8 145.1 100.5 -9.7 20.5 -39.1 18.5 10 10 A D - 0 0 15 -5,-0.1 -4,-2.6 39,-0.1 2,-0.5 -0.303 40.9-144.1 -60.3 144.8 20.8 -35.4 19.1 11 11 A T E -A 5 0A 42 -6,-0.2 39,-2.3 -3,-0.1 2,-0.3 -0.974 20.4-172.4-116.0 118.4 18.1 -34.1 21.5 12 12 A I E -A 4 0A 0 -8,-3.0 -8,-2.5 -2,-0.5 2,-0.3 -0.743 14.3-135.9-111.0 161.5 16.8 -30.7 20.7 13 13 A T E -Ab 3 52A 48 38,-1.8 40,-2.8 -2,-0.3 -10,-0.2 -0.840 21.8-173.1-114.1 150.0 14.4 -28.3 22.6 14 14 A G - 0 0 5 -12,-3.1 2,-0.5 -2,-0.3 9,-0.2 -0.439 28.5 -79.8-126.0-159.1 11.6 -26.2 21.1 15 15 A L E -C 22 0B 64 7,-3.1 7,-2.5 38,-0.4 2,-0.8 -0.930 25.0-146.4-116.2 125.7 9.0 -23.6 21.9 16 16 A N E +C 21 0B 83 -2,-0.5 5,-0.2 5,-0.2 3,-0.1 -0.845 20.0 174.8 -90.4 109.7 5.8 -24.3 23.7 17 17 A A - 0 0 37 3,-2.5 2,-2.4 -2,-0.8 4,-0.2 0.204 42.1-126.6 -99.7 17.4 3.3 -21.8 22.1 18 18 A I S S+ 0 0 129 2,-0.4 -1,-0.1 1,-0.2 3,-0.1 -0.438 107.2 54.0 70.8 -60.2 0.4 -23.3 24.1 19 19 A I S S- 0 0 91 -2,-2.4 2,-0.3 86,-0.1 -1,-0.2 0.610 129.3 -8.2 -75.5 -15.2 -1.7 -23.9 20.9 20 20 A N - 0 0 14 85,-0.2 -3,-2.5 2,-0.0 2,-0.4 -0.947 67.6-112.9-165.9 174.8 1.2 -25.8 19.4 21 21 A E E -CD 16 104B 18 83,-2.4 83,-2.9 -2,-0.3 2,-0.3 -0.998 33.6-164.9-123.8 122.9 4.9 -26.8 19.8 22 22 A A E -CD 15 103B 6 -7,-2.5 -7,-3.1 -2,-0.4 2,-0.4 -0.861 21.2-168.1-113.6 149.5 7.4 -25.3 17.4 23 23 A F E - D 0 102B 0 79,-2.1 79,-2.4 -2,-0.3 2,-0.4 -0.912 29.3-175.1-132.4 95.6 11.0 -26.2 16.5 24 24 A L E +n 54 0C 16 29,-2.1 31,-0.8 -2,-0.4 77,-0.2 -0.839 51.1 16.6-105.2 139.6 12.1 -23.3 14.5 25 25 A G E + 0 0 15 -2,-0.4 -1,-0.2 75,-0.3 76,-0.2 0.750 66.5 165.0 80.4 25.2 15.4 -22.7 12.6 26 26 A I E - D 0 100B 0 74,-1.7 74,-3.2 -3,-0.3 2,-0.3 -0.625 36.0-129.8 -73.7 121.6 16.8 -26.2 12.5 27 27 A P E + D 0 99B 27 0, 0.0 72,-0.3 0, 0.0 3,-0.1 -0.591 29.8 175.8 -75.6 136.8 19.7 -26.2 9.9 28 28 A F + 0 0 6 70,-2.3 16,-1.6 -2,-0.3 2,-0.3 0.533 63.3 30.7-115.0 -9.8 19.4 -29.0 7.3 29 29 A A B S-O 43 0D 3 69,-1.0 -1,-0.1 14,-0.3 15,-0.1 -0.922 89.3 -90.8-141.7 165.8 22.3 -28.2 5.0 30 30 A E - 0 0 49 12,-3.1 12,-0.4 -2,-0.3 14,-0.1 -0.536 63.6 -83.7 -75.9 143.1 25.7 -26.6 5.2 31 31 A P - 0 0 39 0, 0.0 2,-2.0 0, 0.0 65,-0.2 -0.272 36.6-139.2 -50.3 120.5 25.6 -22.8 4.6 32 32 A P + 0 0 4 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.254 57.5 137.9 -79.9 54.0 25.7 -22.4 0.7 33 33 A V > - 0 0 76 -2,-2.0 3,-2.5 4,-0.1 4,-0.2 -0.503 55.9 -14.8-102.3 162.6 28.1 -19.5 1.1 34 34 A G G > S+ 0 0 25 1,-0.3 3,-1.5 2,-0.2 247,-0.1 -0.188 137.1 11.0 53.3-115.5 31.2 -18.5 -0.8 35 35 A N G 3 S+ 0 0 127 1,-0.3 -1,-0.3 245,-0.1 244,-0.1 0.473 127.1 61.3 -73.6 -3.4 32.5 -21.4 -2.9 36 36 A L G X S+ 0 0 63 -3,-2.5 3,-1.5 243,-0.1 -1,-0.3 0.407 76.5 126.9 -99.7 -1.2 29.3 -23.3 -2.3 37 37 A R T < S+ 0 0 13 -3,-1.5 -4,-0.1 1,-0.3 3,-0.1 -0.255 79.2 5.9 -57.3 142.6 27.2 -20.6 -4.0 38 38 A F T 3 S+ 0 0 5 123,-0.5 -1,-0.3 -6,-0.2 139,-0.1 0.330 108.0 118.8 62.9 -1.7 24.9 -21.8 -6.8 39 39 A K S < S- 0 0 79 -3,-1.5 -1,-0.2 1,-0.2 3,-0.1 -0.452 77.7 -82.5 -93.9 163.9 25.9 -25.4 -6.0 40 40 A D - 0 0 72 -2,-0.1 -1,-0.2 1,-0.1 2,-0.1 -0.224 59.6 -99.5 -56.5 149.0 23.8 -28.4 -4.8 41 41 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -12,-0.0 -0.397 30.2-136.1 -73.8 155.0 23.2 -28.2 -1.0 42 42 A V - 0 0 61 -12,-0.4 -12,-3.1 -3,-0.1 3,-0.1 -0.947 26.5-107.3-114.5 127.1 25.4 -30.3 1.3 43 43 A P B -O 29 0D 79 0, 0.0 -14,-0.3 0, 0.0 2,-0.3 -0.157 40.3-104.7 -51.9 143.2 23.7 -32.2 4.2 44 44 A Y - 0 0 80 -16,-1.6 -14,-0.0 1,-0.1 -15,-0.0 -0.577 38.4-179.1 -71.4 136.8 24.4 -30.6 7.6 45 45 A S + 0 0 104 -2,-0.3 -1,-0.1 -3,-0.1 -17,-0.0 0.587 43.4 97.6-115.6 -15.1 27.0 -32.7 9.5 46 46 A G S S- 0 0 33 1,-0.1 2,-0.4 2,-0.0 -2,-0.0 0.070 76.5 -98.3 -66.6-178.2 27.4 -31.0 12.8 47 47 A S - 0 0 72 1,-0.1 -1,-0.1 2,-0.1 -2,-0.1 -0.898 26.4-176.7-108.4 133.8 25.8 -31.9 16.1 48 48 A L > + 0 0 7 -2,-0.4 3,-2.6 3,-0.1 -1,-0.1 0.413 34.2 142.5-105.3 -0.7 22.7 -30.0 17.4 49 49 A N T 3 S+ 0 0 96 1,-0.3 -37,-0.2 -37,-0.1 3,-0.1 -0.092 73.8 9.9 -47.5 128.0 22.5 -31.9 20.7 50 50 A G T 3 S+ 0 0 61 -39,-2.3 -1,-0.3 1,-0.3 2,-0.2 0.292 97.8 128.6 84.8 -9.1 21.4 -29.6 23.5 51 51 A Q < - 0 0 85 -3,-2.6 -38,-1.8 -40,-0.1 2,-0.4 -0.485 52.0-133.2 -82.7 151.6 20.5 -26.6 21.3 52 52 A K B -b 13 0A 146 -40,-0.2 2,-0.6 -2,-0.2 -38,-0.2 -0.873 10.2-163.0-107.3 134.4 17.2 -24.8 21.4 53 53 A F + 0 0 17 -40,-2.8 -29,-2.1 -2,-0.4 -38,-0.4 -0.734 35.4 137.6-118.6 85.2 15.2 -23.9 18.3 54 54 A T B +n 24 0C 42 -2,-0.6 2,-0.3 -31,-0.2 -1,-0.1 0.342 57.0 44.3-112.3 5.9 12.7 -21.2 19.3 55 55 A S S S- 0 0 80 -31,-0.8 2,-0.2 -40,-0.0 -1,-0.1 -0.997 82.6 -95.8-151.9 151.7 12.7 -18.7 16.4 56 56 A Y - 0 0 70 -2,-0.3 3,-0.1 1,-0.1 -32,-0.1 -0.446 40.2-131.9 -65.4 134.0 12.6 -18.4 12.6 57 57 A G - 0 0 22 1,-0.2 74,-0.1 -2,-0.2 40,-0.1 -0.139 40.7 -72.1 -75.2 179.8 16.0 -18.1 11.0 58 58 A P - 0 0 39 0, 0.0 35,-0.3 0, 0.0 41,-0.2 -0.314 50.3-109.5 -73.6 159.3 16.6 -15.4 8.4 59 59 A S B -p 93 0E 9 33,-2.6 35,-2.3 1,-0.1 3,-0.1 -0.480 38.8 -98.1 -79.8 158.4 15.2 -15.8 4.9 60 60 A a - 0 0 3 68,-0.3 35,-0.2 96,-0.3 -1,-0.1 -0.225 68.5 -62.2 -64.9 169.7 17.5 -16.5 2.0 61 61 A M - 0 0 11 33,-0.2 2,-0.4 32,-0.1 97,-0.4 -0.279 59.0-139.4 -57.9 144.6 18.4 -13.4 0.1 62 62 A Q - 0 0 28 -3,-0.1 2,-0.3 95,-0.1 65,-0.2 -0.865 0.5-137.2-114.6 138.6 15.5 -11.6 -1.6 63 63 A Q - 0 0 0 63,-2.5 63,-0.1 -2,-0.4 96,-0.1 -0.703 30.8-110.1 -91.7 139.9 15.3 -9.9 -5.0 64 64 A N > - 0 0 0 -2,-0.3 3,-2.3 1,-0.1 15,-0.1 -0.596 23.2-142.6 -65.3 120.3 13.5 -6.6 -5.3 65 65 A P T 3 S+ 0 0 13 0, 0.0 232,-1.7 0, 0.0 233,-0.6 0.705 103.3 50.9 -60.5 -22.3 10.2 -7.4 -7.2 66 66 A E T 3 S+ 0 0 53 8,-0.2 9,-0.3 9,-0.2 233,-0.1 0.314 86.0 134.8 -95.6 7.6 10.5 -4.0 -9.0 67 67 A G < + 0 0 0 -3,-2.3 228,-2.9 8,-0.1 2,-0.3 -0.191 21.0 139.9 -58.3 144.9 14.1 -4.9 -9.9 68 68 A T - 0 0 5 223,-1.5 225,-0.2 226,-0.3 4,-0.1 -0.923 62.3-108.9-176.0 162.6 15.2 -4.2 -13.5 69 69 A F S S+ 0 0 106 -2,-0.3 2,-0.1 2,-0.1 224,-0.1 0.674 98.7 81.1 -77.0 -17.9 18.2 -2.9 -15.5 70 70 A E S S- 0 0 107 1,-0.1 2,-0.5 -3,-0.0 -2,-0.2 -0.458 89.7-112.8 -82.1 161.1 16.2 0.2 -16.3 71 71 A E + 0 0 189 -2,-0.1 2,-0.3 -4,-0.1 -2,-0.1 -0.835 48.7 151.9-101.7 128.1 16.0 3.0 -13.7 72 72 A N > - 0 0 58 -2,-0.5 4,-2.1 -4,-0.1 5,-0.1 -0.990 53.0-117.7-152.7 156.9 12.7 3.6 -12.1 73 73 A L H > S+ 0 0 93 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.760 110.9 59.6 -64.2 -30.6 11.1 4.9 -8.9 74 74 A G H > S+ 0 0 28 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.929 108.5 44.9 -65.1 -42.8 9.4 1.7 -8.2 75 75 A K H > S+ 0 0 27 -9,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.970 116.9 45.3 -62.3 -52.8 12.7 -0.1 -8.0 76 76 A T H X S+ 0 0 66 -4,-2.1 4,-2.1 2,-0.2 3,-0.2 0.934 112.3 49.2 -56.6 -56.0 14.3 2.6 -6.0 77 77 A A H X S+ 0 0 46 -4,-2.8 4,-1.7 1,-0.3 -1,-0.2 0.920 111.6 50.4 -51.8 -48.0 11.5 3.0 -3.5 78 78 A L H X S+ 0 0 52 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.3 0.870 108.0 53.0 -61.6 -35.8 11.4 -0.7 -2.9 79 79 A D H X S+ 0 0 43 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.873 105.4 55.1 -66.4 -37.2 15.1 -0.8 -2.3 80 80 A L H X S+ 0 0 104 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.877 111.6 44.0 -63.4 -38.7 14.8 1.9 0.3 81 81 A V H < S+ 0 0 74 -4,-1.7 3,-0.5 2,-0.2 6,-0.3 0.929 115.8 44.3 -73.0 -47.6 12.2 -0.2 2.2 82 82 A M H < S+ 0 0 37 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.797 116.6 47.0 -67.7 -31.6 14.0 -3.6 2.0 83 83 A Q H < S+ 0 0 128 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.555 88.7 110.3 -88.1 -10.0 17.4 -2.1 2.9 84 84 A S S X S- 0 0 37 -4,-0.5 4,-2.3 -3,-0.5 5,-0.2 -0.351 75.2-124.1 -68.0 147.7 16.0 -0.1 5.8 85 85 A K H > S+ 0 0 169 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.816 108.7 55.0 -63.2 -35.3 17.1 -1.2 9.3 86 86 A V H > S+ 0 0 51 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.914 111.9 45.0 -65.4 -40.4 13.5 -1.6 10.6 87 87 A F H > S+ 0 0 58 -6,-0.3 4,-3.2 1,-0.2 -2,-0.2 0.903 113.0 50.1 -68.0 -42.1 12.7 -3.9 7.8 88 88 A Q H < S+ 0 0 97 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.680 109.7 52.9 -70.5 -16.9 16.0 -5.8 8.3 89 89 A A H < S+ 0 0 79 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.820 117.1 36.8 -84.7 -33.9 15.1 -6.0 12.0 90 90 A V H < S+ 0 0 77 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.2 0.934 132.3 22.6 -82.3 -54.4 11.7 -7.5 11.2 91 91 A L S < S- 0 0 64 -4,-3.2 -1,-0.2 -5,-0.1 -2,-0.1 -0.737 81.0-169.2-118.5 81.9 12.5 -9.7 8.2 92 92 A P - 0 0 57 0, 0.0 -33,-2.6 0, 0.0 2,-0.3 -0.413 3.0-162.0 -71.4 143.0 16.2 -10.5 8.3 93 93 A Q B +p 59 0E 60 -35,-0.3 2,-0.3 -2,-0.1 -33,-0.2 -0.897 15.6 159.7-125.1 159.3 17.9 -12.2 5.3 94 94 A S - 0 0 41 -35,-2.3 -33,-0.2 -2,-0.3 0, 0.0 -0.953 49.2-119.9-170.8 152.6 21.2 -14.1 4.8 95 95 A E S S+ 0 0 16 -2,-0.3 2,-1.4 -35,-0.2 3,-0.3 0.703 107.8 75.7 -71.5 -20.2 22.9 -16.5 2.4 96 96 A D + 0 0 90 1,-0.2 -1,-0.2 -65,-0.2 -66,-0.0 -0.762 65.4 118.5 -90.6 90.0 23.1 -18.7 5.5 97 97 A a + 0 0 1 -2,-1.4 2,-2.1 -40,-0.1 -37,-0.2 0.380 16.7 123.2-140.8 1.5 19.4 -19.6 5.3 98 98 A L + 0 0 4 -3,-0.3 -70,-2.3 -69,-0.1 -69,-1.0 -0.417 40.8 136.9 -76.4 77.9 18.9 -23.4 4.8 99 99 A T E -D 27 0B 17 -2,-2.1 56,-2.0 -72,-0.3 2,-0.3 -0.806 41.1-145.2-119.0 158.4 16.7 -24.1 7.8 100 100 A I E -DE 26 154B 0 -74,-3.2 -74,-1.7 -2,-0.3 2,-0.4 -0.885 10.1-147.4-124.1 151.1 13.6 -26.3 8.3 101 101 A N E - E 0 153B 5 52,-2.4 52,-2.1 -2,-0.3 2,-0.5 -0.981 7.8-167.8-125.9 135.4 10.7 -25.7 10.6 102 102 A V E +DE 23 152B 0 -79,-2.4 -79,-2.1 -2,-0.4 2,-0.5 -0.971 6.1 178.9-123.7 122.8 8.4 -28.2 12.5 103 103 A V E +DE 22 151B 4 48,-3.0 48,-2.8 -2,-0.5 -81,-0.2 -0.986 11.4 177.5-125.4 126.2 5.2 -27.2 14.2 104 104 A R E -D 21 0B 6 -83,-2.9 -83,-2.4 -2,-0.5 46,-0.1 -0.836 35.6 -85.4-128.2 162.1 3.1 -29.9 15.9 105 105 A P > - 0 0 7 0, 0.0 3,-1.5 0, 0.0 -85,-0.2 -0.295 63.6 -83.7 -60.1 149.3 -0.2 -30.2 18.0 106 106 A P T 3 S+ 0 0 61 0, 0.0 -85,-0.1 0, 0.0 -87,-0.0 -0.249 114.3 16.4 -56.1 138.8 0.2 -29.6 21.8 107 107 A G T 3 S+ 0 0 42 1,-0.2 2,-0.1 -3,-0.1 -87,-0.0 0.631 85.6 152.8 74.1 13.8 1.4 -32.7 23.6 108 108 A T < - 0 0 13 -3,-1.5 2,-0.3 -4,-0.0 -1,-0.2 -0.484 19.8-174.9 -77.2 148.5 2.6 -34.6 20.6 109 109 A K > - 0 0 138 88,-0.1 3,-1.5 -2,-0.1 4,-0.2 -0.933 37.6 -77.5-138.2 161.7 5.4 -37.1 21.2 110 110 A A T 3 S+ 0 0 62 85,-0.4 85,-0.2 -2,-0.3 84,-0.1 -0.326 117.5 40.4 -58.3 139.5 7.5 -39.3 19.0 111 111 A G T 3 S+ 0 0 55 83,-0.8 -1,-0.3 87,-0.3 84,-0.1 0.417 76.4 111.5 99.3 -4.1 5.4 -42.3 17.9 112 112 A A < - 0 0 47 -3,-1.5 86,-0.2 82,-0.3 -2,-0.1 0.877 64.0-156.6 -66.2 -36.0 2.3 -40.4 17.4 113 113 A N + 0 0 81 85,-0.3 85,-0.3 84,-0.3 86,-0.1 0.930 23.6 174.6 58.0 49.0 2.8 -41.2 13.7 114 114 A L E -f 198 0B 25 83,-2.4 85,-2.3 1,-0.1 88,-0.2 -0.520 37.9 -97.3 -84.4 151.3 0.7 -38.2 12.5 115 115 A P E - 0 0 11 0, 0.0 35,-2.2 0, 0.0 2,-0.4 -0.326 40.3-135.7 -65.2 156.0 0.4 -37.3 8.9 116 116 A V E -fg 203 150B 0 86,-2.7 88,-2.7 83,-0.3 2,-0.6 -0.949 12.1-159.9-118.2 134.5 2.8 -34.5 7.8 117 117 A M E -fg 204 151B 0 33,-2.9 35,-2.7 -2,-0.4 2,-0.8 -0.966 11.8-159.0-114.8 113.3 2.0 -31.6 5.6 118 118 A L E -fg 205 152B 1 86,-2.6 88,-2.6 -2,-0.6 2,-0.4 -0.857 10.0-151.9 -97.9 108.1 5.2 -30.2 4.1 119 119 A W E -fg 206 153B 3 33,-3.3 35,-1.4 -2,-0.8 2,-0.6 -0.665 10.0-166.1 -83.5 133.7 4.7 -26.5 3.0 120 120 A I E -f 207 0B 1 86,-2.2 88,-0.8 -2,-0.4 95,-0.1 -0.947 21.6-137.3-120.7 106.5 6.7 -25.0 0.1 121 121 A F - 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0 0 2 0, 0.0 11,-0.5 0, 0.0 -226,-0.3 -0.375 41.2-149.5 -62.5 132.7 -15.4 7.4 10.0 830 295 B G > - 0 0 2 -228,-2.9 3,-2.2 -4,-0.1 6,-0.3 -0.540 34.9 -97.6 -92.0 164.9 -11.9 8.2 8.8 831 296 B F T 3 S+ 0 0 31 1,-0.3 -230,-0.1 -2,-0.2 52,-0.1 0.670 123.6 51.8 -60.6 -17.8 -11.2 10.1 5.6 832 297 B L T 3 S+ 0 0 47 -232,-2.2 -1,-0.3 -233,-0.1 -231,-0.2 0.422 91.5 97.3 -96.5 -0.9 -10.7 6.9 3.6 833 298 B A S X S- 0 0 8 -3,-2.2 3,-2.4 -233,-0.5 50,-0.1 -0.295 100.0 -85.8 -77.5 173.2 -14.0 5.3 4.7 834 299 B Y T 3 S+ 0 0 66 1,-0.3 3,-0.1 -233,-0.1 49,-0.1 0.846 126.3 64.9 -48.4 -42.2 -17.2 5.4 2.6 835 300 B S T > S+ 0 0 22 1,-0.2 3,-2.3 -5,-0.1 -1,-0.3 0.659 81.8 171.4 -57.1 -22.1 -18.1 8.9 4.0 836 301 B S T < + 0 0 2 -3,-2.4 -1,-0.2 -6,-0.3 -3,-0.2 -0.074 63.0 5.6 50.4-128.0 -15.0 10.2 2.4 837 302 B L T 3 S+ 0 0 36 1,-0.2 2,-2.2 -3,-0.1 -1,-0.3 0.461 102.9 97.8 -69.4 -1.0 -14.6 14.0 2.4 838 303 B R S < S- 0 0 37 -3,-2.3 -1,-0.2 -7,-0.1 -3,-0.1 -0.648 80.9-151.7 -82.8 78.2 -17.7 14.3 4.6 839 304 B L - 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0 0 82 -14,-0.3 2,-0.9 -2,-0.2 3,-0.2 -0.857 19.6-133.3-117.0 152.5 -6.2 30.0 -18.0 1050 515 B D S S+ 0 0 0 -2,-0.3 -15,-0.0 1,-0.2 -1,-0.0 -0.453 75.8 106.8 -95.8 57.5 -8.4 29.2 -15.0 1051 516 B N + 0 0 93 -2,-0.9 3,-0.4 -20,-0.0 2,-0.2 0.013 42.1 121.0-127.5 28.1 -11.5 28.7 -17.1 1052 517 B F S S+ 0 0 43 1,-0.2 5,-0.1 -3,-0.2 -2,-0.0 -0.624 74.9 7.9 -93.2 155.1 -12.1 25.0 -17.1 1053 518 B R S > S+ 0 0 57 -2,-0.2 4,-1.6 1,-0.1 -1,-0.2 0.817 70.9 160.6 44.7 46.0 -15.2 23.2 -15.9 1054 519 B T H > S+ 0 0 76 -3,-0.4 4,-2.2 1,-0.2 5,-0.2 0.805 70.3 59.6 -63.4 -30.4 -17.1 26.5 -15.4 1055 520 B A H > S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.935 106.3 47.1 -62.8 -47.1 -20.4 24.7 -15.5 1056 521 B G H > S+ 0 0 1 -141,-0.3 4,-2.1 1,-0.2 5,-0.3 0.847 108.2 57.2 -63.5 -32.9 -19.2 22.7 -12.5 1057 522 B Y H X S+ 0 0 31 -4,-1.6 4,-3.0 1,-0.2 -2,-0.2 0.920 110.1 42.7 -64.8 -43.3 -18.1 26.0 -10.9 1058 523 B D H X S+ 0 0 93 -4,-2.2 4,-1.1 2,-0.2 5,-0.2 0.861 110.5 56.7 -70.0 -36.2 -21.7 27.4 -11.1 1059 524 B A H < S+ 0 0 14 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.917 121.8 27.0 -60.3 -42.7 -23.2 24.2 -10.0 1060 525 B L H < S+ 0 0 0 -4,-2.1 7,-0.2 -5,-0.1 -2,-0.2 0.841 125.0 42.1 -90.8 -37.5 -21.2 24.2 -6.8 1061 526 B M H < S+ 0 0 11 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.1 0.308 87.0 83.4-100.3 6.5 -20.4 27.9 -6.1 1062 527 B T S < S+ 0 0 105 -4,-1.1 -1,-0.2 1,-0.3 -3,-0.1 0.924 119.3 8.4 -72.0 -44.0 -23.7 29.7 -6.8 1063 528 B N S > S- 0 0 78 -4,-0.3 3,-2.0 -5,-0.2 4,-0.3 -0.679 77.6-177.7-136.5 80.4 -24.9 28.8 -3.3 1064 529 B P G > S+ 0 0 7 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.800 75.7 65.3 -46.7 -43.0 -21.8 27.3 -1.5 1065 530 B S G > S+ 0 0 48 1,-0.3 3,-1.5 2,-0.2 -162,-0.1 0.714 85.5 72.6 -60.4 -20.3 -23.7 26.5 1.7 1066 531 B S G < S+ 0 0 9 -3,-2.0 -163,-0.4 1,-0.3 -1,-0.3 0.744 101.9 44.1 -66.7 -20.4 -25.9 23.9 -0.1 1067 532 B F G < S+ 0 0 2 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.136 87.2 128.3-111.5 20.1 -22.9 21.6 -0.2 1068 533 B F < 0 0 5 -3,-1.5 -165,-0.4 1,-0.1 -166,-0.3 -0.336 360.0 360.0 -74.8 153.1 -21.7 22.1 3.3 1069 534 B V 0 0 11 -288,-2.5 -287,-0.2 -168,-0.1 -280,-0.2 0.508 360.0 360.0-115.9 360.0 -20.9 19.2 5.6