==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE (SERINE PROTEINASE) 20-FEB-91 1S02 . COMPND 2 MOLECULE: SUBTILISIN BPN'; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; . AUTHOR C.R.ERWIN,B.L.BARNETT,J.D.OLIVER,J.F.SULLIVAN . 275 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10216.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 5.8 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 . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 1 0.4 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 . 21 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 0 1 0 0 2 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 2 1 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 PARALLEL BRIDGES PER LADDER . 5 0 0 0 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 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 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 0 128 0, 0.0 79,-0.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 146.4 20.0 51.5 -22.0 2 2 A Q - 0 0 49 77,-0.2 2,-0.3 75,-0.2 79,-0.2 -0.817 360.0-155.9-102.5 142.6 17.3 49.0 -21.4 3 3 A S - 0 0 69 77,-3.1 79,-0.1 -2,-0.4 76,-0.0 -0.849 13.0-135.0-115.5 151.2 17.9 45.8 -19.4 4 4 A V - 0 0 68 -2,-0.3 79,-0.1 77,-0.2 5,-0.1 -0.953 27.6-128.3-105.4 108.3 16.0 42.5 -19.6 5 5 A P >> - 0 0 19 0, 0.0 3,-1.3 0, 0.0 4,-1.1 -0.316 17.7-125.0 -56.8 136.5 15.4 41.3 -16.0 6 6 A Y H 3> S+ 0 0 132 1,-0.3 4,-3.3 2,-0.2 5,-0.2 0.822 108.1 67.4 -55.5 -37.3 16.6 37.7 -15.8 7 7 A G H 3> S+ 0 0 7 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.851 98.9 52.6 -54.4 -33.2 13.2 36.6 -14.5 8 8 A V H X4>S+ 0 0 3 -3,-1.3 5,-1.7 1,-0.2 3,-0.5 0.962 113.2 42.7 -66.2 -45.2 11.9 37.5 -18.0 9 9 A S H ><5S+ 0 0 48 -4,-1.1 3,-1.3 1,-0.2 -2,-0.2 0.853 105.7 64.9 -64.9 -39.0 14.5 35.3 -19.5 10 10 A Q H 3<5S+ 0 0 11 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.776 106.2 41.3 -60.8 -31.0 14.0 32.5 -17.0 11 11 A I T <<5S- 0 0 0 -4,-1.2 259,-2.3 -3,-0.5 260,-0.6 0.426 115.3-116.6 -97.6 0.6 10.5 31.8 -18.1 12 12 A K T X>5 + 0 0 92 -3,-1.3 3,-1.2 -4,-0.3 4,-0.7 0.733 63.7 146.3 70.6 30.4 11.5 32.1 -21.8 13 13 A A H >>< + 0 0 0 -5,-1.7 4,-2.0 1,-0.3 3,-1.0 0.895 65.0 66.1 -59.5 -45.7 9.3 35.2 -22.7 14 14 A P H 3> S+ 0 0 40 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.724 92.1 64.0 -53.8 -23.5 12.0 36.5 -25.1 15 15 A A H <> S+ 0 0 28 -3,-1.2 4,-0.5 2,-0.2 -2,-0.2 0.919 104.5 44.2 -68.8 -43.7 11.3 33.4 -27.3 16 16 A L H XX>S+ 0 0 0 -3,-1.0 5,-2.4 -4,-0.7 3,-1.3 0.858 108.2 59.7 -64.9 -40.4 7.8 34.5 -28.0 17 17 A H H ><5S+ 0 0 38 -4,-2.0 3,-1.1 1,-0.3 -1,-0.2 0.885 102.6 52.0 -54.1 -42.2 9.0 38.0 -28.6 18 18 A S H 3<5S+ 0 0 114 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.641 106.3 53.9 -68.6 -16.1 11.2 36.8 -31.4 19 19 A E H <<5S- 0 0 93 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.495 126.5-105.5 -91.3 -8.3 8.1 35.1 -32.9 20 20 A G T <<5S+ 0 0 56 -3,-1.1 2,-0.6 -4,-0.6 -3,-0.2 0.640 80.4 128.0 93.3 19.0 6.4 38.5 -32.7 21 21 A Y < + 0 0 76 -5,-2.4 -1,-0.2 1,-0.1 -2,-0.2 -0.956 10.8 146.9-111.2 117.5 4.1 37.8 -29.8 22 22 A T S S- 0 0 28 -2,-0.6 65,-2.8 63,-0.1 66,-0.5 0.011 75.3 -87.3-135.0 19.5 4.3 40.4 -27.0 23 23 A G > - 0 0 0 210,-0.3 3,-1.6 64,-0.2 66,-0.3 0.711 58.5-178.0 78.1 31.4 0.8 40.4 -25.7 24 24 A S T 3 + 0 0 62 1,-0.3 64,-0.2 64,-0.1 -1,-0.2 -0.303 67.8 8.3 -62.9 138.9 -0.8 43.0 -28.0 25 25 A N T 3 S+ 0 0 142 62,-0.7 2,-0.5 1,-0.2 -1,-0.3 0.514 90.5 131.3 69.3 15.9 -4.5 43.6 -27.3 26 26 A V < - 0 0 6 -3,-1.6 63,-2.5 61,-0.1 2,-0.6 -0.885 52.8-137.5 -99.6 126.7 -4.7 41.6 -24.1 27 27 A K E -a 89 0A 78 -2,-0.5 93,-2.9 91,-0.3 94,-2.0 -0.778 23.9-174.7 -89.4 120.0 -6.4 43.5 -21.2 28 28 A V E -ab 90 121A 0 61,-3.0 63,-2.6 -2,-0.6 2,-0.5 -0.976 11.3-154.5-115.5 125.3 -4.5 43.0 -18.0 29 29 A A E -ab 91 122A 0 92,-3.1 94,-2.7 -2,-0.5 2,-0.9 -0.880 1.7-159.9-103.6 125.5 -5.7 44.3 -14.6 30 30 A V E -ab 92 123A 0 61,-3.0 63,-1.8 -2,-0.5 2,-1.2 -0.882 9.5-163.5-101.4 96.3 -3.2 44.9 -11.9 31 31 A I E +a 93 0A 0 92,-2.4 94,-0.5 -2,-0.9 63,-0.2 -0.798 50.4 93.2 -87.7 99.1 -5.3 44.9 -8.7 32 32 A D E S-a 94 0A 0 61,-2.1 63,-3.2 -2,-1.2 64,-1.4 -0.584 92.7 -40.5-154.8-145.5 -2.9 46.6 -6.3 33 33 A S S S- 0 0 1 1,-0.3 28,-0.5 61,-0.2 29,-0.3 0.318 94.6 -91.5 -83.9 6.1 -1.8 49.9 -4.8 34 34 A G - 0 0 1 59,-0.3 2,-0.4 -4,-0.3 -1,-0.3 -0.481 39.6 -91.3 110.2 177.7 -2.2 51.7 -8.2 35 35 A I - 0 0 0 22,-2.1 2,-0.7 -2,-0.2 57,-0.1 -0.984 31.4-118.7-140.4 124.4 0.2 52.4 -11.0 36 36 A D > - 0 0 19 -2,-0.4 3,-1.2 1,-0.2 23,-0.2 -0.499 22.4-166.5 -63.5 103.4 2.4 55.5 -11.3 37 37 A S T 3 S+ 0 0 79 21,-1.8 -1,-0.2 -2,-0.7 7,-0.1 0.651 81.2 69.8 -69.4 -14.7 1.2 57.2 -14.5 38 38 A S T 3 S+ 0 0 80 20,-0.3 -1,-0.2 2,-0.0 -2,-0.1 0.487 73.5 108.7 -81.9 -2.6 4.3 59.5 -14.5 39 39 A H X - 0 0 4 -3,-1.2 3,-1.5 1,-0.1 169,-0.0 -0.638 58.8-155.1 -81.4 119.3 6.7 56.6 -15.3 40 40 A P T 3 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 39,-0.1 0.732 90.9 61.0 -65.2 -21.5 8.1 56.7 -18.8 41 41 A D T 3 S+ 0 0 0 33,-0.1 34,-2.8 36,-0.0 2,-0.4 0.346 99.0 67.8 -91.8 8.9 8.7 52.9 -18.9 42 42 A L < - 0 0 15 -3,-1.5 2,-0.5 32,-0.2 32,-0.1 -0.963 60.2-160.6-127.4 144.2 5.0 52.1 -18.4 43 43 A K - 0 0 148 -2,-0.4 47,-0.6 30,-0.3 2,-0.5 -0.988 14.8-157.9-125.1 117.9 1.9 52.7 -20.7 44 44 A V E -c 90 0A 42 -2,-0.5 47,-0.2 -7,-0.1 3,-0.1 -0.842 13.4-169.2-102.1 131.2 -1.4 52.6 -18.9 45 45 A A E - 0 0 52 45,-3.0 2,-0.3 -2,-0.5 46,-0.2 0.732 62.6 -58.4 -86.9 -28.9 -4.6 51.9 -20.8 46 46 A G E +c 91 0A 19 44,-1.1 46,-2.5 2,-0.0 -1,-0.3 -0.933 54.7 177.6 172.3-169.0 -7.0 52.9 -18.0 47 47 A G E -c 92 0A 25 44,-0.3 2,-0.3 -2,-0.3 46,-0.2 -0.897 17.0-133.6 164.2 179.4 -8.0 52.1 -14.4 48 48 A A E -c 93 0A 17 44,-2.0 46,-2.1 -2,-0.3 2,-0.4 -0.961 17.9-127.9-156.0 152.5 -10.3 52.8 -11.4 49 49 A S E -c 94 0A 28 6,-0.4 46,-0.2 -2,-0.3 44,-0.1 -0.940 16.1-178.3-112.5 133.0 -9.7 53.3 -7.7 50 50 A M + 0 0 35 44,-3.3 45,-0.1 -2,-0.4 5,-0.1 0.248 58.3 103.2-103.9 1.3 -11.7 51.4 -5.1 51 51 A V B > -J 54 0B 2 3,-0.5 3,-1.3 43,-0.4 45,-0.1 -0.872 59.7-157.7 -95.5 109.4 -10.0 53.2 -2.1 52 52 A P T 3 S+ 0 0 91 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.672 93.6 48.1 -57.2 -28.0 -12.3 55.8 -0.8 53 53 A S T 3 S+ 0 0 98 1,-0.2 2,-0.2 2,-0.0 -2,-0.0 0.523 119.6 37.7 -92.5 -8.9 -9.4 57.8 0.7 54 54 A E B < +J 51 0B 30 -3,-1.3 -3,-0.5 40,-0.1 -1,-0.2 -0.680 64.4 172.3-142.0 81.5 -7.3 57.7 -2.5 55 55 A T + 0 0 113 -3,-0.3 -6,-0.4 -2,-0.2 3,-0.1 0.445 54.9 86.0 -72.6 -5.8 -9.5 58.1 -5.6 56 56 A N > - 0 0 79 1,-0.1 3,-1.3 -8,-0.1 -8,-0.1 -0.877 55.1-168.7-102.8 112.3 -6.7 58.4 -8.3 57 57 A P T 3 S+ 0 0 10 0, 0.0 -22,-2.1 0, 0.0 -1,-0.1 0.714 84.8 65.8 -68.2 -21.8 -5.6 54.9 -9.4 58 58 A F T 3 S+ 0 0 62 -24,-0.2 -21,-1.8 -22,-0.1 2,-0.6 0.262 83.6 83.4 -83.1 5.2 -2.7 56.5 -11.2 59 59 A Q < - 0 0 95 -3,-1.3 2,-1.0 -23,-0.2 -23,-0.1 -0.950 63.5-166.8-115.1 103.0 -1.2 57.6 -7.9 60 60 A D + 0 0 13 -2,-0.6 -26,-0.2 1,-0.1 -24,-0.1 -0.825 14.7 169.9 -93.7 99.4 0.8 54.7 -6.4 61 61 A N S S+ 0 0 76 -2,-1.0 -1,-0.1 -28,-0.5 -27,-0.1 0.335 77.1 46.2 -88.9 4.4 1.6 55.7 -2.8 62 62 A N S S- 0 0 48 -29,-0.3 -1,-0.1 34,-0.1 -28,-0.1 0.707 92.8-136.6-114.6 -31.8 2.9 52.3 -1.8 63 63 A S S > S+ 0 0 34 -30,-0.2 4,-1.4 -29,-0.0 5,-0.1 0.102 79.2 99.9 93.6 -15.7 5.2 51.4 -4.7 64 64 A H H > S+ 0 0 34 1,-0.2 4,-2.5 2,-0.2 3,-0.3 0.958 78.9 47.5 -63.0 -60.1 3.9 47.9 -4.9 65 65 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.814 110.8 52.2 -54.3 -37.7 1.5 48.2 -7.8 66 66 A T H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 142,-0.3 0.863 110.6 48.3 -70.3 -36.1 4.1 50.1 -9.9 67 67 A H H X S+ 0 0 0 -4,-1.4 4,-1.2 -3,-0.3 141,-0.3 0.928 112.7 47.1 -67.3 -47.4 6.7 47.3 -9.4 68 68 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 3,-0.4 0.915 110.5 54.1 -58.1 -47.0 4.2 44.5 -10.2 69 69 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.3 -1,-0.2 0.877 104.0 54.2 -56.6 -47.8 3.1 46.5 -13.3 70 70 A G H X S+ 0 0 1 -4,-1.8 4,-1.8 138,-0.3 -1,-0.3 0.778 106.0 53.9 -61.7 -30.2 6.6 46.8 -14.6 71 71 A T H < S+ 0 0 6 -4,-1.2 13,-2.4 -3,-0.4 -2,-0.2 0.929 112.5 43.0 -71.4 -42.2 7.0 43.0 -14.4 72 72 A V H < S- 0 0 0 -4,-1.9 13,-4.0 11,-0.2 -2,-0.2 0.967 139.5 -5.8 -62.8 -55.3 3.9 42.4 -16.5 73 73 A A H < + 0 0 3 -4,-2.8 -30,-0.3 10,-0.2 -3,-0.2 0.072 63.1 164.7-140.5 33.9 4.6 45.1 -19.1 74 74 A A < - 0 0 0 -4,-1.8 9,-2.8 -5,-0.1 -32,-0.2 -0.252 55.9 -97.2 -50.4 125.8 7.6 47.5 -18.8 75 75 A L - 0 0 40 -34,-2.8 2,-1.2 7,-0.2 4,-0.1 -0.106 22.1-119.3 -55.8 148.2 7.8 49.0 -22.3 76 76 A N S S+ 0 0 118 10,-0.2 2,-0.2 -3,-0.1 -1,-0.1 -0.724 72.8 104.4 -86.2 94.9 10.2 47.7 -25.0 77 77 A N S S- 0 0 57 -2,-1.2 -75,-0.2 2,-0.4 -36,-0.0 -0.529 86.4 -64.0-146.0-147.6 12.3 50.9 -25.6 78 78 A S S S+ 0 0 97 -2,-0.2 2,-0.3 -77,-0.1 -2,-0.1 0.337 103.2 59.0 -97.1 1.4 15.6 52.6 -24.8 79 79 A I S S- 0 0 64 2,-0.2 -2,-0.4 -4,-0.1 -77,-0.2 -0.866 92.2 -15.2-136.1 165.4 15.2 52.7 -21.1 80 80 A G S S- 0 0 14 -79,-0.4 -77,-3.1 -2,-0.3 2,-0.1 -0.224 93.1 -33.3 53.2-123.8 14.7 50.9 -17.9 81 81 A V - 0 0 5 -79,-0.2 -4,-0.4 -40,-0.1 2,-0.4 -0.322 50.4-115.0-115.9-166.1 13.5 47.3 -18.1 82 82 A L - 0 0 12 -2,-0.1 -7,-0.2 -79,-0.1 -74,-0.1 -0.994 22.6-139.1-141.0 130.2 11.3 45.0 -20.1 83 83 A G - 0 0 0 -9,-2.8 -10,-0.2 -2,-0.4 -11,-0.2 -0.287 28.0-109.7 -87.7 169.9 8.1 43.2 -19.1 84 84 A V S S+ 0 0 0 -13,-2.4 -11,-0.2 1,-0.3 -12,-0.2 0.934 119.0 23.8 -60.4 -44.9 7.0 39.7 -19.9 85 85 A A S > S+ 0 0 0 -13,-4.0 3,-2.0 -14,-0.2 -1,-0.3 -0.704 72.6 177.1-127.1 80.3 4.3 41.2 -22.2 86 86 A P T 3 S+ 0 0 10 0, 0.0 -10,-0.2 0, 0.0 -63,-0.2 0.680 79.7 49.3 -57.0 -21.2 5.5 44.6 -23.2 87 87 A S T 3 S+ 0 0 52 -65,-2.8 -62,-0.7 -12,-0.1 -64,-0.2 0.355 81.7 121.7-101.5 3.9 2.5 45.2 -25.5 88 88 A A < - 0 0 10 -3,-2.0 2,-0.6 -66,-0.5 -61,-0.2 -0.302 70.0-113.3 -68.2 148.7 -0.3 44.3 -23.1 89 89 A S E -a 27 0A 34 -63,-2.5 -61,-3.0 -66,-0.3 2,-0.4 -0.818 37.4-148.6 -83.8 113.8 -3.0 46.8 -22.2 90 90 A L E -ac 28 44A 1 -47,-0.6 -45,-3.0 -2,-0.6 -44,-1.1 -0.838 12.5-165.4 -98.8 134.6 -2.5 47.6 -18.6 91 91 A Y E -ac 29 46A 35 -63,-2.6 -61,-3.0 -2,-0.4 2,-0.9 -0.957 13.0-144.4-118.8 130.2 -5.3 48.6 -16.2 92 92 A A E +ac 30 47A 0 -46,-2.5 -44,-2.0 -2,-0.5 2,-0.8 -0.809 20.1 177.3 -93.0 105.4 -4.7 50.1 -12.8 93 93 A V E -ac 31 48A 0 -63,-1.8 -61,-2.1 -2,-0.9 2,-0.6 -0.922 16.9-156.4-109.4 104.9 -7.2 48.8 -10.4 94 94 A K E +ac 32 49A 0 -46,-2.1 -44,-3.3 -2,-0.8 -43,-0.4 -0.780 34.5 147.0 -88.1 115.4 -6.3 50.4 -7.0 95 95 A V + 0 0 0 -63,-3.2 2,-0.4 -2,-0.6 -62,-0.2 0.348 56.3 67.1-125.6 -0.3 -7.6 48.4 -4.0 96 96 A L - 0 0 10 -64,-1.4 6,-0.2 6,-0.1 -45,-0.1 -0.947 69.4-140.8-123.9 142.7 -4.8 49.1 -1.5 97 97 A G > - 0 0 6 4,-2.9 3,-2.0 -2,-0.4 -2,-0.1 -0.083 45.6 -70.4 -87.5-169.3 -3.9 52.4 0.2 98 98 A A T 3 S+ 0 0 49 1,-0.3 -65,-0.0 2,-0.1 -2,-0.0 0.821 129.1 55.3 -49.2 -46.9 -0.5 53.9 1.1 99 99 A D T 3 S- 0 0 124 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.271 117.3-107.3 -75.1 5.1 0.2 51.5 3.9 100 100 A G S < S+ 0 0 29 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.458 83.2 118.8 80.3 2.2 -0.3 48.4 1.6 101 101 A S + 0 0 73 -68,-0.0 -4,-2.9 -5,-0.0 2,-0.3 -0.666 35.5 173.6-103.8 156.7 -3.6 47.5 3.2 102 102 A G - 0 0 30 -2,-0.3 2,-0.1 -6,-0.2 -6,-0.1 -0.986 31.7-111.6-158.3 150.0 -7.1 47.3 1.9 103 103 A Q > - 0 0 113 -2,-0.3 4,-1.5 -8,-0.2 3,-0.5 -0.507 31.5-119.6 -78.8 155.3 -10.6 46.2 3.0 104 104 A Y H > S+ 0 0 73 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.848 114.7 60.7 -62.5 -35.1 -12.0 43.0 1.4 105 105 A S H > S+ 0 0 57 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.863 103.3 49.5 -60.3 -38.0 -14.9 45.2 0.1 106 106 A W H > S+ 0 0 40 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.885 111.5 48.8 -67.7 -43.4 -12.4 47.3 -1.9 107 107 A I H X S+ 0 0 7 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.903 112.0 48.0 -63.5 -46.9 -10.8 44.2 -3.4 108 108 A I H X S+ 0 0 28 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.892 110.4 51.9 -61.6 -40.8 -14.1 42.7 -4.4 109 109 A N H X S+ 0 0 88 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.887 110.6 50.2 -60.0 -42.7 -15.2 46.0 -5.9 110 110 A G H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.932 109.4 49.0 -60.7 -50.6 -11.9 45.9 -7.8 111 111 A I H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.911 111.6 50.8 -58.9 -45.6 -12.5 42.4 -9.1 112 112 A E H X S+ 0 0 85 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.877 107.2 52.3 -62.2 -36.3 -16.0 43.4 -10.2 113 113 A W H X S+ 0 0 53 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.901 108.7 52.3 -61.8 -41.4 -14.8 46.4 -12.1 114 114 A A H <>S+ 0 0 0 -4,-2.0 5,-2.2 2,-0.2 -2,-0.2 0.918 111.3 45.8 -61.3 -44.2 -12.3 44.0 -13.9 115 115 A I H ><5S+ 0 0 24 -4,-2.1 3,-2.0 1,-0.2 -2,-0.2 0.943 111.8 50.8 -62.3 -52.1 -15.1 41.6 -14.9 116 116 A A H 3<5S+ 0 0 78 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.785 112.0 48.4 -59.7 -28.0 -17.5 44.4 -16.0 117 117 A N T 3<5S- 0 0 69 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.237 112.8-116.3 -98.4 13.1 -14.7 45.9 -18.2 118 118 A N T < 5 - 0 0 114 -3,-2.0 -91,-0.3 1,-0.2 -3,-0.2 0.807 41.3-178.3 55.9 45.0 -13.7 42.6 -19.8 119 119 A M < - 0 0 5 -5,-2.2 -91,-0.2 1,-0.1 -1,-0.2 -0.504 20.1-151.3 -65.2 147.9 -10.1 42.2 -18.6 120 120 A D S S+ 0 0 57 -93,-2.9 28,-2.2 1,-0.3 2,-0.3 0.774 79.8 23.2 -88.5 -33.8 -8.5 39.0 -20.0 121 121 A V E -bd 28 148A 0 -94,-2.0 -92,-3.1 26,-0.2 2,-0.4 -0.987 64.5-160.6-138.6 141.3 -6.2 38.6 -17.1 122 122 A I E -bd 29 149A 0 26,-2.8 28,-2.7 -2,-0.3 2,-0.5 -0.984 6.9-161.9-124.3 135.4 -6.3 39.7 -13.4 123 123 A N E -bd 30 150A 0 -94,-2.7 -92,-2.4 -2,-0.4 2,-0.5 -0.987 6.3-175.4-118.5 128.1 -3.2 39.8 -11.2 124 124 A M E - d 0 151A 0 26,-2.6 2,-1.7 -2,-0.5 28,-1.7 -0.856 5.5-179.0-126.7 92.0 -3.6 40.0 -7.4 125 125 A S + 0 0 1 -94,-0.5 2,-0.3 -2,-0.5 96,-0.1 -0.617 59.3 85.9 -90.8 71.9 -0.2 40.3 -5.7 126 126 A L - 0 0 22 -2,-1.7 2,-0.3 26,-0.2 43,-0.3 -0.953 51.1-178.2-166.3 152.1 -1.8 40.3 -2.3 127 127 A G - 0 0 52 -2,-0.3 27,-0.1 41,-0.1 26,-0.1 -0.984 8.6-162.8-157.8 158.3 -2.9 37.7 0.2 128 128 A G B -K 167 0C 14 39,-1.6 39,-4.2 -2,-0.3 -2,-0.0 -0.944 30.4-123.3-141.9 148.4 -4.6 37.4 3.6 129 129 A P S S+ 0 0 122 0, 0.0 2,-0.4 0, 0.0 36,-0.0 0.591 95.4 59.7 -69.2 -16.0 -4.7 34.5 6.1 130 130 A S - 0 0 75 37,-0.1 2,-0.2 2,-0.0 37,-0.1 -0.967 66.1-158.4-125.6 139.8 -8.5 34.6 6.0 131 131 A G - 0 0 32 -2,-0.4 2,-0.3 35,-0.0 3,-0.1 -0.499 9.1-152.0 -98.9 172.4 -11.0 34.1 3.1 132 132 A S > - 0 0 38 -2,-0.2 4,-2.3 1,-0.1 5,-0.1 -0.949 27.8-118.1-142.4 154.8 -14.6 35.3 3.0 133 133 A A H > S+ 0 0 90 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.850 117.7 52.8 -61.8 -37.2 -17.7 34.0 1.2 134 134 A A H > S+ 0 0 54 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.896 107.3 48.7 -68.6 -40.6 -17.8 37.3 -0.6 135 135 A L H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.895 112.9 50.0 -65.4 -38.6 -14.2 37.2 -1.8 136 136 A K H X S+ 0 0 85 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.927 108.9 50.5 -65.3 -42.1 -14.8 33.6 -3.0 137 137 A A H X S+ 0 0 62 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.888 109.9 52.7 -60.8 -40.1 -17.9 34.5 -4.9 138 138 A A H X S+ 0 0 2 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.918 112.4 40.9 -63.8 -52.3 -16.0 37.4 -6.6 139 139 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.906 114.7 52.5 -65.7 -38.6 -13.1 35.3 -7.9 140 140 A D H X S+ 0 0 47 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.862 108.5 52.1 -62.7 -35.5 -15.4 32.4 -8.9 141 141 A K H X S+ 0 0 95 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.912 108.6 51.3 -65.3 -40.7 -17.5 35.0 -10.8 142 142 A A H <>S+ 0 0 0 -4,-2.0 5,-2.6 2,-0.2 4,-0.3 0.905 112.2 44.1 -64.2 -45.4 -14.3 36.1 -12.6 143 143 A V H ><5S+ 0 0 41 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.877 113.5 51.5 -67.5 -40.2 -13.2 32.6 -13.7 144 144 A A H 3<5S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.851 106.0 55.2 -62.4 -35.1 -16.8 31.8 -14.7 145 145 A S T 3<5S- 0 0 67 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.582 126.2-102.9 -75.8 -9.8 -16.8 35.0 -16.8 146 146 A G T < 5S+ 0 0 38 -3,-1.1 -3,-0.2 -4,-0.3 2,-0.2 0.448 73.4 139.6 103.3 2.7 -13.7 33.7 -18.6 147 147 A V < - 0 0 5 -5,-2.6 2,-0.5 -6,-0.2 -1,-0.3 -0.543 53.0-126.0 -78.5 149.1 -11.0 35.8 -16.9 148 148 A V E -d 121 0A 4 -28,-2.2 -26,-2.8 -2,-0.2 2,-0.5 -0.872 28.0-156.7 -92.1 123.8 -7.6 34.2 -16.0 149 149 A V E +d 122 0A 3 -2,-0.5 26,-2.4 24,-0.4 2,-0.4 -0.937 13.7 179.7-112.1 123.2 -7.0 34.9 -12.3 150 150 A V E +de 123 175A 0 -28,-2.7 -26,-2.6 -2,-0.5 2,-0.3 -0.980 4.2 172.5-123.0 135.9 -3.4 34.9 -10.9 151 151 A A E -de 124 176A 0 24,-2.3 26,-2.5 -2,-0.4 -26,-0.2 -0.987 37.3 -99.5-145.9 151.8 -2.4 35.5 -7.3 152 152 A A E - e 0 177A 4 -28,-1.7 17,-0.4 -2,-0.3 26,-0.2 -0.351 27.7-137.8 -63.9 146.9 0.7 35.4 -5.1 153 153 A A - 0 0 0 24,-2.6 13,-2.2 1,-0.2 2,-0.2 0.800 53.2-100.6 -76.0 -28.8 0.8 32.2 -3.0 154 154 A G - 0 0 12 23,-0.4 37,-2.4 11,-0.2 -1,-0.2 -0.432 15.5-106.8 122.9 157.5 2.0 34.1 0.2 155 155 A N S S+ 0 0 70 35,-0.2 35,-0.2 -2,-0.2 -1,-0.1 -0.347 80.9 111.4-111.0 45.8 5.3 34.7 1.9 156 156 A E - 0 0 146 8,-0.3 34,-0.2 1,-0.3 -1,-0.1 0.138 59.3-157.9-103.7 15.7 4.6 32.5 5.0 157 157 A G - 0 0 7 32,-2.7 35,-1.0 -3,-0.2 -1,-0.3 -0.089 44.6 -25.2 45.5-134.7 7.2 29.8 4.1 158 158 A T - 0 0 73 30,-0.3 3,-0.1 33,-0.2 5,-0.1 -0.698 39.1-176.6-109.6 164.5 6.5 26.4 5.7 159 159 A S B > -L 162 0D 69 3,-0.6 3,-2.3 1,-0.5 2,-0.2 -0.486 58.3 -87.9-159.7 70.3 4.7 25.1 8.7 160 160 A G T 3 S- 0 0 59 1,-0.3 -1,-0.5 0, 0.0 0, 0.0 -0.396 100.5 -19.3 62.8-125.6 5.2 21.4 8.9 161 161 A S T 3 S+ 0 0 116 -2,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.365 112.0 111.4 -95.8 4.9 2.5 19.6 7.0 162 162 A S B < S-L 159 0D 66 -3,-2.3 -3,-0.6 1,-0.1 2,-0.3 -0.508 72.5-115.7 -83.0 146.4 0.2 22.6 7.0 163 163 A S - 0 0 31 -2,-0.2 30,-0.3 1,-0.1 -1,-0.1 -0.643 23.8-173.7 -80.8 131.2 -0.7 24.7 3.9 164 164 A T + 0 0 22 28,-3.7 2,-0.4 -2,-0.3 -8,-0.3 0.150 37.8 132.8-113.3 17.9 0.6 28.3 4.3 165 165 A V - 0 0 4 27,-0.6 -11,-0.2 26,-0.1 -12,-0.1 -0.577 46.7-144.8 -74.7 129.0 -1.1 29.5 1.1 166 166 A G > - 0 0 12 -13,-2.2 4,-1.5 -2,-0.4 -1,-0.1 -0.175 32.9 -55.3 -81.7 172.9 -2.9 32.8 1.7 167 167 A Y B 4 S+K 128 0C 59 -39,-4.2 -39,-1.6 1,-0.3 -37,-0.1 -0.785 114.1 18.3-100.7 149.6 -6.2 34.0 0.2 168 168 A P T >4 S+ 0 0 1 0, 0.0 3,-2.0 0, 0.0 -1,-0.3 -0.994 120.3 63.0 -80.5 -2.7 -7.3 34.4 -2.6 169 169 A G T 34 S+ 0 0 1 -17,-0.4 7,-0.3 -43,-0.3 -2,-0.2 0.779 94.1 66.6 -48.9 -34.8 -4.5 32.1 -3.8 170 170 A K T 3< S+ 0 0 48 -4,-1.5 -1,-0.3 5,-0.1 -3,-0.1 0.761 78.0 100.4 -62.0 -25.7 -6.0 29.3 -1.8 171 171 A Y S X S- 0 0 21 -3,-2.0 3,-2.0 1,-0.1 5,-0.1 -0.400 76.5-132.4 -68.4 134.6 -9.1 29.1 -3.9 172 172 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.784 105.0 59.8 -55.5 -35.5 -9.2 26.3 -6.5 173 173 A S T 3 S+ 0 0 26 2,-0.1 -24,-0.4 0, 0.0 2,-0.3 0.573 96.7 79.2 -74.8 -8.2 -10.3 28.7 -9.3 174 174 A V S < S- 0 0 0 -3,-2.0 2,-1.0 -6,-0.2 -24,-0.2 -0.797 80.5-127.9-106.0 145.7 -7.2 30.9 -8.7 175 175 A I E -e 150 0A 6 -26,-2.4 -24,-2.3 -2,-0.3 2,-0.5 -0.807 28.7-156.4 -89.0 100.6 -3.7 30.2 -10.0 176 176 A A E -e 151 0A 0 -2,-1.0 21,-2.0 19,-0.4 22,-1.8 -0.706 6.9-155.7 -81.5 125.3 -1.5 30.5 -6.9 177 177 A V E -ef 152 198A 0 -26,-2.5 -24,-2.6 -2,-0.5 -23,-0.4 -0.928 8.8-168.6-112.3 122.9 2.1 31.3 -7.6 178 178 A G E - f 0 199A 0 20,-2.9 22,-1.8 -2,-0.5 2,-0.4 -0.437 24.6-108.4 -98.4 171.8 5.2 30.6 -5.4 179 179 A A E - f 0 200A 0 20,-0.2 8,-2.5 8,-0.2 2,-0.3 -0.852 26.4-178.9-113.1 144.3 8.7 31.9 -5.8 180 180 A V E -Gf 186 201A 0 20,-1.8 22,-2.2 -2,-0.4 23,-0.8 -0.874 24.0-125.7-124.2 158.0 12.1 30.5 -6.9 181 181 A D > - 0 0 48 4,-2.4 3,-1.5 -2,-0.3 -1,-0.1 -0.204 48.6 -80.1 -88.0-172.9 15.5 32.1 -7.1 182 182 A S T 3 S+ 0 0 74 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.581 130.9 57.8 -66.5 -17.1 17.7 32.2 -10.3 183 183 A S T 3 S- 0 0 80 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.357 117.0-111.1 -94.7 -6.9 18.8 28.6 -9.5 184 184 A N S < S+ 0 0 46 -3,-1.5 2,-0.4 1,-0.3 -2,-0.1 0.534 73.4 138.7 82.3 12.1 15.2 27.3 -9.5 185 185 A Q - 0 0 102 1,-0.1 -4,-2.4 72,-0.1 -1,-0.3 -0.760 62.7-102.5 -91.3 135.1 15.4 26.7 -5.8 186 186 A R B -G 180 0A 51 -2,-0.4 -6,-0.3 -6,-0.2 2,-0.2 -0.291 37.1-112.2 -55.9 131.7 12.3 27.6 -3.8 187 187 A A > - 0 0 7 -8,-2.5 3,-1.9 1,-0.1 -8,-0.2 -0.486 23.2-125.0 -67.8 132.2 12.6 30.9 -1.9 188 188 A S T 3 S+ 0 0 98 1,-0.3 -30,-0.3 -2,-0.2 -1,-0.1 0.823 110.5 49.2 -53.0 -34.9 12.7 30.2 1.9 189 189 A F T 3 S+ 0 0 53 -32,-0.1 -32,-2.7 -33,-0.1 -1,-0.3 0.596 82.3 118.2 -85.3 -6.8 9.7 32.6 2.4 190 190 A S < - 0 0 0 -3,-1.9 -35,-0.2 -34,-0.2 -12,-0.1 -0.383 68.4-117.5 -62.2 131.1 7.6 31.1 -0.4 191 191 A S - 0 0 0 -37,-2.4 2,-0.3 -14,-0.1 -33,-0.2 -0.241 31.4-155.6 -64.5 154.1 4.2 29.7 1.0 192 192 A V + 0 0 0 -35,-1.0 -28,-3.7 -30,-0.2 -27,-0.6 -0.879 29.5 102.3-131.3 162.3 3.6 25.9 0.6 193 193 A G S > S- 0 0 0 68,-2.7 3,-2.2 -2,-0.3 71,-0.2 -0.800 77.2 -68.9 148.0 169.9 0.6 23.6 0.4 194 194 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 68,-0.0 0.775 125.4 61.0 -60.7 -28.1 -1.7 21.5 -1.8 195 195 A E T 3 S+ 0 0 53 -3,-0.1 -19,-0.4 66,-0.1 2,-0.2 0.437 74.9 108.6 -79.9 -4.3 -3.1 24.7 -3.2 196 196 A L < + 0 0 7 -3,-2.2 -19,-0.1 65,-0.2 68,-0.1 -0.583 42.5 174.9 -72.5 132.7 0.3 25.9 -4.6 197 197 A D - 0 0 22 -21,-2.0 68,-3.1 1,-0.4 2,-0.3 0.800 50.2 -3.3-107.5 -51.6 0.1 25.6 -8.4 198 198 A V E -f 177 0A 1 -22,-1.8 -20,-2.9 66,-0.2 -1,-0.4 -0.955 56.6-128.3-143.8 165.3 3.2 27.0 -10.2 199 199 A M E +fh 178 267A 0 67,-2.5 69,-1.8 -2,-0.3 -20,-0.2 -0.802 24.5 168.9-112.9 152.6 6.5 28.7 -9.5 200 200 A A E -f 179 0A 0 -22,-1.8 -20,-1.8 -2,-0.3 2,-0.2 -0.900 48.9 -69.2-154.8 163.4 8.0 31.9 -11.0 201 201 A P E +f 180 0A 3 0, 0.0 25,-0.2 0, 0.0 -20,-0.2 -0.452 53.8 155.9 -61.1 129.6 11.0 34.1 -10.2 202 202 A G + 0 0 0 -22,-2.2 17,-2.6 -2,-0.2 2,-0.6 0.134 39.3 100.1-140.5 12.0 10.5 36.0 -7.0 203 203 A V S S- 0 0 44 -23,-0.8 15,-0.2 15,-0.2 -196,-0.1 -0.922 99.7 -19.0-113.3 120.8 14.0 36.8 -5.8 204 204 A S S S- 0 0 66 -2,-0.6 2,-0.6 1,-0.2 14,-0.2 0.910 78.1-171.1 55.6 53.0 15.5 40.2 -6.4 205 205 A I E -M 217 0E 9 12,-2.4 12,-1.4 -3,-0.2 2,-0.5 -0.680 12.4-146.5 -79.8 111.8 13.2 41.2 -9.2 206 206 A Q E +M 216 0E 90 -2,-0.6 2,-0.3 10,-0.2 10,-0.2 -0.708 40.0 134.5 -82.9 127.7 14.2 44.4 -10.9 207 207 A S E -M 215 0E 0 8,-2.1 8,-2.1 -2,-0.5 2,-0.2 -0.891 53.4 -58.3-157.0-175.9 11.3 46.5 -12.0 208 208 A T E -M 214 0E 0 -142,-0.3 -138,-0.3 -141,-0.3 6,-0.3 -0.497 41.4-168.5 -78.2 144.3 9.8 50.0 -12.1 209 209 A L E > -M 213 0E 31 4,-2.1 4,-2.0 -2,-0.2 3,-0.3 -0.898 37.1 -79.4-129.8 151.8 9.1 52.2 -9.0 210 210 A P T 4 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.135 109.8 37.9 -53.7 144.9 7.2 55.5 -8.6 211 211 A G T 4 S- 0 0 46 1,-0.1 3,-0.1 2,-0.1 -172,-0.1 0.826 132.9 -63.8 81.1 35.4 9.0 58.7 -9.6 212 212 A N T 4 S+ 0 0 84 -3,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.907 102.8 129.5 53.5 50.3 10.8 57.3 -12.7 213 213 A K E < -M 209 0E 136 -4,-2.0 -4,-2.1 2,-0.0 2,-0.3 -0.645 44.4-150.9-124.0 176.0 12.9 54.9 -10.6 214 214 A Y E +M 208 0E 81 -6,-0.3 2,-0.3 -2,-0.2 -6,-0.2 -0.952 23.6 148.0-149.4 150.1 13.8 51.2 -10.6 215 215 A G E -M 207 0E 15 -8,-2.1 -8,-2.1 -2,-0.3 2,-0.3 -0.964 39.1 -93.1-176.8 167.6 14.6 48.7 -7.9 216 216 A A E -M 206 0E 41 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.796 29.5-177.9-103.4 145.6 14.5 45.1 -6.7 217 217 A Y E -M 205 0E 85 -12,-1.4 -12,-2.4 -2,-0.3 2,-0.4 -0.927 15.2-144.3-134.7 152.7 11.9 43.4 -4.5 218 218 A N + 0 0 100 -2,-0.3 2,-0.2 -14,-0.2 -15,-0.2 -0.967 46.8 87.7-117.3 142.5 11.6 39.9 -3.2 219 219 A G S >> S- 0 0 1 -17,-2.6 3,-1.6 -2,-0.4 4,-0.9 -0.698 81.9 -92.1 147.9 158.4 8.4 38.0 -2.8 220 220 A T H 3> S+ 0 0 1 1,-0.3 4,-2.0 -2,-0.2 -67,-0.1 0.686 120.7 68.5 -67.5 -21.6 5.7 35.8 -4.2 221 221 A S H 34 S+ 0 0 16 1,-0.2 -1,-0.3 2,-0.2 -69,-0.1 0.719 100.1 46.8 -66.1 -25.1 4.1 39.2 -5.1 222 222 A M H <4 S+ 0 0 5 -3,-1.6 4,-0.4 -20,-0.2 -1,-0.2 0.655 110.1 55.4 -85.4 -26.1 7.0 39.6 -7.6 223 223 A A H >X S+ 0 0 0 -4,-0.9 3,-1.1 -46,-0.2 4,-0.9 0.893 97.1 61.6 -75.9 -45.5 6.4 36.0 -8.9 224 224 A S H >X S+ 0 0 0 -4,-2.0 4,-2.4 -47,-0.3 3,-1.2 0.895 96.9 57.9 -48.7 -53.4 2.6 36.4 -9.7 225 225 A P H 3> S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.759 98.7 60.3 -52.4 -32.1 3.2 39.1 -12.4 226 226 A H H <> S+ 0 0 3 -3,-1.1 4,-1.7 -4,-0.4 -2,-0.2 0.886 109.7 42.7 -64.2 -41.3 5.5 36.8 -14.3 227 227 A V H < + 0 0 41 -4,-2.0 3,-1.8 -5,-0.2 -1,-0.2 -0.640 64.9 170.8-135.0 73.5 -4.2 32.2 -29.3 239 239 A P T 3 S+ 0 0 107 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.682 78.6 59.9 -59.0 -17.4 -6.8 34.9 -28.8 240 240 A N T 3 S+ 0 0 141 -3,-0.1 -5,-0.1 2,-0.0 -2,-0.0 0.647 76.1 108.6 -85.4 -23.6 -9.4 32.1 -29.0 241 241 A W < - 0 0 36 -3,-1.8 2,-0.1 -7,-0.2 -3,-0.1 -0.375 65.9-129.5 -60.3 142.8 -8.2 30.0 -26.1 242 242 A T > - 0 0 73 1,-0.1 4,-2.0 -95,-0.0 3,-0.3 -0.320 28.5-103.5 -86.1 170.8 -10.5 30.0 -23.0 243 243 A N H > S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.815 123.4 62.3 -63.6 -30.1 -9.1 30.7 -19.5 244 244 A T H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 106.8 41.9 -56.6 -48.4 -9.4 26.9 -19.0 245 245 A Q H > S+ 0 0 85 -3,-0.3 4,-3.3 2,-0.2 -1,-0.2 0.829 112.0 53.7 -69.6 -41.5 -6.9 26.2 -21.8 246 246 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.954 114.0 42.9 -62.7 -48.8 -4.5 29.0 -20.8 247 247 A R H X S+ 0 0 48 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.958 114.3 49.5 -61.5 -53.6 -4.3 27.7 -17.3 248 248 A S H X S+ 0 0 53 -4,-2.3 4,-2.0 -5,-0.3 -2,-0.2 0.929 111.8 50.5 -52.6 -47.6 -4.1 24.0 -18.4 249 249 A S H X S+ 0 0 10 -4,-3.3 4,-0.6 1,-0.2 -1,-0.2 0.866 109.4 48.8 -59.8 -42.2 -1.3 25.0 -20.8 250 250 A L H >< S+ 0 0 4 -4,-2.3 3,-0.5 1,-0.2 19,-0.3 0.898 116.5 43.5 -64.7 -40.0 0.7 26.8 -18.2 251 251 A E H 3< S+ 0 0 22 -4,-2.8 3,-0.4 1,-0.2 -2,-0.2 0.758 113.3 51.1 -80.0 -19.5 0.4 23.9 -15.7 252 252 A N H 3< S+ 0 0 123 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.431 111.1 45.8 -94.3 -2.7 1.1 21.2 -18.3 253 253 A T S << S+ 0 0 36 -4,-0.6 -1,-0.2 -3,-0.5 20,-0.2 0.147 82.4 129.1-123.8 12.6 4.3 22.6 -19.8 254 254 A T - 0 0 11 -3,-0.4 2,-0.8 -4,-0.1 14,-0.2 -0.201 66.9-113.2 -68.4 160.8 6.1 23.5 -16.6 255 255 A T B -I 267 0A 67 12,-3.3 12,-1.9 0, 0.0 -1,-0.1 -0.919 40.3-126.9 -93.0 109.8 9.7 22.5 -15.8 256 256 A K + 0 0 126 -2,-0.8 10,-0.2 10,-0.2 9,-0.1 -0.372 36.5 171.2 -62.6 135.8 9.2 20.0 -12.9 257 257 A L - 0 0 51 1,-0.4 -1,-0.1 7,-0.2 3,-0.1 0.594 47.0 -40.2-113.1-102.4 11.3 21.0 -9.9 258 258 A G S S- 0 0 43 1,-0.3 -1,-0.4 2,-0.0 5,-0.1 -0.111 95.6 -19.4-111.7-150.7 10.7 19.1 -6.5 259 259 A D >> - 0 0 97 1,-0.1 4,-1.9 -2,-0.1 3,-1.7 -0.260 58.7-128.0 -55.2 132.4 7.7 17.9 -4.5 260 260 A S H 3> S+ 0 0 77 1,-0.3 4,-2.2 2,-0.2 -67,-0.2 0.723 105.6 70.5 -56.9 -25.1 4.5 19.6 -5.5 261 261 A F H 34 S+ 0 0 37 1,-0.2 -68,-2.7 2,-0.2 -1,-0.3 0.891 116.6 24.0 -57.1 -36.6 3.8 20.5 -1.9 262 262 A Y H <4 S+ 0 0 82 -3,-1.7 -2,-0.2 -70,-0.2 -1,-0.2 0.692 139.2 25.4-101.6 -21.8 6.7 22.9 -2.2 263 263 A Y H >< S- 0 0 34 -4,-1.9 3,-1.9 1,-0.3 -64,-0.2 0.317 81.2-148.3-126.3 0.3 6.8 23.6 -6.0 264 264 A G T 3< S- 0 0 6 -4,-2.2 -1,-0.3 1,-0.3 -66,-0.2 -0.350 77.6 -26.7 60.1-138.1 3.3 23.0 -7.4 265 265 A K T 3 S- 0 0 87 -68,-3.1 -1,-0.3 1,-0.3 2,-0.2 0.541 106.8-111.0 -79.5 -12.6 3.8 21.7 -11.0 266 266 A G < - 0 0 0 -3,-1.9 -67,-2.5 -69,-0.2 2,-0.3 -0.719 59.5 -12.7 114.2-168.4 7.2 23.6 -11.2 267 267 A L B -hI 199 255A 8 -12,-1.9 -12,-3.3 -2,-0.2 -67,-0.2 -0.586 69.0-117.3 -75.9 131.4 8.5 26.6 -13.1 268 268 A I - 0 0 1 -69,-1.8 2,-0.4 -2,-0.3 -14,-0.1 -0.270 20.5-163.8 -67.9 153.1 6.4 28.0 -16.0 269 269 A N > - 0 0 26 -19,-0.3 4,-2.1 1,-0.1 -257,-0.2 -0.917 3.5-172.0-137.6 99.1 7.8 28.0 -19.5 270 270 A V H > S+ 0 0 0 -259,-2.3 4,-2.0 -2,-0.4 -258,-0.2 0.757 83.4 62.1 -70.4 -27.3 5.8 30.4 -21.7 271 271 A E H 4 S+ 0 0 90 -260,-0.6 4,-0.3 2,-0.2 -1,-0.2 0.883 113.0 36.3 -62.3 -44.8 7.5 29.2 -24.9 272 272 A A H >4 S+ 0 0 42 1,-0.2 3,-1.6 -19,-0.2 -2,-0.2 0.958 117.4 52.3 -69.0 -52.5 6.2 25.7 -24.4 273 273 A A H 3< S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.736 100.6 61.4 -52.4 -36.0 2.9 26.8 -23.0 274 274 A A T 3< 0 0 0 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.1 0.544 360.0 360.0 -73.4 -17.7 2.0 29.1 -25.9 275 275 A Q < 0 0 147 -3,-1.6 -1,-0.2 -4,-0.3 -37,-0.0 -0.394 360.0 360.0 49.6 360.0 2.0 26.4 -28.5