==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-AUG-98 1BP4 . COMPND 2 MOLECULE: PAPAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CARICA PAPAYA; . AUTHOR J.M.LALONDE,B.ZHAO,W.W.SMITH,C.A.JANSON,R.L.DESJARLAIS,T.A.T . 212 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9606.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 58.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 17.5 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 0.5 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 . 13 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 1 0 0 1 1 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 0 1 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 . 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 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 I 0 0 132 0, 0.0 122,-0.1 0, 0.0 121,-0.0 0.000 360.0 360.0 360.0 164.0 -14.5 57.6 -31.5 2 2 A P - 0 0 74 0, 0.0 3,-0.1 0, 0.0 124,-0.0 -0.240 360.0-129.2 -71.4 159.5 -13.1 55.6 -34.5 3 3 A E S S+ 0 0 140 1,-0.2 2,-0.4 -2,-0.0 0, 0.0 0.823 97.9 35.6 -71.6 -39.4 -14.7 52.7 -36.4 4 4 A Y + 0 0 145 163,-0.2 2,-0.4 164,-0.1 163,-0.2 -0.981 63.5 175.4-122.9 137.0 -11.5 50.6 -35.9 5 5 A V E +A 166 0A 21 161,-2.4 161,-1.7 -2,-0.4 2,-0.3 -0.998 5.6 165.2-138.7 131.9 -9.0 50.5 -33.0 6 6 A D E > -A 165 0A 40 -2,-0.4 3,-1.1 159,-0.2 4,-0.2 -0.788 19.9-163.8-151.0 104.7 -6.0 48.2 -32.7 7 7 A W G > >S+ 0 0 34 157,-2.9 5,-2.2 -2,-0.3 3,-1.1 0.698 88.0 68.9 -63.7 -19.0 -3.4 49.0 -30.1 8 8 A R G > 5S+ 0 0 103 156,-0.3 3,-1.4 1,-0.3 -1,-0.2 0.861 94.8 57.6 -65.6 -33.6 -0.9 46.6 -31.9 9 9 A Q G < 5S+ 0 0 152 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.557 103.8 51.5 -73.6 -11.9 -0.8 49.1 -34.7 10 10 A K G < 5S- 0 0 139 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.259 118.6-109.6-107.1 7.7 0.3 51.9 -32.3 11 11 A G T < 5S+ 0 0 31 -3,-1.4 -3,-0.2 1,-0.1 -2,-0.1 0.732 84.4 122.2 70.2 28.3 3.1 49.8 -30.9 12 12 A A < + 0 0 2 -5,-2.2 2,-0.4 152,-0.1 -4,-0.2 0.308 50.9 71.3-104.0 1.8 1.4 49.3 -27.6 13 13 A V - 0 0 21 -6,-0.3 3,-0.1 -5,-0.2 -2,-0.1 -0.983 64.5-145.8-126.3 138.6 1.1 45.6 -27.2 14 14 A T - 0 0 6 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.335 43.6 -62.5 -88.8 170.3 3.8 43.0 -26.5 15 15 A P - 0 0 89 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.089 63.0 -91.0 -52.6 153.6 4.1 39.4 -27.8 16 16 A V - 0 0 22 168,-0.2 163,-0.2 -3,-0.1 2,-0.2 -0.482 46.8-156.2 -68.2 136.0 1.4 36.9 -26.9 17 17 A K - 0 0 19 158,-0.4 161,-2.3 -2,-0.2 2,-0.4 -0.570 10.7-134.0-107.9 174.6 2.2 34.9 -23.7 18 18 A N B -I 177 0B 91 159,-0.2 159,-0.2 -2,-0.2 158,-0.0 -0.985 5.5-164.1-134.6 116.7 1.2 31.6 -22.4 19 19 A Q - 0 0 14 157,-2.5 158,-0.1 -2,-0.4 2,-0.1 0.701 30.5-159.5 -74.1 -18.2 0.1 31.3 -18.7 20 20 A G - 0 0 45 156,-0.4 2,-1.3 1,-0.2 -1,-0.2 -0.415 55.6 -22.0 73.7-151.4 0.5 27.5 -18.8 21 21 A S S S+ 0 0 133 -2,-0.1 2,-0.3 2,-0.1 -1,-0.2 -0.542 111.8 95.3 -93.6 66.3 -1.3 25.4 -16.3 22 22 A a S S- 0 0 10 -2,-1.3 2,-2.8 69,-0.1 3,-0.3 -0.940 80.3-121.5-155.0 129.9 -1.8 28.1 -13.6 23 23 A G B +j 64 0C 21 40,-2.3 42,-0.6 -2,-0.3 3,-0.3 -0.313 69.2 128.6 -71.8 58.7 -4.8 30.3 -13.1 24 24 A S >> + 0 0 0 -2,-2.8 3,-2.2 1,-0.2 4,-1.9 0.395 27.1 114.0 -93.8 -0.5 -2.7 33.4 -13.6 25 25 A C H 3> S+ 0 0 17 -3,-0.3 4,-3.2 1,-0.3 5,-0.2 0.812 72.0 57.6 -38.1 -46.3 -5.0 34.9 -16.3 26 26 A W H 3> S+ 0 0 1 -3,-0.3 4,-1.7 1,-0.2 -1,-0.3 0.827 109.8 44.8 -58.4 -34.1 -5.9 37.8 -14.0 27 27 A A H <> S+ 0 0 0 -3,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.922 113.5 48.0 -76.4 -48.4 -2.2 38.7 -13.8 28 28 A F H X S+ 0 0 7 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.945 112.9 51.6 -55.7 -46.4 -1.6 38.4 -17.5 29 29 A S H X S+ 0 0 3 -4,-3.2 4,-1.3 -5,-0.2 -1,-0.2 0.909 110.6 45.4 -56.8 -51.3 -4.7 40.4 -18.1 30 30 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.908 109.5 57.0 -62.9 -39.9 -3.7 43.3 -15.8 31 31 A V H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.880 100.6 56.7 -60.2 -39.9 -0.2 43.3 -17.3 32 32 A V H X S+ 0 0 16 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.930 108.3 48.5 -58.4 -41.6 -1.5 43.8 -20.8 33 33 A T H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.911 112.7 47.8 -66.5 -39.1 -3.2 46.9 -19.6 34 34 A I H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.958 110.2 49.9 -66.0 -50.9 -0.1 48.2 -17.8 35 35 A E H X S+ 0 0 2 -4,-3.2 4,-1.6 1,-0.2 11,-0.3 0.917 114.4 49.4 -53.9 -40.9 2.3 47.6 -20.8 36 36 A G H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.3 -2,-0.2 0.911 109.7 45.1 -67.1 -50.1 -0.3 49.5 -22.9 37 37 A I H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.900 111.4 53.5 -64.7 -38.2 -0.9 52.6 -20.8 38 38 A I H X>S+ 0 0 9 -4,-2.2 4,-3.5 2,-0.2 5,-0.8 0.919 110.4 47.7 -62.4 -41.5 2.9 53.2 -20.1 39 39 A K H X5S+ 0 0 56 -4,-1.6 4,-1.2 -5,-0.3 -1,-0.2 0.919 112.6 49.1 -65.0 -43.8 3.6 53.1 -23.9 40 40 A I H <5S+ 0 0 51 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.850 121.6 35.2 -62.4 -38.0 0.7 55.5 -24.5 41 41 A R H <5S+ 0 0 120 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.935 133.4 21.2 -82.1 -54.3 2.0 57.8 -21.8 42 42 A T H <5S- 0 0 78 -4,-3.5 -3,-0.2 2,-0.2 -2,-0.1 0.760 94.5-121.0 -90.2 -29.6 5.8 57.5 -22.1 43 43 A G S < + 0 0 0 32,-2.6 4,-0.8 -2,-0.2 32,-0.1 -0.605 33.1 171.4 -81.6 116.6 5.9 40.9 -14.5 50 50 A E H > S+ 0 0 3 -2,-0.6 4,-2.9 2,-0.2 -1,-0.2 0.775 85.8 60.9 -84.2 -30.9 2.9 38.7 -14.1 51 51 A Q H > S+ 0 0 0 35,-0.4 4,-2.1 1,-0.2 5,-0.2 0.905 99.6 55.5 -62.8 -40.3 4.8 36.5 -11.7 52 52 A E H > S+ 0 0 4 34,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.908 110.8 43.9 -58.1 -47.0 5.2 39.5 -9.4 53 53 A L H X S+ 0 0 0 -4,-0.8 4,-1.7 1,-0.2 -2,-0.2 0.956 110.2 56.0 -62.5 -48.2 1.4 40.0 -9.3 54 54 A L H < S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.818 118.4 33.7 -51.9 -37.3 0.9 36.3 -8.9 55 55 A D H < S+ 0 0 13 -4,-2.1 40,-0.5 -5,-0.1 -1,-0.2 0.754 122.5 42.5 -89.1 -37.4 3.1 36.3 -5.8 56 56 A b H < S+ 0 0 18 -4,-2.5 2,-0.8 -5,-0.2 -2,-0.2 0.393 82.9 99.5 -96.6 -2.8 2.3 39.7 -4.3 57 57 A D < - 0 0 4 -4,-1.7 5,-0.4 1,-0.2 3,-0.2 -0.829 45.6-176.4 -91.3 111.6 -1.4 40.0 -4.6 58 58 A R S S+ 0 0 213 -2,-0.8 -1,-0.2 1,-0.2 13,-0.0 0.745 80.7 54.7 -75.0 -29.8 -2.9 39.1 -1.2 59 59 A R S S+ 0 0 88 8,-0.1 2,-0.2 11,-0.1 -1,-0.2 0.594 101.8 70.9 -82.5 -12.1 -6.6 39.4 -2.4 60 60 A S S S- 0 0 8 -3,-0.2 6,-0.3 -7,-0.1 3,-0.1 -0.585 82.7-125.4-101.2 168.8 -6.0 37.0 -5.2 61 61 A Y > - 0 0 127 4,-1.9 3,-2.6 1,-0.3 5,-0.2 -0.130 34.5-131.4-108.4 39.0 -5.4 33.2 -5.0 62 62 A G T > S- 0 0 0 -5,-0.4 3,-1.1 1,-0.3 -1,-0.3 -0.291 86.1 -2.7 54.5-124.4 -2.2 32.8 -6.9 63 63 A a T 3 S+ 0 0 35 1,-0.2 -40,-2.3 -3,-0.1 -1,-0.3 0.386 128.3 70.6 -80.7 5.4 -2.6 30.0 -9.5 64 64 A N B < S-j 23 0C 142 -3,-2.6 -1,-0.2 1,-0.5 2,-0.2 0.351 118.0 -76.1-100.9 3.4 -6.1 29.3 -8.2 65 65 A G < - 0 0 17 -3,-1.1 -4,-1.9 -42,-0.6 -1,-0.5 -0.579 53.8-174.3 124.6 172.3 -7.5 32.4 -9.7 66 66 A G - 0 0 22 -6,-0.3 -6,-0.1 -2,-0.2 -40,-0.0 -0.977 27.9 -79.2-179.9-172.0 -7.5 36.1 -8.8 67 67 A Y > - 0 0 74 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.943 13.0-155.1-122.5 128.1 -8.8 39.6 -9.6 68 68 A P H > S+ 0 0 11 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.863 99.7 53.2 -64.2 -37.6 -7.6 42.0 -12.3 69 69 A W H > S+ 0 0 97 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.870 110.5 45.2 -67.4 -37.7 -8.8 45.0 -10.3 70 70 A S H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.906 113.1 50.3 -74.0 -39.0 -6.8 44.0 -7.1 71 71 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.905 111.5 49.8 -64.0 -36.8 -3.7 43.2 -9.2 72 72 A L H X S+ 0 0 0 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.784 107.9 53.8 -71.1 -26.9 -4.1 46.6 -10.8 73 73 A Q H X S+ 0 0 24 -4,-1.2 4,-1.0 2,-0.2 3,-0.5 0.944 104.3 55.4 -69.9 -47.9 -4.5 48.2 -7.3 74 74 A L H >X>S+ 0 0 12 -4,-2.3 4,-2.6 1,-0.3 3,-1.2 0.917 107.4 48.8 -50.5 -51.9 -1.2 46.6 -6.2 75 75 A V H 3X5S+ 0 0 0 -4,-1.7 4,-1.0 1,-0.3 32,-0.9 0.820 107.0 55.6 -61.7 -33.3 0.7 48.2 -9.1 76 76 A A H 3<5S+ 0 0 19 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.693 120.3 31.9 -73.3 -17.9 -0.8 51.6 -8.3 77 77 A Q H <<5S+ 0 0 87 -3,-1.2 -2,-0.2 -4,-1.0 -3,-0.2 0.857 138.5 15.3 -97.3 -65.3 0.6 51.4 -4.8 78 78 A Y H <5S- 0 0 162 -4,-2.6 -3,-0.2 1,-0.2 25,-0.2 0.426 96.4-139.6 -93.0 -4.0 3.8 49.4 -5.0 79 79 A G << - 0 0 1 -4,-1.0 2,-0.3 -5,-0.7 27,-0.3 -0.173 20.9 -94.0 72.4-167.9 4.5 49.5 -8.7 80 80 A I B -L 105 0E 0 25,-2.7 25,-2.0 -5,-0.1 24,-1.6 -0.993 21.1-124.5-151.2 153.2 5.8 46.6 -10.8 81 81 A H - 0 0 7 -2,-0.3 -32,-2.6 22,-0.2 -29,-0.1 -0.584 37.8 -92.1 -94.0 162.1 9.0 45.1 -12.2 82 82 A Y B > -K 48 0D 89 -34,-0.2 4,-2.2 -2,-0.2 -34,-0.3 -0.286 33.9-118.3 -67.7 156.2 10.0 44.3 -15.7 83 83 A R T 4 S+ 0 0 53 -36,-2.4 -35,-0.2 1,-0.2 -1,-0.1 0.834 116.1 56.0 -65.4 -31.6 9.3 40.8 -16.8 84 84 A N T 4 S+ 0 0 156 -37,-0.4 -1,-0.2 1,-0.2 -36,-0.1 0.836 109.4 44.7 -71.0 -32.1 13.0 40.3 -17.4 85 85 A T T 4 S+ 0 0 57 -3,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.877 129.9 24.4 -76.6 -40.4 13.8 41.2 -13.8 86 86 A Y S < S- 0 0 1 -4,-2.2 -34,-0.4 14,-0.0 -35,-0.4 -0.658 90.3-166.6-129.3 75.4 11.0 39.1 -12.3 87 87 A P - 0 0 61 0, 0.0 2,-0.5 0, 0.0 -3,-0.1 0.042 25.9 -94.5 -59.9 167.4 10.2 36.3 -14.8 88 88 A Y + 0 0 45 1,-0.1 -5,-0.0 -37,-0.1 -39,-0.0 -0.765 36.9 171.6 -93.6 126.2 7.3 34.0 -14.9 89 89 A E - 0 0 86 -2,-0.5 -1,-0.1 2,-0.3 3,-0.1 0.586 42.6-125.8-105.7 -19.3 7.6 30.6 -13.3 90 90 A G S S+ 0 0 27 1,-0.3 2,-0.3 -70,-0.1 -69,-0.1 0.726 84.9 81.8 78.5 21.3 4.0 29.3 -13.5 91 91 A V S S- 0 0 50 -69,-0.1 2,-0.6 -67,-0.0 -2,-0.3 -0.967 84.7-113.0-152.2 147.2 3.9 28.7 -9.8 92 92 A Q + 0 0 86 -2,-0.3 2,-0.1 -3,-0.1 -37,-0.1 -0.812 41.9 163.9 -91.1 121.4 3.3 31.1 -6.9 93 93 A R - 0 0 134 -2,-0.6 2,-0.2 -42,-0.2 -1,-0.0 -0.102 48.3 -58.2-106.7-144.3 6.4 31.6 -4.7 94 94 A Y - 0 0 141 -2,-0.1 2,-0.4 1,-0.1 -1,-0.2 -0.675 61.9 -85.4-104.4 158.4 6.8 34.5 -2.3 95 95 A b + 0 0 63 -40,-0.5 3,-0.2 -2,-0.2 4,-0.1 -0.456 46.4 171.7 -65.0 118.5 6.6 38.2 -3.0 96 96 A R > + 0 0 26 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 0.128 36.1 120.0-115.2 21.7 10.1 39.2 -4.0 97 97 A S T 4 S+ 0 0 25 1,-0.2 4,-0.4 2,-0.2 -1,-0.1 0.907 78.8 46.9 -53.1 -46.7 9.4 42.8 -5.2 98 98 A R T >4 S+ 0 0 237 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.875 109.4 53.5 -64.4 -40.8 11.8 44.3 -2.6 99 99 A E T 34 S+ 0 0 122 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.890 103.3 56.6 -61.5 -43.3 14.6 41.9 -3.4 100 100 A K T 3< S- 0 0 75 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.565 110.8-127.8 -67.4 -11.0 14.6 42.7 -7.1 101 101 A G < + 0 0 31 -3,-1.0 -1,-0.2 -4,-0.4 2,-0.1 -0.660 57.9 6.1 103.0-156.3 15.1 46.3 -6.3 102 102 A P S S- 0 0 121 0, 0.0 -23,-0.0 0, 0.0 -4,-0.0 -0.409 81.5-102.1 -69.8 139.4 13.2 49.5 -7.4 103 103 A Y - 0 0 122 -25,-0.2 -22,-0.2 1,-0.1 3,-0.1 -0.296 19.3-138.7 -61.3 145.5 10.0 49.0 -9.4 104 104 A A S S- 0 0 32 -24,-1.6 2,-0.3 1,-0.2 -23,-0.2 0.851 79.9 -3.4 -73.1 -41.1 10.2 49.6 -13.1 105 105 A A B -L 80 0E 13 -25,-2.0 -25,-2.7 -30,-0.0 2,-0.4 -0.984 58.2-157.9-151.3 159.5 6.9 51.5 -13.3 106 106 A K - 0 0 59 -2,-0.3 -30,-0.2 -27,-0.3 2,-0.2 -0.995 13.5-141.3-142.8 138.6 4.0 52.6 -11.2 107 107 A T - 0 0 0 -32,-0.9 104,-0.2 -2,-0.4 -28,-0.1 -0.474 14.2-131.8 -93.6 167.7 0.4 53.5 -12.1 108 108 A D S S- 0 0 76 102,-2.4 2,-0.3 1,-0.2 103,-0.2 0.559 70.0 -54.4 -94.6 -15.5 -1.7 56.2 -10.6 109 109 A G E -B 210 0A 17 101,-1.4 101,-2.2 -37,-0.1 2,-0.3 -0.991 49.0 -98.2 170.6-162.5 -4.9 54.2 -10.1 110 110 A V E -B 209 0A 50 99,-0.3 2,-0.3 -2,-0.3 -41,-0.0 -0.984 24.6-166.6-153.2 140.8 -7.6 51.9 -11.5 111 111 A R E -B 208 0A 151 97,-2.4 97,-1.8 -2,-0.3 2,-0.4 -0.887 16.9-127.3-128.0 160.4 -11.1 52.6 -12.8 112 112 A Q E -B 207 0A 103 -2,-0.3 2,-0.3 95,-0.2 95,-0.2 -0.902 17.7-131.0-110.7 136.8 -14.1 50.4 -13.7 113 113 A V - 0 0 8 93,-3.2 93,-0.5 -2,-0.4 8,-0.1 -0.645 42.6 -95.2 -79.6 141.7 -16.0 50.5 -17.0 114 114 A Q - 0 0 126 -2,-0.3 3,-0.5 1,-0.1 6,-0.1 -0.473 54.1-119.8 -58.1 125.5 -19.7 50.7 -16.4 115 115 A P S S+ 0 0 48 0, 0.0 89,-0.2 0, 0.0 90,-0.1 -0.187 84.4 21.2 -71.3 161.5 -20.8 47.0 -16.7 116 116 A Y S S+ 0 0 107 87,-2.4 2,-0.3 81,-0.2 82,-0.1 0.816 96.0 115.9 49.8 42.6 -23.2 45.4 -19.1 117 117 A N > - 0 0 51 -3,-0.5 4,-1.6 86,-0.3 3,-0.2 -0.849 47.1-169.9-145.5 101.2 -22.7 48.4 -21.5 118 118 A Q H > S+ 0 0 37 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.862 89.2 52.4 -58.0 -40.5 -21.1 47.9 -24.9 119 119 A G H > S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.870 106.1 52.1 -66.6 -38.8 -20.7 51.6 -25.6 120 120 A A H > S+ 0 0 23 -3,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.860 111.8 48.8 -66.8 -32.9 -18.9 52.3 -22.3 121 121 A L H X S+ 0 0 3 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.919 109.6 49.4 -72.8 -43.8 -16.5 49.5 -23.1 122 122 A L H X S+ 0 0 17 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.900 108.7 54.6 -63.4 -37.9 -15.7 50.6 -26.7 123 123 A Y H < S+ 0 0 138 -4,-2.0 4,-0.2 1,-0.2 -1,-0.2 0.913 110.2 45.5 -61.6 -45.5 -15.1 54.1 -25.5 124 124 A S H >X S+ 0 0 12 -4,-1.4 3,-1.9 1,-0.2 4,-1.8 0.916 109.7 54.2 -64.9 -43.3 -12.5 52.9 -23.0 125 125 A I H 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.823 100.5 61.8 -60.5 -30.0 -10.8 50.6 -25.5 126 126 A A T 3< S+ 0 0 22 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.600 110.6 40.6 -72.2 -10.7 -10.4 53.7 -27.8 127 127 A N T <4 S- 0 0 78 -3,-1.9 -2,-0.2 1,-0.4 -1,-0.2 0.733 132.1 -28.2-103.3 -34.9 -8.3 55.2 -25.0 128 128 A Q S < S- 0 0 19 -4,-1.8 -1,-0.4 35,-0.1 -95,-0.1 -0.967 78.2 -68.1-173.6 163.6 -6.2 52.2 -23.9 129 129 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 35,-0.2 -0.369 53.4-148.2 -62.0 150.6 -6.3 48.4 -23.6 130 130 A V E -C 163 0A 0 33,-2.0 33,-3.1 78,-0.1 2,-0.4 -0.952 13.8-120.1-130.4 142.0 -8.8 47.1 -21.0 131 131 A S E +CD 162 207A 0 76,-2.9 76,-1.3 -2,-0.4 2,-0.3 -0.691 43.1 175.1 -77.2 129.9 -9.0 44.2 -18.6 132 132 A V E -C 161 0A 0 29,-2.9 29,-3.5 -2,-0.4 2,-0.3 -0.944 20.5-144.2-139.8 151.7 -12.0 42.1 -19.5 133 133 A V E +C 160 0A 17 69,-0.4 71,-0.3 -2,-0.3 2,-0.3 -0.878 22.7 159.8-119.6 154.9 -13.6 38.8 -18.4 134 134 A L E -C 159 0A 0 25,-2.1 24,-3.0 -2,-0.3 25,-1.3 -0.938 45.8 -86.0-158.8 172.8 -15.5 36.1 -20.2 135 135 A Q + 0 0 8 65,-2.0 3,-0.2 19,-0.4 22,-0.2 -0.851 42.1 164.5 -94.4 114.9 -16.5 32.5 -20.1 136 136 A A + 0 0 5 -2,-0.7 6,-0.1 20,-0.2 -1,-0.1 0.377 50.9 94.7-109.9 1.9 -13.8 30.3 -21.6 137 137 A A + 0 0 60 19,-0.3 -1,-0.1 4,-0.1 2,-0.1 0.647 62.0 101.4 -70.2 -16.9 -15.0 26.9 -20.2 138 138 A G S > S- 0 0 19 -3,-0.2 4,-2.0 1,-0.1 3,-0.3 -0.450 75.6-131.4 -75.6 148.7 -16.9 26.1 -23.4 139 139 A K H > S+ 0 0 152 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.818 106.2 59.1 -63.3 -38.9 -15.5 23.8 -25.9 140 140 A D H 4 S+ 0 0 75 12,-0.2 -1,-0.2 2,-0.2 13,-0.1 0.852 107.9 46.0 -61.6 -38.0 -16.2 26.2 -28.8 141 141 A F H >4 S+ 0 0 1 -3,-0.3 3,-1.2 11,-0.2 -2,-0.2 0.904 112.8 50.2 -71.2 -41.0 -14.0 28.8 -27.1 142 142 A Q H 3< S+ 0 0 104 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.811 113.6 45.6 -66.4 -32.0 -11.3 26.3 -26.4 143 143 A L T 3< S+ 0 0 121 -4,-2.1 -1,-0.3 -5,-0.1 2,-0.2 0.281 80.5 137.6 -95.9 9.7 -11.3 25.1 -30.0 144 144 A Y < + 0 0 5 -3,-1.2 38,-1.6 1,-0.1 3,-0.1 -0.396 18.9 166.9 -63.3 125.3 -11.4 28.6 -31.6 145 145 A R - 0 0 185 1,-0.4 2,-0.2 -2,-0.2 -1,-0.1 0.347 60.2 -45.6-118.0 -3.2 -9.0 28.8 -34.6 146 146 A G S S+ 0 0 14 37,-0.1 -1,-0.4 1,-0.1 2,-0.1 -0.721 82.5 80.6 149.1 163.0 -10.1 32.1 -36.2 147 147 A G S S- 0 0 29 -2,-0.2 41,-0.8 -3,-0.1 2,-0.8 -0.386 87.3 -49.6 102.4 173.1 -13.1 34.2 -37.3 148 148 A I E -e 188 0A 56 -2,-0.1 2,-0.4 39,-0.1 41,-0.2 -0.817 65.0-135.5 -84.7 109.8 -15.5 36.5 -35.5 149 149 A F E +e 189 0A 14 39,-3.3 41,-3.0 -2,-0.8 50,-0.1 -0.650 34.3 168.5 -73.4 126.8 -16.5 34.3 -32.6 150 150 A V - 0 0 90 1,-0.5 3,-0.2 -2,-0.4 50,-0.1 0.396 37.4-156.0-114.4 -7.2 -20.3 34.3 -31.9 151 151 A G - 0 0 14 1,-0.3 -1,-0.5 48,-0.1 2,-0.2 -0.790 42.6-130.2 116.8-155.5 -20.4 31.4 -29.5 152 152 A P S S+ 0 0 93 0, 0.0 -1,-0.3 0, 0.0 2,-0.3 0.429 70.9 120.5 -70.8 152.1 -22.1 29.3 -28.3 153 153 A c - 0 0 39 -3,-0.2 47,-0.3 -2,-0.2 48,-0.1 -0.938 49.5-130.8-170.7 158.6 -21.1 30.2 -24.8 154 154 A G - 0 0 26 -2,-0.3 -19,-0.4 46,-0.2 -16,-0.1 -0.174 31.0-103.2-102.1-160.3 -22.8 31.3 -21.6 155 155 A N S S+ 0 0 73 46,-0.1 2,-1.8 -2,-0.1 46,-0.0 0.000 74.8 122.1-119.6 29.8 -22.0 34.2 -19.2 156 156 A K - 0 0 156 -21,-0.0 -19,-0.3 2,-0.0 -20,-0.2 -0.624 57.8-154.4 -88.5 70.7 -20.4 32.2 -16.4 157 157 A V + 0 0 48 -2,-1.8 -22,-0.3 -22,-0.2 3,-0.1 -0.198 34.5 152.4 -49.2 137.8 -17.2 34.3 -16.8 158 158 A D + 0 0 87 -24,-3.0 2,-0.3 1,-0.3 -23,-0.2 0.175 51.0 64.1-158.6 21.1 -14.1 32.5 -15.6 159 159 A H E -C 134 0A 12 -25,-1.3 -25,-2.1 -134,-0.1 2,-0.4 -0.940 63.4-145.4-156.1 124.5 -11.2 33.8 -17.5 160 160 A A E +C 133 0A 6 -2,-0.3 -27,-0.2 -27,-0.2 2,-0.2 -0.806 29.9 157.8 -95.4 138.0 -9.7 37.3 -17.6 161 161 A V E -C 132 0A 4 -29,-3.5 -29,-2.9 -2,-0.4 2,-0.4 -0.722 36.0-104.7-141.2-174.4 -8.2 38.6 -20.8 162 162 A A E -CF 131 174A 0 12,-1.6 12,-3.1 -31,-0.2 2,-0.6 -0.988 14.2-139.6-129.0 138.6 -7.5 42.0 -22.3 163 163 A A E +CF 130 173A 0 -33,-3.1 -33,-2.0 -2,-0.4 10,-0.2 -0.839 24.1 171.5 -93.3 117.7 -9.3 44.0 -25.0 164 164 A V E - 0 0 0 8,-2.2 -157,-2.9 -2,-0.6 2,-0.3 0.287 60.5 -23.1-110.2 8.9 -6.8 45.7 -27.3 165 165 A G E -AF 6 172A 0 7,-1.0 7,-2.2 -159,-0.2 2,-0.3 -0.977 53.1-141.2 169.8-178.6 -9.1 46.9 -30.0 166 166 A Y E -AF 5 171A 5 -161,-1.7 -161,-2.4 5,-0.3 5,-0.2 -0.978 3.5-160.3-162.4 166.5 -12.5 46.7 -31.9 167 167 A G E > - F 0 170A 0 3,-2.5 3,-1.2 -2,-0.3 -163,-0.2 -0.860 51.4 -74.4-143.2 176.8 -14.1 46.9 -35.2 168 168 A P T 3 S+ 0 0 56 0, 0.0 -164,-0.1 0, 0.0 3,-0.0 0.756 130.2 17.5 -46.7 -35.0 -17.7 47.5 -36.6 169 169 A N T 3 S+ 0 0 69 21,-0.1 22,-1.2 23,-0.0 2,-0.3 0.259 123.0 41.0-127.9 14.7 -18.7 44.0 -35.6 170 170 A Y E < -FG 167 190A 36 -3,-1.2 -3,-2.5 20,-0.3 2,-0.4 -0.947 59.7-131.4-153.9 169.3 -16.1 42.6 -33.1 171 171 A I E -FG 166 189A 0 18,-2.0 18,-2.7 -2,-0.3 2,-0.6 -0.997 31.2-132.1-125.4 125.6 -14.0 43.3 -30.1 172 172 A L E -FG 165 188A 4 -7,-2.2 -8,-2.2 -2,-0.4 -7,-1.0 -0.758 25.9-166.6 -86.0 121.8 -10.3 42.3 -30.4 173 173 A I E -FG 163 187A 0 14,-3.1 14,-1.8 -2,-0.6 2,-0.7 -0.900 18.9-145.7-118.1 136.6 -9.0 40.3 -27.5 174 174 A K E -FG 162 186A 10 -12,-3.1 -12,-1.6 -2,-0.4 12,-0.2 -0.847 26.0-168.6 -96.4 115.3 -5.5 39.4 -26.5 175 175 A N - 0 0 4 10,-2.0 -158,-0.4 -2,-0.7 3,-0.2 -0.521 23.1-135.8 -98.9 169.3 -5.5 35.9 -24.8 176 176 A S S S+ 0 0 8 -2,-0.2 -157,-2.5 1,-0.1 -156,-0.4 -0.310 75.1 100.4-121.3 47.5 -2.7 34.2 -22.8 177 177 A W B S-I 18 0B 70 1,-0.4 -159,-0.2 8,-0.2 3,-0.2 -0.030 93.3 -95.7-118.0 25.9 -2.9 30.7 -24.2 178 178 A G > - 0 0 11 -161,-2.3 3,-1.0 1,-0.2 -1,-0.4 0.035 42.5 -74.3 81.5 168.0 0.1 31.1 -26.6 179 179 A T T 3 S+ 0 0 90 1,-0.2 5,-0.4 -163,-0.2 6,-0.3 0.532 119.6 75.9 -77.3 -8.9 0.2 32.0 -30.3 180 180 A G T 3 S+ 0 0 82 -3,-0.2 2,-0.4 4,-0.2 -1,-0.2 0.493 84.7 76.2 -82.4 -0.9 -1.0 28.5 -31.2 181 181 A W S <> S- 0 0 24 -3,-1.0 4,-2.6 2,-0.0 -36,-0.2 -0.915 102.5 -26.0-113.5 138.2 -4.6 29.4 -30.2 182 182 A G T 4 S- 0 0 16 -38,-1.6 2,-1.4 -2,-0.4 5,-0.2 -0.312 123.1 -12.9 66.2-146.1 -6.9 31.5 -32.2 183 183 A E B >4 S-H 186 0A 50 3,-2.6 3,-0.6 1,-0.2 -1,-0.2 -0.648 132.1 -46.2 -92.5 75.0 -5.6 34.1 -34.6 184 184 A N T 34 S- 0 0 120 -2,-1.4 -1,-0.2 -5,-0.4 -2,-0.2 0.874 121.0 -38.8 64.5 41.9 -2.0 34.0 -33.3 185 185 A G T 3< S+ 0 0 0 -4,-2.6 -10,-2.0 1,-0.4 -1,-0.2 0.373 123.1 104.0 92.4 -5.3 -3.2 34.2 -29.7 186 186 A Y E < -HG 183 174A 15 -3,-0.6 -3,-2.6 -12,-0.2 -1,-0.4 -0.630 50.2-160.7-107.8 163.5 -6.0 36.6 -30.4 187 187 A I E - G 0 173A 0 -14,-1.8 -14,-3.1 -2,-0.2 2,-0.7 -0.992 11.6-147.6-144.7 135.6 -9.7 36.3 -30.7 188 188 A R E -eG 148 172A 70 -41,-0.8 -39,-3.3 -2,-0.3 2,-0.4 -0.949 22.6-161.7-105.0 108.9 -12.3 38.6 -32.4 189 189 A I E -eG 149 171A 0 -18,-2.7 -18,-2.0 -2,-0.7 -39,-0.2 -0.812 23.4-106.4 -96.8 135.8 -15.5 38.4 -30.4 190 190 A K E - G 0 170A 69 -41,-3.0 9,-0.5 -2,-0.4 2,-0.3 -0.235 39.9-175.3 -55.3 139.8 -18.9 39.5 -31.9 191 191 A R + 0 0 48 -22,-1.2 -1,-0.0 1,-0.1 -20,-0.0 -0.824 54.6 49.2-131.0 171.5 -20.3 42.7 -30.5 192 192 A G + 0 0 53 -2,-0.3 -1,-0.1 3,-0.2 -2,-0.0 0.817 60.2 133.0 67.0 33.1 -23.6 44.6 -31.1 193 193 A T S S- 0 0 67 2,-0.2 3,-0.1 -3,-0.2 -1,-0.1 0.576 76.4-118.8 -85.7 -7.6 -25.8 41.5 -30.5 194 194 A G S S+ 0 0 79 1,-0.4 2,-0.4 2,-0.0 3,-0.0 0.351 73.1 137.2 85.2 -9.8 -28.0 43.8 -28.2 195 195 A N - 0 0 66 1,-0.2 -1,-0.4 2,-0.1 -2,-0.2 -0.609 46.7-156.0 -71.5 122.0 -27.1 41.3 -25.5 196 196 A S S S+ 0 0 63 -2,-0.4 -1,-0.2 1,-0.2 3,-0.0 0.761 92.8 56.1 -72.3 -27.2 -26.2 43.5 -22.4 197 197 A Y S S- 0 0 106 1,-0.1 6,-2.7 -81,-0.1 7,-0.4 0.763 108.7-133.0 -72.7 -27.5 -24.1 40.7 -20.9 198 198 A G > - 0 0 1 4,-0.2 3,-2.2 -3,-0.2 -2,-0.1 0.052 41.5 -47.3 87.9 158.0 -22.0 40.7 -24.1 199 199 A V G > S- 0 0 12 -9,-0.5 3,-1.9 1,-0.3 -45,-0.1 -0.405 133.7 -0.7 -62.6 130.4 -21.0 37.5 -26.0 200 200 A c G 3 S- 0 0 5 -47,-0.3 -65,-2.0 1,-0.3 -1,-0.3 0.618 132.4 -64.2 62.0 15.2 -19.6 35.0 -23.4 201 201 A G G X S+ 0 0 0 -3,-2.2 3,-3.0 -67,-0.2 -1,-0.3 0.551 84.9 157.1 86.7 12.3 -20.2 37.6 -20.7 202 202 A L T < + 0 0 0 -3,-1.9 -69,-0.4 1,-0.3 -4,-0.2 0.631 68.9 52.1 -42.9 -27.5 -17.7 40.0 -22.1 203 203 A Y T 3 S+ 0 0 3 -6,-2.7 -87,-2.4 1,-0.1 -86,-0.3 0.393 78.7 101.8 -97.8 9.0 -19.4 43.0 -20.4 204 204 A T S < S- 0 0 28 -3,-3.0 2,-0.3 -7,-0.4 -1,-0.1 0.923 96.2 -10.0 -57.5 -58.7 -19.5 41.7 -16.8 205 205 A S + 0 0 34 -4,-0.2 2,-0.4 -72,-0.2 -72,-0.2 -0.829 65.6 175.3-151.6 118.9 -16.5 43.5 -15.2 206 206 A S + 0 0 5 -93,-0.5 -93,-3.2 -2,-0.3 2,-0.3 -0.962 4.2 176.6-128.0 131.8 -13.9 45.6 -17.0 207 207 A F E -BD 112 131A 21 -76,-1.3 -76,-2.9 -2,-0.4 -95,-0.2 -0.903 7.2-170.5-131.2 158.2 -11.1 47.6 -15.4 208 208 A Y E -B 111 0A 41 -97,-1.8 -97,-2.4 -2,-0.3 2,-0.3 -0.980 28.3-108.5-147.0 150.7 -8.2 49.7 -16.6 209 209 A P E -B 110 0A 0 0, 0.0 2,-0.4 0, 0.0 -99,-0.3 -0.627 28.8-141.2 -81.6 141.3 -5.1 51.4 -15.0 210 210 A V E +B 109 0A 32 -101,-2.2 -102,-2.4 -2,-0.3 -101,-1.4 -0.802 26.7 165.9-101.4 144.7 -5.1 55.1 -14.7 211 211 A K 0 0 39 -2,-0.4 -104,-0.1 -103,-0.2 -135,-0.0 -0.828 360.0 360.0-162.0 122.5 -1.9 57.1 -15.2 212 212 A N 0 0 167 -2,-0.3 -1,-0.1 -171,-0.0 -105,-0.0 0.828 360.0 360.0 -97.5 360.0 -1.3 60.8 -15.7