==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-DEC-12 4IDN . COMPND 2 MOLECULE: ATLASTIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.J.BYRNES,A.SINGH,K.SZETO,N.M.BENVIN,J.P.O'DONNELL,W.R.ZIPF . 840 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35305.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 604 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 6.2 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 52 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 342 40.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 0 2 0 0 2 0 1 0 2 4 2 3 2 1 0 0 0 2 0 0 0 0 0 1 0 2 1 RESIDUES PER ALPHA HELIX . 2 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 4 2 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 30 A K 0 0 258 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -42.7 14.2 -8.3 -73.7 2 31 A K - 0 0 191 1,-0.1 2,-0.1 0, 0.0 96,-0.0 -0.573 360.0-105.1 -80.4 145.1 17.1 -6.5 -72.0 3 32 A A + 0 0 25 -2,-0.2 -1,-0.1 94,-0.0 94,-0.0 -0.420 53.3 142.8 -74.9 146.9 18.6 -8.2 -69.0 4 33 A G - 0 0 16 -2,-0.1 94,-2.2 92,-0.1 95,-0.1 -0.969 50.5 -61.5-166.2 177.4 18.0 -6.9 -65.5 5 34 A P E -A 97 0A 52 0, 0.0 2,-0.5 0, 0.0 92,-0.2 -0.448 43.8-154.2 -71.9 144.6 17.4 -7.8 -61.8 6 35 A V E -A 96 0A 32 90,-3.0 90,-2.3 -2,-0.1 2,-0.6 -0.979 15.5-130.0-126.7 120.9 14.3 -9.8 -61.0 7 36 A Q E +A 95 0A 59 -2,-0.5 88,-0.2 88,-0.2 3,-0.1 -0.564 38.5 161.8 -67.9 114.9 12.5 -9.7 -57.6 8 37 A V E + 0 0 0 86,-2.4 12,-2.6 -2,-0.6 2,-0.5 0.784 63.9 39.4-109.8 -42.0 12.2 -13.4 -56.7 9 38 A L E S-AB 94 19A 0 85,-2.2 85,-1.7 10,-0.2 2,-0.5 -0.969 75.3-160.7-109.7 125.8 11.5 -13.3 -53.0 10 39 A I E - B 0 18A 40 8,-3.4 8,-2.6 -2,-0.5 2,-0.6 -0.899 7.1-159.6-106.6 130.3 9.2 -10.5 -51.8 11 40 A V E - B 0 17A 27 -2,-0.5 6,-0.2 6,-0.2 2,-0.1 -0.953 18.9-153.8-107.0 118.3 9.1 -9.3 -48.2 12 41 A K > - 0 0 94 4,-2.7 3,-1.9 -2,-0.6 4,-0.1 -0.409 30.0-101.2 -89.6 166.9 5.8 -7.5 -47.6 13 42 A D T 3 S+ 0 0 162 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.790 120.3 61.7 -55.9 -30.3 5.1 -4.8 -45.0 14 43 A D T 3 S- 0 0 112 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.206 120.3-108.3 -83.9 17.5 3.4 -7.4 -42.7 15 44 A H S < S+ 0 0 48 -3,-1.9 2,-0.3 1,-0.2 -2,-0.2 0.685 76.9 137.5 61.8 21.7 6.7 -9.2 -42.5 16 45 A S - 0 0 44 -4,-0.1 -4,-2.7 2,-0.0 2,-0.4 -0.682 47.4-135.2 -93.5 152.3 5.3 -12.0 -44.7 17 46 A F E -B 11 0A 14 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.883 19.5-175.6-107.7 141.6 7.4 -13.6 -47.5 18 47 A E E -B 10 0A 82 -8,-2.6 -8,-3.4 -2,-0.4 2,-0.5 -0.999 15.6-142.9-134.6 136.2 6.1 -14.4 -50.9 19 48 A L E -B 9 0A 19 -2,-0.4 2,-1.3 -10,-0.2 -10,-0.2 -0.829 10.9-140.3 -96.3 132.3 7.8 -16.2 -53.8 20 49 A D > + 0 0 58 -12,-2.6 4,-2.5 -2,-0.5 5,-0.2 -0.725 27.7 175.0 -87.4 88.9 7.3 -15.0 -57.4 21 50 A E H > S+ 0 0 98 -2,-1.3 4,-3.6 1,-0.2 5,-0.3 0.880 72.8 58.1 -65.4 -39.1 7.2 -18.5 -59.0 22 51 A T H > S+ 0 0 87 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.935 112.1 40.2 -56.1 -48.7 6.3 -17.2 -62.4 23 52 A A H > S+ 0 0 4 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.920 116.8 48.9 -69.4 -43.5 9.5 -15.1 -62.5 24 53 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.911 113.7 47.5 -60.4 -44.4 11.6 -17.8 -60.9 25 54 A N H X S+ 0 0 50 -4,-3.6 4,-1.6 1,-0.2 -1,-0.2 0.855 107.8 56.8 -62.5 -38.4 10.2 -20.4 -63.3 26 55 A R H < S+ 0 0 169 -4,-2.0 4,-0.2 -5,-0.3 -2,-0.2 0.925 115.9 34.6 -59.7 -45.9 10.8 -18.1 -66.3 27 56 A I H < S+ 0 0 16 -4,-1.9 3,-0.3 1,-0.1 -2,-0.2 0.911 127.5 31.0 -79.4 -48.2 14.5 -17.7 -65.5 28 57 A L H < S+ 0 0 2 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.580 117.1 52.9 -95.1 -9.5 15.6 -21.1 -64.2 29 58 A L S < S+ 0 0 52 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.1 0.280 73.3 124.3-111.9 10.5 13.3 -23.4 -66.0 30 59 A S S >> S- 0 0 48 -3,-0.3 4,-2.9 -4,-0.2 3,-1.4 -0.394 74.3-113.5 -65.5 150.5 13.9 -22.3 -69.6 31 60 A E T 34 S+ 0 0 154 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.810 113.3 61.9 -57.2 -32.1 15.0 -25.2 -71.9 32 61 A A T 34 S+ 0 0 63 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.771 123.3 14.5 -66.9 -28.1 18.5 -23.7 -72.3 33 62 A V T X4 S+ 0 0 8 -3,-1.4 3,-1.7 -6,-0.1 260,-0.6 0.628 97.1 94.0-121.7 -20.1 19.3 -23.9 -68.6 34 63 A R T 3< S+ 0 0 84 -4,-2.9 260,-2.1 1,-0.3 261,-0.3 0.801 94.6 38.7 -50.8 -40.6 16.8 -26.2 -66.8 35 64 A D T 3 S+ 0 0 97 -4,-0.4 -1,-0.3 258,-0.2 2,-0.2 0.493 95.1 104.9 -92.7 -3.6 18.9 -29.4 -67.1 36 65 A K S < S- 0 0 63 -3,-1.7 257,-2.2 1,-0.1 258,-0.2 -0.485 78.5-109.7 -77.5 144.7 22.3 -27.8 -66.4 37 66 A E B -J 292 0B 52 73,-0.4 75,-2.9 255,-0.3 2,-0.4 -0.411 43.9-127.7 -66.0 152.6 24.1 -28.1 -63.1 38 67 A V E -c 112 0A 0 253,-2.2 246,-3.4 246,-0.2 2,-0.5 -0.875 23.4-165.3-121.2 138.5 24.0 -24.8 -61.2 39 68 A V E -c 113 0A 0 73,-3.5 75,-3.5 -2,-0.4 2,-0.5 -0.984 19.3-166.8-108.7 125.1 26.5 -22.5 -59.6 40 69 A A E -c 114 0A 0 -2,-0.5 103,-3.0 242,-0.4 104,-2.2 -0.962 3.6-166.8-120.3 122.4 24.8 -19.9 -57.3 41 70 A V E +cd 115 144A 0 73,-2.9 75,-2.9 -2,-0.5 2,-0.3 -0.902 11.5 178.0-110.6 129.8 26.6 -16.9 -56.0 42 71 A S E -cd 116 145A 0 102,-3.0 104,-3.0 -2,-0.5 2,-0.4 -0.896 19.0-154.7-127.6 155.2 25.1 -14.8 -53.2 43 72 A V E +cd 117 146A 0 73,-1.3 75,-0.5 -2,-0.3 2,-0.3 -0.999 25.7 163.4-127.9 136.1 26.1 -11.8 -51.2 44 73 A A E + d 0 147A 1 102,-2.9 104,-3.2 -2,-0.4 2,-0.3 -0.971 15.4 83.9-149.1 161.5 24.7 -11.1 -47.7 45 74 A G E S+ d 0 148A 1 74,-0.3 76,-2.1 -2,-0.3 104,-0.1 -0.906 71.3 1.5 139.0-165.2 25.2 -9.2 -44.5 46 75 A A B > S-k 121 0C 17 102,-0.6 3,-0.9 -2,-0.3 5,-0.2 -0.120 73.8-102.9 -59.9 145.7 24.5 -5.8 -43.0 47 76 A F T 3 S+ 0 0 3 74,-2.1 -1,-0.1 1,-0.2 42,-0.1 -0.299 99.1 24.0 -66.9 150.8 22.6 -3.1 -45.0 48 77 A R T 3 S+ 0 0 52 40,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.587 86.4 114.2 72.2 18.0 24.4 -0.1 -46.6 49 78 A K S < S- 0 0 28 -3,-0.9 -2,-0.1 99,-0.1 -3,-0.1 0.345 92.2 -93.7-104.2 6.5 27.7 -1.9 -46.9 50 79 A G S > S+ 0 0 25 34,-0.1 4,-1.9 98,-0.0 5,-0.1 0.739 75.5 139.1 95.1 26.1 28.1 -2.2 -50.7 51 80 A K H > S+ 0 0 11 -5,-0.2 4,-2.1 2,-0.2 5,-0.1 0.960 78.8 40.1 -65.4 -53.9 26.6 -5.6 -51.4 52 81 A S H > S+ 0 0 10 1,-0.2 4,-1.7 2,-0.2 29,-0.3 0.867 112.4 57.6 -64.5 -37.2 24.7 -4.7 -54.6 53 82 A F H > S+ 0 0 15 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.928 108.6 47.5 -56.2 -46.0 27.7 -2.4 -55.7 54 83 A L H >X S+ 0 0 1 -4,-1.9 4,-1.5 1,-0.2 3,-0.9 0.940 107.4 54.4 -63.5 -46.9 29.9 -5.5 -55.5 55 84 A M H 3X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.3 -1,-0.2 0.805 102.1 59.2 -59.0 -32.0 27.4 -7.7 -57.5 56 85 A D H 3X S+ 0 0 1 -4,-1.7 4,-1.5 1,-0.2 -1,-0.3 0.829 104.8 49.0 -70.4 -30.8 27.4 -5.2 -60.3 57 86 A F H < S+ 0 0 19 -4,-1.5 3,-0.5 2,-0.2 -2,-0.2 0.921 110.3 50.7 -70.7 -44.8 33.1 -9.9 -65.2 62 91 A M H >< S+ 0 0 8 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.881 113.7 46.2 -62.9 -35.0 30.4 -12.4 -66.2 63 92 A Y H 3< S+ 0 0 87 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.682 124.8 30.6 -80.6 -18.1 29.6 -10.4 -69.3 64 93 A N T X< S+ 0 0 82 -4,-0.9 3,-0.9 -3,-0.5 -1,-0.2 -0.293 70.9 144.3-138.4 52.5 33.3 -9.9 -70.3 65 94 A Q T < S+ 0 0 30 -3,-0.5 5,-0.1 1,-0.2 -1,-0.1 0.846 73.1 47.2 -64.4 -41.2 35.2 -12.9 -69.1 66 95 A E T 3 S+ 0 0 181 -3,-0.1 2,-0.3 3,-0.1 -1,-0.2 0.523 93.2 97.1 -84.0 -3.4 37.7 -13.3 -72.0 67 96 A S X - 0 0 49 -3,-0.9 3,-0.8 -6,-0.2 -3,-0.1 -0.686 67.4-147.4 -86.5 137.3 38.6 -9.6 -71.9 68 97 A V T 3 S+ 0 0 121 -2,-0.3 3,-0.2 1,-0.3 -1,-0.1 0.779 101.0 49.7 -70.8 -25.9 41.7 -8.4 -70.0 69 98 A D T > + 0 0 115 1,-0.2 3,-1.5 2,-0.1 -1,-0.3 -0.286 67.0 138.2-108.5 46.1 39.9 -5.2 -69.2 70 99 A W T < + 0 0 21 -3,-0.8 -1,-0.2 1,-0.3 3,-0.1 0.743 52.9 83.3 -61.9 -24.1 36.6 -6.7 -67.9 71 100 A V T 3 S- 0 0 8 -3,-0.2 -1,-0.3 1,-0.2 2,-0.1 0.672 102.9-112.6 -61.7 -16.5 36.5 -4.2 -65.0 72 101 A G < - 0 0 20 -3,-1.5 2,-0.2 -12,-0.1 -1,-0.2 -0.304 36.1 -53.0 113.3 165.5 34.9 -1.7 -67.4 73 102 A D > - 0 0 108 -3,-0.1 3,-1.5 -2,-0.1 184,-0.4 -0.551 53.7-120.4 -71.6 145.8 35.7 1.6 -69.1 74 103 A Y T 3 S+ 0 0 97 1,-0.3 184,-1.8 -2,-0.2 185,-0.2 0.562 111.1 45.3 -72.9 -7.6 36.8 4.2 -66.6 75 104 A N T 3 S+ 0 0 76 182,-0.1 -1,-0.3 181,-0.1 181,-0.1 0.324 88.1 113.5-110.8 3.2 34.0 6.7 -67.5 76 105 A E < - 0 0 100 -3,-1.5 181,-0.4 179,-0.1 182,-0.1 -0.656 66.4-126.9 -84.7 124.0 31.3 4.0 -67.5 77 106 A P - 0 0 38 0, 0.0 2,-0.6 0, 0.0 178,-0.2 -0.323 27.0-109.1 -65.1 150.5 28.6 4.2 -64.8 78 107 A L + 0 0 8 176,-2.5 2,-0.3 -6,-0.0 5,-0.2 -0.736 48.3 167.6 -90.2 121.0 27.9 1.1 -62.7 79 108 A T + 0 0 104 -2,-0.6 2,-0.4 -23,-0.2 -20,-0.1 -0.807 26.5 72.4-131.0 169.9 24.6 -0.6 -63.4 80 109 A G S S+ 0 0 24 -2,-0.3 2,-0.2 3,-0.1 -27,-0.1 -0.972 90.6 36.2 133.1-117.5 22.7 -3.8 -62.7 81 110 A F S S- 0 0 0 -2,-0.4 2,-0.1 -29,-0.3 -25,-0.1 -0.535 101.4 -98.2 -65.0 137.6 21.3 -4.4 -59.3 82 111 A S + 0 0 59 -2,-0.2 2,-0.3 -3,-0.1 9,-0.1 -0.360 53.5 165.1 -67.0 129.7 20.1 -1.1 -57.9 83 112 A W + 0 0 54 -5,-0.2 2,-0.3 -2,-0.1 -3,-0.1 -0.960 1.5 149.1-139.9 160.2 22.6 0.7 -55.5 84 113 A R - 0 0 90 -2,-0.3 -34,-0.1 2,-0.1 -31,-0.1 -0.967 41.4 -94.3-173.7 170.5 22.9 4.2 -54.1 85 114 A G + 0 0 36 -2,-0.3 3,-0.1 166,-0.2 2,-0.1 -0.081 64.6 99.2 -83.1-165.8 24.1 6.2 -51.1 86 115 A G S S- 0 0 2 522,-0.1 -2,-0.1 1,-0.1 523,-0.0 -0.083 77.2 -99.2 100.4 154.8 21.8 7.3 -48.3 87 116 A S S S+ 0 0 0 522,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.621 93.3 92.5 -85.6 -15.0 21.3 5.9 -44.8 88 117 A E S S- 0 0 56 -3,-0.1 -40,-0.1 1,-0.1 35,-0.0 -0.625 84.4-102.7 -86.8 139.9 18.1 4.0 -45.8 89 118 A R - 0 0 60 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 -0.168 34.8-179.4 -57.6 147.4 18.1 0.4 -47.0 90 119 A E + 0 0 55 1,-0.1 -1,-0.1 -6,-0.1 -7,-0.1 0.762 55.3 64.9-114.8 -68.7 17.7 -0.3 -50.7 91 120 A T - 0 0 17 27,-0.2 29,-0.5 -9,-0.1 2,-0.3 -0.362 64.2-168.1 -64.4 135.9 17.6 -4.0 -51.7 92 121 A T - 0 0 47 27,-0.2 -83,-0.2 -3,-0.1 -1,-0.0 -0.949 48.4 -21.4-124.6 152.6 14.7 -6.0 -50.3 93 122 A G S S- 0 0 0 -2,-0.3 26,-2.2 27,-0.1 2,-0.4 -0.243 108.3 -40.0 55.4-134.3 14.0 -9.7 -50.2 94 123 A I E -AE 9 118A 0 -85,-1.7 -86,-2.4 24,-0.2 -85,-2.2 -0.993 55.4-170.5-131.9 127.1 16.0 -11.6 -52.7 95 124 A Q E -AE 7 117A 26 22,-2.6 22,-2.4 -2,-0.4 2,-0.3 -0.905 2.8-166.5-109.1 144.4 16.8 -10.5 -56.3 96 125 A I E -AE 6 116A 0 -90,-2.3 -90,-3.0 -2,-0.4 2,-0.3 -0.892 30.1-103.8-121.4 160.9 18.4 -12.6 -59.0 97 126 A W E -A 5 0A 16 18,-1.6 18,-0.2 -2,-0.3 -94,-0.0 -0.650 24.0-137.3 -80.3 138.7 19.9 -11.6 -62.4 98 127 A S S S+ 0 0 40 -94,-2.2 2,-0.7 -2,-0.3 -1,-0.1 0.713 86.2 73.4 -72.4 -23.3 17.6 -12.4 -65.3 99 128 A E S S- 0 0 85 -95,-0.1 2,-0.4 16,-0.0 16,-0.2 -0.857 71.5-154.1 -96.9 117.4 20.4 -13.7 -67.5 100 129 A I - 0 0 19 -2,-0.7 2,-0.4 -73,-0.2 14,-0.2 -0.755 18.3-134.6 -82.0 132.2 21.8 -17.0 -66.4 101 130 A F E -F 113 0A 13 12,-1.9 12,-2.7 -2,-0.4 2,-0.7 -0.764 5.6-145.6 -95.1 132.8 25.4 -17.4 -67.6 102 131 A L E -F 112 0A 70 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.861 25.2-177.6 -98.9 114.5 26.7 -20.5 -69.2 103 132 A I E -F 111 0A 14 8,-2.7 8,-2.1 -2,-0.7 2,-0.7 -0.898 24.9-128.8-119.6 138.0 30.3 -21.2 -68.2 104 133 A N E -F 110 0A 99 -2,-0.4 6,-0.2 6,-0.2 5,-0.1 -0.773 19.3-145.5 -89.6 112.1 32.7 -24.0 -69.3 105 134 A K > - 0 0 31 4,-2.7 3,-1.8 -2,-0.7 174,-0.1 -0.424 33.9-104.1 -66.4 150.6 34.4 -25.8 -66.4 106 135 A P T 3 S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 173,-0.1 0.748 122.6 55.0 -55.0 -25.9 38.0 -26.8 -67.2 107 136 A D T 3 S- 0 0 109 2,-0.1 -3,-0.0 1,-0.0 -2,-0.0 0.781 126.8 -96.9 -75.1 -29.4 36.8 -30.4 -67.7 108 137 A G S < S+ 0 0 55 -3,-1.8 2,-0.3 1,-0.3 -1,-0.0 0.340 71.3 150.4 124.8 -1.5 34.1 -29.4 -70.2 109 138 A K - 0 0 72 1,-0.1 -4,-2.7 -5,-0.1 2,-1.2 -0.468 41.6-142.6 -63.5 122.4 31.1 -29.2 -67.9 110 139 A K E + F 0 104A 98 -2,-0.3 -73,-0.4 -6,-0.2 2,-0.3 -0.742 32.9 178.4 -87.4 91.7 28.6 -26.7 -69.2 111 140 A V E - F 0 103A 0 -8,-2.1 -8,-2.7 -2,-1.2 2,-0.4 -0.678 25.3-128.0-100.9 152.9 27.4 -25.2 -65.9 112 141 A A E -cF 38 102A 0 -75,-2.9 -73,-3.5 -2,-0.3 2,-0.6 -0.791 17.4-148.2-100.0 139.1 24.8 -22.4 -65.3 113 142 A V E -cF 39 101A 0 -12,-2.7 -12,-1.9 -2,-0.4 2,-0.4 -0.926 10.8-169.3-116.5 118.9 25.7 -19.5 -63.1 114 143 A L E -c 40 0A 4 -75,-3.5 -73,-2.9 -2,-0.6 2,-0.4 -0.841 8.1-152.5-104.1 138.4 23.1 -17.7 -61.0 115 144 A L E -c 41 0A 2 -2,-0.4 -18,-1.6 -18,-0.2 2,-0.5 -0.954 11.1-168.2-116.0 133.3 23.7 -14.3 -59.2 116 145 A M E -cE 42 96A 1 -75,-2.9 -73,-1.3 -2,-0.4 2,-0.4 -0.956 7.7-171.5-130.2 118.6 21.8 -13.4 -56.1 117 146 A D E -cE 43 95A 0 -22,-2.4 -22,-2.6 -2,-0.5 2,-0.3 -0.855 19.7-156.5-107.7 144.3 21.6 -10.0 -54.3 118 147 A T E - E 0 94A 1 -75,-0.5 2,-0.2 -2,-0.4 -24,-0.2 -0.839 23.4 -95.6-129.4 159.5 20.0 -9.8 -50.9 119 148 A Q - 0 0 6 -26,-2.2 -74,-0.3 -2,-0.3 -27,-0.2 -0.516 52.2-112.7 -64.8 128.9 18.2 -7.5 -48.4 120 149 A G > - 0 0 4 -29,-0.5 3,-0.6 -2,-0.2 -74,-0.3 -0.351 29.4-116.4 -67.0 145.9 20.7 -6.2 -45.8 121 150 A T B 3 S+k 46 0C 6 -76,-2.1 -74,-2.1 1,-0.2 -1,-0.1 -0.385 86.2 27.2 -76.8 155.9 20.5 -7.4 -42.2 122 151 A F T 3 S+ 0 0 15 1,-0.2 450,-2.9 -76,-0.2 451,-0.2 0.612 73.8 148.7 71.9 18.7 19.7 -5.1 -39.2 123 152 A D < - 0 0 2 -3,-0.6 3,-0.5 448,-0.2 -1,-0.2 -0.339 57.7-113.1 -70.1 166.3 17.8 -2.3 -41.0 124 153 A S S S+ 0 0 13 1,-0.2 -1,-0.1 -2,-0.1 -36,-0.0 0.478 110.8 57.7 -85.5 -4.8 15.1 -0.6 -38.9 125 154 A Q S S+ 0 0 114 2,-0.1 2,-0.3 509,-0.0 -1,-0.2 0.626 95.8 84.2 -93.0 -17.4 12.1 -1.9 -40.8 126 155 A S - 0 0 5 -3,-0.5 2,-0.2 512,-0.0 3,-0.0 -0.622 65.4-142.2-103.0 146.0 12.9 -5.5 -40.3 127 156 A T > - 0 0 7 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.476 36.2-108.0 -88.0 166.0 12.3 -8.0 -37.6 128 157 A L H > S+ 0 0 5 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.916 121.7 55.4 -66.8 -39.3 15.1 -10.5 -36.7 129 158 A R H > S+ 0 0 40 186,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.886 106.0 53.4 -55.3 -41.0 13.0 -13.3 -38.3 130 159 A D H > S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.966 113.2 41.5 -57.5 -54.4 12.9 -11.2 -41.5 131 160 A S H X S+ 0 0 6 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.928 115.6 49.3 -64.0 -45.5 16.7 -10.8 -41.6 132 161 A A H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 5,-0.2 0.863 109.0 53.7 -61.3 -37.0 17.5 -14.4 -40.6 133 162 A T H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.926 111.8 43.2 -67.0 -45.0 15.1 -15.8 -43.2 134 163 A V H X S+ 0 0 2 -4,-1.9 4,-2.1 2,-0.2 5,-0.2 0.915 117.4 46.7 -65.9 -42.7 16.7 -13.9 -46.1 135 164 A F H X S+ 0 0 3 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.948 114.8 46.4 -65.9 -46.6 20.2 -14.8 -44.8 136 165 A A H X S+ 0 0 0 -4,-3.2 4,-2.8 -5,-0.2 5,-0.2 0.937 112.4 50.3 -59.1 -49.3 19.4 -18.5 -44.3 137 166 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 -5,-0.2 5,-0.3 0.926 109.9 48.3 -58.9 -49.5 17.6 -18.8 -47.7 138 167 A S H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.883 114.5 47.8 -59.0 -37.1 20.5 -17.3 -49.7 139 168 A T H < S+ 0 0 2 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.902 112.5 48.4 -69.7 -40.0 22.9 -19.6 -47.8 140 169 A M H < S+ 0 0 2 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.775 121.1 37.1 -68.8 -28.3 20.7 -22.6 -48.4 141 170 A I H < S+ 0 0 0 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.880 104.5 73.6 -92.5 -47.0 20.4 -21.8 -52.1 142 171 A S < - 0 0 4 -4,-3.0 39,-0.3 -5,-0.3 -101,-0.2 -0.239 57.5-157.5 -66.3 156.1 23.8 -20.4 -53.1 143 172 A S S S+ 0 0 2 -103,-3.0 39,-2.1 1,-0.3 2,-0.4 0.512 92.1 41.2-103.8 -15.6 26.9 -22.6 -53.4 144 173 A I E S-dg 41 182A 5 -104,-2.2 -102,-3.0 37,-0.1 2,-0.6 -0.950 73.2-171.2-133.0 113.7 29.1 -19.5 -52.8 145 174 A Q E -dg 42 183A 1 37,-2.7 39,-2.5 -2,-0.4 2,-0.8 -0.922 10.1-155.8-106.5 118.5 28.0 -17.1 -50.1 146 175 A V E -dg 43 184A 1 -104,-3.0 -102,-2.9 -2,-0.6 2,-1.0 -0.836 8.0-155.9 -93.7 108.4 29.9 -13.8 -49.8 147 176 A Y E -dg 44 185A 8 37,-2.5 39,-2.3 -2,-0.8 2,-0.6 -0.760 14.5-150.2 -86.5 102.7 29.5 -12.6 -46.2 148 177 A N E +dg 45 186A 0 -104,-3.2 -102,-0.6 -2,-1.0 2,-0.3 -0.681 22.5 175.0 -87.0 117.3 30.0 -8.9 -46.6 149 178 A L E - g 0 187A 9 37,-3.1 39,-3.4 -2,-0.6 2,-0.5 -0.819 26.9-122.7-122.5 158.3 31.5 -7.2 -43.5 150 179 A S E S- g 0 188A 23 -2,-0.3 2,-2.8 37,-0.2 39,-0.2 -0.897 71.7 -38.8-106.7 125.2 32.7 -3.7 -42.5 151 180 A Q S S+ 0 0 28 37,-3.3 40,-0.4 -2,-0.5 2,-0.3 -0.145 119.1 13.1 70.3 -47.9 36.3 -3.0 -41.2 152 181 A N S S- 0 0 4 -2,-2.8 2,-0.7 38,-0.1 -2,-0.2 -0.917 72.7-105.5-149.4 171.5 36.7 -6.1 -39.0 153 182 A V - 0 0 0 -2,-0.3 2,-0.2 351,-0.1 388,-0.1 -0.929 46.5-171.7-106.2 107.4 35.5 -9.6 -38.1 154 183 A Q > - 0 0 19 -2,-0.7 4,-1.4 1,-0.1 3,-0.4 -0.498 36.0-112.2 -98.0 165.5 33.8 -9.1 -34.7 155 184 A E H > S+ 0 0 3 384,-3.1 4,-2.1 1,-0.2 5,-0.1 0.856 117.9 56.1 -68.5 -32.2 32.4 -11.7 -32.3 156 185 A D H > S+ 0 0 7 383,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.781 102.6 57.1 -68.9 -26.3 28.9 -10.5 -32.9 157 186 A D H > S+ 0 0 26 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.888 108.1 46.9 -64.9 -40.8 29.4 -11.2 -36.6 158 187 A L H X S+ 0 0 0 -4,-1.4 4,-2.1 1,-0.2 -2,-0.2 0.897 111.6 50.2 -69.8 -40.2 30.3 -14.8 -35.8 159 188 A Q H X S+ 0 0 12 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.795 111.1 48.9 -69.0 -29.4 27.3 -15.2 -33.5 160 189 A H H X S+ 0 0 12 -4,-1.5 4,-3.3 2,-0.2 5,-0.2 0.929 110.6 50.1 -73.6 -45.0 24.9 -13.8 -36.2 161 190 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.884 112.1 49.7 -55.1 -40.5 26.4 -16.1 -38.8 162 191 A Q H X S+ 0 0 16 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.960 112.2 46.2 -65.2 -52.2 25.9 -18.9 -36.3 163 192 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.944 115.8 46.2 -53.6 -50.8 22.2 -17.9 -35.7 164 193 A F H X S+ 0 0 1 -4,-3.3 4,-1.6 1,-0.2 -2,-0.2 0.900 114.0 46.3 -63.9 -44.1 21.5 -17.5 -39.4 165 194 A T H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.2 -1,-0.2 0.904 110.8 52.6 -66.6 -42.1 23.1 -20.8 -40.5 166 195 A E H X S+ 0 0 6 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.859 107.3 53.5 -61.0 -34.1 21.5 -22.8 -37.7 167 196 A Y H X S+ 0 0 1 -4,-1.8 4,-1.0 -5,-0.2 -1,-0.2 0.881 110.0 47.3 -67.3 -38.1 18.1 -21.3 -38.9 168 197 A G H >< S+ 0 0 0 -4,-1.6 3,-0.7 1,-0.2 4,-0.4 0.922 109.0 54.7 -65.1 -44.3 18.9 -22.6 -42.4 169 198 A R H >< S+ 0 0 78 -4,-2.9 3,-1.5 1,-0.2 -2,-0.2 0.884 101.2 59.6 -54.6 -43.5 19.9 -26.0 -41.0 170 199 A L H 3< S+ 0 0 15 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.826 106.3 45.7 -57.9 -36.6 16.5 -26.3 -39.2 171 200 A A T << S+ 0 0 5 -4,-1.0 -1,-0.3 -3,-0.7 2,-0.2 0.426 102.0 88.2 -88.3 -0.3 14.6 -26.1 -42.5 172 201 A M S < S- 0 0 27 -3,-1.5 3,-0.1 -4,-0.4 -3,-0.0 -0.574 87.3 -92.5 -95.0 159.3 16.9 -28.5 -44.3 173 202 A E - 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0 0 1 50,-3.1 52,-0.5 -3,-0.6 -1,-0.2 -0.456 4.4-170.2 -58.2 131.5 40.2 -3.1 -44.2 191 220 A S + 0 0 20 -40,-0.4 3,-0.2 1,-0.2 -1,-0.1 0.372 63.8 66.6-110.9 3.3 42.5 -0.5 -42.6 192 221 A F >> + 0 0 22 1,-0.1 4,-2.5 4,-0.1 3,-2.2 -0.359 39.9 147.0-128.1 57.0 45.5 -2.5 -41.6 193 222 A P T 34 S+ 0 0 41 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.735 77.0 64.1 -64.8 -19.1 47.4 -3.8 -44.6 194 223 A Y T 34 S+ 0 0 100 472,-0.2 3,-0.1 -3,-0.2 -2,-0.1 0.586 110.7 37.1 -76.7 -12.7 50.6 -3.4 -42.5 195 224 A E T <4 S+ 0 0 71 -3,-2.2 2,-0.3 1,-0.3 -1,-0.1 0.769 140.0 5.8-101.9 -43.4 49.2 -6.1 -40.1 196 225 A F S < S- 0 0 38 -4,-2.5 -1,-0.3 9,-0.0 -4,-0.1 -0.938 88.8-115.3-142.1 121.6 47.6 -8.3 -42.8 197 226 A S - 0 0 78 -2,-0.3 42,-0.2 -3,-0.1 5,-0.2 -0.094 35.5 -97.4 -55.2 147.2 48.0 -7.6 -46.5 198 227 A Y S S+ 0 0 37 4,-0.1 4,-0.3 3,-0.1 3,-0.2 -0.357 87.6 35.1 -55.2 143.8 45.1 -6.6 -48.7 199 228 A G B > S-I 239 0A 6 40,-2.3 4,-1.9 1,-0.2 40,-1.5 -0.539 107.3 -43.2 109.4-170.7 43.7 -9.6 -50.5 200 229 A A H > S+ 0 0 20 38,-0.2 4,-3.1 2,-0.2 37,-0.3 0.852 126.8 51.0 -69.6 -39.4 43.1 -13.4 -50.1 201 230 A D H > S+ 0 0 129 2,-0.2 4,-1.9 -3,-0.2 5,-0.2 0.927 114.3 42.1 -71.7 -45.3 46.5 -14.3 -48.5 202 231 A G H > S+ 0 0 2 -4,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.907 115.9 53.3 -60.8 -42.1 46.3 -11.6 -45.8 203 232 A G H X S+ 0 0 0 -4,-1.9 4,-3.5 1,-0.2 5,-0.3 0.936 106.1 52.3 -55.5 -48.7 42.7 -12.6 -45.4 204 233 A A H X S+ 0 0 54 -4,-3.1 4,-2.4 33,-0.4 -1,-0.2 0.896 112.4 43.5 -57.2 -47.9 43.5 -16.2 -45.0 205 234 A K H X S+ 0 0 124 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.909 115.7 49.3 -66.0 -43.1 46.0 -15.5 -42.2 206 235 A F H X S+ 0 0 1 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.960 114.6 43.1 -59.7 -52.0 43.7 -13.0 -40.5 207 236 A L H X S+ 0 0 8 -4,-3.5 4,-2.9 1,-0.2 5,-0.2 0.893 107.7 60.7 -65.9 -38.8 40.7 -15.4 -40.6 208 237 A E H X S+ 0 0 141 -4,-2.4 4,-0.6 -5,-0.3 -1,-0.2 0.923 109.1 42.6 -51.4 -48.1 42.7 -18.3 -39.5 209 238 A K H < S+ 0 0 109 -4,-1.8 3,-0.4 1,-0.2 -1,-0.2 0.870 113.6 54.0 -68.4 -35.0 43.6 -16.5 -36.3 210 239 A R H < S+ 0 0 6 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.910 117.6 32.6 -64.0 -44.7 40.0 -15.3 -35.9 211 240 A L H < S+ 0 0 5 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.344 86.3 131.6 -98.5 5.1 38.3 -18.7 -36.2 212 241 A K < - 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